0 B10R1.17 BrCC#Cc1ccccc1 Amb26032687 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.17 BrCCCc1ccccc1 Amb2721516 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.17 BrCCCc1ccccn1 Amb27866171 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.17 BrCCCc1cccnc1 Amb1102301 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.17 BrCCCc1cccnc1 Amb17610084 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.17 BrCCCc1ccncc1 Amb32751195 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 BrCCOc1cccnc1 Amb33109804 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 BrCCOc1cccnc1 Amb9783592 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.17 BrCCSc1ccccc1 Amb6255409 [0,0,0,0,0,0|2,0,1]=3 10 B10R1.17 BrCCSc1ccncc1 Amb28206814 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.17 BrCCSc1ccncc1 Amb32670844 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 BrCOCc1ccccc1 Amb27410470 [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [0,0,0,0,0,0|2,0,2]=4 14 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,0,0,0,0|2,0,1]=3 16 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|1,0,3]=4 19 B10R1.17 C#CCCc1ccccc1 Amb6336492 [0,0,0,0,0,0|1,0,2]=3 20 B10R1.17 C#CCCc1ccccn1 Amb24571654 [0,0,0,0,0,0|2,0,2]=4 21 B10R1.17 C#CCCc1cccnc1 Amb24085226 [0,0,0,0,0,0|2,0,2]=4 22 B10R1.17 C#CCCc1ccncc1 Amb24091331 [0,0,0,0,0,0|2,0,2]=4 23 B10R1.17 C#CCNc1ccccn1 Amb18959521 [0,0,0,0,0,0|1,0,2]=3 24 B10R1.17 C#CCNc1ccncc1 Amb18284709 [0,0,0,0,0,0|1,0,2]=3 25 B10R1.17 C#CCNc1ncccn1 Amb18958802 [0,0,0,0,0,0|2,0,2]=4 26 B10R1.17 C#CCOc1ccccc1 Amb839455 [0,0,0,0,0,0|1,0,2]=3 27 B10R1.17 C#CCOc1cccnc1 Amb22586592 [0,0,0,0,0,0|2,0,2]=4 28 B10R1.17 C#CCOc1ccncc1 Amb24117045 [0,0,0,0,0,0|2,0,2]=4 29 B10R1.17 C#CCSc1ccccc1 Amb3836098 [0,0,0,0,0,0|1,0,2]=3 30 B10R1.17 C#CCSc1ccncc1 Amb27809865 [0,0,0,0,0,0|2,0,2]=4 31 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [0,0,0,0,0,0|1,0,3]=4 32 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|1,0,2]=3 33 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|1,0,1]=2 34 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,0,0,0,0,0|1,0,0]=1 35 B10R1.17 C=CCCc1ccccn1 Amb25337662 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.17 C=CCCc1cccnc1 Amb24477186 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.17 C=CCCc1cnccn1 Amb28049385 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.17 C=CCCc1cncnc1 Amb35715623 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.17 C=CCNC1=CCCCC1 Amb28050070 [0,0,0,0,0,0|0,0,4]=4 40 B10R1.17 C=CCNC1C=CCCC1 Amb27205052 [0,0,0,0,0,0|0,0,4]=4 41 B10R1.17 C=CCNC1CC=CCC1 Amb27781888 [0,0,0,0,0,0|0,0,4]=4 42 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,0,0,0,0,0|0,0,0]=0 43 B10R1.17 C=CCNc1cccnc1 Amb8394248 [0,0,0,0,0,0|1,0,0]=1 44 B10R1.17 C=CCNc1ncccn1 Amb2439058 [0,0,0,0,0,0|2,0,0]=2 45 B10R1.17 C=CCNc1ncncn1 Amb26967841 [0,0,0,0,0,0|3,0,0]=3 46 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,0,0,0,0,0|1,0,0]=1 47 B10R1.17 C=CCOc1cccnc1 Amb26643102 [0,0,0,0,0,0|2,0,0]=2 48 B10R1.17 C=CCOc1ccncc1 Amb25234559 [0,0,0,0,0,0|2,0,0]=2 49 B10R1.17 C=CCOc1cnccn1 Amb28050251 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.17 C=CCSC1C=CC=CN1 Amb28323182 [0,0,0,0,0,0|2,0,1]=3 51 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,0,0,0,0,0|1,0,0]=1 52 B10R1.17 C=CCSc1cccnn1 Amb27660118 [0,0,0,0,0,0|3,0,0]=3 53 B10R1.17 C=CCSc1cnccn1 Amb25859620 [0,0,0,0,0,0|3,0,0]=3 54 B10R1.17 C=CCSc1ncccn1 Amb10564170 [0,0,0,0,0,0|3,0,0]=3 55 B10R1.17 C=CC[Se]c1ccccn1 Amb24101157 [0,0,0,0,0,0|2,0,0]=2 56 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|2,0,0]=2 57 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,0,0,0,0|1,0,1]=2 58 B10R1.17 C=C\C=C\c1cccnc1 Amb27976078 [0,0,0,0,0,0|2,0,1]=3 59 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,0,0,0,0|1,0,2]=3 60 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [0,0,0,0,0,0|2,0,2]=4 61 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [0,0,0,0,0,0|2,0,2]=4 62 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [0,0,0,0,0,0|2,0,2]=4 63 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.17 CCCCc1ccccc1 Amb6608912 [0,0,0,0,0,0|1,0,2]=3 65 B10R1.17 CCCCc1ccccn1 Amb8395993 [0,0,0,0,0,0|2,0,2]=4 66 B10R1.17 CCCCc1cccnc1 Amb4037068 [0,0,0,0,0,0|2,0,2]=4 67 B10R1.17 CCCCc1ccncc1 Amb10555008 [0,0,0,0,0,0|2,0,2]=4 68 B10R1.17 CCCNc1ccccc1 Amb534130 [0,0,0,0,0,0|0,0,2]=2 69 B10R1.17 CCCNc1cccnc1 Amb6686632 [0,0,0,0,0,0|1,0,2]=3 70 B10R1.17 CCCNc1ccncc1 Amb6614447 [0,0,0,0,0,0|1,0,2]=3 71 B10R1.17 CCCNc1ccnnc1 Amb23559651 [0,0,0,0,0,0|2,0,2]=4 72 B10R1.17 CCCNc1cncnc1 Amb28074211 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.17 CCCOc1ccccc1 Amb2842271 [0,0,0,0,0,0|1,0,2]=3 74 B10R1.17 CCCSc1ccccc1 Amb4014460 [0,0,0,0,0,0|1,0,2]=3 75 B10R1.17 CCCSc1ccccn1 Amb24733306 [0,0,0,0,0,0|2,0,2]=4 76 B10R1.17 CCCSc1ccncc1 Amb28126322 [0,0,0,0,0,0|2,0,2]=4 77 B10R1.17 CCNCc1ccccc1 Amb3699539 [0,0,0,0,0,0|2,0,2]=4 78 B10R1.17 CCOCc1ccccc1 Amb9787555 [0,0,0,0,0,0|2,0,2]=4 79 B10R1.17 CCOSc1ccccc1 Amb28049338 [0,0,0,0,0,0|2,0,2]=4 80 B10R1.17 CCSCc1ccccc1 Amb9787636 [0,0,0,0,0,0|2,0,2]=4 81 B10R1.17 CCSSc1ccccc1 Amb28057163 [0,0,0,0,0,0|2,0,2]=4 82 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [0,0,0,0,0,0|1,0,3]=4 83 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|2,0,2]=4 84 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [0,0,0,0,0,0|2,0,2]=4 85 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [0,0,0,0,0,0|2,0,2]=4 86 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|2,0,1]=3 87 B10R1.17 CNCCc1ccccc1 Amb33545919 [0,0,0,0,0,0|2,0,1]=3 88 B10R1.17 CNCCc1ccccn1 Amb1651624 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.17 CNCCc1ccccn1 Amb22167479 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.17 CNCCc1ccccn1 Amb6741463 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.17 CNCCc1cccnc1 Amb10068754 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.17 CNCCc1cccnc1 Amb10576410 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.17 CNCCc1ccncc1 Amb10071184 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.17 CNCCc1ccncc1 Amb19958269 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.17 CNCCc1ccncc1 Amb2592519 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.17 CNNCc1ccccc1 Amb26859422 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.17 CNNCc1ccccc1 Amb33328543 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.17 CNOCc1ccccc1 Amb32412803 [0,0,0,0,0,0|3,0,1]=4 100 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|2,0,2]=4 102 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [0,0,0,0,0,0|3,0,1]=4 103 B10R1.17 COCCc1ccccc1 Amb4020014 [0,0,0,0,0,0|2,0,1]=3 104 B10R1.17 COCCc1ccccn1 Amb4034583 [0,0,0,0,0,0|3,0,1]=4 105 B10R1.17 COCCc1ccncc1 Amb26565974 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.17 COCOc1ccccc1 Amb2608594 [0,0,0,0,0,0|2,0,1]=3 107 B10R1.17 COCOc1ccccn1 Amb27757113 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.17 CONCc1ccccc1 Amb26432339 [0,0,0,0,0,0|3,0,1]=4 109 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,2]=4 110 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [0,0,0,0,0,0|1,0,3]=4 111 B10R1.17 CSCCc1ccccc1 Amb26586093 [0,0,0,0,0,0|2,0,1]=3 112 B10R1.17 CSCCc1ccccn1 Amb24552366 [0,0,0,0,0,0|3,0,1]=4 113 B10R1.17 CSCNc1ccccc1 Amb25992690 [0,0,0,0,0,0|1,0,1]=2 114 B10R1.17 CSCNc1ccccn1 Amb27972069 [0,0,0,0,0,0|2,0,1]=3 115 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|2,0,1]=3 116 B10R1.17 CSCOc1ccccn1 Amb27256230 [0,0,0,0,0,0|3,0,1]=4 117 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [0,0,0,0,0,0|2,0,2]=4 118 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [0,0,0,0,0,0|2,0,2]=4 119 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,0,0,0,0|1,0,2]=3 120 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|1,0,2]=3 121 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,0,0,0,0,0|1,0,1]=2 122 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|2,0,2]=4 123 B10R1.17 ClCCCc1ccccc1 Amb3941487 [0,0,0,0,0,0|2,0,1]=3 124 B10R1.17 ClCCCc1ccccn1 Amb32751196 [0,0,0,0,0,0|3,0,1]=4 125 B10R1.17 ClCCCc1cccnc1 Amb17477795 [0,0,0,0,0,0|3,0,1]=4 126 B10R1.17 ClCCCc1cccnc1 Amb32665795 [0,0,0,0,0,0|3,0,1]=4 127 B10R1.17 ClCCCc1ccncc1 Amb17477794 [0,0,0,0,0,0|3,0,1]=4 128 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|1,0,1]=2 129 B10R1.17 ClCCNc1ccncc1 Amb27484998 [0,0,0,0,0,0|2,0,1]=3 130 B10R1.17 ClCCNc1ccncn1 Amb27218714 [0,0,0,0,0,0|3,0,1]=4 131 B10R1.17 ClCCNc1ncccn1 Amb28291384 [0,0,0,0,0,0|3,0,1]=4 132 B10R1.17 ClCCOc1ccccc1 Amb3940573 [0,0,0,0,0,0|2,0,1]=3 133 B10R1.17 ClCCOc1cccnc1 Amb19878080 [0,0,0,0,0,0|3,0,1]=4 134 B10R1.17 ClCCOc1ccncc1 Amb28384309 [0,0,0,0,0,0|3,0,1]=4 135 B10R1.17 ClCCSc1ccccc1 Amb2685910 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.17 ClCCSc1ccccn1 Amb9305061 [0,0,0,0,0,0|3,0,1]=4 137 B10R1.17 ClCOCc1ccccc1 Amb2684626 [0,0,0,0,0,0|3,0,1]=4 138 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|3,0,1]=4 139 B10R1.17 ClCSSc1ccccc1 Amb27865461 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [0,0,0,0,0,0|2,0,2]=4 141 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,0,0,0,0|2,0,1]=3 142 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb2613089 [0,0,0,0,0,0|3,0,1]=4 143 B10R1.17 Cl\C=N\Oc1ccccn1 Amb27430268 [0,0,0,0,0,0|4,0,0]=4 144 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|2,0,2]=4 145 B10R1.17 FCCNc1ccccc1 Amb26349791 [0,0,0,0,0,0|1,0,1]=2 146 B10R1.17 FCCNc1cccnn1 Amb27760749 [0,0,0,0,0,0|3,0,1]=4 147 B10R1.17 FCCNc1cnccn1 Amb27250878 [0,0,0,0,0,0|3,0,1]=4 148 B10R1.17 FCCSc1ccccn1 Amb28125479 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.17 FCCSc1ccncc1 Amb27971685 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [0,0,0,0,0,0|2,0,2]=4 151 B10R1.17 ICC#Cc1ccccc1 Amb27262163 [0,0,0,0,0,0|2,0,2]=4 152 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|2,0,1]=3 153 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|2,0,1]=3 154 B10R1.17 ICCSc1ccccc1 Amb27458209 [0,0,0,0,0,0|2,0,1]=3 155 B10R1.17 ICOCc1ccccc1 Amb28348666 [0,0,0,0,0,0|3,0,1]=4 156 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|2,0,2]=4 157 B10R1.17 N#CCC[n+]1ccccc1 Amb28458262 [0,0,0,0,0,0|3,0,1]=4 158 B10R1.17 N#CCCc1ccccc1 Amb33551192 [0,0,0,0,0,0|2,0,1]=3 159 B10R1.17 N#CCCc1ccccn1 Amb1102488 [0,0,0,0,0,0|3,0,1]=4 160 B10R1.17 N#CCCc1cccnc1 Amb10605345 [0,0,0,0,0,0|3,0,1]=4 161 B10R1.17 N#CCCc1ccncc1 Amb2694189 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|1,0,1]=2 163 B10R1.17 N#CCNc1ccccn1 Amb22052191 [0,0,0,0,0,0|2,0,1]=3 164 B10R1.17 N#CCNc1ccccn1 Amb32665267 [0,0,0,0,0,0|2,0,1]=3 165 B10R1.17 N#CCOc1ccccc1 Amb2725206 [0,0,0,0,0,0|2,0,1]=3 166 B10R1.17 N#CCOc1ccccn1 Amb2459771 [0,0,0,0,0,0|3,0,1]=4 167 B10R1.17 N#CCOc1cccnc1 Amb17399827 [0,0,0,0,0,0|3,0,1]=4 168 B10R1.17 N#CCSc1ccccc1 Amb2690327 [0,0,0,0,0,0|2,0,1]=3 169 B10R1.17 N#CNCc1ccccc1 Amb27257452 [0,0,0,0,0,0|3,0,1]=4 170 B10R1.17 N#CSCc1ccccc1 Amb2611897 [0,0,0,0,0,0|3,0,1]=4 171 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|2,0,2]=4 172 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [0,0,0,0,0,0|2,0,1]=3 173 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|2,0,2]=4 174 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|2,0,2]=4 175 B10R1.17 NCCCc1ccccc1 Amb844788 [0,0,0,0,0,0|2,0,1]=3 176 B10R1.17 NCCCc1ccccn1 Amb1088884 [0,0,0,0,0,0|3,0,1]=4 177 B10R1.17 NCCCc1ccccn1 Amb21954278 [0,0,0,0,0,0|3,0,1]=4 178 B10R1.17 NCCCc1cccnc1 Amb18363942 [0,0,0,0,0,0|3,0,1]=4 179 B10R1.17 NCCCc1cccnc1 Amb31188323 [0,0,0,0,0,0|3,0,1]=4 180 B10R1.17 NCCCc1cccnc1 Amb5735475 [0,0,0,0,0,0|3,0,1]=4 181 B10R1.17 NCCCc1ccncc1 Amb22490382 [0,0,0,0,0,0|3,0,1]=4 182 B10R1.17 NCCCc1ccncc1 Amb24099592 [0,0,0,0,0,0|3,0,1]=4 183 B10R1.17 NCCCc1ccncc1 Amb33535434 [0,0,0,0,0,0|3,0,1]=4 184 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|1,0,1]=2 185 B10R1.17 NCCNc1ccccc1 Amb2720312 [0,0,0,0,0,0|1,0,1]=2 186 B10R1.17 NCCNc1ccccn1 Amb10608961 [0,0,0,0,0,0|2,0,1]=3 187 B10R1.17 NCCNc1ccccn1 Amb1154294 [0,0,0,0,0,0|2,0,1]=3 188 B10R1.17 NCCNc1cccnc1 Amb10607840 [0,0,0,0,0,0|2,0,1]=3 189 B10R1.17 NCCNc1cccnn1 Amb18298689 [0,0,0,0,0,0|3,0,1]=4 190 B10R1.17 NCCNc1cccnn1 Amb33042830 [0,0,0,0,0,0|3,0,1]=4 191 B10R1.17 NCCNc1ccncc1 Amb19887545 [0,0,0,0,0,0|2,0,1]=3 192 B10R1.17 NCCNc1ccncc1 Amb6279124 [0,0,0,0,0,0|2,0,1]=3 193 B10R1.17 NCCNc1ccncn1 Amb18973879 [0,0,0,0,0,0|3,0,1]=4 194 B10R1.17 NCCNc1cnccn1 Amb33526497 [0,0,0,0,0,0|3,0,1]=4 195 B10R1.17 NCCNc1cnccn1 Amb6892799 [0,0,0,0,0,0|3,0,1]=4 196 B10R1.17 NCCNc1ncccn1 Amb33526463 [0,0,0,0,0,0|3,0,1]=4 197 B10R1.17 NCCNc1ncccn1 Amb33529208 [0,0,0,0,0,0|3,0,1]=4 198 B10R1.17 NCCNc1ncccn1 Amb33545764 [0,0,0,0,0,0|3,0,1]=4 199 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|2,0,1]=3 200 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|2,0,1]=3 201 B10R1.17 NCCOc1ccccn1 Amb2237065 [0,0,0,0,0,0|3,0,1]=4 202 B10R1.17 NCCOc1cccnc1 Amb9392843 [0,0,0,0,0,0|3,0,1]=4 203 B10R1.17 NCCOc1ccncc1 Amb18988858 [0,0,0,0,0,0|3,0,1]=4 204 B10R1.17 NCCOc1ccncc1 Amb22728098 [0,0,0,0,0,0|3,0,1]=4 205 B10R1.17 NCCSc1ccccc1 Amb6374305 [0,0,0,0,0,0|2,0,1]=3 206 B10R1.17 NCCSc1ccccc1 Amb6827055 [0,0,0,0,0,0|2,0,1]=3 207 B10R1.17 NCCSc1ccccn1 Amb13949032 [0,0,0,0,0,0|3,0,1]=4 208 B10R1.17 NCCSc1ccccn1 Amb6370511 [0,0,0,0,0,0|3,0,1]=4 209 B10R1.17 NCCSc1ccccn1 Amb6844895 [0,0,0,0,0,0|3,0,1]=4 210 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|2,0,2]=4 211 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [0,0,0,0,0,0|2,0,2]=4 212 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|2,0,2]=4 213 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [0,0,0,0,0,0|2,0,2]=4 214 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|3,0,0]=3 215 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|3,0,0]=3 216 B10R1.17 NNCCc1ccccc1 Amb33552804 [0,0,0,0,0,0|3,0,0]=3 217 B10R1.17 NNCCc1ccccn1 Amb20669588 [0,0,0,0,0,0|4,0,0]=4 218 B10R1.17 NNCCc1ccccn1 Amb33528741 [0,0,0,0,0,0|4,0,0]=4 219 B10R1.17 NNCCc1ccncc1 Amb6248763 [0,0,0,0,0,0|4,0,0]=4 220 B10R1.17 NOCCc1ccccc1 Amb2899735 [0,0,0,0,0,0|3,0,0]=3 221 B10R1.17 NOCCc1ccccc1 Amb6308543 [0,0,0,0,0,0|3,0,0]=3 222 B10R1.17 NOCCc1ccccn1 Amb17231907 [0,0,0,0,0,0|4,0,0]=4 223 B10R1.17 NOCCc1cccnc1 Amb25779030 [0,0,0,0,0,0|4,0,0]=4 224 B10R1.17 NOCCc1ccncc1 Amb17231908 [0,0,0,0,0,0|4,0,0]=4 225 B10R1.17 N\N=C\Nc1ccccc1 Amb27770569 [0,0,0,0,0,0|2,0,1]=3 226 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,0,0,0,0,0|3,0,1]=4 227 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,0,0,0,0|2,0,1]=3 228 B10R1.17 O=CC#Cc1cccnc1 Amb25950612 [0,0,0,0,0,0|3,0,1]=4 229 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,0,0,0,0|2,0,0]=2 230 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|3,0,0]=3 231 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|3,0,0]=3 232 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,0,0,0,0,0|3,0,0]=3 233 B10R1.17 O=CCCc1ccncn1 Amb26958514 [0,0,0,0,0,0|4,0,0]=4 234 B10R1.17 O=CCCc1cnccn1 Amb25876683 [0,0,0,0,0,0|4,0,0]=4 235 B10R1.17 O=CCCc1cncnc1 Amb24657168 [0,0,0,0,0,0|4,0,0]=4 236 B10R1.17 O=CCCc1ncccn1 Amb24056162 [0,0,0,0,0,0|4,0,0]=4 237 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,0,0,0,0|2,0,0]=2 238 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,0,0,0,0|3,0,0]=3 239 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|2,0,0]=2 240 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|3,0,0]=3 241 B10R1.17 O=CNCc1ccccn1 Amb22370826 [0,0,0,0,0,0|4,0,0]=4 242 B10R1.17 O=CNCc1cccnc1 Amb2694543 [0,0,0,0,0,0|4,0,0]=4 243 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,0,0,0,0|2,0,0]=2 244 B10R1.17 O=CNNc1ccncc1 Amb26560692 [0,0,0,0,0,0|3,0,0]=3 245 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,0,0,0,0|3,0,0]=3 246 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,0,0,0,0|2,0,1]=3 247 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|2,0,1]=3 248 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,0,0,0,0|2,0,1]=3 249 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,0,0,0,0|3,0,1]=4 250 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,0,0,0,0|3,0,1]=4 251 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [0,0,0,0,0,0|3,0,1]=4 252 B10R1.17 OCC#Cc1ccccc1 Amb534712 [0,0,0,0,0,0|2,0,2]=4 253 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,0,0,0,0,0|2,0,1]=3 254 B10R1.17 OCCCc1ccccn1 Amb22749323 [0,0,0,0,0,0|3,0,1]=4 255 B10R1.17 OCCCc1ccccn1 Amb3939333 [0,0,0,0,0,0|3,0,1]=4 256 B10R1.17 OCCCc1cccnc1 Amb2694598 [0,0,0,0,0,0|3,0,1]=4 257 B10R1.17 OCCCc1cccnc1 Amb33623848 [0,0,0,0,0,0|3,0,1]=4 258 B10R1.17 OCCCc1ccncc1 Amb3650114 [0,0,0,0,0,0|3,0,1]=4 259 B10R1.17 OCCNc1ccccc1 Amb3940335 [0,0,0,0,0,0|1,0,1]=2 260 B10R1.17 OCCNc1ccccn1 Amb10809152 [0,0,0,0,0,0|2,0,1]=3 261 B10R1.17 OCCNc1ccccn1 Amb2610537 [0,0,0,0,0,0|2,0,1]=3 262 B10R1.17 OCCNc1cccnc1 Amb18266115 [0,0,0,0,0,0|2,0,1]=3 263 B10R1.17 OCCNc1cccnn1 Amb18298692 [0,0,0,0,0,0|3,0,1]=4 264 B10R1.17 OCCNc1ccncc1 Amb6631563 [0,0,0,0,0,0|2,0,1]=3 265 B10R1.17 OCCNc1ccncn1 Amb18973688 [0,0,0,0,0,0|3,0,1]=4 266 B10R1.17 OCCNc1cnccn1 Amb6650910 [0,0,0,0,0,0|3,0,1]=4 267 B10R1.17 OCCNc1ncccn1 Amb6622896 [0,0,0,0,0,0|3,0,1]=4 268 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|2,0,1]=3 269 B10R1.17 OCCOc1ccccn1 Amb23598433 [0,0,0,0,0,0|3,0,1]=4 270 B10R1.17 OCCOc1cccnc1 Amb19333986 [0,0,0,0,0,0|3,0,1]=4 271 B10R1.17 OCCSc1ccccn1 Amb2722740 [0,0,0,0,0,0|3,0,1]=4 272 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|3,0,1]=4 273 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,0,0,0,0,0|3,0,1]=4 274 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,0,0,0,0,0|2,0,2]=4 275 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,0,0,0,0,0|3,0,0]=3 276 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,0,0,0,0,0|3,0,1]=4 277 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [0,0,0,0,0,0|2,0,1]=3 278 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|3,0,1]=4 279 B10R1.17 SCC#Cc1ccccc1 Amb27454293 [0,0,0,0,0,0|2,0,2]=4 280 B10R1.17 SCCCc1ccccc1 Amb6255807 [0,0,0,0,0,0|2,0,1]=3 281 B10R1.17 SCCCc1ccccn1 Amb17399950 [0,0,0,0,0,0|3,0,1]=4 282 B10R1.17 SCCCc1cccnc1 Amb17399951 [0,0,0,0,0,0|3,0,1]=4 283 B10R1.17 SCCCc1ccncc1 Amb17399952 [0,0,0,0,0,0|3,0,1]=4 284 B10R1.17 SCCOc1ccccc1 Amb2794986 [0,0,0,0,0,0|2,0,1]=3 285 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|2,0,1]=3 286 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [0,0,0,0,0,0|2,0,2]=4 287 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|2,0,1]=3 288 B10R1.17 [C-]#[N+]CCc1ccccn1 Amb5456295 [0,0,0,0,0,0|3,0,1]=4 289 B10R1.17 [C-]#[N+]CCc1cccnc1 Amb33429418 [0,0,0,0,0,0|3,0,1]=4 290 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [0,0,0,0,0,0|3,0,1]=4 291 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,0,0,0,0,0|4,0,0]=4 292 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|1,1,1]=3 293 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 294 B9R1.8 BrCC[n+]1ccccc1 Amb2617784 [1,0,0,0,0,0|2,0,1]=4 295 B9R1.8 BrCC[n+]1ccccc1 Amb26365793 [1,0,0,0,0,0|2,0,1]=4 296 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.8 BrCCc1cccnc1 Amb19069960 [1,0,0,0,0,0|2,0,1]=4 299 B9R1.8 BrCCc1cccnc1 Amb19372982 [1,0,0,0,0,0|2,0,1]=4 300 B9R1.8 BrCCc1ccncc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 301 B9R1.8 BrCCc1ccncc1 Amb33313562 [1,0,0,0,0,0|2,0,1]=4 302 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,1]=3 303 B9R1.8 Br\C=C/c1ccccn1 Amb25200984 [1,0,0,0,0,0|2,0,1]=4 304 B9R1.8 Br\C=C/c1cccnc1 Amb24085678 [1,0,0,0,0,0|2,0,1]=4 305 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,0,0,0,0|1,0,1]=3 306 B9R1.8 Br\C=C\c1ccccn1 Amb33134753 [1,0,0,0,0,0|2,0,1]=4 307 B9R1.8 Br\C=C\c1cccnc1 Amb33134788 [1,0,0,0,0,0|2,0,1]=4 308 B9R1.8 Br\C=C\c1ccncc1 Amb27756767 [1,0,0,0,0,0|2,0,1]=4 309 B9R1.8 C#CCc1ccccn1 Amb25759001 [1,0,0,0,0,0|1,0,2]=4 310 B9R1.8 C#CCc1cccnc1 Amb27219897 [1,0,0,0,0,0|1,0,2]=4 311 B9R1.8 C#CCc1ccncc1 Amb24478677 [1,0,0,0,0,0|1,0,2]=4 312 B9R1.8 C#COc1ccccc1 Amb27194589 [1,0,0,0,0,0|1,0,2]=4 313 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|1,0,2]=4 314 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 315 B9R1.8 C#NCc1ccccc1 Amb31132452 [1,0,0,0,0,0|1,0,1]=3 316 B9R1.8 C#NCc1ccccn1 Amb31132453 [1,0,0,0,0,0|2,0,1]=4 317 B9R1.8 C#NCc1cccnc1 Amb31132454 [1,0,0,0,0,0|2,0,1]=4 318 B9R1.8 C#NCc1ccncc1 Amb31132455 [1,0,0,0,0,0|2,0,1]=4 319 B9R1.8 C=CCN1C=CC=CC1 Amb26480044 [1,0,0,0,0,0|1,0,1]=3 320 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [1,0,0,0,0,0|1,0,0]=2 321 B9R1.8 C=CCc1ccccc1 Amb2599341 [1,0,0,0,0,0|0,0,0]=1 322 B9R1.8 C=CCc1cccnc1 Amb24477831 [1,0,0,0,0,0|1,0,0]=2 323 B9R1.8 C=CCc1cncnc1 Amb27431822 [1,0,0,0,0,0|2,0,0]=3 324 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|1,0,0]=2 325 B9R1.8 C=COc1cccnc1 Amb24085952 [1,0,0,0,0,0|2,0,0]=3 326 B9R1.8 C=CSc1ccccc1 Amb8387516 [1,0,0,0,0,0|1,0,0]=2 327 B9R1.8 C=NCc1ccccc1 Amb28256747 [1,0,0,0,0,0|1,0,0]=2 328 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,0,0,0,0|2,0,0]=3 329 B9R1.8 CC#Cc1ccccc1 Amb8513696 [1,0,0,0,0,0|0,0,3]=4 330 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|1,0,2]=4 331 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|0,0,2]=3 332 B9R1.8 CCCc1ccccn1 Amb6366812 [1,0,0,0,0,0|1,0,2]=4 333 B9R1.8 CCCc1cccnc1 Amb2613018 [1,0,0,0,0,0|1,0,2]=4 334 B9R1.8 CCCc1ccncc1 Amb4017941 [1,0,0,0,0,0|1,0,2]=4 335 B9R1.8 CCNc1ccccc1 Amb3940127 [1,0,0,0,0,0|0,0,1]=2 336 B9R1.8 CCNc1ccccn1 Amb6640743 [1,0,0,0,0,0|1,0,1]=3 337 B9R1.8 CCNc1cccnc1 Amb6686634 [1,0,0,0,0,0|1,0,1]=3 338 B9R1.8 CCNc1cccnn1 Amb18286130 [1,0,0,0,0,0|2,0,1]=4 339 B9R1.8 CCNc1ccncc1 Amb33545749 [1,0,0,0,0,0|1,0,1]=3 340 B9R1.8 CCNc1ccncn1 Amb18282107 [1,0,0,0,0,0|2,0,1]=4 341 B9R1.8 CCNc1ccnnc1 Amb23559704 [1,0,0,0,0,0|2,0,1]=4 342 B9R1.8 CCNc1cncnc1 Amb18270553 [1,0,0,0,0,0|2,0,1]=4 343 B9R1.8 CCNc1ncccn1 Amb6633030 [1,0,0,0,0,0|2,0,1]=4 344 B9R1.8 CCOc1ccccc1 Amb2842270 [1,0,0,0,0,0|1,0,1]=3 345 B9R1.8 CCOc1ccccn1 Amb2609960 [1,0,0,0,0,0|2,0,1]=4 346 B9R1.8 CCOc1cccnc1 Amb10573342 [1,0,0,0,0,0|2,0,1]=4 347 B9R1.8 CCOc1ccncc1 Amb8396897 [1,0,0,0,0,0|2,0,1]=4 348 B9R1.8 CCSc1ccccc1 Amb2687929 [1,0,0,0,0,0|1,0,1]=3 349 B9R1.8 CCSc1ccccn1 Amb26656831 [1,0,0,0,0,0|2,0,1]=4 350 B9R1.8 CCSc1ccncc1 Amb27766422 [1,0,0,0,0,0|2,0,1]=4 351 B9R1.8 CNCc1ccccc1 Amb3699562 [1,0,0,0,0,0|1,0,1]=3 352 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|2,0,1]=4 353 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|2,0,1]=4 354 B9R1.8 CNCc1ccccn1 Amb3941148 [1,0,0,0,0,0|2,0,1]=4 355 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|2,0,1]=4 356 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|2,0,1]=4 357 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|2,0,1]=4 358 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|2,0,1]=4 359 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|2,0,1]=4 360 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|1,0,1]=3 361 B9R1.8 CNNc1ccccc1 Amb27969267 [1,0,0,0,0,0|1,0,1]=3 362 B9R1.8 COCc1ccccc1 Amb2782562 [1,0,0,0,0,0|1,0,1]=3 363 B9R1.8 COCc1ccccn1 Amb4017561 [1,0,0,0,0,0|2,0,1]=4 364 B9R1.8 CSCc1ccccn1 Amb27837576 [1,0,0,0,0,0|2,0,1]=4 365 B9R1.8 CSCc1cccnc1 Amb24523080 [1,0,0,0,0,0|2,0,1]=4 366 B9R1.8 CSSc1ccccc1 Amb4008371 [1,0,0,0,0,0|2,0,1]=4 367 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,1]=3 368 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,0,0,0,0|0,0,2]=3 369 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,0,0,0,0|0,0,2]=3 370 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [1,0,0,0,0,0|0,0,2]=3 371 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [1,0,0,0,0,0|1,0,2]=4 372 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,0,0,0,0|1,0,2]=4 373 B9R1.8 ClCC[n+]1ccccc1 Amb28195087 [1,0,0,0,0,0|2,0,1]=4 374 B9R1.8 ClCCc1ccccc1 Amb535682 [1,0,0,0,0,0|1,0,1]=3 375 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,1]=4 376 B9R1.8 ClCCc1ccccn1 Amb19892295 [1,0,0,0,0,0|2,0,1]=4 377 B9R1.8 ClCCc1cccnc1 Amb24061504 [1,0,0,0,0,0|2,0,1]=4 378 B9R1.8 ClCCc1ccncc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 379 B9R1.8 ClCCc1ccncc1 Amb9004339 [1,0,0,0,0,0|2,0,1]=4 380 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,0]=3 381 B9R1.8 ClCSc1ccccn1 Amb27603302 [1,0,0,0,0,0|3,0,0]=4 382 B9R1.8 ClCSc1ccncc1 Amb27185726 [1,0,0,0,0,0|3,0,0]=4 383 B9R1.8 ClNCc1cccnc1 Amb27951574 [1,0,0,0,0,0|3,0,0]=4 384 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,1]=3 385 B9R1.8 Cl\C=C\c1cccnc1 Amb27435566 [1,0,0,0,0,0|2,0,1]=4 386 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,1]=3 387 B9R1.8 F\C=C\c1ccccn1 Amb27258216 [1,0,0,0,0,0|2,0,1]=4 388 B9R1.8 IC#Cc1ccccc1 Amb26442219 [1,0,0,0,0,0|1,0,2]=4 389 B9R1.8 ICCc1ccccc1 Amb8515353 [1,0,0,0,0,0|1,0,1]=3 390 B9R1.8 ICCc1cccnc1 Amb33534604 [1,0,0,0,0,0|2,0,1]=4 391 B9R1.8 ICCc1ccncc1 Amb28383331 [1,0,0,0,0,0|2,0,1]=4 392 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,1]=3 393 B9R1.8 N#CC[n+]1ccccc1 Amb2608894 [1,0,0,0,0,0|2,0,1]=4 394 B9R1.8 N#CCc1ccccc1 Amb3598087 [1,0,0,0,0,0|1,0,1]=3 395 B9R1.8 N#CCc1ccccn1 Amb845695 [1,0,0,0,0,0|2,0,1]=4 396 B9R1.8 N#CCc1cccnc1 Amb2695344 [1,0,0,0,0,0|2,0,1]=4 397 B9R1.8 N#CCc1ccncc1 Amb6661799 [1,0,0,0,0,0|2,0,1]=4 398 B9R1.8 N#CCc1ccncc1 Amb8516296 [1,0,0,0,0,0|2,0,1]=4 399 B9R1.8 N#CNc1ccccc1 Amb9783273 [1,0,0,0,0,0|1,0,1]=3 400 B9R1.8 N#CNc1ccncc1 Amb25319718 [1,0,0,0,0,0|2,0,1]=4 401 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 402 B9R1.8 N#CSc1ccccc1 Amb6892469 [1,0,0,0,0,0|2,0,1]=4 403 B9R1.8 N#C[Se]c1ccccc1 Amb2690321 [1,0,0,0,0,0|2,0,1]=4 404 B9R1.8 NCC[n+]1ccccc1 Amb27246156 [1,0,0,0,0,0|2,0,1]=4 405 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,1]=3 406 B9R1.8 NCCc1ccccc1 Amb2792829 [1,0,0,0,0,0|1,0,1]=3 407 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,1]=4 408 B9R1.8 NCCc1ccccn1 Amb24066975 [1,0,0,0,0,0|2,0,1]=4 409 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,1]=4 410 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,1]=4 411 B9R1.8 NCCc1cccnc1 Amb20241523 [1,0,0,0,0,0|2,0,1]=4 412 B9R1.8 NCCc1cccnc1 Amb8631307 [1,0,0,0,0,0|2,0,1]=4 413 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,1]=4 414 B9R1.8 NCCc1ccncc1 Amb8631358 [1,0,0,0,0,0|2,0,1]=4 415 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|1,0,0]=2 416 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,0]=3 417 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 418 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 419 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 420 B9R1.8 NNCc1ccccc1 Amb8513062 [1,0,0,0,0,0|2,0,0]=3 421 B9R1.8 NNCc1ccccc1 Amb9826089 [1,0,0,0,0,0|2,0,0]=3 422 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.8 NNCc1ccccn1 Amb28984160 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.8 NNCc1ccccn1 Amb6892424 [1,0,0,0,0,0|3,0,0]=4 425 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 426 B9R1.8 NNCc1cccnc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 427 B9R1.8 NNCc1cccnc1 Amb33551495 [1,0,0,0,0,0|3,0,0]=4 428 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 429 B9R1.8 NNCc1ccncc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 430 B9R1.8 NNCc1ccncc1 Amb2691315 [1,0,0,0,0,0|3,0,0]=4 431 B9R1.8 NNCc1ccncc1 Amb28984138 [1,0,0,0,0,0|3,0,0]=4 432 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 433 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 434 B9R1.8 NOCc1ccccc1 Amb6600539 [1,0,0,0,0,0|2,0,0]=3 435 B9R1.8 NOCc1ccccn1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 436 B9R1.8 NOCc1ccccn1 Amb32663271 [1,0,0,0,0,0|3,0,0]=4 437 B9R1.8 NOCc1cccnc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 438 B9R1.8 NOCc1cccnc1 Amb33546939 [1,0,0,0,0,0|3,0,0]=4 439 B9R1.8 NOCc1ccncc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 440 B9R1.8 N\C=C/c1ccccn1 Amb27443779 [1,0,0,0,0,0|2,0,1]=4 441 B9R1.8 N\C=C/c1cccnc1 Amb28137814 [1,0,0,0,0,0|2,0,1]=4 442 B9R1.8 N\C=C/c1ccncc1 Amb24068867 [1,0,0,0,0,0|2,0,1]=4 443 B9R1.8 N\C=C\c1cccnc1 Amb27776892 [1,0,0,0,0,0|2,0,1]=4 444 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|1,0,1]=3 445 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,0,0,0,0|1,1,0]=3 446 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,0,0,0,0|2,0,1]=4 447 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [1,0,0,0,0,0|1,0,2]=4 448 B9R1.8 O=CCc1ccccc1 Amb3939950 [1,0,0,0,0,0|1,0,0]=2 449 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|2,0,0]=3 450 B9R1.8 O=CCc1cccnc1 Amb8011002 [1,0,0,0,0,0|2,0,0]=3 451 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|2,0,0]=3 452 B9R1.8 O=CCc1cnccn1 Amb25124492 [1,0,0,0,0,0|3,0,0]=4 453 B9R1.8 O=CCc1cncnc1 Amb24634482 [1,0,0,0,0,0|3,0,0]=4 454 B9R1.8 O=CCc1ncccn1 Amb24061341 [1,0,0,0,0,0|3,0,0]=4 455 B9R1.8 O=CNc1ccccc1 Amb2613772 [1,0,0,0,0,0|1,0,0]=2 456 B9R1.8 O=CNc1ccccn1 Amb3319168 [1,0,0,0,0,0|2,0,0]=3 457 B9R1.8 O=CNc1cccnc1 Amb4019648 [1,0,0,0,0,0|2,0,0]=3 458 B9R1.8 O=CNc1cccnn1 Amb29872451 [1,0,0,0,0,0|3,0,0]=4 459 B9R1.8 O=CNc1ccnnc1 Amb27200081 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|2,0,0]=3 461 B9R1.8 O=C\C=C1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|2,0,1]=4 462 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [1,0,0,0,0,0|2,0,1]=4 463 B9R1.8 OCC[n+]1ccccc1 Amb27839429 [1,0,0,0,0,0|2,0,1]=4 464 B9R1.8 OCCc1ccccc1 Amb2793058 [1,0,0,0,0,0|1,0,1]=3 465 B9R1.8 OCCc1ccccn1 Amb3939045 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.8 OCCc1cccnc1 Amb2688750 [1,0,0,0,0,0|2,0,1]=4 467 B9R1.8 OCCc1ccncc1 Amb3939219 [1,0,0,0,0,0|2,0,1]=4 468 B9R1.8 OCSc1ccccc1 Amb27776457 [1,0,0,0,0,0|2,0,0]=3 469 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|2,0,0]=3 470 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,0,0,0,0|2,0,0]=3 471 B9R1.8 ONCc1ccccn1 Amb28457793 [1,0,0,0,0,0|3,0,0]=4 472 B9R1.8 ONCc1ccccn1 Amb32680372 [1,0,0,0,0,0|3,0,0]=4 473 B9R1.8 ONCc1cccnc1 Amb25147084 [1,0,0,0,0,0|3,0,0]=4 474 B9R1.8 ONCc1ccncc1 Amb25851052 [1,0,0,0,0,0|3,0,0]=4 475 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,0,0,0,0|2,0,1]=4 476 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|2,0,1]=4 477 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,0,2]=4 478 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,0,0]=2 479 B9R1.8 S=CNc1cccnc1 Amb27492962 [1,0,0,0,0,0|2,0,0]=3 480 B9R1.8 SCCc1ccccc1 Amb6255605 [1,0,0,0,0,0|1,0,1]=3 481 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|2,0,1]=4 482 B9R1.8 SCCc1cccnc1 Amb22008806 [1,0,0,0,0,0|2,0,1]=4 483 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|2,0,1]=4 484 B9R1.8 SCCc1ccncc1 Amb9800962 [1,0,0,0,0,0|2,0,1]=4 485 B9R1.8 SSCc1ccccc1 Amb27646980 [1,0,0,0,0,0|2,0,0]=3 486 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,1]=3 487 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|2,0,1]=4 488 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|2,0,1]=4 489 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|2,0,1]=4 490 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 491 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [1,0,0,0,0,0|2,0,1]=4 492 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,1]=3 493 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [1,0,0,0,0,0|2,0,0]=3 494 B9R1.8 [O-][N+]#Cc1ccccc1 Amb25951967 [1,0,0,0,0,0|2,0,1]=4 495 B11R1.1 BrCCCc1ccc(Br)cc1 Amb17104577 [0,1,0,0,0,0|2,0,1]=4 496 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [0,1,0,0,0,0|2,0,1]=4 497 B11R1.1 BrCCOc1ccc(Br)cc1 Amb1106775 [0,1,0,0,0,0|2,0,1]=4 498 B11R1.1 BrCCOc1ccc(I)cc1 Amb602656 [0,1,0,0,0,0|2,0,1]=4 499 B11R1.1 Brc1ccc(OCCI)cc1 Amb28365441 [0,1,0,0,0,0|2,0,1]=4 500 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [0,1,0,0,0,0|1,0,2]=4 501 B11R1.1 C#CCCc1ccc(C)cc1 Amb18634818 [0,1,0,0,0,0|1,0,2]=4 502 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [0,1,0,0,0,0|1,0,2]=4 503 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [0,1,0,0,0,0|1,0,2]=4 504 B11R1.1 C#CCCc1ccc(O)cc1 Amb26053114 [0,1,0,0,0,0|1,0,2]=4 505 B11R1.1 C#CCNc1ccc(Br)cc1 Amb27403970 [0,1,0,0,0,0|0,0,2]=3 506 B11R1.1 C#CCNc1ccc(C)cc1 Amb21953776 [0,1,0,0,0,0|0,0,2]=3 507 B11R1.1 C#CCNc1ccc(C)cc1 Amb33529603 [0,1,0,0,0,0|0,0,2]=3 508 B11R1.1 C#CCNc1ccc(Cl)cc1 Amb33330127 [0,1,0,0,0,0|0,0,2]=3 509 B11R1.1 C#CCNc1ccc(Cl)cc1 Amb4148888 [0,1,0,0,0,0|0,0,2]=3 510 B11R1.1 C#CCNc1ccc(Cl)cn1 Amb18284774 [0,1,0,0,0,0|1,0,2]=4 511 B11R1.1 C#CCNc1ccc(F)cc1 Amb24070273 [0,1,0,0,0,0|0,0,2]=3 512 B11R1.1 C#CCNc1ccc(F)cc1 Amb33330129 [0,1,0,0,0,0|0,0,2]=3 513 B11R1.1 C#CCOc1ccc(Br)cc1 Amb33532765 [0,1,0,0,0,0|1,0,2]=4 514 B11R1.1 C#CCOc1ccc(C)cc1 Amb19373357 [0,1,0,0,0,0|1,0,2]=4 515 B11R1.1 C#CCOc1ccc(Cl)cc1 Amb5722320 [0,1,0,0,0,0|1,0,2]=4 516 B11R1.1 C#CCOc1ccc(F)cc1 Amb18182727 [0,1,0,0,0,0|1,0,2]=4 517 B11R1.1 C#CCOc1ccc(I)cc1 Amb24476574 [0,1,0,0,0,0|1,0,2]=4 518 B11R1.1 C#CCOc1ccc(N)cc1 Amb13783679 [0,1,0,0,0,0|1,0,2]=4 519 B11R1.1 C#CCOc1ccc(N)cc1 Amb22587338 [0,1,0,0,0,0|1,0,2]=4 520 B11R1.1 C#CCSc1ccc(Cl)cc1 Amb3836119 [0,1,0,0,0,0|1,0,2]=4 521 B11R1.1 C#CCSc1ccc(F)cc1 Amb18801035 [0,1,0,0,0,0|1,0,2]=4 522 B11R1.1 C#CCSc1ccc(O)cc1 Amb18792578 [0,1,0,0,0,0|1,0,2]=4 523 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [0,1,0,0,0,0|1,0,0]=2 524 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [0,1,0,0,0,0|1,0,0]=2 525 B11R1.1 C=CCCc1ccc(C)nc1 Amb35715634 [0,1,0,0,0,0|2,0,0]=3 526 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [0,1,0,0,0,0|1,0,0]=2 527 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|1,0,0]=2 528 B11R1.1 C=CCNc1ccc(Br)cc1 Amb17306795 [0,1,0,0,0,0|0,0,0]=1 529 B11R1.1 C=CCNc1ccc(C)cc1 Amb17306868 [0,1,0,0,0,0|0,0,0]=1 530 B11R1.1 C=CCNc1ccc(C)cn1 Amb18986518 [0,1,0,0,0,0|1,0,0]=2 531 B11R1.1 C=CCNc1ccc(Cl)nc1 Amb25046921 [0,1,0,0,0,0|1,0,0]=2 532 B11R1.1 C=CCNc1ccc(Cl)nn1 Amb18985920 [0,1,0,0,0,0|2,0,0]=3 533 B11R1.1 C=CCNc1ccc(F)cc1 Amb17306180 [0,1,0,0,0,0|0,0,0]=1 534 B11R1.1 C=CCNc1ccc(F)cn1 Amb18986520 [0,1,0,0,0,0|1,0,0]=2 535 B11R1.1 C=CCNc1ccc(I)cc1 Amb17306247 [0,1,0,0,0,0|0,0,0]=1 536 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|0,0,0]=1 537 B11R1.1 C=CCNc1ccc(N)cn1 Amb17042248 [0,1,0,0,0,0|1,0,0]=2 538 B11R1.1 C=CCNc1ccc(N)nc1 Amb17041329 [0,1,0,0,0,0|1,0,0]=2 539 B11R1.1 C=CCNc1ncc(Br)cn1 Amb4553619 [0,1,0,0,0,0|2,0,0]=3 540 B11R1.1 C=CCNc1ncc(C)cn1 Amb27598844 [0,1,0,0,0,0|2,0,0]=3 541 B11R1.1 C=CCOc1ccc(Br)cc1 Amb5722388 [0,1,0,0,0,0|1,0,0]=2 542 B11R1.1 C=CCOc1ccc(C)cc1 Amb3940652 [0,1,0,0,0,0|1,0,0]=2 543 B11R1.1 C=CCOc1ccc(C)nn1 Amb33617691 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|1,0,0]=2 545 B11R1.1 C=CCOc1ccc(F)cc1 Amb27214032 [0,1,0,0,0,0|1,0,0]=2 546 B11R1.1 C=CCOc1ccc(F)nc1 Amb27176237 [0,1,0,0,0,0|2,0,0]=3 547 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|1,0,0]=2 548 B11R1.1 C=CCOc1ccc(I)nc1 Amb27598139 [0,1,0,0,0,0|2,0,0]=3 549 B11R1.1 C=CCOc1ccc(N)cc1 Amb2592767 [0,1,0,0,0,0|1,0,0]=2 550 B11R1.1 C=CCOc1ccc(N)cc1 Amb6541454 [0,1,0,0,0,0|1,0,0]=2 551 B11R1.1 C=CCOc1ccc(N)nn1 Amb25708198 [0,1,0,0,0,0|3,0,0]=4 552 B11R1.1 C=CCOc1ccc(O)cc1 Amb2612084 [0,1,0,0,0,0|1,0,0]=2 553 B11R1.1 C=CCOc1cnc(Br)cn1 Amb27479625 [0,1,0,0,0,0|3,0,0]=4 554 B11R1.1 C=CCOc1cnc(Cl)cn1 Amb27620038 [0,1,0,0,0,0|3,0,0]=4 555 B11R1.1 C=CCOc1cnc(Cl)nc1 Amb27438600 [0,1,0,0,0,0|3,0,0]=4 556 B11R1.1 C=CCOc1ncc(Br)cn1 Amb25145794 [0,1,0,0,0,0|3,0,0]=4 557 B11R1.1 C=CCOc1ncc(Cl)cn1 Amb24756911 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.1 C=CCOc1ncc(F)cn1 Amb33617864 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.1 C=CCOc1ncc(I)cn1 Amb28313229 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.1 C=CCSC1=NNC(=O)C=C1 Amb27246773 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.1 C=CCSc1ccc(Br)cc1 Amb4013518 [0,1,0,0,0,0|1,0,0]=2 562 B11R1.1 C=CCSc1ccc(Br)cn1 Amb24367725 [0,1,0,0,0,0|2,0,0]=3 563 B11R1.1 C=CCSc1ccc(C)cc1 Amb3836102 [0,1,0,0,0,0|1,0,0]=2 564 B11R1.1 C=CCSc1ccc(Cl)cc1 Amb3836125 [0,1,0,0,0,0|1,0,0]=2 565 B11R1.1 C=CCSc1ccc(Cl)nn1 Amb25152058 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|1,0,0]=2 567 B11R1.1 C=CCSc1ccc(N)cn1 Amb8931864 [0,1,0,0,0,0|2,0,0]=3 568 B11R1.1 C=CCSc1ccc(N)nn1 Amb27259389 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.1 C=CCSc1ccc(O)cc1 Amb8394315 [0,1,0,0,0,0|1,0,0]=2 570 B11R1.1 C=CCSc1cnc(N)cn1 Amb27403231 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.1 C=CCSc1ncc(Br)cn1 Amb25100418 [0,1,0,0,0,0|3,0,0]=4 572 B11R1.1 C=CCSc1ncc(Cl)cn1 Amb24623077 [0,1,0,0,0,0|3,0,0]=4 573 B11R1.1 C=CCSc1ncc(I)cn1 Amb28240595 [0,1,0,0,0,0|3,0,0]=4 574 B11R1.1 C=COCc1ccc(Br)cc1 Amb28046575 [0,1,0,0,0,0|2,0,0]=3 575 B11R1.1 C=COCc1ccc(Cl)cc1 Amb27976232 [0,1,0,0,0,0|2,0,0]=3 576 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [0,1,0,0,0,0|1,0,1]=3 577 B11R1.1 C=C\C=C\c1ccc(F)cc1 Amb26993814 [0,1,0,0,0,0|1,0,1]=3 578 B11R1.1 CC=C=Cc1ccc(F)cc1 Amb27246329 [0,1,0,0,0,0|1,0,2]=4 579 B11R1.1 CCCCc1ccc(Br)cc1 Amb3939176 [0,1,0,0,0,0|1,0,2]=4 580 B11R1.1 CCCCc1ccc(C)cc1 Amb22002059 [0,1,0,0,0,0|1,0,2]=4 581 B11R1.1 CCCCc1ccc(Cl)cc1 Amb6365908 [0,1,0,0,0,0|1,0,2]=4 582 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [0,1,0,0,0,0|1,0,2]=4 583 B11R1.1 CCCCc1ccc(I)cc1 Amb2726236 [0,1,0,0,0,0|1,0,2]=4 584 B11R1.1 CCCCc1ccc(N)cc1 Amb2721121 [0,1,0,0,0,0|1,0,2]=4 585 B11R1.1 CCCCc1ccc(O)cc1 Amb2778508 [0,1,0,0,0,0|1,0,2]=4 586 B11R1.1 CCCCc1ccc(S)cc1 Amb2685702 [0,1,0,0,0,0|1,0,2]=4 587 B11R1.1 CCCNC1=CNC(=O)C=C1 Amb28045138 [0,1,0,0,0,0|1,0,2]=4 588 B11R1.1 CCCNc1ccc(Br)cc1 Amb29083384 [0,1,0,0,0,0|0,0,2]=3 589 B11R1.1 CCCNc1ccc(Br)cc1 Amb4313508 [0,1,0,0,0,0|0,0,2]=3 590 B11R1.1 CCCNc1ccc(Br)cn1 Amb6629917 [0,1,0,0,0,0|1,0,2]=4 591 B11R1.1 CCCNc1ccc(Br)nc1 Amb27201574 [0,1,0,0,0,0|1,0,2]=4 592 B11R1.1 CCCNc1ccc(C)cc1 Amb4313501 [0,1,0,0,0,0|0,0,2]=3 593 B11R1.1 CCCNc1ccc(C)cn1 Amb6636195 [0,1,0,0,0,0|1,0,2]=4 594 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [0,1,0,0,0,0|0,0,2]=3 595 B11R1.1 CCCNc1ccc(Cl)cc1 Amb4313503 [0,1,0,0,0,0|0,0,2]=3 596 B11R1.1 CCCNc1ccc(F)cc1 Amb4313509 [0,1,0,0,0,0|0,0,2]=3 597 B11R1.1 CCCNc1ccc(F)cn1 Amb18975389 [0,1,0,0,0,0|1,0,2]=4 598 B11R1.1 CCCNc1ccc(I)cc1 Amb7784946 [0,1,0,0,0,0|0,0,2]=3 599 B11R1.1 CCCNc1ccc(N)cn1 Amb1113758 [0,1,0,0,0,0|1,0,2]=4 600 B11R1.1 CCCNc1ccc(N)nc1 Amb7767448 [0,1,0,0,0,0|1,0,2]=4 601 B11R1.1 CCCOc1ccc(Br)cc1 Amb3428588 [0,1,0,0,0,0|1,0,2]=4 602 B11R1.1 CCCOc1ccc(C)cc1 Amb26409646 [0,1,0,0,0,0|1,0,2]=4 603 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [0,1,0,0,0,0|1,0,2]=4 604 B11R1.1 CCCOc1ccc(N)cc1 Amb1125044 [0,1,0,0,0,0|1,0,2]=4 605 B11R1.1 CCCOc1ccc(N)cc1 Amb32409662 [0,1,0,0,0,0|1,0,2]=4 606 B11R1.1 CCCOc1ccc(O)cc1 Amb1810008 [0,1,0,0,0,0|1,0,2]=4 607 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [0,1,0,0,0,0|1,0,2]=4 608 B11R1.1 CCCSc1ccc(Br)cc1 Amb28184382 [0,1,0,0,0,0|1,0,2]=4 609 B11R1.1 CCCSc1ccc(C)cc1 Amb4035211 [0,1,0,0,0,0|1,0,2]=4 610 B11R1.1 CCCSc1ccc(Cl)cc1 Amb27466470 [0,1,0,0,0,0|1,0,2]=4 611 B11R1.1 CCCSc1ccc(F)cc1 Amb28365659 [0,1,0,0,0,0|1,0,2]=4 612 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [0,1,0,0,0,0|1,0,2]=4 613 B11R1.1 CCCSc1ccc(N)cc1 Amb6680313 [0,1,0,0,0,0|1,0,2]=4 614 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [0,1,0,0,0,0|1,0,2]=4 615 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [0,1,0,0,0,0|1,0,2]=4 616 B11R1.1 CNCCc1ccc(Br)cc1 Amb9214717 [0,1,0,0,0,0|2,0,1]=4 617 B11R1.1 CNCCc1ccc(C)cc1 Amb8853647 [0,1,0,0,0,0|2,0,1]=4 618 B11R1.1 CNCCc1ccc(Cl)cc1 Amb32789565 [0,1,0,0,0,0|2,0,1]=4 619 B11R1.1 CNCCc1ccc(Cl)cc1 Amb5785545 [0,1,0,0,0,0|2,0,1]=4 620 B11R1.1 CNCCc1ccc(F)cc1 Amb33483732 [0,1,0,0,0,0|2,0,1]=4 621 B11R1.1 CNCCc1ccc(F)cc1 Amb5785548 [0,1,0,0,0,0|2,0,1]=4 622 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [0,1,0,0,0,0|2,0,1]=4 623 B11R1.1 CNCCc1ccc(O)cc1 Amb15690577 [0,1,0,0,0,0|2,0,1]=4 624 B11R1.1 CNCCc1ccc(O)cc1 Amb2698071 [0,1,0,0,0,0|2,0,1]=4 625 B11R1.1 COCCc1ccc(Br)cc1 Amb6257601 [0,1,0,0,0,0|2,0,1]=4 626 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [0,1,0,0,0,0|2,0,1]=4 627 B11R1.1 COCCc1ccc(N)cc1 Amb1139224 [0,1,0,0,0,0|2,0,1]=4 628 B11R1.1 COCCc1ccc(N)cc1 Amb33551018 [0,1,0,0,0,0|2,0,1]=4 629 B11R1.1 COCCc1ccc(O)cc1 Amb3939657 [0,1,0,0,0,0|2,0,1]=4 630 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [0,1,0,0,0,0|2,0,1]=4 631 B11R1.1 COCOc1ccc(Cl)cc1 Amb26860995 [0,1,0,0,0,0|2,0,1]=4 632 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [0,1,0,0,0,0|2,0,1]=4 633 B11R1.1 COCOc1ccc(I)cc1 Amb26900030 [0,1,0,0,0,0|2,0,1]=4 634 B11R1.1 COCOc1ccc(N)cc1 Amb33547964 [0,1,0,0,0,0|2,0,1]=4 635 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [0,1,0,0,0,0|2,0,1]=4 637 B11R1.1 CSCCc1ccc(C)cc1 Amb27404222 [0,1,0,0,0,0|2,0,1]=4 638 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [0,1,0,0,0,0|2,0,1]=4 639 B11R1.1 CSCSc1ccc(O)cc1 Amb27762489 [0,1,0,0,0,0|2,0,1]=4 640 B11R1.1 C[n+]1ccc(NCCN)cc1 Amb28245279 [0,1,0,0,0,0|2,0,1]=4 641 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|1,0,2]=4 642 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|1,0,2]=4 643 B11R1.1 C\C=C\Oc1ccc(N)cc1 Amb27859329 [0,1,0,0,0,0|1,0,2]=4 644 B11R1.1 C\N=N\Nc1ccc(C)cc1 Amb22227984 [0,1,0,0,0,0|2,0,1]=4 645 B11R1.1 Cc1ccc(CCC#N)cc1 Amb17204297 [0,1,0,0,0,0|2,0,1]=4 646 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [0,1,0,0,0,0|2,0,0]=3 647 B11R1.1 Cc1ccc(CCC=O)cn1 Amb28124472 [0,1,0,0,0,0|3,0,0]=4 648 B11R1.1 Cc1ccc(CCCBr)cc1 Amb17104554 [0,1,0,0,0,0|2,0,1]=4 649 B11R1.1 Cc1ccc(CCCCl)cc1 Amb17104527 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.1 Cc1ccc(CCCN)cc1 Amb844761 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.1 Cc1ccc(CCCO)cc1 Amb3372062 [0,1,0,0,0,0|2,0,1]=4 652 B11R1.1 Cc1ccc(CCCS)cc1 Amb17400220 [0,1,0,0,0,0|2,0,1]=4 653 B11R1.1 Cc1ccc(CCNN)cc1 Amb8842845 [0,1,0,0,0,0|3,0,0]=4 654 B11R1.1 Cc1ccc(CCON)cc1 Amb33373961 [0,1,0,0,0,0|3,0,0]=4 655 B11R1.1 Cc1ccc(CC[Mg]Br)cc1 Amb6300498 [0,1,0,0,0,0|3,0,0]=4 656 B11R1.1 Cc1ccc(CNC=O)cc1 Amb1916037 [0,1,0,0,0,0|3,0,0]=4 657 B11R1.1 Cc1ccc(NCC#N)cc1 Amb363741 [0,1,0,0,0,0|1,0,1]=3 658 B11R1.1 Cc1ccc(NCCCl)cc1 Amb17334787 [0,1,0,0,0,0|1,0,1]=3 659 B11R1.1 Cc1ccc(NCCN)cc1 Amb17057746 [0,1,0,0,0,0|1,0,1]=3 660 B11R1.1 Cc1ccc(NCCN)nc1 Amb33548417 [0,1,0,0,0,0|2,0,1]=4 661 B11R1.1 Cc1ccc(NCCN)nc1 Amb6265998 [0,1,0,0,0,0|2,0,1]=4 662 B11R1.1 Cc1ccc(NCCO)cc1 Amb2721832 [0,1,0,0,0,0|1,0,1]=3 663 B11R1.1 Cc1ccc(NCCO)nc1 Amb6644779 [0,1,0,0,0,0|2,0,1]=4 664 B11R1.1 Cc1ccc(NNC=O)cc1 Amb2721110 [0,1,0,0,0,0|2,0,0]=3 665 B11R1.1 Cc1ccc(OCC#N)cc1 Amb4017041 [0,1,0,0,0,0|2,0,1]=4 666 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [0,1,0,0,0,0|2,0,0]=3 667 B11R1.1 Cc1ccc(OCCBr)cc1 Amb1397755 [0,1,0,0,0,0|2,0,1]=4 668 B11R1.1 Cc1ccc(OCCCl)cc1 Amb5559280 [0,1,0,0,0,0|2,0,1]=4 669 B11R1.1 Cc1ccc(OCCN)cc1 Amb1101721 [0,1,0,0,0,0|2,0,1]=4 670 B11R1.1 Cc1ccc(OCCO)cc1 Amb2209347 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.1 Cc1ccc(OCCS)cc1 Amb6261684 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.1 Cc1ccc(OCC[NH3+])cc1 Amb3986072 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.1 Cc1ccc(O\C=C/Cl)cc1 Amb27400345 [0,1,0,0,0,0|2,0,1]=4 674 B11R1.1 Cc1ccc(SCC#N)cc1 Amb2726052 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.1 Cc1ccc(SCC=O)cc1 Amb17082904 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.1 Cc1ccc(SCCBr)cc1 Amb6271838 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.1 Cc1ccc(SCCCl)cc1 Amb1657286 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.1 Cc1ccc(SCCN)cc1 Amb3358619 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.1 Cc1ccc(SCCN)cc1 Amb6388803 [0,1,0,0,0,0|2,0,1]=4 680 B11R1.1 Cc1ccc(SCCO)cc1 Amb3939497 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.1 Cc1ccc(SCCS)cc1 Amb13881735 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.1 Cc1ccc(\C=C/C=O)cc1 Amb27268490 [0,1,0,0,0,0|2,0,1]=4 683 B11R1.1 Cc1ccc(\C=C\C=O)cc1 Amb17232009 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.1 ClCCCc1ccc(Br)cc1 Amb17104549 [0,1,0,0,0,0|2,0,1]=4 685 B11R1.1 ClCCCc1ccc(Cl)cc1 Amb3429107 [0,1,0,0,0,0|2,0,1]=4 686 B11R1.1 ClCCCc1ccc(I)cc1 Amb27163564 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.1 ClCCNc1ccc(Br)cc1 Amb17346195 [0,1,0,0,0,0|1,0,1]=3 688 B11R1.1 ClCCNc1ccc(Cl)cc1 Amb17336182 [0,1,0,0,0,0|1,0,1]=3 689 B11R1.1 ClCCOc1ccc(Br)cc1 Amb8827992 [0,1,0,0,0,0|2,0,1]=4 690 B11R1.1 ClCCOc1ccc(Cl)cc1 Amb8627758 [0,1,0,0,0,0|2,0,1]=4 691 B11R1.1 ClCCOc1ccc(I)cc1 Amb9211195 [0,1,0,0,0,0|2,0,1]=4 692 B11R1.1 ClCCSc1ccc(Br)cc1 Amb8995012 [0,1,0,0,0,0|2,0,1]=4 693 B11R1.1 ClCCSc1ccc(Cl)cc1 Amb1154201 [0,1,0,0,0,0|2,0,1]=4 694 B11R1.1 Cl\C=C\Oc1ccc(Cl)cc1 Amb27878895 [0,1,0,0,0,0|2,0,1]=4 695 B11R1.1 Clc1ccc(CCCBr)cc1 Amb17104562 [0,1,0,0,0,0|2,0,1]=4 696 B11R1.1 Clc1ccc(CC[Mg]Br)cc1 Amb6300494 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.1 Clc1ccc(OCCBr)cc1 Amb1151965 [0,1,0,0,0,0|2,0,1]=4 698 B11R1.1 Clc1ccc(OCCI)cc1 Amb25833023 [0,1,0,0,0,0|2,0,1]=4 699 B11R1.1 Clc1ccc(SCCBr)cc1 Amb6277932 [0,1,0,0,0,0|2,0,1]=4 700 B11R1.1 FCCNc1ccc(Br)cc1 Amb27960248 [0,1,0,0,0,0|1,0,1]=3 701 B11R1.1 FCCNc1ccc(Cl)cn1 Amb27768120 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.1 FCCOc1ccc(Br)cc1 Amb22227902 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.1 FCCOc1ccc(I)cc1 Amb22227565 [0,1,0,0,0,0|2,0,1]=4 704 B11R1.1 FCCOc1ccc(S)cc1 Amb23580141 [0,1,0,0,0,0|2,0,1]=4 705 B11R1.1 FCCSc1ccc(Br)cc1 Amb28125377 [0,1,0,0,0,0|2,0,1]=4 706 B11R1.1 Fc1ccc(CCCBr)cc1 Amb17104556 [0,1,0,0,0,0|2,0,1]=4 707 B11R1.1 Fc1ccc(CCCCl)cc1 Amb17104529 [0,1,0,0,0,0|2,0,1]=4 708 B11R1.1 Fc1ccc(CCCS)cc1 Amb17400333 [0,1,0,0,0,0|2,0,1]=4 709 B11R1.1 Fc1ccc(CC[Mg]Br)cc1 Amb6300496 [0,1,0,0,0,0|3,0,0]=4 710 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [0,1,0,0,0,0|3,0,0]=4 711 B11R1.1 Fc1ccc(NCCCl)cc1 Amb17334965 [0,1,0,0,0,0|1,0,1]=3 712 B11R1.1 Fc1ccc(NCCS)cc1 Amb24545874 [0,1,0,0,0,0|1,0,1]=3 713 B11R1.1 Fc1ccc(OCCBr)cc1 Amb1152775 [0,1,0,0,0,0|2,0,1]=4 714 B11R1.1 Fc1ccc(OCCCl)cc1 Amb8828433 [0,1,0,0,0,0|2,0,1]=4 715 B11R1.1 Fc1ccc(OCCS)cc1 Amb17232868 [0,1,0,0,0,0|2,0,1]=4 716 B11R1.1 Fc1ccc(SCCBr)cc1 Amb33532712 [0,1,0,0,0,0|2,0,1]=4 717 B11R1.1 Fc1ccc(SCCCl)cc1 Amb426863 [0,1,0,0,0,0|2,0,1]=4 718 B11R1.1 ICCOc1ccc(I)cc1 Amb28074249 [0,1,0,0,0,0|2,0,1]=4 719 B11R1.1 N#CCCc1ccc(Br)cc1 Amb2685460 [0,1,0,0,0,0|2,0,1]=4 720 B11R1.1 N#CCCc1ccc(Cl)cc1 Amb2686407 [0,1,0,0,0,0|2,0,1]=4 721 B11R1.1 N#CCCc1ccc(F)cc1 Amb17204299 [0,1,0,0,0,0|2,0,1]=4 722 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [0,1,0,0,0,0|2,0,1]=4 723 B11R1.1 N#CCCc1ccc(N)cc1 Amb26509671 [0,1,0,0,0,0|2,0,1]=4 724 B11R1.1 N#CCCc1ccc(O)cc1 Amb2688782 [0,1,0,0,0,0|2,0,1]=4 725 B11R1.1 N#CCCc1ccc(S)cc1 Amb27634330 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.1 N#CCNc1ccc(Br)cc1 Amb33526942 [0,1,0,0,0,0|1,0,1]=3 727 B11R1.1 N#CCNc1ccc(Cl)cc1 Amb32664421 [0,1,0,0,0,0|1,0,1]=3 728 B11R1.1 N#CCNc1ccc(Cl)cc1 Amb33526938 [0,1,0,0,0,0|1,0,1]=3 729 B11R1.1 N#CCNc1ccc(F)cc1 Amb33526944 [0,1,0,0,0,0|1,0,1]=3 730 B11R1.1 N#CCNc1ccc(O)cc1 Amb3992192 [0,1,0,0,0,0|1,0,1]=3 731 B11R1.1 N#CCOc1ccc(Br)cc1 Amb2761587 [0,1,0,0,0,0|2,0,1]=4 732 B11R1.1 N#CCOc1ccc(Cl)cc1 Amb2725205 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.1 N#CCOc1ccc(F)cc1 Amb3428060 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.1 N#CCOc1ccc(I)cc1 Amb8830749 [0,1,0,0,0,0|2,0,1]=4 735 B11R1.1 N#CCOc1ccc(N)cc1 Amb421709 [0,1,0,0,0,0|2,0,1]=4 736 B11R1.1 N#CCOc1ccc(O)cc1 Amb33528797 [0,1,0,0,0,0|2,0,1]=4 737 B11R1.1 N#CCSc1ccc(Cl)cc1 Amb1156063 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.1 N#CCSc1ccc(F)cc1 Amb1152494 [0,1,0,0,0,0|2,0,1]=4 739 B11R1.1 N#CCSc1ccc(N)cc1 Amb8903896 [0,1,0,0,0,0|2,0,1]=4 740 B11R1.1 NCCCc1ccc(Br)cc1 Amb9304905 [0,1,0,0,0,0|2,0,1]=4 741 B11R1.1 NCCCc1ccc(Cl)cc1 Amb1092541 [0,1,0,0,0,0|2,0,1]=4 742 B11R1.1 NCCCc1ccc(Cl)cc1 Amb13952055 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.1 NCCCc1ccc(F)cc1 Amb28988628 [0,1,0,0,0,0|2,0,1]=4 744 B11R1.1 NCCCc1ccc(F)cc1 Amb5400261 [0,1,0,0,0,0|2,0,1]=4 745 B11R1.1 NCCCc1ccc(N)cc1 Amb17477693 [0,1,0,0,0,0|2,0,1]=4 746 B11R1.1 NCCCc1ccc(N)cc1 Amb34913304 [0,1,0,0,0,0|2,0,1]=4 747 B11R1.1 NCCCc1ccc(O)cc1 Amb2695306 [0,1,0,0,0,0|2,0,1]=4 748 B11R1.1 NCCCc1ccc(O)cc1 Amb33548453 [0,1,0,0,0,0|2,0,1]=4 749 B11R1.1 NCCNC1=CNC(=O)C=C1 Amb27603162 [0,1,0,0,0,0|2,0,1]=4 750 B11R1.1 NCCNc1ccc(Br)cc1 Amb17057752 [0,1,0,0,0,0|1,0,1]=3 751 B11R1.1 NCCNc1ccc(Br)cc1 Amb33802287 [0,1,0,0,0,0|1,0,1]=3 752 B11R1.1 NCCNc1ccc(Br)cn1 Amb6257612 [0,1,0,0,0,0|2,0,1]=4 753 B11R1.1 NCCNc1ccc(Br)cn1 Amb8631387 [0,1,0,0,0,0|2,0,1]=4 754 B11R1.1 NCCNc1ccc(Cl)cc1 Amb17057751 [0,1,0,0,0,0|1,0,1]=3 755 B11R1.1 NCCNc1ccc(Cl)cn1 Amb6259122 [0,1,0,0,0,0|2,0,1]=4 756 B11R1.1 NCCNc1ccc(F)cc1 Amb17845075 [0,1,0,0,0,0|1,0,1]=3 757 B11R1.1 NCCNc1ccc(F)cn1 Amb18291560 [0,1,0,0,0,0|2,0,1]=4 758 B11R1.1 NCCNc1ccc(F)nc1 Amb27840149 [0,1,0,0,0,0|2,0,1]=4 759 B11R1.1 NCCNc1ccc(I)cc1 Amb27478342 [0,1,0,0,0,0|1,0,1]=3 760 B11R1.1 NCCNc1ccc(N)cc1 Amb18298668 [0,1,0,0,0,0|1,0,1]=3 761 B11R1.1 NCCNc1ccc(N)cn1 Amb8332866 [0,1,0,0,0,0|2,0,1]=4 762 B11R1.1 NCCNc1ccc(O)cc1 Amb26372806 [0,1,0,0,0,0|1,0,1]=3 763 B11R1.1 NCCNc1ccc(O)cc1 Amb33620334 [0,1,0,0,0,0|1,0,1]=3 764 B11R1.1 NCCOc1ccc(Br)cc1 Amb1098668 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.1 NCCOc1ccc(Br)cc1 Amb19338687 [0,1,0,0,0,0|2,0,1]=4 766 B11R1.1 NCCOc1ccc(Cl)cc1 Amb1153919 [0,1,0,0,0,0|2,0,1]=4 767 B11R1.1 NCCOc1ccc(Cl)cc1 Amb836282 [0,1,0,0,0,0|2,0,1]=4 768 B11R1.1 NCCOc1ccc(F)cc1 Amb1102015 [0,1,0,0,0,0|2,0,1]=4 769 B11R1.1 NCCOc1ccc(F)cc1 Amb6760496 [0,1,0,0,0,0|2,0,1]=4 770 B11R1.1 NCCOc1ccc(F)cc1 Amb8503394 [0,1,0,0,0,0|2,0,1]=4 771 B11R1.1 NCCOc1ccc(I)cc1 Amb8838565 [0,1,0,0,0,0|2,0,1]=4 772 B11R1.1 NCCOc1ccc(N)cc1 Amb23401881 [0,1,0,0,0,0|2,0,1]=4 773 B11R1.1 NCCOc1ccc(N)cc1 Amb6369536 [0,1,0,0,0,0|2,0,1]=4 774 B11R1.1 NCCOc1ccc(N)cc1 Amb6878165 [0,1,0,0,0,0|2,0,1]=4 775 B11R1.1 NCCOc1ccc(O)cc1 Amb18125536 [0,1,0,0,0,0|2,0,1]=4 776 B11R1.1 NCCOc1ccc(O)cc1 Amb34913371 [0,1,0,0,0,0|2,0,1]=4 777 B11R1.1 NCCSc1ccc(Br)cc1 Amb1105170 [0,1,0,0,0,0|2,0,1]=4 778 B11R1.1 NCCSc1ccc(Br)cc1 Amb265577 [0,1,0,0,0,0|2,0,1]=4 779 B11R1.1 NCCSc1ccc(Cl)cc1 Amb2236679 [0,1,0,0,0,0|2,0,1]=4 780 B11R1.1 NCCSc1ccc(Cl)cc1 Amb6384759 [0,1,0,0,0,0|2,0,1]=4 781 B11R1.1 NCCSc1ccc(F)cc1 Amb3430826 [0,1,0,0,0,0|2,0,1]=4 782 B11R1.1 NCCSc1ccc(F)cc1 Amb6256366 [0,1,0,0,0,0|2,0,1]=4 783 B11R1.1 NCCSc1ccc(I)cc1 Amb25952689 [0,1,0,0,0,0|2,0,1]=4 784 B11R1.1 NNCCc1ccc(Br)cc1 Amb6243917 [0,1,0,0,0,0|3,0,0]=4 785 B11R1.1 NNCCc1ccc(Cl)cc1 Amb6257002 [0,1,0,0,0,0|3,0,0]=4 786 B11R1.1 NNCCc1ccc(F)cc1 Amb6245233 [0,1,0,0,0,0|3,0,0]=4 787 B11R1.1 NNCCc1ccc(I)cc1 Amb27816617 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.1 NNCCc1ccc(O)cc1 Amb27802782 [0,1,0,0,0,0|3,0,0]=4 789 B11R1.1 NOCCc1ccc(Br)cc1 Amb33241028 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.1 NOCCc1ccc(Cl)cc1 Amb28411635 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [0,1,0,0,0,0|3,0,0]=4 792 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.1 N\C=N\Nc1ccc(N)cc1 Amb24637265 [0,1,0,0,0,0|2,0,0]=3 794 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [0,1,0,0,0,0|2,0,0]=3 795 B11R1.1 Nc1ccc(CCCBr)cc1 Amb27751175 [0,1,0,0,0,0|2,0,1]=4 796 B11R1.1 Nc1ccc(CCCCl)cc1 Amb17477708 [0,1,0,0,0,0|2,0,1]=4 797 B11R1.1 Nc1ccc(CCCO)cc1 Amb17477700 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.1 Nc1ccc(CCCS)cc1 Amb29854940 [0,1,0,0,0,0|2,0,1]=4 799 B11R1.1 Nc1ccc(C\C=C\Br)cc1 Amb27217330 [0,1,0,0,0,0|2,0,1]=4 800 B11R1.1 Nc1ccc(NCC=O)cc1 Amb27607100 [0,1,0,0,0,0|1,0,0]=2 801 B11R1.1 Nc1ccc(NCCO)cc1 Amb2715786 [0,1,0,0,0,0|1,0,1]=3 802 B11R1.1 Nc1ccc(NCCO)cc1 Amb34913368 [0,1,0,0,0,0|1,0,1]=3 803 B11R1.1 Nc1ccc(NCCO)cn1 Amb7768137 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.1 Nc1ccc(NCCO)nc1 Amb24080718 [0,1,0,0,0,0|2,0,1]=4 805 B11R1.1 Nc1ccc(NCCO)nc1 Amb7768146 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.1 Nc1ccc(OCCBr)cc1 Amb20620461 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.1 Nc1ccc(OCCBr)cc1 Amb842416 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.1 Nc1ccc(OCCF)cc1 Amb23579951 [0,1,0,0,0,0|2,0,1]=4 809 B11R1.1 Nc1ccc(OCCO)cc1 Amb15740917 [0,1,0,0,0,0|2,0,1]=4 810 B11R1.1 Nc1ccc(OCCO)cc1 Amb6702377 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.1 Nc1ccc(OCCS)cc1 Amb17504126 [0,1,0,0,0,0|2,0,1]=4 812 B11R1.1 Nc1ccc(SCC=O)cc1 Amb30012112 [0,1,0,0,0,0|2,0,0]=3 813 B11R1.1 Nc1ccc(SCCO)cc1 Amb8929761 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.1 O=CC#Cc1ccc(Br)cc1 Amb18115173 [0,1,0,0,0,0|2,0,1]=4 815 B11R1.1 O=CC#Cc1ccc(F)cc1 Amb18117287 [0,1,0,0,0,0|2,0,1]=4 816 B11R1.1 O=CC#Cc1ccc(O)cc1 Amb18117760 [0,1,0,0,0,0|2,0,1]=4 817 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [0,1,0,0,0,0|2,0,0]=3 818 B11R1.1 O=CCCc1ccc(Br)cn1 Amb24704728 [0,1,0,0,0,0|3,0,0]=4 819 B11R1.1 O=CCCc1ccc(Br)nc1 Amb33388882 [0,1,0,0,0,0|3,0,0]=4 820 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [0,1,0,0,0,0|2,0,0]=3 821 B11R1.1 O=CCCc1ccc(Cl)cn1 Amb26462754 [0,1,0,0,0,0|3,0,0]=4 822 B11R1.1 O=CCCc1ccc(Cl)nc1 Amb33220658 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [0,1,0,0,0,0|2,0,0]=3 824 B11R1.1 O=CCCc1ccc(F)nc1 Amb33225081 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [0,1,0,0,0,0|2,0,0]=3 826 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [0,1,0,0,0,0|2,0,0]=3 827 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [0,1,0,0,0,0|2,0,0]=3 828 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [0,1,0,0,0,0|2,0,0]=3 829 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [0,1,0,0,0,0|2,0,0]=3 830 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [0,1,0,0,0,0|2,0,0]=3 831 B11R1.1 O=CCSc1ccc(Br)cc1 Amb17082907 [0,1,0,0,0,0|2,0,0]=3 832 B11R1.1 O=CCSc1ccc(Cl)cc1 Amb17082906 [0,1,0,0,0,0|2,0,0]=3 833 B11R1.1 O=CCSc1ccc(F)cc1 Amb17082905 [0,1,0,0,0,0|2,0,0]=3 834 B11R1.1 O=CNCc1ccc(Br)cc1 Amb27410847 [0,1,0,0,0,0|3,0,0]=4 835 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|3,0,0]=4 836 B11R1.1 O=CNNc1ccc(Br)cc1 Amb25147924 [0,1,0,0,0,0|2,0,0]=3 837 B11R1.1 O=C\C=C\c1ccc(Br)cc1 Amb1787168 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.1 O=C\C=C\c1ccc(Cl)cc1 Amb34005096 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.1 O=C\C=C\c1ccc(F)cc1 Amb6296447 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [0,1,0,0,0,0|3,0,0]=4 842 B11R1.1 OCCCc1ccc(Br)cc1 Amb13883587 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.1 OCCCc1ccc(Cl)cc1 Amb2724698 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.1 OCCCc1ccc(F)cc1 Amb17089497 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.1 OCCCc1ccc(O)cc1 Amb9825857 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.1 OCCNc1ccc(Br)cc1 Amb6712224 [0,1,0,0,0,0|1,0,1]=3 848 B11R1.1 OCCNc1ccc(Br)cn1 Amb6649055 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.1 OCCNc1ccc(Cl)cc1 Amb6711989 [0,1,0,0,0,0|1,0,1]=3 850 B11R1.1 OCCNc1ccc(Cl)cn1 Amb6641858 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.1 OCCNc1ccc(F)cc1 Amb6712341 [0,1,0,0,0,0|1,0,1]=3 852 B11R1.1 OCCNc1ccc(F)cn1 Amb18975393 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.1 OCCNc1ccc(I)cc1 Amb7785103 [0,1,0,0,0,0|1,0,1]=3 854 B11R1.1 OCCNc1ccc(O)cc1 Amb2697158 [0,1,0,0,0,0|1,0,1]=3 855 B11R1.1 OCCOc1ccc(Br)cc1 Amb3939111 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.1 OCCOc1ccc(Cl)cc1 Amb2209356 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.1 OCCOc1ccc(F)cc1 Amb9370676 [0,1,0,0,0,0|2,0,1]=4 858 B11R1.1 OCCOc1ccc(I)cc1 Amb9247649 [0,1,0,0,0,0|2,0,1]=4 859 B11R1.1 OCCOc1ccc(O)cc1 Amb33528799 [0,1,0,0,0,0|2,0,1]=4 860 B11R1.1 OCCSc1ccc(Br)cc1 Amb9247642 [0,1,0,0,0,0|2,0,1]=4 861 B11R1.1 OCCSc1ccc(Cl)cc1 Amb3939208 [0,1,0,0,0,0|2,0,1]=4 862 B11R1.1 ONCCc1ccc(O)cc1 Amb27409616 [0,1,0,0,0,0|3,0,0]=4 863 B11R1.1 O\N=C\Nc1ccc(Cl)cc1 Amb27606304 [0,1,0,0,0,0|2,0,1]=4 864 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [0,1,0,0,0,0|2,0,1]=4 865 B11R1.1 Oc1ccc(CCCCl)cc1 Amb17477722 [0,1,0,0,0,0|2,0,1]=4 866 B11R1.1 Oc1ccc(CCCS)cc1 Amb26880425 [0,1,0,0,0,0|2,0,1]=4 867 B11R1.1 Oc1ccc(NCCF)cc1 Amb28070962 [0,1,0,0,0,0|1,0,1]=3 868 B11R1.1 Oc1ccc(OCCBr)cc1 Amb8393912 [0,1,0,0,0,0|2,0,1]=4 869 B11R1.1 Oc1ccc(OCCCl)cc1 Amb18126982 [0,1,0,0,0,0|2,0,1]=4 870 B11R1.1 SCCCc1ccc(Br)cc1 Amb17407562 [0,1,0,0,0,0|2,0,1]=4 871 B11R1.1 SCCCc1ccc(Cl)cc1 Amb17401097 [0,1,0,0,0,0|2,0,1]=4 872 B11R1.1 SCCOc1ccc(Br)cc1 Amb6255894 [0,1,0,0,0,0|2,0,1]=4 873 B11R1.1 SCCOc1ccc(Cl)cc1 Amb6255692 [0,1,0,0,0,0|2,0,1]=4 874 B11R1.1 SCCOc1ccc(I)cc1 Amb27197400 [0,1,0,0,0,0|2,0,1]=4 875 B11R1.1 SCCSc1ccc(Br)cc1 Amb28206773 [0,1,0,0,0,0|2,0,1]=4 876 B11R1.1 SCCSc1ccc(Cl)cc1 Amb13881736 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.1 Sc1ccc(CCCCl)cc1 Amb27233376 [0,1,0,0,0,0|2,0,1]=4 878 B11R1.1 [C-]#[N+]CCc1ccc(Br)cc1 Amb2685409 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.1 [C-]#[N+]CCc1ccc(C)cc1 Amb33203684 [0,1,0,0,0,0|2,0,1]=4 880 B11R1.1 [C-]#[N+]CCc1ccc(Cl)cc1 Amb2686346 [0,1,0,0,0,0|2,0,1]=4 881 B11R1.1 [C-]#[N+]CCc1ccc(F)cc1 Amb2688287 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,1]=4 883 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,1,0,0,0,0|1,0,2]=4 884 B11R1.16 C#CCC(Br)c1ccccc1 Amb27841700 [0,1,0,0,0,0|1,0,2]=4 885 B11R1.16 C#CCC(C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|1,0,2]=4 886 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|1,0,2]=4 887 B11R1.16 C#CCC(N)c1ccccc1 Amb6752054 [0,1,0,0,0,0|1,0,2]=4 888 B11R1.16 C#CCC(O)c1ccccc1 Amb2721611 [0,1,0,0,0,0|1,0,2]=4 889 B11R1.16 C#CCN(C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|0,0,2]=3 890 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb28423448 [0,1,0,0,0,0|1,0,2]=4 891 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb33871477 [0,1,0,0,0,0|1,0,2]=4 892 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,1,0,0,0,0|2,0,1]=4 893 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,1,0,0,0,0|1,0,2]=4 894 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,1,0,0,0,0|3,0,0]=4 897 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,1,0,0,0,0|2,0,1]=4 898 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [0,1,0,0,0,0|3,0,0]=4 899 B11R1.16 C=C=C[C@@H](N)c1ccccc1 Amb28241475 [0,1,0,0,0,0|1,0,2]=4 900 B11R1.16 C=C=C[C@H](O)c1ccccc1 Amb27207074 [0,1,0,0,0,0|1,0,2]=4 901 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|1,0,0]=2 902 B11R1.16 C=CCC(=O)c1ccccn1 Amb17334265 [0,1,0,0,0,0|2,0,0]=3 903 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [0,1,0,0,0,0|2,0,0]=3 904 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,1,0,0,0,0|2,0,0]=3 905 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [0,1,0,0,0,0|1,0,0]=2 906 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [0,1,0,0,0,0|1,0,0]=2 907 B11R1.16 C=CCC(N)c1ccccn1 Amb18977590 [0,1,0,0,0,0|2,0,0]=3 908 B11R1.16 C=CCC(N)c1ccncc1 Amb18292093 [0,1,0,0,0,0|2,0,0]=3 909 B11R1.16 C=CCC(N)c1ccncc1 Amb33545929 [0,1,0,0,0,0|2,0,0]=3 910 B11R1.16 C=CCC(N)c1cnccn1 Amb18292011 [0,1,0,0,0,0|3,0,0]=4 911 B11R1.16 C=CCC(N)c1ncccn1 Amb18977465 [0,1,0,0,0,0|3,0,0]=4 912 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [0,1,0,0,0,0|1,0,0]=2 913 B11R1.16 C=CCC(O)c1ccccn1 Amb25735233 [0,1,0,0,0,0|2,0,0]=3 914 B11R1.16 C=CCC(O)c1ccnnc1 Amb27459620 [0,1,0,0,0,0|3,0,0]=4 915 B11R1.16 C=CCC(O)c1cncnc1 Amb27869318 [0,1,0,0,0,0|3,0,0]=4 916 B11R1.16 C=CCN(C)c1ccncc1 Amb26358329 [0,1,0,0,0,0|1,0,0]=2 917 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|1,0,0]=2 918 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|1,0,0]=2 919 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|1,0,0]=2 920 B11R1.16 C=CC[C@@H](N)c1ccccn1 Amb25844369 [0,1,0,0,0,0|2,0,0]=3 921 B11R1.16 C=CC[C@@H](N)c1cccnc1 Amb24487504 [0,1,0,0,0,0|2,0,0]=3 922 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|1,0,0]=2 923 B11R1.16 C=CC[C@@H](O)c1cccnc1 Amb26978853 [0,1,0,0,0,0|2,0,0]=3 924 B11R1.16 C=CC[C@@H](O)c1ccncc1 Amb27645293 [0,1,0,0,0,0|2,0,0]=3 925 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [0,1,0,0,0,0|1,0,0]=2 926 B11R1.16 C=CC[C@H](N)c1ccccn1 Amb25117558 [0,1,0,0,0,0|2,0,0]=3 927 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [0,1,0,0,0,0|1,0,0]=2 928 B11R1.16 C=CC[C@H](O)c1ccccn1 Amb28139402 [0,1,0,0,0,0|2,0,0]=3 929 B11R1.16 C=CC[C@H](O)c1cccnc1 Amb25724316 [0,1,0,0,0,0|2,0,0]=3 930 B11R1.16 C=CC[C@H](O)c1ccncc1 Amb25854958 [0,1,0,0,0,0|2,0,0]=3 931 B11R1.16 C=CNC(=O)c1ccncc1 Amb27170598 [0,1,0,0,0,0|3,0,0]=4 932 B11R1.16 C=CNC(C)c1ccccc1 Amb27455084 [0,1,0,0,0,0|2,0,0]=3 933 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,0,0,0,0|2,0,0]=3 934 B11R1.16 C=COC(C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|2,0,0]=3 935 B11R1.16 C=C\C=C(\N)c1ccccc1 Amb26578846 [0,1,0,0,0,0|1,0,1]=3 936 B11R1.16 C=C\C=C(\N)c1ccccn1 Amb24579514 [0,1,0,0,0,0|2,0,1]=4 937 B11R1.16 CC(CC#N)c1ccccc1 Amb17593643 [0,1,0,0,0,0|2,0,1]=4 938 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [0,1,0,0,0,0|2,0,0]=3 939 B11R1.16 CC(CC=O)c1ccccn1 Amb27965829 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [0,1,0,0,0,0|2,0,1]=4 941 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [0,1,0,0,0,0|2,0,1]=4 942 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|2,0,1]=4 943 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.16 CC(CNO)c1ccccc1 Amb26657287 [0,1,0,0,0,0|3,0,0]=4 948 B11R1.16 CC(CON)c1ccccc1 Amb28144909 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.16 CC(NC=O)c1ccccc1 Amb4020107 [0,1,0,0,0,0|3,0,0]=4 950 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|3,0,0]=4 951 B11R1.16 CC(\C=C\Br)c1ccccc1 Amb33134868 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,1,0,0,0,0|1,0,2]=4 953 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [0,1,0,0,0,0|1,0,2]=4 954 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [0,1,0,0,0,0|1,0,2]=4 955 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [0,1,0,0,0,0|1,0,2]=4 956 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [0,1,0,0,0,0|1,0,2]=4 957 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [0,1,0,0,0,0|1,0,2]=4 958 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [0,1,0,0,0,0|1,0,2]=4 959 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [0,1,0,0,0,0|1,0,2]=4 960 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [0,1,0,0,0,0|0,0,2]=3 961 B11R1.16 CCCN(C)c1ccncc1 Amb27176636 [0,1,0,0,0,0|1,0,2]=4 962 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,1,0,0,0,0|1,0,2]=4 963 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [0,1,0,0,0,0|1,0,2]=4 964 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|1,0,2]=4 965 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|1,0,2]=4 966 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|1,0,2]=4 967 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|1,0,2]=4 968 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,1,0,0,0,0|1,0,2]=4 969 B11R1.16 CN(CC#N)c1ccccc1 Amb5781397 [0,1,0,0,0,0|1,0,1]=3 970 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|1,0,1]=3 971 B11R1.16 CN(CCBr)c1ccncc1 Amb28240010 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.16 CN(CCCl)c1ccccc1 Amb17334788 [0,1,0,0,0,0|1,0,1]=3 973 B11R1.16 CN(CCI)c1ccccc1 Amb28138218 [0,1,0,0,0,0|1,0,1]=3 974 B11R1.16 CN(CCN)c1ccccc1 Amb13949227 [0,1,0,0,0,0|1,0,1]=3 975 B11R1.16 CN(CCN)c1ccccc1 Amb2371516 [0,1,0,0,0,0|1,0,1]=3 976 B11R1.16 CN(CCN)c1ccccc1 Amb59983 [0,1,0,0,0,0|1,0,1]=3 977 B11R1.16 CN(CCN)c1ccccn1 Amb18302344 [0,1,0,0,0,0|2,0,1]=4 978 B11R1.16 CN(CCN)c1ccccn1 Amb31188270 [0,1,0,0,0,0|2,0,1]=4 979 B11R1.16 CN(CCO)c1cccc[nH+]1 Amb33512959 [0,1,0,0,0,0|2,0,1]=4 980 B11R1.16 CN(CCO)c1ccccc1 Amb2720819 [0,1,0,0,0,0|1,0,1]=3 981 B11R1.16 CN(CCO)c1ccccn1 Amb2445428 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.16 CN(CCO)c1ccncc1 Amb18179433 [0,1,0,0,0,0|2,0,1]=4 983 B11R1.16 CN(CCO)c1ccncc1 Amb19373596 [0,1,0,0,0,0|2,0,1]=4 984 B11R1.16 CN(CCS)c1ccccc1 Amb13881732 [0,1,0,0,0,0|1,0,1]=3 985 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,1,0,0,0,0|2,0,0]=3 986 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,1,0,0,0,0|2,0,1]=4 987 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [0,1,0,0,0,0|2,0,1]=4 988 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|2,0,1]=4 991 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [0,1,0,0,0,0|2,0,1]=4 992 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [0,1,0,0,0,0|2,0,1]=4 993 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [0,1,0,0,0,0|2,0,1]=4 994 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,0,0,0,0|2,0,1]=4 995 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [0,1,0,0,0,0|2,0,1]=4 997 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [0,1,0,0,0,0|2,0,1]=4 998 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|2,0,1]=4 999 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [0,1,0,0,0,0|2,0,1]=4 1003 B11R1.16 CP(CC=O)c1ccccc1 Amb28241337 [0,1,0,0,0,0|1,1,0]=3 1004 B11R1.16 CP(CCCl)c1ccccc1 Amb28239778 [0,1,0,0,0,0|1,1,1]=4 1005 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|2,0,1]=4 1009 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [0,1,0,0,0,0|2,0,1]=4 1010 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [0,1,0,0,0,0|2,0,1]=4 1011 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [0,1,0,0,0,0|2,0,0]=3 1012 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.16 C[C@@H](NC=S)c1ccccc1 Amb27229087 [0,1,0,0,0,0|3,0,0]=4 1014 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.16 C[C@H](NC=S)c1ccccc1 Amb28071285 [0,1,0,0,0,0|3,0,0]=4 1016 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [0,1,0,0,0,0|2,0,1]=4 1017 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|1,0,2]=4 1018 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [0,1,0,0,0,0|1,0,2]=4 1019 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [0,1,0,0,0,0|1,0,2]=4 1020 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,1]=4 1021 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|2,0,1]=4 1023 B11R1.16 N#CCC(N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 1024 B11R1.16 N#CCC(N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 1025 B11R1.16 N#CCC(N)c1ccccc1 Amb33068991 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.16 N#CCC(O)c1ccccc1 Amb4407013 [0,1,0,0,0,0|2,0,1]=4 1027 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,1,0,0,0,0|2,0,1]=4 1028 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb26346763 [0,1,0,0,0,0|2,0,1]=4 1029 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb32653409 [0,1,0,0,0,0|2,0,1]=4 1030 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb33212393 [0,1,0,0,0,0|2,0,1]=4 1031 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 1032 B11R1.16 N#CC[C@H](N)c1ccccc1 Amb28398545 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 1034 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [0,1,0,0,0,0|3,0,0]=4 1035 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [0,1,0,0,0,0|2,0,1]=4 1037 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,1,0,0,0,0|2,0,1]=4 1039 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,1]=4 1042 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,1]=4 1043 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,1,0,0,0,0|2,0,1]=4 1045 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,1,0,0,0,0|2,0,1]=4 1046 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,1]=4 1047 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,1]=4 1048 B11R1.16 NN(CCO)c1ccccn1 Amb27656570 [0,1,0,0,0,0|2,0,1]=4 1049 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [0,1,0,0,0,0|3,0,0]=4 1050 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,0,0,0,0|3,0,0]=4 1051 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [0,1,0,0,0,0|3,0,0]=4 1052 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|2,0,1]=4 1054 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [0,1,0,0,0,0|2,0,1]=4 1055 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,1,0,0,0,0|2,0,1]=4 1056 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,1,0,0,0,0|2,0,1]=4 1057 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,0,0,0,0|2,0,1]=4 1058 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,1,0,0,0,0|2,0,1]=4 1060 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,1,0,0,0,0|2,0,1]=4 1061 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,1,0,0,0,0|2,0,1]=4 1062 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,0,0,0,0|3,0,0]=4 1064 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,0,0,0,0|2,0,0]=3 1065 B11R1.16 O=CCC(=O)c1ccccn1 Amb9204927 [0,1,0,0,0,0|3,0,0]=4 1066 B11R1.16 O=CCC(=O)c1cccnc1 Amb9204929 [0,1,0,0,0,0|3,0,0]=4 1067 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [0,1,0,0,0,0|3,0,0]=4 1068 B11R1.16 O=CCC(O)c1ccccn1 Amb26844000 [0,1,0,0,0,0|3,0,0]=4 1069 B11R1.16 O=CCC(O)c1ccncc1 Amb24434533 [0,1,0,0,0,0|3,0,0]=4 1070 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,1,0,0,0,0|3,0,0]=4 1071 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,1,0,0,0,0|2,0,1]=4 1072 B11R1.16 O=C\C=C(/Cl)c1ccccc1 Amb17232626 [0,1,0,0,0,0|2,0,1]=4 1073 B11R1.16 O=S(CCCl)c1ccccc1 Amb9158149 [0,1,0,0,0,0|2,0,1]=4 1074 B11R1.16 O=S(CCO)c1ccccc1 Amb27411411 [0,1,0,0,0,0|2,0,1]=4 1075 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [0,1,0,0,0,0|2,0,1]=4 1076 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [0,1,0,0,0,0|2,0,1]=4 1077 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [0,1,0,0,0,0|2,0,1]=4 1078 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [0,1,0,0,0,0|2,0,1]=4 1079 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|2,0,1]=4 1080 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [0,1,0,0,0,0|2,0,1]=4 1081 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [0,1,0,0,0,0|3,0,0]=4 1082 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [0,1,0,0,0,0|2,0,1]=4 1083 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [0,1,0,0,0,0|2,0,1]=4 1084 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [0,1,0,0,0,0|2,0,1]=4 1085 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [0,1,0,0,0,0|2,0,1]=4 1086 B11R1.16 [C-]#[N+]CC(C)c1ccccc1 Amb2684685 [0,1,0,0,0,0|2,0,1]=4 1087 B11R1.16 [C-]#[N+]CC(F)c1ccccc1 Amb27441196 [0,1,0,0,0,0|2,0,1]=4 1088 B11R1.17 BrCCCc1ccccc1Br Amb26341120 [0,1,0,0,0,0|2,0,1]=4 1089 B11R1.17 BrCCOc1ccccc1Br Amb6280497 [0,1,0,0,0,0|2,0,1]=4 1090 B11R1.17 C#CCCc1ccccc1Br Amb3991957 [0,1,0,0,0,0|1,0,2]=4 1091 B11R1.17 C#CCCc1ccccc1C Amb18636111 [0,1,0,0,0,0|1,0,2]=4 1092 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [0,1,0,0,0,0|1,0,2]=4 1093 B11R1.17 C#CCCc1ccccc1F Amb18636110 [0,1,0,0,0,0|1,0,2]=4 1094 B11R1.17 C#CCCc1ccccc1O Amb28253821 [0,1,0,0,0,0|1,0,2]=4 1095 B11R1.17 C#CCNc1ccccc1F Amb27441677 [0,1,0,0,0,0|0,0,2]=3 1096 B11R1.17 C#CCNc1ccccc1I Amb27597826 [0,1,0,0,0,0|0,0,2]=3 1097 B11R1.17 C#CCNc1cccnc1Br Amb28070764 [0,1,0,0,0,0|1,0,2]=4 1098 B11R1.17 C#CCNc1cccnc1Cl Amb27232531 [0,1,0,0,0,0|1,0,2]=4 1099 B11R1.17 C#CCNc1cccnc1F Amb35725080 [0,1,0,0,0,0|1,0,2]=4 1100 B11R1.17 C#CCNc1ccncc1F Amb30036526 [0,1,0,0,0,0|1,0,2]=4 1101 B11R1.17 C#CCOc1ccccc1Br Amb6263893 [0,1,0,0,0,0|1,0,2]=4 1102 B11R1.17 C#CCOc1ccccc1C Amb19373366 [0,1,0,0,0,0|1,0,2]=4 1103 B11R1.17 C#CCOc1ccccc1Cl Amb18183540 [0,1,0,0,0,0|1,0,2]=4 1104 B11R1.17 C#CCOc1ccccc1F Amb18799352 [0,1,0,0,0,0|1,0,2]=4 1105 B11R1.17 C#CCOc1ccccc1I Amb27217813 [0,1,0,0,0,0|1,0,2]=4 1106 B11R1.17 C#CCOc1ccccc1N Amb22492402 [0,1,0,0,0,0|1,0,2]=4 1107 B11R1.17 C#CCOc1ccccc1N Amb8389695 [0,1,0,0,0,0|1,0,2]=4 1108 B11R1.17 C#CCOc1ccccc1O Amb8837375 [0,1,0,0,0,0|1,0,2]=4 1109 B11R1.17 C#CCSc1ccccc1Br Amb28312974 [0,1,0,0,0,0|1,0,2]=4 1110 B11R1.17 C#CCSc1ccccc1F Amb18801036 [0,1,0,0,0,0|1,0,2]=4 1111 B11R1.17 C#CCSc1ccccc1N Amb6275344 [0,1,0,0,0,0|1,0,2]=4 1112 B11R1.17 C=CC#Cc1ccccc1F Amb25349463 [0,1,0,0,0,0|1,0,1]=3 1113 B11R1.17 C=CCCN1C=CC=CC1=O Amb27461258 [0,1,0,0,0,0|2,0,0]=3 1114 B11R1.17 C=CCCN1C=CN=CC1=O Amb27768475 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|1,0,0]=2 1116 B11R1.17 C=CCCc1cccnc1N Amb25916395 [0,1,0,0,0,0|2,0,0]=3 1117 B11R1.17 C=CCCc1ccncc1Br Amb26462441 [0,1,0,0,0,0|2,0,0]=3 1118 B11R1.17 C=CCCc1ccncc1F Amb35711460 [0,1,0,0,0,0|2,0,0]=3 1119 B11R1.17 C=CCCc1cnccc1C Amb29864608 [0,1,0,0,0,0|2,0,0]=3 1120 B11R1.17 C=CCCc1ncccc1Br Amb27840078 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.17 C=CCNC1=CCCCC1=O Amb27866375 [0,1,0,0,0,0|0,0,3]=4 1122 B11R1.17 C=CCNC1=NC=CNC1=O Amb27456888 [0,1,0,0,0,0|2,0,0]=3 1123 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|0,0,0]=1 1124 B11R1.17 C=CCNc1ccccc1C Amb4035723 [0,1,0,0,0,0|0,0,0]=1 1125 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|0,0,0]=1 1126 B11R1.17 C=CCNc1ccccc1I Amb28285324 [0,1,0,0,0,0|0,0,0]=1 1127 B11R1.17 C=CCNc1ccccc1S Amb27870731 [0,1,0,0,0,0|0,0,0]=1 1128 B11R1.17 C=CCNc1ccncc1Br Amb27766985 [0,1,0,0,0,0|1,0,0]=2 1129 B11R1.17 C=CCNc1ccncc1F Amb30036527 [0,1,0,0,0,0|1,0,0]=2 1130 B11R1.17 C=CCNc1cnccc1N Amb28140055 [0,1,0,0,0,0|1,0,0]=2 1131 B11R1.17 C=CCNc1ncccc1N Amb17067314 [0,1,0,0,0,0|1,0,0]=2 1132 B11R1.17 C=CCNc1nccnc1F Amb30018636 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.17 C=CCOC1=CC=CNC1=O Amb18034612 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.17 C=CCOC1=COC=CC1=O Amb28253799 [0,1,0,0,0,0|2,0,0]=3 1135 B11R1.17 C=CCON1C=CC=CC1=O Amb22364567 [0,1,0,0,0,0|2,0,0]=3 1136 B11R1.17 C=CCOc1ccccc1Br Amb4422143 [0,1,0,0,0,0|1,0,0]=2 1137 B11R1.17 C=CCOc1ccccc1C Amb2721161 [0,1,0,0,0,0|1,0,0]=2 1138 B11R1.17 C=CCOc1ccccc1Cl Amb3940570 [0,1,0,0,0,0|1,0,0]=2 1139 B11R1.17 C=CCOc1ccccc1F Amb2688315 [0,1,0,0,0,0|1,0,0]=2 1140 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|1,0,0]=2 1141 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|1,0,0]=2 1142 B11R1.17 C=CCOc1ccccc1N Amb2721826 [0,1,0,0,0,0|1,0,0]=2 1143 B11R1.17 C=CCOc1ccccc1O Amb8837354 [0,1,0,0,0,0|1,0,0]=2 1144 B11R1.17 C=CCOc1cccnc1Br Amb27157328 [0,1,0,0,0,0|2,0,0]=3 1145 B11R1.17 C=CCOc1cccnc1Cl Amb28076128 [0,1,0,0,0,0|2,0,0]=3 1146 B11R1.17 C=CCOc1cccnc1I Amb28130489 [0,1,0,0,0,0|2,0,0]=3 1147 B11R1.17 C=CCOc1cccnc1N Amb10608175 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.17 C=CCOc1ccncc1N Amb27635701 [0,1,0,0,0,0|2,0,0]=3 1149 B11R1.17 C=CCOc1cnccc1Cl Amb27625282 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.17 C=CCOc1ncccc1Cl Amb27960947 [0,1,0,0,0,0|2,0,0]=3 1151 B11R1.17 C=CCOc1nccnc1C Amb25972337 [0,1,0,0,0,0|3,0,0]=4 1152 B11R1.17 C=CCOc1nccnc1Cl Amb18183621 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.17 C=CCOc1nccnc1F Amb35729089 [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.17 C=CCSc1cccc[n+]1[O-] Amb27604062 [0,1,0,0,0,0|2,0,0]=3 1155 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|1,0,0]=2 1156 B11R1.17 C=CCSc1ccccc1C Amb25231651 [0,1,0,0,0,0|1,0,0]=2 1157 B11R1.17 C=CCSc1ccccc1Cl Amb27218500 [0,1,0,0,0,0|1,0,0]=2 1158 B11R1.17 C=CCSc1ccccc1F Amb28319358 [0,1,0,0,0,0|1,0,0]=2 1159 B11R1.17 C=CCSc1ccccc1N Amb433020 [0,1,0,0,0,0|1,0,0]=2 1160 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|1,0,0]=2 1161 B11R1.17 C=CCSc1ncccc1Br Amb24486891 [0,1,0,0,0,0|2,0,0]=3 1162 B11R1.17 C=CCSc1ncccc1C Amb28284949 [0,1,0,0,0,0|2,0,0]=3 1163 B11R1.17 C=CCSc1nccnc1Cl Amb27247980 [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.17 C=CCSc1nccnc1F Amb35729429 [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.17 C=C\C=C\c1ccccc1C Amb26953331 [0,1,0,0,0,0|1,0,1]=3 1166 B11R1.17 CCCCc1ccccc1Br Amb15690808 [0,1,0,0,0,0|1,0,2]=4 1167 B11R1.17 CCCCc1ccccc1C Amb25825024 [0,1,0,0,0,0|1,0,2]=4 1168 B11R1.17 CCCCc1ccccc1F Amb24426932 [0,1,0,0,0,0|1,0,2]=4 1169 B11R1.17 CCCCc1ccccc1I Amb25955656 [0,1,0,0,0,0|1,0,2]=4 1170 B11R1.17 CCCCc1ccccc1N Amb4037102 [0,1,0,0,0,0|1,0,2]=4 1171 B11R1.17 CCCCc1ccccc1O Amb25744605 [0,1,0,0,0,0|1,0,2]=4 1172 B11R1.17 CCCNc1ccccc1Br Amb6696451 [0,1,0,0,0,0|0,0,2]=3 1173 B11R1.17 CCCNc1ccccc1C Amb6701222 [0,1,0,0,0,0|0,0,2]=3 1174 B11R1.17 CCCNc1ccccc1Cl Amb4313502 [0,1,0,0,0,0|0,0,2]=3 1175 B11R1.17 CCCNc1ccccc1F Amb6697369 [0,1,0,0,0,0|0,0,2]=3 1176 B11R1.17 CCCNc1ccccc1N Amb440116 [0,1,0,0,0,0|0,0,2]=3 1177 B11R1.17 CCCNc1cccnc1F Amb35725083 [0,1,0,0,0,0|1,0,2]=4 1178 B11R1.17 CCCNc1ccncc1C Amb28437320 [0,1,0,0,0,0|1,0,2]=4 1179 B11R1.17 CCCNc1ccncc1N Amb9205187 [0,1,0,0,0,0|1,0,2]=4 1180 B11R1.17 CCCNc1cnccc1C Amb27436805 [0,1,0,0,0,0|1,0,2]=4 1181 B11R1.17 CCCNc1cnccc1Cl Amb27814860 [0,1,0,0,0,0|1,0,2]=4 1182 B11R1.17 CCCNc1ncccc1C Amb18987728 [0,1,0,0,0,0|1,0,2]=4 1183 B11R1.17 CCCNc1ncccc1F Amb18300627 [0,1,0,0,0,0|1,0,2]=4 1184 B11R1.17 CCCNc1ncccc1N Amb20668081 [0,1,0,0,0,0|1,0,2]=4 1185 B11R1.17 CCCNc1ncccc1N Amb7767452 [0,1,0,0,0,0|1,0,2]=4 1186 B11R1.17 CCCOc1ccccc1Br Amb6267012 [0,1,0,0,0,0|1,0,2]=4 1187 B11R1.17 CCCOc1ccccc1F Amb21856719 [0,1,0,0,0,0|1,0,2]=4 1188 B11R1.17 CCCOc1ccccc1I Amb27171983 [0,1,0,0,0,0|1,0,2]=4 1189 B11R1.17 CCCOc1ccccc1N Amb1210617 [0,1,0,0,0,0|1,0,2]=4 1190 B11R1.17 CCCOc1ccccc1N Amb840073 [0,1,0,0,0,0|1,0,2]=4 1191 B11R1.17 CCCOc1ccccc1O Amb433886 [0,1,0,0,0,0|1,0,2]=4 1192 B11R1.17 CCCOc1ccccc1S Amb28399283 [0,1,0,0,0,0|1,0,2]=4 1193 B11R1.17 CCCSc1ccccc1Br Amb28046780 [0,1,0,0,0,0|1,0,2]=4 1194 B11R1.17 CCCSc1ccccc1Cl Amb25957434 [0,1,0,0,0,0|1,0,2]=4 1195 B11R1.17 CCCSc1ccccc1F Amb27752807 [0,1,0,0,0,0|1,0,2]=4 1196 B11R1.17 CCCSc1ccccc1N Amb22588094 [0,1,0,0,0,0|1,0,2]=4 1197 B11R1.17 CCCSc1ccccc1N Amb6276699 [0,1,0,0,0,0|1,0,2]=4 1198 B11R1.17 CCCSc1ccccc1S Amb26323053 [0,1,0,0,0,0|1,0,2]=4 1199 B11R1.17 CNCCc1ccccc1Br Amb18299468 [0,1,0,0,0,0|2,0,1]=4 1200 B11R1.17 CNCCc1ccccc1Br Amb33313471 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.17 CNCCc1ccccc1C Amb19959980 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.17 CNCCc1ccccc1C Amb8841496 [0,1,0,0,0,0|2,0,1]=4 1203 B11R1.17 CNCCc1ccccc1Cl Amb8853664 [0,1,0,0,0,0|2,0,1]=4 1204 B11R1.17 CNCCc1ccccc1F Amb6710685 [0,1,0,0,0,0|2,0,1]=4 1205 B11R1.17 CNCCc1ccccc1O Amb18560895 [0,1,0,0,0,0|2,0,1]=4 1206 B11R1.17 CNCCc1ccccc1O Amb30584750 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.17 COCCc1ccccc1Br Amb4021414 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.17 COCCc1ccccc1N Amb18992153 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.17 COCCc1ccccc1O Amb33552299 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.17 COCOc1ccccc1Br Amb21912438 [0,1,0,0,0,0|2,0,1]=4 1211 B11R1.17 COCOc1ccccc1C Amb10559613 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.17 COCOc1ccccc1Cl Amb25840223 [0,1,0,0,0,0|2,0,1]=4 1213 B11R1.17 COCOc1ccccc1F Amb22546792 [0,1,0,0,0,0|2,0,1]=4 1214 B11R1.17 COCOc1ccccc1I Amb22284514 [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.17 COCOc1ccccc1N Amb23599107 [0,1,0,0,0,0|2,0,1]=4 1216 B11R1.17 COCSc1ccccc1Br Amb27605149 [0,1,0,0,0,0|2,0,1]=4 1217 B11R1.17 COCSc1ccccc1C Amb27775698 [0,1,0,0,0,0|2,0,1]=4 1218 B11R1.17 COCSc1ccccc1F Amb28282291 [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.17 COCSc1ccccc1O Amb27754976 [0,1,0,0,0,0|2,0,1]=4 1220 B11R1.17 CSCCc1ccccc1N Amb18299122 [0,1,0,0,0,0|2,0,1]=4 1221 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [0,1,0,0,0,0|1,0,2]=4 1222 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [0,1,0,0,0,0|1,0,2]=4 1223 B11R1.17 C\C=C\Sc1ccccc1N Amb27234697 [0,1,0,0,0,0|1,0,2]=4 1224 B11R1.17 C\C=N\Nc1ccccc1N Amb27167739 [0,1,0,0,0,0|1,0,1]=3 1225 B11R1.17 Cc1ccccc1C#CC=O Amb18635840 [0,1,0,0,0,0|2,0,1]=4 1226 B11R1.17 Cc1ccccc1CCC#N Amb17204295 [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [0,1,0,0,0,0|2,0,0]=3 1228 B11R1.17 Cc1ccccc1CCCBr Amb17104552 [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.17 Cc1ccccc1CCCCl Amb17104525 [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.17 Cc1ccccc1CCCN Amb33743608 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.17 Cc1ccccc1CCCN Amb5735477 [0,1,0,0,0,0|2,0,1]=4 1232 B11R1.17 Cc1ccccc1CCCO Amb17089494 [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.17 Cc1ccccc1CCCS Amb17400218 [0,1,0,0,0,0|2,0,1]=4 1234 B11R1.17 Cc1ccccc1CCNN Amb6242730 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.17 Cc1ccccc1CCON Amb26991554 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.17 Cc1ccccc1NCC#N Amb6714251 [0,1,0,0,0,0|1,0,1]=3 1240 B11R1.17 Cc1ccccc1NCCBr Amb27481681 [0,1,0,0,0,0|1,0,1]=3 1241 B11R1.17 Cc1ccccc1NCCCl Amb17334785 [0,1,0,0,0,0|1,0,1]=3 1242 B11R1.17 Cc1ccccc1NCCN Amb17057744 [0,1,0,0,0,0|1,0,1]=3 1243 B11R1.17 Cc1ccccc1NCCO Amb2720820 [0,1,0,0,0,0|1,0,1]=3 1244 B11R1.17 Cc1ccccc1OCC#N Amb4036310 [0,1,0,0,0,0|2,0,1]=4 1245 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,1,0,0,0,0|2,0,0]=3 1246 B11R1.17 Cc1ccccc1OCCBr Amb1105693 [0,1,0,0,0,0|2,0,1]=4 1247 B11R1.17 Cc1ccccc1OCCCl Amb5559281 [0,1,0,0,0,0|2,0,1]=4 1248 B11R1.17 Cc1ccccc1OCCF Amb26588103 [0,1,0,0,0,0|2,0,1]=4 1249 B11R1.17 Cc1ccccc1OCCN Amb1098984 [0,1,0,0,0,0|2,0,1]=4 1250 B11R1.17 Cc1ccccc1OCCN Amb2052283 [0,1,0,0,0,0|2,0,1]=4 1251 B11R1.17 Cc1ccccc1OCCO Amb2209345 [0,1,0,0,0,0|2,0,1]=4 1252 B11R1.17 Cc1ccccc1OCCS Amb6255243 [0,1,0,0,0,0|2,0,1]=4 1253 B11R1.17 Cc1ccccc1SCC#N Amb18792512 [0,1,0,0,0,0|2,0,1]=4 1254 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|2,0,0]=3 1255 B11R1.17 Cc1ccccc1SCCF Amb27853875 [0,1,0,0,0,0|2,0,1]=4 1256 B11R1.17 Cc1ccccc1SCCN Amb18992759 [0,1,0,0,0,0|2,0,1]=4 1257 B11R1.17 Cc1ccccc1SCCO Amb18180155 [0,1,0,0,0,0|2,0,1]=4 1258 B11R1.17 Cc1ccccc1S\C=C\Cl Amb26481359 [0,1,0,0,0,0|2,0,1]=4 1259 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [0,1,0,0,0,0|2,0,1]=4 1260 B11R1.17 Cc1cccnc1NCCCl Amb27761712 [0,1,0,0,0,0|2,0,1]=4 1261 B11R1.17 Cc1cccnc1NCCN Amb10607838 [0,1,0,0,0,0|2,0,1]=4 1262 B11R1.17 Cc1cccnc1NCCS Amb27840266 [0,1,0,0,0,0|2,0,1]=4 1263 B11R1.17 Cc1cccnc1SCC=O Amb29879878 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.17 Cc1ccncc1CCC=O Amb27971665 [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.17 Cc1cnccc1CCC=O Amb33426427 [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.17 Cc1cnccc1NCCN Amb8503377 [0,1,0,0,0,0|2,0,1]=4 1267 B11R1.17 Cc1ncccc1CCC=O Amb32879664 [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.17 Cc1ncccc1NCCN Amb28365662 [0,1,0,0,0,0|2,0,1]=4 1269 B11R1.17 ClCCCc1ccccc1Br Amb26508575 [0,1,0,0,0,0|2,0,1]=4 1270 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [0,1,0,0,0,0|2,0,1]=4 1271 B11R1.17 ClCCNc1ccccc1Br Amb17346196 [0,1,0,0,0,0|1,0,1]=3 1272 B11R1.17 ClCCNc1ccccc1Cl Amb17336180 [0,1,0,0,0,0|1,0,1]=3 1273 B11R1.17 ClCCNc1ccncc1Br Amb28050806 [0,1,0,0,0,0|2,0,1]=4 1274 B11R1.17 ClCCOc1ccccc1Br Amb4477181 [0,1,0,0,0,0|2,0,1]=4 1275 B11R1.17 ClCCOc1ccccc1Cl Amb8828429 [0,1,0,0,0,0|2,0,1]=4 1276 B11R1.17 ClCCSc1ccccc1Cl Amb8827948 [0,1,0,0,0,0|2,0,1]=4 1277 B11R1.17 Clc1ccccc1CCCBr Amb17104560 [0,1,0,0,0,0|2,0,1]=4 1278 B11R1.17 Clc1ccccc1OCCBr Amb1150980 [0,1,0,0,0,0|2,0,1]=4 1279 B11R1.17 Clc1ccccc1OCCI Amb28056714 [0,1,0,0,0,0|2,0,1]=4 1280 B11R1.17 FCCNc1ccccc1Br Amb27596368 [0,1,0,0,0,0|1,0,1]=3 1281 B11R1.17 FCCNc1ccccc1Cl Amb27868080 [0,1,0,0,0,0|1,0,1]=3 1282 B11R1.17 FCCNc1ccncc1F Amb30035770 [0,1,0,0,0,0|2,0,1]=4 1283 B11R1.17 FCCNc1ncccc1Br Amb27249939 [0,1,0,0,0,0|2,0,1]=4 1284 B11R1.17 FCCOc1ccccc1Br Amb27391893 [0,1,0,0,0,0|2,0,1]=4 1285 B11R1.17 FCCOc1ccccc1I Amb28072521 [0,1,0,0,0,0|2,0,1]=4 1286 B11R1.17 FCCSc1ccccc1Br Amb22227854 [0,1,0,0,0,0|2,0,1]=4 1287 B11R1.17 Fc1ccccc1CCCBr Amb17104555 [0,1,0,0,0,0|2,0,1]=4 1288 B11R1.17 Fc1ccccc1CCCCl Amb17104528 [0,1,0,0,0,0|2,0,1]=4 1289 B11R1.17 Fc1ccccc1CCCS Amb17400332 [0,1,0,0,0,0|2,0,1]=4 1290 B11R1.17 Fc1ccccc1NCCCl Amb17334964 [0,1,0,0,0,0|1,0,1]=3 1291 B11R1.17 Fc1ccccc1OCCBr Amb1103643 [0,1,0,0,0,0|2,0,1]=4 1292 B11R1.17 Fc1ccccc1OCCCl Amb8828428 [0,1,0,0,0,0|2,0,1]=4 1293 B11R1.17 Fc1ccccc1OCCS Amb6255864 [0,1,0,0,0,0|2,0,1]=4 1294 B11R1.17 Fc1ccccc1SCCCl Amb1154202 [0,1,0,0,0,0|2,0,1]=4 1295 B11R1.17 Fc1ccccc1SCCI Amb28364151 [0,1,0,0,0,0|2,0,1]=4 1296 B11R1.17 Fc1cccnc1NCCCl Amb28207697 [0,1,0,0,0,0|2,0,1]=4 1297 B11R1.17 Fc1cnccc1NCCCl Amb35655335 [0,1,0,0,0,0|2,0,1]=4 1298 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [0,1,0,0,0,0|2,0,1]=4 1299 B11R1.17 N#CCCc1ccccc1Cl Amb2686406 [0,1,0,0,0,0|2,0,1]=4 1300 B11R1.17 N#CCCc1ccccc1F Amb17204298 [0,1,0,0,0,0|2,0,1]=4 1301 B11R1.17 N#CCCc1ccccc1O Amb17509008 [0,1,0,0,0,0|2,0,1]=4 1302 B11R1.17 N#CCCc1ccccc1S Amb28208431 [0,1,0,0,0,0|2,0,1]=4 1303 B11R1.17 N#CCNc1ccccc1Br Amb6712133 [0,1,0,0,0,0|1,0,1]=3 1304 B11R1.17 N#CCNc1ccccc1Cl Amb6712355 [0,1,0,0,0,0|1,0,1]=3 1305 B11R1.17 N#CCNc1ccccc1F Amb6712545 [0,1,0,0,0,0|1,0,1]=3 1306 B11R1.17 N#CCNc1ccccc1N Amb2609638 [0,1,0,0,0,0|1,0,1]=3 1307 B11R1.17 N#CCNc1ccccc1O Amb28119295 [0,1,0,0,0,0|1,0,1]=3 1308 B11R1.17 N#CCNc1cnccc1I Amb27209356 [0,1,0,0,0,0|2,0,1]=4 1309 B11R1.17 N#CCOc1ccccc1Br Amb2720452 [0,1,0,0,0,0|2,0,1]=4 1310 B11R1.17 N#CCOc1ccccc1Cl Amb2686311 [0,1,0,0,0,0|2,0,1]=4 1311 B11R1.17 N#CCOc1ccccc1F Amb33532602 [0,1,0,0,0,0|2,0,1]=4 1312 B11R1.17 N#CCOc1ccccc1N Amb6251107 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.17 N#CCSc1ccccc1Br Amb8994901 [0,1,0,0,0,0|2,0,1]=4 1314 B11R1.17 N#CCSc1ccccc1Cl Amb6677759 [0,1,0,0,0,0|2,0,1]=4 1315 B11R1.17 N#CCSc1ccccc1F Amb6677732 [0,1,0,0,0,0|2,0,1]=4 1316 B11R1.17 N#CCSc1ccccc1O Amb18177810 [0,1,0,0,0,0|2,0,1]=4 1317 B11R1.17 N=C\C=C\c1ccccc1O Amb27226996 [0,1,0,0,0,0|2,0,1]=4 1318 B11R1.17 NCCCc1ccccc1Br Amb33533965 [0,1,0,0,0,0|2,0,1]=4 1319 B11R1.17 NCCCc1ccccc1Br Amb9304915 [0,1,0,0,0,0|2,0,1]=4 1320 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [0,1,0,0,0,0|2,0,1]=4 1321 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [0,1,0,0,0,0|2,0,1]=4 1322 B11R1.17 NCCCc1ccccc1F Amb13949158 [0,1,0,0,0,0|2,0,1]=4 1323 B11R1.17 NCCCc1ccccc1F Amb5735478 [0,1,0,0,0,0|2,0,1]=4 1324 B11R1.17 NCCCc1ccccc1I Amb27814275 [0,1,0,0,0,0|2,0,1]=4 1325 B11R1.17 NCCCc1ccccc1N Amb17477695 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.17 NCCCc1ccccc1O Amb2695303 [0,1,0,0,0,0|2,0,1]=4 1327 B11R1.17 NCCNc1ccccc1Br Amb17091073 [0,1,0,0,0,0|1,0,1]=3 1328 B11R1.17 NCCNc1ccccc1Cl Amb17057749 [0,1,0,0,0,0|1,0,1]=3 1329 B11R1.17 NCCNc1ccccc1F Amb17057747 [0,1,0,0,0,0|1,0,1]=3 1330 B11R1.17 NCCNc1ccccc1N Amb2794704 [0,1,0,0,0,0|1,0,1]=3 1331 B11R1.17 NCCNc1ccccc1O Amb18251377 [0,1,0,0,0,0|1,0,1]=3 1332 B11R1.17 NCCNc1cccnc1F Amb35725084 [0,1,0,0,0,0|2,0,1]=4 1333 B11R1.17 NCCNc1ncccc1I Amb27209343 [0,1,0,0,0,0|2,0,1]=4 1334 B11R1.17 NCCNc1ncccc1N Amb18991500 [0,1,0,0,0,0|2,0,1]=4 1335 B11R1.17 NCCOc1ccccc1Br Amb10609932 [0,1,0,0,0,0|2,0,1]=4 1336 B11R1.17 NCCOc1ccccc1Br Amb5781215 [0,1,0,0,0,0|2,0,1]=4 1337 B11R1.17 NCCOc1ccccc1Cl Amb836407 [0,1,0,0,0,0|2,0,1]=4 1338 B11R1.17 NCCOc1ccccc1F Amb1105167 [0,1,0,0,0,0|2,0,1]=4 1339 B11R1.17 NCCOc1ccccc1F Amb6859379 [0,1,0,0,0,0|2,0,1]=4 1340 B11R1.17 NCCOc1ccccc1N Amb18251366 [0,1,0,0,0,0|2,0,1]=4 1341 B11R1.17 NCCSc1ccccc1F Amb6265436 [0,1,0,0,0,0|2,0,1]=4 1342 B11R1.17 NCCSc1ccccc1N Amb6761760 [0,1,0,0,0,0|2,0,1]=4 1343 B11R1.17 NCCSc1ccccc1O Amb18984794 [0,1,0,0,0,0|2,0,1]=4 1344 B11R1.17 NNCCc1ccccc1Cl Amb6243429 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.17 NNCCc1ccccc1F Amb20668135 [0,1,0,0,0,0|3,0,0]=4 1346 B11R1.17 NNCCc1ccccc1F Amb6480211 [0,1,0,0,0,0|3,0,0]=4 1347 B11R1.17 NOCCc1ccccc1Br Amb18657908 [0,1,0,0,0,0|3,0,0]=4 1348 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [0,1,0,0,0,0|3,0,0]=4 1349 B11R1.17 NOCCc1ccccc1F Amb22896629 [0,1,0,0,0,0|3,0,0]=4 1350 B11R1.17 NOCCc1ccccc1O Amb28063031 [0,1,0,0,0,0|3,0,0]=4 1351 B11R1.17 Nc1ccccc1CCCCl Amb17477710 [0,1,0,0,0,0|2,0,1]=4 1352 B11R1.17 Nc1ccccc1CCCF Amb28059275 [0,1,0,0,0,0|2,0,1]=4 1353 B11R1.17 Nc1ccccc1CCCO Amb17477702 [0,1,0,0,0,0|2,0,1]=4 1354 B11R1.17 Nc1ccccc1NCCO Amb404596 [0,1,0,0,0,0|1,0,1]=3 1355 B11R1.17 Nc1ccccc1NCCO Amb6891865 [0,1,0,0,0,0|1,0,1]=3 1356 B11R1.17 Nc1ccccc1NCCS Amb27794574 [0,1,0,0,0,0|1,0,1]=3 1357 B11R1.17 Nc1ccccc1OCCBr Amb34157677 [0,1,0,0,0,0|2,0,1]=4 1358 B11R1.17 Nc1ccccc1OCCBr Amb842426 [0,1,0,0,0,0|2,0,1]=4 1359 B11R1.17 Nc1ccccc1OCCCl Amb27474853 [0,1,0,0,0,0|2,0,1]=4 1360 B11R1.17 Nc1ccccc1OCCF Amb23579999 [0,1,0,0,0,0|2,0,1]=4 1361 B11R1.17 Nc1ccccc1OCCO Amb33734854 [0,1,0,0,0,0|2,0,1]=4 1362 B11R1.17 Nc1ccccc1OCCO Amb6702378 [0,1,0,0,0,0|2,0,1]=4 1363 B11R1.17 Nc1ccccc1SCCCl Amb18129706 [0,1,0,0,0,0|2,0,1]=4 1364 B11R1.17 Nc1ccccc1SCCS Amb28137778 [0,1,0,0,0,0|2,0,1]=4 1365 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,0,0,0,0|2,0,1]=4 1366 B11R1.17 Nc1cccnc1NCCF Amb28061770 [0,1,0,0,0,0|2,0,1]=4 1367 B11R1.17 Nc1cccnc1NCCO Amb7768142 [0,1,0,0,0,0|2,0,1]=4 1368 B11R1.17 Nc1ccncc1NCCF Amb27478095 [0,1,0,0,0,0|2,0,1]=4 1369 B11R1.17 Nc1ccncc1NCCO Amb27857352 [0,1,0,0,0,0|2,0,1]=4 1370 B11R1.17 Nc1cnccc1NCCCl Amb27478063 [0,1,0,0,0,0|2,0,1]=4 1371 B11R1.17 Nc1cnccc1NCCO Amb33529127 [0,1,0,0,0,0|2,0,1]=4 1372 B11R1.17 Nc1ncccc1NNC=O Amb18125378 [0,1,0,0,0,0|3,0,0]=4 1373 B11R1.17 O=CC#Cc1ccccc1F Amb18117458 [0,1,0,0,0,0|2,0,1]=4 1374 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|2,0,0]=3 1375 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|2,0,0]=3 1376 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|2,0,0]=3 1377 B11R1.17 O=CCCc1ccccc1O Amb22228954 [0,1,0,0,0,0|2,0,0]=3 1378 B11R1.17 O=CCCc1cccnc1Br Amb33388081 [0,1,0,0,0,0|3,0,0]=4 1379 B11R1.17 O=CCCc1cccnc1Cl Amb33052730 [0,1,0,0,0,0|3,0,0]=4 1380 B11R1.17 O=CCCc1cccnc1F Amb33377143 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.17 O=CCCc1ccncc1Br Amb33243315 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.17 O=CCCc1ccncc1Cl Amb27617324 [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.17 O=CCCc1ccncc1F Amb25677089 [0,1,0,0,0,0|3,0,0]=4 1384 B11R1.17 O=CCCc1ncccc1Br Amb27153362 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.17 O=CCCc1ncccc1F Amb27878559 [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|2,0,0]=3 1387 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,1,0,0,0,0|2,0,0]=3 1388 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|2,0,0]=3 1389 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,1,0,0,0,0|2,0,0]=3 1390 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,1,0,0,0,0|2,0,0]=3 1391 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [0,1,0,0,0,0|2,0,0]=3 1392 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|2,0,0]=3 1393 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|2,0,0]=3 1394 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|3,0,0]=4 1395 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,0,0,0,0|2,0,1]=4 1396 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [0,1,0,0,0,0|2,0,1]=4 1400 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [0,1,0,0,0,0|3,0,0]=4 1401 B11R1.17 OCCCc1ccccc1Br Amb15692692 [0,1,0,0,0,0|2,0,1]=4 1402 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [0,1,0,0,0,0|2,0,1]=4 1403 B11R1.17 OCCCc1ccccc1F Amb17089496 [0,1,0,0,0,0|2,0,1]=4 1404 B11R1.17 OCCCc1ccccc1I Amb27246348 [0,1,0,0,0,0|2,0,1]=4 1405 B11R1.17 OCCCc1ccccc1O Amb17477714 [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.17 OCCNc1ccccc1Br Amb6712178 [0,1,0,0,0,0|1,0,1]=3 1407 B11R1.17 OCCNc1ccccc1Cl Amb6712397 [0,1,0,0,0,0|1,0,1]=3 1408 B11R1.17 OCCNc1ccccc1F Amb6712587 [0,1,0,0,0,0|1,0,1]=3 1409 B11R1.17 OCCNc1ccncc1Br Amb27766939 [0,1,0,0,0,0|2,0,1]=4 1410 B11R1.17 OCCNc1ccncc1F Amb35737123 [0,1,0,0,0,0|2,0,1]=4 1411 B11R1.17 OCCNc1ncccc1Br Amb18292072 [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.17 OCCOc1ccccc1Br Amb6702414 [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.17 OCCOc1ccccc1Cl Amb2209355 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.17 OCCOc1ccccc1F Amb9370651 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.17 OCCOc1ccccc1I Amb25761613 [0,1,0,0,0,0|2,0,1]=4 1416 B11R1.17 OCCOc1ccccc1O Amb1144452 [0,1,0,0,0,0|2,0,1]=4 1417 B11R1.17 OCCSc1ccccc1Br Amb2685464 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.17 OCCSc1ccccc1Cl Amb2686420 [0,1,0,0,0,0|2,0,1]=4 1419 B11R1.17 OCCSc1ccccc1F Amb2688392 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.17 OCCSc1ccccc1O Amb18177935 [0,1,0,0,0,0|2,0,1]=4 1421 B11R1.17 Oc1ccccc1CCCBr Amb27667946 [0,1,0,0,0,0|2,0,1]=4 1422 B11R1.17 Oc1ccccc1CCCCl Amb17477721 [0,1,0,0,0,0|2,0,1]=4 1423 B11R1.17 Oc1ccccc1CCCS Amb26040563 [0,1,0,0,0,0|2,0,1]=4 1424 B11R1.17 Oc1ccccc1OCCCl Amb27595619 [0,1,0,0,0,0|2,0,1]=4 1425 B11R1.17 Oc1ccccc1OCCF Amb27601772 [0,1,0,0,0,0|2,0,1]=4 1426 B11R1.17 SCCCc1ccccc1Br Amb18070447 [0,1,0,0,0,0|2,0,1]=4 1427 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [0,1,0,0,0,0|2,0,1]=4 1428 B11R1.17 SCCOc1ccccc1Br Amb17250554 [0,1,0,0,0,0|2,0,1]=4 1429 B11R1.17 SCCOc1ccccc1Cl Amb6255607 [0,1,0,0,0,0|2,0,1]=4 1430 B11R1.17 SCCOc1ccccc1I Amb27761382 [0,1,0,0,0,0|2,0,1]=4 1431 B11R1.17 SCCSc1ccccc1Cl Amb27588702 [0,1,0,0,0,0|2,0,1]=4 1432 B11R1.17 [C-]#[N+]CCc1ccccc1Br Amb33387614 [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.17 [C-]#[N+]CCc1ccccc1C Amb2689592 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.17 [C-]#[N+]CCc1ccccc1Cl Amb2686344 [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.17 [C-]#[N+]CCc1ccccc1F Amb2688285 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.24 BrCCCc1cccc(Br)c1 Amb17104576 [0,1,0,0,0,0|2,0,1]=4 1437 B11R1.24 BrCCOc1cccc(Br)c1 Amb1150981 [0,1,0,0,0,0|2,0,1]=4 1438 B11R1.24 BrCCSc1cccc(Br)c1 Amb27594209 [0,1,0,0,0,0|2,0,1]=4 1439 B11R1.24 C#CCCc1cccc(Br)c1 Amb33451616 [0,1,0,0,0,0|1,0,2]=4 1440 B11R1.24 C#CCCc1cccc(C)c1 Amb33380572 [0,1,0,0,0,0|1,0,2]=4 1441 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [0,1,0,0,0,0|1,0,2]=4 1442 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [0,1,0,0,0,0|1,0,2]=4 1443 B11R1.24 C#CCCc1cccc(O)c1 Amb33312065 [0,1,0,0,0,0|1,0,2]=4 1444 B11R1.24 C#CCNc1cc(N)ccn1 Amb25230495 [0,1,0,0,0,0|1,0,2]=4 1445 B11R1.24 C#CCNc1cccc(Br)c1 Amb27838179 [0,1,0,0,0,0|0,0,2]=3 1446 B11R1.24 C#CCNc1cccc(C)c1 Amb27823265 [0,1,0,0,0,0|0,0,2]=3 1447 B11R1.24 C#CCNc1cccc(Cl)c1 Amb18800989 [0,1,0,0,0,0|0,0,2]=3 1448 B11R1.24 C#CCNc1cccc(F)c1 Amb24102181 [0,1,0,0,0,0|0,0,2]=3 1449 B11R1.24 C#CCNc1cccc(F)c1 Amb33330128 [0,1,0,0,0,0|0,0,2]=3 1450 B11R1.24 C#CCNc1cccc(F)n1 Amb27803794 [0,1,0,0,0,0|1,0,2]=4 1451 B11R1.24 C#CCNc1ccnc(F)c1 Amb27236377 [0,1,0,0,0,0|1,0,2]=4 1452 B11R1.24 C#CCNc1cncc(C)c1 Amb27951869 [0,1,0,0,0,0|1,0,2]=4 1453 B11R1.24 C#CCNc1cncc(Cl)c1 Amb35706898 [0,1,0,0,0,0|1,0,2]=4 1454 B11R1.24 C#CCNc1cncc(F)c1 Amb28365803 [0,1,0,0,0,0|1,0,2]=4 1455 B11R1.24 C#CCOc1cccc(Br)c1 Amb6257577 [0,1,0,0,0,0|1,0,2]=4 1456 B11R1.24 C#CCOc1cccc(C)c1 Amb19373318 [0,1,0,0,0,0|1,0,2]=4 1457 B11R1.24 C#CCOc1cccc(Cl)c1 Amb18183541 [0,1,0,0,0,0|1,0,2]=4 1458 B11R1.24 C#CCOc1cccc(F)c1 Amb18182728 [0,1,0,0,0,0|1,0,2]=4 1459 B11R1.24 C#CCOc1cccc(I)c1 Amb27779244 [0,1,0,0,0,0|1,0,2]=4 1460 B11R1.24 C#CCOc1cccc(N)c1 Amb13783680 [0,1,0,0,0,0|1,0,2]=4 1461 B11R1.24 C#CCOc1cccc(O)c1 Amb33528803 [0,1,0,0,0,0|1,0,2]=4 1462 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [0,1,0,0,0,0|1,0,0]=2 1463 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [0,1,0,0,0,0|1,0,0]=2 1464 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|1,0,0]=2 1465 B11R1.24 C=CCCc1cncc(C)c1 Amb35715633 [0,1,0,0,0,0|2,0,0]=3 1466 B11R1.24 C=CCCc1cncc(F)c1 Amb35711757 [0,1,0,0,0,0|2,0,0]=3 1467 B11R1.24 C=CCNC1=CC=NC(=O)N1 Amb27849267 [0,1,0,0,0,0|2,0,0]=3 1468 B11R1.24 C=CCNC1=NC(=O)C=CN1 Amb27423884 [0,1,0,0,0,0|2,0,0]=3 1469 B11R1.24 C=CCNC1=NC(=O)NN=C1 Amb19117035 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.24 C=CCNc1cc(C)cnn1 Amb28369431 [0,1,0,0,0,0|2,0,0]=3 1471 B11R1.24 C=CCNc1cc(Cl)ncn1 Amb21958698 [0,1,0,0,0,0|2,0,0]=3 1472 B11R1.24 C=CCNc1cc(F)ncn1 Amb27413219 [0,1,0,0,0,0|2,0,0]=3 1473 B11R1.24 C=CCNc1cc(N)ccn1 Amb17334286 [0,1,0,0,0,0|1,0,0]=2 1474 B11R1.24 C=CCNc1cccc(Br)c1 Amb17306222 [0,1,0,0,0,0|0,0,0]=1 1475 B11R1.24 C=CCNc1cccc(Br)n1 Amb27786248 [0,1,0,0,0,0|1,0,0]=2 1476 B11R1.24 C=CCNc1cccc(C)c1 Amb17306547 [0,1,0,0,0,0|0,0,0]=1 1477 B11R1.24 C=CCNc1cccc(Cl)c1 Amb17307127 [0,1,0,0,0,0|0,0,0]=1 1478 B11R1.24 C=CCNc1cccc(F)c1 Amb17306228 [0,1,0,0,0,0|0,0,0]=1 1479 B11R1.24 C=CCNc1cccc(N)c1 Amb8394241 [0,1,0,0,0,0|0,0,0]=1 1480 B11R1.24 C=CCNc1ccnc(Cl)n1 Amb27798056 [0,1,0,0,0,0|2,0,0]=3 1481 B11R1.24 C=CCNc1ccnc(F)c1 Amb28119394 [0,1,0,0,0,0|1,0,0]=2 1482 B11R1.24 C=CCNc1ccnc(F)n1 Amb35677711 [0,1,0,0,0,0|2,0,0]=3 1483 B11R1.24 C=CCNc1cncc(Cl)c1 Amb35706902 [0,1,0,0,0,0|1,0,0]=2 1484 B11R1.24 C=CCNc1cncc(F)n1 Amb35693652 [0,1,0,0,0,0|2,0,0]=3 1485 B11R1.24 C=CCNc1cncc(N)n1 Amb27757842 [0,1,0,0,0,0|2,0,0]=3 1486 B11R1.24 C=CCNc1nccc(N)n1 Amb27826633 [0,1,0,0,0,0|2,0,0]=3 1487 B11R1.24 C=CCOc1cc(F)ncn1 Amb27666642 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.24 C=CCOc1cccc(Br)c1 Amb6263292 [0,1,0,0,0,0|1,0,0]=2 1489 B11R1.24 C=CCOc1cccc(Br)n1 Amb27804353 [0,1,0,0,0,0|2,0,0]=3 1490 B11R1.24 C=CCOc1cccc(C)n1 Amb25752190 [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.24 C=CCOc1cccc(Cl)c1 Amb27223591 [0,1,0,0,0,0|1,0,0]=2 1492 B11R1.24 C=CCOc1cccc(N)c1 Amb2094493 [0,1,0,0,0,0|1,0,0]=2 1493 B11R1.24 C=CCOc1cccc(N)c1 Amb33527291 [0,1,0,0,0,0|1,0,0]=2 1494 B11R1.24 C=CCOc1cccc(O)c1 Amb8837461 [0,1,0,0,0,0|1,0,0]=2 1495 B11R1.24 C=CCOc1ccnc(C)n1 Amb24102912 [0,1,0,0,0,0|3,0,0]=4 1496 B11R1.24 C=CCOc1ccnc(Cl)n1 Amb18183622 [0,1,0,0,0,0|3,0,0]=4 1497 B11R1.24 C=CCOc1ccnc(F)n1 Amb35657141 [0,1,0,0,0,0|3,0,0]=4 1498 B11R1.24 C=CCOc1ccnc(N)c1 Amb27870562 [0,1,0,0,0,0|2,0,0]=3 1499 B11R1.24 C=CCOc1cncc(Br)c1 Amb25128103 [0,1,0,0,0,0|2,0,0]=3 1500 B11R1.24 C=CCOc1cncc(C)n1 Amb33617692 [0,1,0,0,0,0|3,0,0]=4 1501 B11R1.24 C=CCOc1cncc(Cl)c1 Amb27849069 [0,1,0,0,0,0|2,0,0]=3 1502 B11R1.24 C=CCOc1cncc(F)n1 Amb35700946 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.24 C=CCOc1nccc(C)n1 Amb27240249 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.24 C=CCOc1nccc(I)n1 Amb27631707 [0,1,0,0,0,0|3,0,0]=4 1505 B11R1.24 C=CCSC1=NC(=O)NC=C1 Amb28346676 [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.24 C=CCSC1=NC=CC(=O)N1 Amb21998055 [0,1,0,0,0,0|3,0,0]=4 1507 B11R1.24 C=CCSc1cc(C)ccn1 Amb24463744 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.24 C=CCSc1cccc(Br)c1 Amb26071614 [0,1,0,0,0,0|1,0,0]=2 1509 B11R1.24 C=CCSc1cccc(Cl)c1 Amb26924103 [0,1,0,0,0,0|1,0,0]=2 1510 B11R1.24 C=CCSc1cccc(F)c1 Amb26648175 [0,1,0,0,0,0|1,0,0]=2 1511 B11R1.24 C=CCSc1cccc(F)n1 Amb28364217 [0,1,0,0,0,0|2,0,0]=3 1512 B11R1.24 C=CCSc1ccnc(C)n1 Amb28255845 [0,1,0,0,0,0|3,0,0]=4 1513 B11R1.24 C=CCSc1ccnc(F)n1 Amb35610849 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.24 C=CCSc1cncc(Cl)n1 Amb27867033 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.24 C=CCSc1cncc(F)n1 Amb35712096 [0,1,0,0,0,0|3,0,0]=4 1516 B11R1.24 C=CCSc1nccc(N)n1 Amb27229561 [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [0,1,0,0,0,0|1,0,2]=4 1518 B11R1.24 CCCCc1cccc(C)c1 Amb22730119 [0,1,0,0,0,0|1,0,2]=4 1519 B11R1.24 CCCCc1cccc(Cl)c1 Amb26984112 [0,1,0,0,0,0|1,0,2]=4 1520 B11R1.24 CCCCc1cccc(F)c1 Amb27221595 [0,1,0,0,0,0|1,0,2]=4 1521 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [0,1,0,0,0,0|1,0,2]=4 1522 B11R1.24 CCCCc1cccc(N)c1 Amb17593719 [0,1,0,0,0,0|1,0,2]=4 1523 B11R1.24 CCCCc1cccc(O)c1 Amb26463186 [0,1,0,0,0,0|1,0,2]=4 1524 B11R1.24 CCCNc1cc(Br)ccn1 Amb19959557 [0,1,0,0,0,0|1,0,2]=4 1525 B11R1.24 CCCNc1cc(N)ccn1 Amb17334314 [0,1,0,0,0,0|1,0,2]=4 1526 B11R1.24 CCCNc1cccc(Br)c1 Amb6696672 [0,1,0,0,0,0|0,0,2]=3 1527 B11R1.24 CCCNc1cccc(Br)n1 Amb22831396 [0,1,0,0,0,0|1,0,2]=4 1528 B11R1.24 CCCNc1cccc(Br)n1 Amb25145786 [0,1,0,0,0,0|1,0,2]=4 1529 B11R1.24 CCCNc1cccc(C)c1 Amb6684516 [0,1,0,0,0,0|0,0,2]=3 1530 B11R1.24 CCCNc1cccc(Cl)c1 Amb6695728 [0,1,0,0,0,0|0,0,2]=3 1531 B11R1.24 CCCNc1cccc(Cl)n1 Amb21958678 [0,1,0,0,0,0|1,0,2]=4 1532 B11R1.24 CCCNc1cccc(F)c1 Amb6695885 [0,1,0,0,0,0|0,0,2]=3 1533 B11R1.24 CCCNc1cccc(F)n1 Amb18973532 [0,1,0,0,0,0|1,0,2]=4 1534 B11R1.24 CCCNc1cccc(N)c1 Amb8825430 [0,1,0,0,0,0|0,0,2]=3 1535 B11R1.24 CCCNc1ccnc(Br)c1 Amb27432407 [0,1,0,0,0,0|1,0,2]=4 1536 B11R1.24 CCCNc1ccnc(C)c1 Amb27637577 [0,1,0,0,0,0|1,0,2]=4 1537 B11R1.24 CCCNc1ccnc(Cl)c1 Amb27989155 [0,1,0,0,0,0|1,0,2]=4 1538 B11R1.24 CCCNc1ccnc(F)c1 Amb27263304 [0,1,0,0,0,0|1,0,2]=4 1539 B11R1.24 CCCOc1cccc(Br)c1 Amb33532692 [0,1,0,0,0,0|1,0,2]=4 1540 B11R1.24 CCCOc1cccc(C)c1 Amb10573406 [0,1,0,0,0,0|1,0,2]=4 1541 B11R1.24 CCCOc1cccc(Cl)c1 Amb25787001 [0,1,0,0,0,0|1,0,2]=4 1542 B11R1.24 CCCOc1cccc(F)c1 Amb25700428 [0,1,0,0,0,0|1,0,2]=4 1543 B11R1.24 CCCOc1cccc(I)c1 Amb27393748 [0,1,0,0,0,0|1,0,2]=4 1544 B11R1.24 CCCOc1cccc(N)c1 Amb1138945 [0,1,0,0,0,0|1,0,2]=4 1545 B11R1.24 CCCOc1cccc(O)c1 Amb8837439 [0,1,0,0,0,0|1,0,2]=4 1546 B11R1.24 CCCOc1cccc(S)c1 Amb26554006 [0,1,0,0,0,0|1,0,2]=4 1547 B11R1.24 CCCSc1cccc(Br)c1 Amb24538191 [0,1,0,0,0,0|1,0,2]=4 1548 B11R1.24 CCCSc1cccc(C)c1 Amb28315009 [0,1,0,0,0,0|1,0,2]=4 1549 B11R1.24 CCCSc1cccc(Cl)c1 Amb25801816 [0,1,0,0,0,0|1,0,2]=4 1550 B11R1.24 CCCSc1cccc(N)c1 Amb18289141 [0,1,0,0,0,0|1,0,2]=4 1551 B11R1.24 CCCSc1cccc(S)c1 Amb26337168 [0,1,0,0,0,0|1,0,2]=4 1552 B11R1.24 CNCCc1cccc(Br)c1 Amb16230486 [0,1,0,0,0,0|2,0,1]=4 1553 B11R1.24 CNCCc1cccc(Br)c1 Amb28652826 [0,1,0,0,0,0|2,0,1]=4 1554 B11R1.24 CNCCc1cccc(C)c1 Amb16230487 [0,1,0,0,0,0|2,0,1]=4 1555 B11R1.24 CNCCc1cccc(Cl)c1 Amb5785537 [0,1,0,0,0,0|2,0,1]=4 1556 B11R1.24 CNCCc1cccc(F)c1 Amb8841505 [0,1,0,0,0,0|2,0,1]=4 1557 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [0,1,0,0,0,0|2,0,1]=4 1558 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [0,1,0,0,0,0|2,0,1]=4 1559 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [0,1,0,0,0,0|2,0,1]=4 1560 B11R1.24 COCOc1cccc(Br)c1 Amb25810590 [0,1,0,0,0,0|2,0,1]=4 1561 B11R1.24 COCOc1cccc(C)c1 Amb27169027 [0,1,0,0,0,0|2,0,1]=4 1562 B11R1.24 COCOc1cccc(Cl)c1 Amb24551706 [0,1,0,0,0,0|2,0,1]=4 1563 B11R1.24 COCOc1cccc(F)c1 Amb21858121 [0,1,0,0,0,0|2,0,1]=4 1564 B11R1.24 COCOc1cccc(N)c1 Amb25096531 [0,1,0,0,0,0|2,0,1]=4 1565 B11R1.24 COCOc1cccc(O)c1 Amb26575320 [0,1,0,0,0,0|2,0,1]=4 1566 B11R1.24 COCSc1cccc(Br)c1 Amb27196993 [0,1,0,0,0,0|2,0,1]=4 1567 B11R1.24 CSCSc1cccc(C)c1 Amb27172833 [0,1,0,0,0,0|2,0,1]=4 1568 B11R1.24 CSCSc1cccc(O)c1 Amb28201670 [0,1,0,0,0,0|2,0,1]=4 1569 B11R1.24 Cc1cc(CCC=O)ccn1 Amb27208272 [0,1,0,0,0,0|3,0,0]=4 1570 B11R1.24 Cc1cc(NCCCl)ccn1 Amb28050822 [0,1,0,0,0,0|2,0,1]=4 1571 B11R1.24 Cc1cc(NCCO)ccn1 Amb27453034 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.24 Cc1cccc(CCC#N)c1 Amb17204296 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [0,1,0,0,0,0|2,0,0]=3 1574 B11R1.24 Cc1cccc(CCC=O)n1 Amb27949575 [0,1,0,0,0,0|3,0,0]=4 1575 B11R1.24 Cc1cccc(CCCBr)c1 Amb17104553 [0,1,0,0,0,0|2,0,1]=4 1576 B11R1.24 Cc1cccc(CCCCl)c1 Amb17104526 [0,1,0,0,0,0|2,0,1]=4 1577 B11R1.24 Cc1cccc(CCCN)c1 Amb844760 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.24 Cc1cccc(CCCO)c1 Amb17089495 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.24 Cc1cccc(CCCS)c1 Amb17400219 [0,1,0,0,0,0|2,0,1]=4 1580 B11R1.24 Cc1cccc(CCNN)c1 Amb17399915 [0,1,0,0,0,0|3,0,0]=4 1581 B11R1.24 Cc1cccc(CCON)c1 Amb25704227 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.24 Cc1cccc(CC[Zn]Br)c1 Amb6300300 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.24 Cc1cccc(CNC=O)c1 Amb27752387 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.24 Cc1cccc(NCC#N)c1 Amb6706712 [0,1,0,0,0,0|1,0,1]=3 1585 B11R1.24 Cc1cccc(NCCBr)c1 Amb27839685 [0,1,0,0,0,0|1,0,1]=3 1586 B11R1.24 Cc1cccc(NCCCl)c1 Amb17334786 [0,1,0,0,0,0|1,0,1]=3 1587 B11R1.24 Cc1cccc(NCCN)c1 Amb17057745 [0,1,0,0,0,0|1,0,1]=3 1588 B11R1.24 Cc1cccc(NCCN)n1 Amb18970380 [0,1,0,0,0,0|2,0,1]=4 1589 B11R1.24 Cc1cccc(NCCN)n1 Amb19440303 [0,1,0,0,0,0|2,0,1]=4 1590 B11R1.24 Cc1cccc(NCCO)c1 Amb6706757 [0,1,0,0,0,0|1,0,1]=3 1591 B11R1.24 Cc1cccc(NCCO)n1 Amb18290373 [0,1,0,0,0,0|2,0,1]=4 1592 B11R1.24 Cc1cccc(OCC#N)c1 Amb5780889 [0,1,0,0,0,0|2,0,1]=4 1593 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [0,1,0,0,0,0|2,0,0]=3 1594 B11R1.24 Cc1cccc(OCCBr)c1 Amb1643479 [0,1,0,0,0,0|2,0,1]=4 1595 B11R1.24 Cc1cccc(OCCCl)c1 Amb9209776 [0,1,0,0,0,0|2,0,1]=4 1596 B11R1.24 Cc1cccc(OCCI)c1 Amb27260656 [0,1,0,0,0,0|2,0,1]=4 1597 B11R1.24 Cc1cccc(OCCN)c1 Amb1098983 [0,1,0,0,0,0|2,0,1]=4 1598 B11R1.24 Cc1cccc(OCCN)c1 Amb4008296 [0,1,0,0,0,0|2,0,1]=4 1599 B11R1.24 Cc1cccc(OCCO)c1 Amb2209346 [0,1,0,0,0,0|2,0,1]=4 1600 B11R1.24 Cc1cccc(OCCS)c1 Amb17232680 [0,1,0,0,0,0|2,0,1]=4 1601 B11R1.24 Cc1cccc(O\C=C\Cl)c1 Amb27471988 [0,1,0,0,0,0|2,0,1]=4 1602 B11R1.24 Cc1cccc(SCC#N)c1 Amb18788233 [0,1,0,0,0,0|2,0,1]=4 1603 B11R1.24 Cc1cccc(SCC=O)c1 Amb17082932 [0,1,0,0,0,0|2,0,0]=3 1604 B11R1.24 Cc1cccc(SCCBr)c1 Amb24753608 [0,1,0,0,0,0|2,0,1]=4 1605 B11R1.24 Cc1cccc(SCCN)c1 Amb17083043 [0,1,0,0,0,0|2,0,1]=4 1606 B11R1.24 Cc1cccc(\C=C\C=O)c1 Amb17232008 [0,1,0,0,0,0|2,0,1]=4 1607 B11R1.24 Cc1ccnc(CCC=O)c1 Amb33317814 [0,1,0,0,0,0|3,0,0]=4 1608 B11R1.24 Cc1ccnc(NCCN)c1 Amb10607842 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.24 Cc1ccnc(NCCO)c1 Amb18981411 [0,1,0,0,0,0|2,0,1]=4 1610 B11R1.24 Cc1ccnc(NCCO)c1 Amb19374562 [0,1,0,0,0,0|2,0,1]=4 1611 B11R1.24 Cc1cncc(CCC=O)c1 Amb33531659 [0,1,0,0,0,0|3,0,0]=4 1612 B11R1.24 ClCCCc1cccc(Br)c1 Amb17104548 [0,1,0,0,0,0|2,0,1]=4 1613 B11R1.24 ClCCCc1cccc(Cl)c1 Amb17104534 [0,1,0,0,0,0|2,0,1]=4 1614 B11R1.24 ClCCNc1cccc(Br)c1 Amb17346197 [0,1,0,0,0,0|1,0,1]=3 1615 B11R1.24 ClCCNc1cccc(Cl)c1 Amb17336181 [0,1,0,0,0,0|1,0,1]=3 1616 B11R1.24 ClCCOc1cccc(Br)c1 Amb8828434 [0,1,0,0,0,0|2,0,1]=4 1617 B11R1.24 ClCCOc1cccc(Cl)c1 Amb9209777 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.24 ClCCOc1cccc(I)c1 Amb8838634 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.24 ClCCSc1cccc(Br)c1 Amb25887053 [0,1,0,0,0,0|2,0,1]=4 1620 B11R1.24 Clc1cccc(CCCBr)c1 Amb17104561 [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.24 Clc1cccc(OCCBr)c1 Amb1152965 [0,1,0,0,0,0|2,0,1]=4 1622 B11R1.24 Clc1cccc(SCCBr)c1 Amb27403537 [0,1,0,0,0,0|2,0,1]=4 1623 B11R1.24 FCCNc1cccc(Br)n1 Amb27753223 [0,1,0,0,0,0|2,0,1]=4 1624 B11R1.24 FCCNc1cccc(Cl)n1 Amb27425167 [0,1,0,0,0,0|2,0,1]=4 1625 B11R1.24 FCCNc1cncc(Br)c1 Amb27832901 [0,1,0,0,0,0|2,0,1]=4 1626 B11R1.24 FCCNc1cncc(Cl)c1 Amb35706905 [0,1,0,0,0,0|2,0,1]=4 1627 B11R1.24 FCCOc1cccc(Br)c1 Amb22227889 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.24 FCCOc1cccc(Cl)c1 Amb24659046 [0,1,0,0,0,0|2,0,1]=4 1629 B11R1.24 FCCOc1cccc(F)c1 Amb22232794 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.24 FCCOc1cccc(I)c1 Amb27823595 [0,1,0,0,0,0|2,0,1]=4 1631 B11R1.24 FCCSc1cccc(Br)c1 Amb28140426 [0,1,0,0,0,0|2,0,1]=4 1632 B11R1.24 Fc1cccc(CCCBr)c1 Amb22886712 [0,1,0,0,0,0|2,0,1]=4 1633 B11R1.24 Fc1cccc(CCCCl)c1 Amb18803316 [0,1,0,0,0,0|2,0,1]=4 1634 B11R1.24 Fc1cccc(CCCS)c1 Amb18065480 [0,1,0,0,0,0|2,0,1]=4 1635 B11R1.24 Fc1cccc(NCCCl)c1 Amb17334966 [0,1,0,0,0,0|1,0,1]=3 1636 B11R1.24 Fc1cccc(OCCBr)c1 Amb6255620 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.24 Fc1cccc(OCCCl)c1 Amb8828438 [0,1,0,0,0,0|2,0,1]=4 1638 B11R1.24 Fc1cccc(OCCS)c1 Amb17232867 [0,1,0,0,0,0|2,0,1]=4 1639 B11R1.24 Fc1cccc(SCCBr)c1 Amb26633460 [0,1,0,0,0,0|2,0,1]=4 1640 B11R1.24 N#CCCc1cccc(Br)c1 Amb2685459 [0,1,0,0,0,0|2,0,1]=4 1641 B11R1.24 N#CCCc1cccc(Cl)c1 Amb17204310 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.24 N#CCCc1cccc(F)c1 Amb10841716 [0,1,0,0,0,0|2,0,1]=4 1643 B11R1.24 N#CCCc1cccc(N)c1 Amb25929710 [0,1,0,0,0,0|2,0,1]=4 1644 B11R1.24 N#CCCc1cccc(O)c1 Amb2609108 [0,1,0,0,0,0|2,0,1]=4 1645 B11R1.24 N#CCNc1cccc(Br)c1 Amb6712240 [0,1,0,0,0,0|1,0,1]=3 1646 B11R1.24 N#CCNc1cccc(Br)n1 Amb18131354 [0,1,0,0,0,0|2,0,1]=4 1647 B11R1.24 N#CCNc1cccc(Cl)c1 Amb6711835 [0,1,0,0,0,0|1,0,1]=3 1648 B11R1.24 N#CCNc1cccc(F)c1 Amb6711894 [0,1,0,0,0,0|1,0,1]=3 1649 B11R1.24 N#CCNc1cncc(Br)c1 Amb27823739 [0,1,0,0,0,0|2,0,1]=4 1650 B11R1.24 N#CCNc1cncc(Cl)c1 Amb35706899 [0,1,0,0,0,0|2,0,1]=4 1651 B11R1.24 N#CCOc1cccc(Br)c1 Amb5780906 [0,1,0,0,0,0|2,0,1]=4 1652 B11R1.24 N#CCOc1cccc(Cl)c1 Amb2725935 [0,1,0,0,0,0|2,0,1]=4 1653 B11R1.24 N#CCOc1cccc(F)c1 Amb6257740 [0,1,0,0,0,0|2,0,1]=4 1654 B11R1.24 N#CCOc1cccc(N)c1 Amb6246011 [0,1,0,0,0,0|2,0,1]=4 1655 B11R1.24 N#CCOc1cccc(O)c1 Amb8837476 [0,1,0,0,0,0|2,0,1]=4 1656 B11R1.24 N#CCSc1cccc(Br)c1 Amb20642031 [0,1,0,0,0,0|2,0,1]=4 1657 B11R1.24 N#CCSc1cccc(Cl)c1 Amb18324763 [0,1,0,0,0,0|2,0,1]=4 1658 B11R1.24 N#CCSc1cccc(N)c1 Amb28319445 [0,1,0,0,0,0|2,0,1]=4 1659 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [0,1,0,0,0,0|2,0,1]=4 1660 B11R1.24 NCCCc1cccc(Br)c1 Amb9304906 [0,1,0,0,0,0|2,0,1]=4 1661 B11R1.24 NCCCc1cccc(Cl)c1 Amb13951536 [0,1,0,0,0,0|2,0,1]=4 1662 B11R1.24 NCCCc1cccc(Cl)c1 Amb5735480 [0,1,0,0,0,0|2,0,1]=4 1663 B11R1.24 NCCCc1cccc(F)c1 Amb13949159 [0,1,0,0,0,0|2,0,1]=4 1664 B11R1.24 NCCCc1cccc(F)c1 Amb9304903 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.24 NCCCc1cccc(I)c1 Amb26471163 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.24 NCCCc1cccc(N)c1 Amb17477694 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.24 NCCCc1cccc(O)c1 Amb17101314 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.24 NCCCc1cccc(O)c1 Amb33552047 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.24 NCCCc1cccc(O)c1 Amb33719034 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.24 NCCNC1=CC=CC(=O)N1 Amb27840014 [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.24 NCCNc1cc(Cl)ccn1 Amb28188710 [0,1,0,0,0,0|2,0,1]=4 1672 B11R1.24 NCCNc1cc(N)ccn1 Amb18298681 [0,1,0,0,0,0|2,0,1]=4 1673 B11R1.24 NCCNc1cccc(Br)c1 Amb33530824 [0,1,0,0,0,0|1,0,1]=3 1674 B11R1.24 NCCNc1cccc(Cl)c1 Amb17057750 [0,1,0,0,0,0|1,0,1]=3 1675 B11R1.24 NCCNc1cccc(Cl)n1 Amb27163532 [0,1,0,0,0,0|2,0,1]=4 1676 B11R1.24 NCCNc1cccc(F)c1 Amb17057748 [0,1,0,0,0,0|1,0,1]=3 1677 B11R1.24 NCCNc1cccc(F)n1 Amb24072626 [0,1,0,0,0,0|2,0,1]=4 1678 B11R1.24 NCCNc1cccc(F)n1 Amb33456098 [0,1,0,0,0,0|2,0,1]=4 1679 B11R1.24 NCCNc1ccnc(Cl)c1 Amb27823717 [0,1,0,0,0,0|2,0,1]=4 1680 B11R1.24 NCCNc1cncc(Cl)c1 Amb35733489 [0,1,0,0,0,0|2,0,1]=4 1681 B11R1.24 NCCOc1cccc(Br)c1 Amb10609758 [0,1,0,0,0,0|2,0,1]=4 1682 B11R1.24 NCCOc1cccc(Br)c1 Amb1111484 [0,1,0,0,0,0|2,0,1]=4 1683 B11R1.24 NCCOc1cccc(Cl)c1 Amb1098576 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.24 NCCOc1cccc(Cl)c1 Amb6754200 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.24 NCCOc1cccc(F)c1 Amb1126100 [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.24 NCCOc1cccc(F)c1 Amb7969602 [0,1,0,0,0,0|2,0,1]=4 1687 B11R1.24 NCCOc1cccc(N)c1 Amb18251365 [0,1,0,0,0,0|2,0,1]=4 1688 B11R1.24 NCCOc1cccc(O)c1 Amb24085157 [0,1,0,0,0,0|2,0,1]=4 1689 B11R1.24 NCCSc1cccc(Cl)c1 Amb17083052 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.24 NCCSc1cccc(O)c1 Amb27851974 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.24 NNCCc1cccc(Br)c1 Amb17404394 [0,1,0,0,0,0|3,0,0]=4 1692 B11R1.24 NNCCc1cccc(Cl)c1 Amb17400340 [0,1,0,0,0,0|3,0,0]=4 1693 B11R1.24 NNCCc1cccc(F)c1 Amb32661220 [0,1,0,0,0,0|3,0,0]=4 1694 B11R1.24 NNCCc1cccc(F)c1 Amb6250670 [0,1,0,0,0,0|3,0,0]=4 1695 B11R1.24 NOCCc1cccc(Br)c1 Amb33450765 [0,1,0,0,0,0|3,0,0]=4 1696 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [0,1,0,0,0,0|3,0,0]=4 1697 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [0,1,0,0,0,0|3,0,0]=4 1698 B11R1.24 NOCCc1cccc(O)c1 Amb33310970 [0,1,0,0,0,0|3,0,0]=4 1699 B11R1.24 Nc1cc(NCCO)ccn1 Amb27406110 [0,1,0,0,0,0|2,0,1]=4 1700 B11R1.24 Nc1cccc(CCCBr)c1 Amb27475647 [0,1,0,0,0,0|2,0,1]=4 1701 B11R1.24 Nc1cccc(CCCCl)c1 Amb17477709 [0,1,0,0,0,0|2,0,1]=4 1702 B11R1.24 Nc1cccc(CCCO)c1 Amb17477701 [0,1,0,0,0,0|2,0,1]=4 1703 B11R1.24 Nc1cccc(CCCS)c1 Amb35672845 [0,1,0,0,0,0|2,0,1]=4 1704 B11R1.24 Nc1cccc(NCCS)c1 Amb27642458 [0,1,0,0,0,0|1,0,1]=3 1705 B11R1.24 Nc1cccc(OCCBr)c1 Amb27832160 [0,1,0,0,0,0|2,0,1]=4 1706 B11R1.24 Nc1cccc(OCCCl)c1 Amb10608112 [0,1,0,0,0,0|2,0,1]=4 1707 B11R1.24 Nc1cccc(OCCCl)c1 Amb22587140 [0,1,0,0,0,0|2,0,1]=4 1708 B11R1.24 Nc1cccc(OCCF)c1 Amb20669100 [0,1,0,0,0,0|2,0,1]=4 1709 B11R1.24 Nc1cccc(OCCO)c1 Amb2586519 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.24 Nc1cccc(OCCS)c1 Amb17504035 [0,1,0,0,0,0|2,0,1]=4 1711 B11R1.24 Nc1cccc(SCCF)c1 Amb28423231 [0,1,0,0,0,0|2,0,1]=4 1712 B11R1.24 Nc1cccc(SCCO)c1 Amb18289366 [0,1,0,0,0,0|2,0,1]=4 1713 B11R1.24 Nc1cncc(NCCF)c1 Amb28127240 [0,1,0,0,0,0|2,0,1]=4 1714 B11R1.24 O=CC#Cc1cccc(Cl)c1 Amb27238485 [0,1,0,0,0,0|2,0,1]=4 1715 B11R1.24 O=CC#Cc1cccc(F)c1 Amb18117776 [0,1,0,0,0,0|2,0,1]=4 1716 B11R1.24 O=CCCC1=CC(=O)NC=C1 Amb27485952 [0,1,0,0,0,0|3,0,0]=4 1717 B11R1.24 O=CCCc1cc(F)ccn1 Amb33325519 [0,1,0,0,0,0|3,0,0]=4 1718 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [0,1,0,0,0,0|2,0,0]=3 1719 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [0,1,0,0,0,0|2,0,0]=3 1720 B11R1.24 O=CCCc1cccc(Cl)n1 Amb24511743 [0,1,0,0,0,0|3,0,0]=4 1721 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [0,1,0,0,0,0|2,0,0]=3 1722 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|2,0,0]=3 1723 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [0,1,0,0,0,0|2,0,0]=3 1724 B11R1.24 O=CCCc1ccnc(Cl)c1 Amb24619570 [0,1,0,0,0,0|3,0,0]=4 1725 B11R1.24 O=CCCc1cncc(Br)c1 Amb28348525 [0,1,0,0,0,0|3,0,0]=4 1726 B11R1.24 O=CCCc1cncc(F)c1 Amb25923216 [0,1,0,0,0,0|3,0,0]=4 1727 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [0,1,0,0,0,0|2,0,0]=3 1728 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|2,0,0]=3 1729 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [0,1,0,0,0,0|2,0,0]=3 1730 B11R1.24 O=CCOc1cncc(Cl)c1 Amb27868020 [0,1,0,0,0,0|3,0,0]=4 1731 B11R1.24 O=CCSc1cccc(Br)c1 Amb25978639 [0,1,0,0,0,0|2,0,0]=3 1732 B11R1.24 O=CCSc1cccc(Cl)c1 Amb17082942 [0,1,0,0,0,0|2,0,0]=3 1733 B11R1.24 O=CCSc1cccc(F)c1 Amb26942694 [0,1,0,0,0,0|2,0,0]=3 1734 B11R1.24 O=CNCc1cccc(Br)c1 Amb27780723 [0,1,0,0,0,0|3,0,0]=4 1735 B11R1.24 O=CNCc1cccc(O)c1 Amb18179387 [0,1,0,0,0,0|3,0,0]=4 1736 B11R1.24 O=CNNc1cccc(Br)n1 Amb22261494 [0,1,0,0,0,0|3,0,0]=4 1737 B11R1.24 O=CNNc1cccc(Cl)n1 Amb10067842 [0,1,0,0,0,0|3,0,0]=4 1738 B11R1.24 O=C\C=C\c1cccc(Br)c1 Amb17240826 [0,1,0,0,0,0|2,0,1]=4 1739 B11R1.24 O=C\C=C\c1cccc(Cl)c1 Amb16193215 [0,1,0,0,0,0|2,0,1]=4 1740 B11R1.24 O=C\C=C\c1cccc(F)c1 Amb17232063 [0,1,0,0,0,0|2,0,1]=4 1741 B11R1.24 O=C\C=C\c1cccc(O)c1 Amb17334281 [0,1,0,0,0,0|2,0,1]=4 1742 B11R1.24 OCCCc1cccc(Br)c1 Amb17089515 [0,1,0,0,0,0|2,0,1]=4 1743 B11R1.24 OCCCc1cccc(Cl)c1 Amb17089500 [0,1,0,0,0,0|2,0,1]=4 1744 B11R1.24 OCCCc1cccc(F)c1 Amb17605781 [0,1,0,0,0,0|2,0,1]=4 1745 B11R1.24 OCCCc1cccc(O)c1 Amb17089514 [0,1,0,0,0,0|2,0,1]=4 1746 B11R1.24 OCCNc1cc(I)ccn1 Amb27963022 [0,1,0,0,0,0|2,0,1]=4 1747 B11R1.24 OCCNc1cccc(Br)c1 Amb33526943 [0,1,0,0,0,0|1,0,1]=3 1748 B11R1.24 OCCNc1cccc(Br)n1 Amb28201319 [0,1,0,0,0,0|2,0,1]=4 1749 B11R1.24 OCCNc1cccc(Cl)c1 Amb6711876 [0,1,0,0,0,0|1,0,1]=3 1750 B11R1.24 OCCNc1cccc(Cl)n1 Amb21958722 [0,1,0,0,0,0|2,0,1]=4 1751 B11R1.24 OCCNc1cccc(F)c1 Amb6711934 [0,1,0,0,0,0|1,0,1]=3 1752 B11R1.24 OCCNc1cccc(F)n1 Amb18973531 [0,1,0,0,0,0|2,0,1]=4 1753 B11R1.24 OCCNc1cncc(Br)c1 Amb23744553 [0,1,0,0,0,0|2,0,1]=4 1754 B11R1.24 OCCNc1cncc(Cl)c1 Amb35706904 [0,1,0,0,0,0|2,0,1]=4 1755 B11R1.24 OCCOc1cccc(Br)c1 Amb33527712 [0,1,0,0,0,0|2,0,1]=4 1756 B11R1.24 OCCOc1cccc(Cl)c1 Amb33531543 [0,1,0,0,0,0|2,0,1]=4 1757 B11R1.24 OCCOc1cccc(F)c1 Amb9370687 [0,1,0,0,0,0|2,0,1]=4 1758 B11R1.24 OCCOc1cccc(I)c1 Amb9370547 [0,1,0,0,0,0|2,0,1]=4 1759 B11R1.24 OCCSc1cccc(Cl)c1 Amb2686421 [0,1,0,0,0,0|2,0,1]=4 1760 B11R1.24 OCCSc1cccc(F)c1 Amb2688393 [0,1,0,0,0,0|2,0,1]=4 1761 B11R1.24 OCCSc1cccc(S)c1 Amb27763842 [0,1,0,0,0,0|2,0,1]=4 1762 B11R1.24 Oc1cccc(CCCBr)c1 Amb18657769 [0,1,0,0,0,0|2,0,1]=4 1763 B11R1.24 Oc1cccc(CCCCl)c1 Amb17477723 [0,1,0,0,0,0|2,0,1]=4 1764 B11R1.24 Oc1cccc(CCCS)c1 Amb33310794 [0,1,0,0,0,0|2,0,1]=4 1765 B11R1.24 Oc1cccc(OCCBr)c1 Amb27391138 [0,1,0,0,0,0|2,0,1]=4 1766 B11R1.24 Oc1cccc(OCCCl)c1 Amb27461339 [0,1,0,0,0,0|2,0,1]=4 1767 B11R1.24 SCCCc1cccc(Br)c1 Amb17407561 [0,1,0,0,0,0|2,0,1]=4 1768 B11R1.24 SCCCc1cccc(Cl)c1 Amb17401096 [0,1,0,0,0,0|2,0,1]=4 1769 B11R1.24 SCCOc1cccc(Br)c1 Amb6255895 [0,1,0,0,0,0|2,0,1]=4 1770 B11R1.24 SCCOc1cccc(Cl)c1 Amb6255391 [0,1,0,0,0,0|2,0,1]=4 1771 B11R1.24 SCCSc1cccc(Cl)c1 Amb28398903 [0,1,0,0,0,0|2,0,1]=4 1772 B11R1.24 Sc1cccc(CCCBr)c1 Amb27192455 [0,1,0,0,0,0|2,0,1]=4 1773 B11R1.24 Sc1cccc(CCCCl)c1 Amb28196581 [0,1,0,0,0,0|2,0,1]=4 1774 B11R1.24 [C-]#[N+]CCc1cccc(Br)c1 Amb2685408 [0,1,0,0,0,0|2,0,1]=4 1775 B11R1.24 [C-]#[N+]CCc1cccc(C)c1 Amb2689593 [0,1,0,0,0,0|2,0,1]=4 1776 B11R1.24 [C-]#[N+]CCc1cccc(Cl)c1 Amb2686345 [0,1,0,0,0,0|2,0,1]=4 1777 B11R1.24 [C-]#[N+]CCc1cccc(F)c1 Amb2688286 [0,1,0,0,0,0|2,0,1]=4 1778 B11R1.28 BrCCCCc1ccccc1 Amb2685395 [0,1,0,0,0,0|1,0,2]=4 1779 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [0,1,0,0,0,0|1,0,2]=4 1780 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [0,1,0,0,0,0|1,0,1]=3 1781 B11R1.28 BrCCOCc1ccccc1 Amb3941567 [0,1,0,0,0,0|2,0,1]=4 1782 B11R1.28 BrCCSCc1ccccc1 Amb9305028 [0,1,0,0,0,0|2,0,1]=4 1783 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|2,0,1]=4 1784 B11R1.28 Br[Mg]CCCc1ccccc1 Amb6300511 [0,1,0,0,0,0|2,0,1]=4 1785 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [0,1,0,0,0,0|1,0,1]=3 1786 B11R1.28 C#CCC#Cc1ccccc1 Amb16233222 [0,1,0,0,0,0|1,0,2]=4 1787 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [0,1,0,0,0,0|1,0,2]=4 1788 B11R1.28 C#CCCOc1ccccc1 Amb25885800 [0,1,0,0,0,0|1,0,2]=4 1789 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [0,1,0,0,0,0|0,0,2]=3 1790 B11R1.28 C#CCNCc1ccccc1 Amb4303989 [0,1,0,0,0,0|0,0,2]=3 1791 B11R1.28 C#CCNCc1ccccn1 Amb6683744 [0,1,0,0,0,0|1,0,2]=4 1792 B11R1.28 C#CCNCc1cccnc1 Amb35747649 [0,1,0,0,0,0|1,0,2]=4 1793 B11R1.28 C#CCNCc1cccnc1 Amb5262797 [0,1,0,0,0,0|1,0,2]=4 1794 B11R1.28 C#CCNCc1ccncc1 Amb6683582 [0,1,0,0,0,0|1,0,2]=4 1795 B11R1.28 C#CCOCc1ccccc1 Amb8517297 [0,1,0,0,0,0|1,0,2]=4 1796 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [0,1,0,0,0,0|1,0,2]=4 1797 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|0,0,3]=4 1798 B11R1.28 C=C=CCNc1ccccc1 Amb27482470 [0,1,0,0,0,0|0,0,0]=1 1799 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|1,0,0]=2 1800 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [0,1,0,0,0,0|0,0,0]=1 1801 B11R1.28 C=CCCNc1ccccn1 Amb28318095 [0,1,0,0,0,0|1,0,0]=2 1802 B11R1.28 C=CCCNc1ccncn1 Amb28244636 [0,1,0,0,0,0|2,0,0]=3 1803 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [0,1,0,0,0,0|1,0,0]=2 1804 B11R1.28 C=CCCOc1ccccn1 Amb27270190 [0,1,0,0,0,0|2,0,0]=3 1805 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [0,1,0,0,0,0|1,0,0]=2 1806 B11R1.28 C=CCCSc1ccccn1 Amb27270192 [0,1,0,0,0,0|2,0,0]=3 1807 B11R1.28 C=CCCSc1cccnn1 Amb27270193 [0,1,0,0,0,0|3,0,0]=4 1808 B11R1.28 C=CCCSc1ccncc1 Amb27270198 [0,1,0,0,0,0|2,0,0]=3 1809 B11R1.28 C=CCCSc1cnccn1 Amb27270199 [0,1,0,0,0,0|3,0,0]=4 1810 B11R1.28 C=CCCSc1ncccn1 Amb27270203 [0,1,0,0,0,0|3,0,0]=4 1811 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [0,1,0,0,0,0|0,0,0]=1 1812 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [0,1,0,0,0,0|0,0,0]=1 1813 B11R1.28 C=CCNCc1ccccn1 Amb19890291 [0,1,0,0,0,0|1,0,0]=2 1814 B11R1.28 C=CCNCc1ccccn1 Amb19891173 [0,1,0,0,0,0|1,0,0]=2 1815 B11R1.28 C=CCNCc1ccccn1 Amb5262452 [0,1,0,0,0,0|1,0,0]=2 1816 B11R1.28 C=CCNCc1cccnc1 Amb19890377 [0,1,0,0,0,0|1,0,0]=2 1817 B11R1.28 C=CCNCc1cccnc1 Amb19891174 [0,1,0,0,0,0|1,0,0]=2 1818 B11R1.28 C=CCNCc1cccnc1 Amb6683809 [0,1,0,0,0,0|1,0,0]=2 1819 B11R1.28 C=CCNCc1cccnn1 Amb27271273 [0,1,0,0,0,0|2,0,0]=3 1820 B11R1.28 C=CCNCc1ccncc1 Amb19890311 [0,1,0,0,0,0|1,0,0]=2 1821 B11R1.28 C=CCNCc1ccncc1 Amb19890811 [0,1,0,0,0,0|1,0,0]=2 1822 B11R1.28 C=CCNCc1ccncc1 Amb6683814 [0,1,0,0,0,0|1,0,0]=2 1823 B11R1.28 C=CCNCc1ccncn1 Amb19030311 [0,1,0,0,0,0|2,0,0]=3 1824 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,0]=2 1825 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [0,1,0,0,0,0|1,0,0]=2 1826 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [0,1,0,0,0,0|1,0,0]=2 1827 B11R1.28 C=CC\N=C/c1cccnc1 Amb27656571 [0,1,0,0,0,0|1,0,1]=3 1828 B11R1.28 C=CC\N=C\c1cccnc1 Amb27667978 [0,1,0,0,0,0|1,0,1]=3 1829 B11R1.28 C=CC\N=C\c1ccncc1 Amb24705579 [0,1,0,0,0,0|1,0,1]=3 1830 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [0,1,0,0,0,0|2,0,0]=3 1831 B11R1.28 C=C\C=C\Sc1ccccc1 Amb28284520 [0,1,0,0,0,0|1,0,1]=3 1832 B11R1.28 CC#CCNc1ccncc1 Amb27983498 [0,1,0,0,0,0|1,0,2]=4 1833 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [0,1,0,0,0,0|1,0,2]=4 1834 B11R1.28 CCCC#Cc1ccccc1 Amb2721608 [0,1,0,0,0,0|1,0,2]=4 1835 B11R1.28 CCCCCc1ccccc1 Amb2722921 [0,1,0,0,0,0|1,0,2]=4 1836 B11R1.28 CCCCNc1ccccc1 Amb3940154 [0,1,0,0,0,0|0,0,2]=3 1837 B11R1.28 CCCCNc1ccccn1 Amb6633041 [0,1,0,0,0,0|1,0,2]=4 1838 B11R1.28 CCCCNc1cccnc1 Amb6686633 [0,1,0,0,0,0|1,0,2]=4 1839 B11R1.28 CCCCNc1ccncc1 Amb6648934 [0,1,0,0,0,0|1,0,2]=4 1840 B11R1.28 CCCCOc1ccccc1 Amb2685665 [0,1,0,0,0,0|1,0,2]=4 1841 B11R1.28 CCCCSc1ccccc1 Amb3836105 [0,1,0,0,0,0|1,0,2]=4 1842 B11R1.28 CCCNCc1ccccc1 Amb1105937 [0,1,0,0,0,0|0,0,2]=3 1843 B11R1.28 CCCNCc1ccccc1 Amb6537999 [0,1,0,0,0,0|0,0,2]=3 1844 B11R1.28 CCCNCc1ccccn1 Amb19890306 [0,1,0,0,0,0|1,0,2]=4 1845 B11R1.28 CCCNCc1ccccn1 Amb19890563 [0,1,0,0,0,0|1,0,2]=4 1846 B11R1.28 CCCNCc1ccccn1 Amb2592504 [0,1,0,0,0,0|1,0,2]=4 1847 B11R1.28 CCCNCc1cccnc1 Amb19890575 [0,1,0,0,0,0|1,0,2]=4 1848 B11R1.28 CCCNCc1cccnc1 Amb6864723 [0,1,0,0,0,0|1,0,2]=4 1849 B11R1.28 CCCNCc1cccnc1 Amb838293 [0,1,0,0,0,0|1,0,2]=4 1850 B11R1.28 CCCNCc1ccncc1 Amb19890591 [0,1,0,0,0,0|1,0,2]=4 1851 B11R1.28 CCCNCc1ccncc1 Amb6864722 [0,1,0,0,0,0|1,0,2]=4 1852 B11R1.28 CCCNCc1ccncc1 Amb837657 [0,1,0,0,0,0|1,0,2]=4 1853 B11R1.28 CCCSCc1ccccc1 Amb27000631 [0,1,0,0,0,0|1,0,2]=4 1854 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [0,1,0,0,0,0|1,0,2]=4 1855 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|0,0,3]=4 1856 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [0,1,0,0,0,0|0,0,3]=4 1857 B11R1.28 CCNCCc1ccccc1 Amb33551205 [0,1,0,0,0,0|1,0,2]=4 1858 B11R1.28 CCNCCc1ccccc1 Amb6244873 [0,1,0,0,0,0|1,0,2]=4 1859 B11R1.28 CCOCCc1ccccc1 Amb4035236 [0,1,0,0,0,0|1,0,2]=4 1860 B11R1.28 CCOCOc1ccccc1 Amb28388170 [0,1,0,0,0,0|1,0,2]=4 1861 B11R1.28 CCONCc1ccccc1 Amb25151184 [0,1,0,0,0,0|1,0,2]=4 1862 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [0,1,0,0,0,0|1,0,1]=3 1863 B11R1.28 CNCCCc1ccccc1 Amb21954280 [0,1,0,0,0,0|1,0,2]=4 1864 B11R1.28 CNCCCc1ccccc1 Amb2721795 [0,1,0,0,0,0|1,0,2]=4 1865 B11R1.28 CNCCNc1ccccc1 Amb6825621 [0,1,0,0,0,0|0,0,2]=3 1866 B11R1.28 CNCCNc1ccccn1 Amb18313466 [0,1,0,0,0,0|1,0,2]=4 1867 B11R1.28 CNCCNc1ccccn1 Amb32757639 [0,1,0,0,0,0|1,0,2]=4 1868 B11R1.28 CNCCOc1ccccc1 Amb1105525 [0,1,0,0,0,0|1,0,2]=4 1869 B11R1.28 CNCCOc1ccccc1 Amb2691365 [0,1,0,0,0,0|1,0,2]=4 1870 B11R1.28 CNCCSc1ccccc1 Amb10608735 [0,1,0,0,0,0|1,0,2]=4 1871 B11R1.28 CNCCSc1ccccc1 Amb17622507 [0,1,0,0,0,0|1,0,2]=4 1872 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|2,0,1]=4 1873 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [0,1,0,0,0,0|2,0,1]=4 1874 B11R1.28 COCCNc1ccccc1 Amb596066 [0,1,0,0,0,0|0,0,2]=3 1875 B11R1.28 COCCNc1cccnc1 Amb18268638 [0,1,0,0,0,0|1,0,2]=4 1876 B11R1.28 COCCNc1ccncc1 Amb6632784 [0,1,0,0,0,0|1,0,2]=4 1877 B11R1.28 COCCOc1ccccc1 Amb4018811 [0,1,0,0,0,0|1,0,2]=4 1878 B11R1.28 COCNCc1ccccc1 Amb25053350 [0,1,0,0,0,0|1,0,1]=3 1879 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|1,0,2]=4 1880 B11R1.28 CSCCCc1ccccc1 Amb25383748 [0,1,0,0,0,0|1,0,2]=4 1881 B11R1.28 CSCCNc1ccccc1 Amb17307504 [0,1,0,0,0,0|0,0,2]=3 1882 B11R1.28 CSCCOc1ccccc1 Amb4020915 [0,1,0,0,0,0|1,0,2]=4 1883 B11R1.28 CSCNCc1ccccc1 Amb26414504 [0,1,0,0,0,0|1,0,1]=3 1884 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [0,1,0,0,0,0|2,0,1]=4 1885 B11R1.28 C\C=C/N=C/c1cccnc1 Amb24486027 [0,1,0,0,0,0|3,0,0]=4 1886 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [0,1,0,0,0,0|1,0,1]=3 1887 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|1,0,0]=2 1888 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [0,1,0,0,0,0|2,0,0]=3 1889 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [0,1,0,0,0,0|0,0,0]=1 1890 B11R1.28 C\C=C\CNc1ccncn1 Amb27226751 [0,1,0,0,0,0|2,0,0]=3 1891 B11R1.28 C\C=C\CNc1ncccn1 Amb27191771 [0,1,0,0,0,0|2,0,0]=3 1892 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [0,1,0,0,0,0|1,0,0]=2 1893 B11R1.28 C\C=C\COc1cccnc1 Amb32668803 [0,1,0,0,0,0|2,0,0]=3 1894 B11R1.28 C\C=C\CSc1ccccn1 Amb28125714 [0,1,0,0,0,0|2,0,0]=3 1895 B11R1.28 C\C=C\CSc1cccnn1 Amb28138307 [0,1,0,0,0,0|3,0,0]=4 1896 B11R1.28 C\C=C\N=C\c1cccnc1 Amb26566876 [0,1,0,0,0,0|3,0,0]=4 1897 B11R1.28 ClCCCCc1ccccc1 Amb3940707 [0,1,0,0,0,0|1,0,2]=4 1898 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [0,1,0,0,0,0|1,0,2]=4 1899 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [0,1,0,0,0,0|1,0,2]=4 1900 B11R1.28 ClCCNCc1ccccc1 Amb2880633 [0,1,0,0,0,0|1,0,1]=3 1901 B11R1.28 ClCCNCc1ccccc1 Amb4323279 [0,1,0,0,0,0|1,0,1]=3 1902 B11R1.28 ClCCNCc1ccccn1 Amb17334832 [0,1,0,0,0,0|2,0,1]=4 1903 B11R1.28 ClCCNCc1cccnc1 Amb17334833 [0,1,0,0,0,0|2,0,1]=4 1904 B11R1.28 ClCCNCc1ccncc1 Amb17334834 [0,1,0,0,0,0|2,0,1]=4 1905 B11R1.28 ClCCOCc1ccccc1 Amb8391048 [0,1,0,0,0,0|2,0,1]=4 1906 B11R1.28 ClCCSCc1ccccc1 Amb9270911 [0,1,0,0,0,0|2,0,1]=4 1907 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|2,0,1]=4 1908 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [0,1,0,0,0,0|1,0,2]=4 1909 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [0,1,0,0,0,0|2,0,1]=4 1910 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [0,1,0,0,0,0|1,0,1]=3 1911 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [0,1,0,0,0,0|1,0,0]=2 1912 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [0,1,0,0,0,0|1,0,0]=2 1913 B11R1.28 Cl\C=C\CSc1ccccn1 Amb28122170 [0,1,0,0,0,0|2,0,0]=3 1914 B11R1.28 FCCCNc1ccncc1 Amb27448183 [0,1,0,0,0,0|1,0,2]=4 1915 B11R1.28 FCCNCc1ccccc1 Amb24611358 [0,1,0,0,0,0|1,0,1]=3 1916 B11R1.28 FCCSCc1ccccc1 Amb27271863 [0,1,0,0,0,0|2,0,1]=4 1917 B11R1.28 IC#CCOc1ccccc1 Amb27640774 [0,1,0,0,0,0|1,0,2]=4 1918 B11R1.28 ICCCCc1ccccc1 Amb25380384 [0,1,0,0,0,0|1,0,2]=4 1919 B11R1.28 ICCCOc1ccccc1 Amb27271705 [0,1,0,0,0,0|1,0,2]=4 1920 B11R1.28 ICCOCc1ccccc1 Amb16191915 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [0,1,0,0,0,0|2,0,1]=4 1922 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [0,1,0,0,0,0|1,0,2]=4 1923 B11R1.28 N#CCC#Cc1ccccc1 Amb25705489 [0,1,0,0,0,0|2,0,1]=4 1924 B11R1.28 N#CCCCc1ccccc1 Amb6251750 [0,1,0,0,0,0|1,0,2]=4 1925 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [0,1,0,0,0,0|0,0,2]=3 1926 B11R1.28 N#CCCNc1ccccn1 Amb26484394 [0,1,0,0,0,0|1,0,2]=4 1927 B11R1.28 N#CCCNc1cccnc1 Amb24085246 [0,1,0,0,0,0|1,0,2]=4 1928 B11R1.28 N#CCCNc1ccncc1 Amb27466233 [0,1,0,0,0,0|1,0,2]=4 1929 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [0,1,0,0,0,0|1,0,2]=4 1930 B11R1.28 N#CCCSc1ccccc1 Amb4018040 [0,1,0,0,0,0|1,0,2]=4 1931 B11R1.28 N#CCNCc1ccccc1 Amb4477202 [0,1,0,0,0,0|1,0,1]=3 1932 B11R1.28 N#CCNCc1ccccn1 Amb33526955 [0,1,0,0,0,0|2,0,1]=4 1933 B11R1.28 N#CCNCc1cccnc1 Amb6628503 [0,1,0,0,0,0|2,0,1]=4 1934 B11R1.28 N#CCNCc1ccncc1 Amb6609481 [0,1,0,0,0,0|2,0,1]=4 1935 B11R1.28 N#CCOCc1ccccc1 Amb4011553 [0,1,0,0,0,0|2,0,1]=4 1936 B11R1.28 N#CCSCc1ccccc1 Amb6677693 [0,1,0,0,0,0|2,0,1]=4 1937 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [0,1,0,0,0,0|1,0,2]=4 1938 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [0,1,0,0,0,0|2,0,1]=4 1939 B11R1.28 N#CNCCc1ccccc1 Amb27763256 [0,1,0,0,0,0|2,0,1]=4 1940 B11R1.28 N#C\C=C\Cc1ccccc1 Amb28255392 [0,1,0,0,0,0|1,0,2]=4 1941 B11R1.28 NCCCCc1ccccc1 Amb1227740 [0,1,0,0,0,0|1,0,2]=4 1942 B11R1.28 NCCCNc1ccccc1 Amb10086594 [0,1,0,0,0,0|0,0,2]=3 1943 B11R1.28 NCCCNc1ccccn1 Amb6260583 [0,1,0,0,0,0|1,0,2]=4 1944 B11R1.28 NCCCNc1cccnc1 Amb10607841 [0,1,0,0,0,0|1,0,2]=4 1945 B11R1.28 NCCCNc1ccncc1 Amb6261403 [0,1,0,0,0,0|1,0,2]=4 1946 B11R1.28 NCCCOc1ccccc1 Amb1108619 [0,1,0,0,0,0|1,0,2]=4 1947 B11R1.28 NCCCOc1ccccc1 Amb2606353 [0,1,0,0,0,0|1,0,2]=4 1948 B11R1.28 NCCCSc1ccccc1 Amb1089343 [0,1,0,0,0,0|1,0,2]=4 1949 B11R1.28 NCCCSc1ccccc1 Amb2099802 [0,1,0,0,0,0|1,0,2]=4 1950 B11R1.28 NCCNCc1ccccc1 Amb2725583 [0,1,0,0,0,0|1,0,1]=3 1951 B11R1.28 NCCNCc1ccccn1 Amb17091028 [0,1,0,0,0,0|2,0,1]=4 1952 B11R1.28 NCCNCc1ccccn1 Amb29844480 [0,1,0,0,0,0|2,0,1]=4 1953 B11R1.28 NCCNCc1cccnc1 Amb17091029 [0,1,0,0,0,0|2,0,1]=4 1954 B11R1.28 NCCNCc1cccnc1 Amb29844477 [0,1,0,0,0,0|2,0,1]=4 1955 B11R1.28 NCCNCc1ccncc1 Amb17091030 [0,1,0,0,0,0|2,0,1]=4 1956 B11R1.28 NCCNCc1ccncc1 Amb29844481 [0,1,0,0,0,0|2,0,1]=4 1957 B11R1.28 NCCOCc1ccccc1 Amb1081962 [0,1,0,0,0,0|2,0,1]=4 1958 B11R1.28 NCCOCc1ccccc1 Amb2137059 [0,1,0,0,0,0|2,0,1]=4 1959 B11R1.28 NCCOCc1ccccc1 Amb28524733 [0,1,0,0,0,0|2,0,1]=4 1960 B11R1.28 NCCPCc1ccccc1 Amb27990149 [0,1,0,0,0,0|1,1,1]=4 1961 B11R1.28 NCCSCc1ccccc1 Amb432271 [0,1,0,0,0,0|2,0,1]=4 1962 B11R1.28 NCCSCc1ccccc1 Amb6335199 [0,1,0,0,0,0|2,0,1]=4 1963 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [0,1,0,0,0,0|2,0,1]=4 1964 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|2,0,1]=4 1965 B11R1.28 NCC\N=C\c1ccccc1 Amb27760044 [0,1,0,0,0,0|1,0,2]=4 1966 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [0,1,0,0,0,0|1,0,2]=4 1967 B11R1.28 NNCC#Cc1ccccc1 Amb27409247 [0,1,0,0,0,0|3,0,0]=4 1968 B11R1.28 NNCCCc1ccccc1 Amb19373221 [0,1,0,0,0,0|2,0,1]=4 1969 B11R1.28 NNCCCc1ccccc1 Amb6252219 [0,1,0,0,0,0|2,0,1]=4 1970 B11R1.28 NNCCNc1ccccc1 Amb28365488 [0,1,0,0,0,0|1,0,1]=3 1971 B11R1.28 NNCCOc1ccccc1 Amb2792851 [0,1,0,0,0,0|2,0,1]=4 1972 B11R1.28 NNCCOc1ccccc1 Amb33624872 [0,1,0,0,0,0|2,0,1]=4 1973 B11R1.28 NNCCOc1ccccc1 Amb9677389 [0,1,0,0,0,0|2,0,1]=4 1974 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [0,1,0,0,0,0|3,0,0]=4 1975 B11R1.28 NOCC#Cc1ccccc1 Amb26371096 [0,1,0,0,0,0|3,0,0]=4 1976 B11R1.28 NOCCCc1ccccc1 Amb2610651 [0,1,0,0,0,0|2,0,1]=4 1977 B11R1.28 NOCCOc1ccccc1 Amb17088287 [0,1,0,0,0,0|2,0,1]=4 1978 B11R1.28 NOCCOc1ccccc1 Amb19894640 [0,1,0,0,0,0|2,0,1]=4 1979 B11R1.28 NOCOCc1ccccc1 Amb10606697 [0,1,0,0,0,0|3,0,0]=4 1980 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [0,1,0,0,0,0|3,0,0]=4 1981 B11R1.28 N\C=C\C#Cc1ccccn1 Amb27468683 [0,1,0,0,0,0|2,0,1]=4 1982 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [0,1,0,0,0,0|1,0,1]=3 1983 B11R1.28 N\C=C\C=C\c1ccccn1 Amb27961333 [0,1,0,0,0,0|2,0,1]=4 1984 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [0,1,0,0,0,0|2,0,1]=4 1985 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [0,1,0,0,0,0|2,0,0]=3 1986 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|2,0,1]=4 1987 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|2,0,1]=4 1988 B11R1.28 O=C=NCSc1ccccc1 Amb27839732 [0,1,0,0,0,0|2,0,1]=4 1989 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [0,1,0,0,0,0|2,0,0]=3 1990 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [0,1,0,0,0,0|1,0,1]=3 1991 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [0,1,0,0,0,0|2,0,1]=4 1992 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [0,1,0,0,0,0|2,0,1]=4 1993 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [0,1,0,0,0,0|2,0,1]=4 1994 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [0,1,0,0,0,0|1,0,1]=3 1995 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|1,0,1]=3 1996 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [0,1,0,0,0,0|2,0,1]=4 1997 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|1,0,0]=2 1998 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [0,1,0,0,0,0|2,0,0]=3 1999 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|2,0,0]=3 2000 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [0,1,0,0,0,0|2,0,1]=4 2002 B11R1.28 O=COCCc1ccccc1 Amb6357955 [0,1,0,0,0,0|2,0,0]=3 2003 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [0,1,0,0,0,0|1,0,1]=3 2004 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [0,1,0,0,0,0|1,0,1]=3 2005 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,0,0,0,0|0,0,1]=2 2006 B11R1.28 O=C\C=C\Nc1cccnc1 Amb27445449 [0,1,0,0,0,0|1,0,1]=3 2007 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|1,0,1]=3 2008 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,0,0,0,0|1,0,0]=2 2009 B11R1.28 O=S=CNCc1ccccc1 Amb27166552 [0,1,0,0,0,0|2,0,1]=4 2010 B11R1.28 OCCC#Cc1ccccc1 Amb2721612 [0,1,0,0,0,0|2,0,1]=4 2011 B11R1.28 OCCCCc1ccccc1 Amb3939083 [0,1,0,0,0,0|1,0,2]=4 2012 B11R1.28 OCCCNc1ccccc1 Amb17307125 [0,1,0,0,0,0|0,0,2]=3 2013 B11R1.28 OCCCNc1ccccn1 Amb6627879 [0,1,0,0,0,0|1,0,2]=4 2014 B11R1.28 OCCCNc1ccncc1 Amb33527020 [0,1,0,0,0,0|1,0,2]=4 2015 B11R1.28 OCCCNc1ccncc1 Amb6651953 [0,1,0,0,0,0|1,0,2]=4 2016 B11R1.28 OCCCOc1ccccc1 Amb4476987 [0,1,0,0,0,0|1,0,2]=4 2017 B11R1.28 OCCCSc1ccccc1 Amb4018847 [0,1,0,0,0,0|1,0,2]=4 2018 B11R1.28 OCCC[SiH2]c1ccccc1 Amb27989504 [0,1,0,0,0,0|1,0,2]=4 2019 B11R1.28 OCCNCc1ccccc1 Amb1835287 [0,1,0,0,0,0|1,0,1]=3 2020 B11R1.28 OCCNCc1ccccc1 Amb6537902 [0,1,0,0,0,0|1,0,1]=3 2021 B11R1.28 OCCNCc1ccccn1 Amb2592506 [0,1,0,0,0,0|2,0,1]=4 2022 B11R1.28 OCCNCc1cccnc1 Amb2721834 [0,1,0,0,0,0|2,0,1]=4 2023 B11R1.28 OCCNCc1ccncc1 Amb4166438 [0,1,0,0,0,0|2,0,1]=4 2024 B11R1.28 OCCOCc1ccccc1 Amb3939139 [0,1,0,0,0,0|2,0,1]=4 2025 B11R1.28 OCCSCc1ccccc1 Amb2688740 [0,1,0,0,0,0|2,0,1]=4 2026 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [0,1,0,0,0,0|2,0,1]=4 2027 B11R1.28 OCC\C=N\c1ccccc1 Amb27805392 [0,1,0,0,0,0|1,0,2]=4 2028 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [0,1,0,0,0,0|1,0,2]=4 2029 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [0,1,0,0,0,0|1,0,2]=4 2030 B11R1.28 ONCCCc1ccccc1 Amb26650950 [0,1,0,0,0,0|2,0,1]=4 2031 B11R1.28 ONCCOc1ccccc1 Amb17088413 [0,1,0,0,0,0|2,0,1]=4 2032 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [0,1,0,0,0,0|3,0,0]=4 2033 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [0,1,0,0,0,0|1,0,1]=3 2034 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|2,0,1]=4 2035 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [0,1,0,0,0,0|2,0,1]=4 2036 B11R1.28 O\N=C\CNc1ccccn1 Amb26576146 [0,1,0,0,0,0|2,0,0]=3 2037 B11R1.28 S=C=NCCc1ccccc1 Amb6316073 [0,1,0,0,0,0|2,0,1]=4 2038 B11R1.28 SCCCCc1ccccc1 Amb17400224 [0,1,0,0,0,0|1,0,2]=4 2039 B11R1.28 SCCCOc1ccccc1 Amb6255479 [0,1,0,0,0,0|1,0,2]=4 2040 B11R1.28 SCCNCc1ccccc1 Amb4405222 [0,1,0,0,0,0|1,0,1]=3 2041 B11R1.28 SCCNCc1ccccn1 Amb27001186 [0,1,0,0,0,0|2,0,1]=4 2042 B11R1.28 SCCNCc1cccnc1 Amb27001194 [0,1,0,0,0,0|2,0,1]=4 2043 B11R1.28 SCCNCc1ccncc1 Amb27272069 [0,1,0,0,0,0|2,0,1]=4 2044 B11R1.28 SCCOCc1ccccc1 Amb27457406 [0,1,0,0,0,0|2,0,1]=4 2045 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [0,1,0,0,0,0|2,0,1]=4 2046 B11R1.28 [C-]#[N+]CCCc1ccccc1 Amb2690315 [0,1,0,0,0,0|1,0,2]=4 2047 B11R1.28 [C-]#[N+]CCOc1ccccc1 Amb27428630 [0,1,0,0,0,0|1,0,2]=4 2048 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [0,1,0,0,0,0|2,0,1]=4 2049 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [0,1,0,0,0,0|3,0,0]=4 2050 B11R1.28 [N-]=[N+]=NCNc1ccccc1 Amb27791942 [0,1,0,0,0,0|2,0,0]=3 2051 B11R1.28 [N-]=[N+]=NCSc1ccccc1 Amb22735141 [0,1,0,0,0,0|3,0,0]=4 2052 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,1,0,0,0,0|0,0,3]=4 2053 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [0,1,0,0,0,0|1,0,2]=4 2054 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [0,1,0,0,0,0|1,0,2]=4 2055 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [0,1,0,0,0,0|1,0,2]=4 2056 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [0,1,0,0,0,0|2,0,1]=4 2057 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [0,1,0,0,0,0|0,0,3]=4 2058 B11R1.40 C=CC(=C)Sc1ccccc1 Amb4013516 [0,1,0,0,0,0|1,0,1]=3 2059 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|1,0,1]=3 2060 B11R1.40 C=CC(=O)Cc1ccccn1 Amb24425169 [0,1,0,0,0,0|2,0,1]=4 2061 B11R1.40 C=CC(=O)Cc1cccnc1 Amb28365485 [0,1,0,0,0,0|2,0,1]=4 2062 B11R1.40 C=CC(=O)Cc1ccncc1 Amb27389580 [0,1,0,0,0,0|2,0,1]=4 2063 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [0,1,0,0,0,0|0,0,1]=2 2064 B11R1.40 C=CC(=O)Nc1ccccn1 Amb33532236 [0,1,0,0,0,0|1,0,1]=3 2065 B11R1.40 C=CC(=O)Nc1cccnc1 Amb33532237 [0,1,0,0,0,0|1,0,1]=3 2066 B11R1.40 C=CC(=O)Nc1ccncc1 Amb9480418 [0,1,0,0,0,0|1,0,1]=3 2067 B11R1.40 C=CC(=O)Nc1ncccn1 Amb33532241 [0,1,0,0,0,0|2,0,1]=4 2068 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [0,1,0,0,0,0|1,0,0]=2 2069 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [0,1,0,0,0,0|1,0,0]=2 2070 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|0,0,0]=1 2071 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [0,1,0,0,0,0|1,0,0]=2 2072 B11R1.40 C=CC(N)Cc1cccnc1 Amb27196336 [0,1,0,0,0,0|2,0,0]=3 2073 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|1,0,0]=2 2074 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [0,1,0,0,0,0|2,0,0]=3 2075 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [0,1,0,0,0,0|0,0,0]=1 2076 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [0,1,0,0,0,0|1,0,0]=2 2077 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [0,1,0,0,0,0|0,0,0]=1 2078 B11R1.40 C=C\C(C)=C/c1ccccc1 Amb27428211 [0,1,0,0,0,0|1,0,1]=3 2079 B11R1.40 C=C\C(C)=C\c1ccccc1 Amb27950688 [0,1,0,0,0,0|1,0,1]=3 2080 B11R1.40 C=C\C(C)=C\c1ccccn1 Amb24101881 [0,1,0,0,0,0|2,0,1]=4 2081 B11R1.40 C=C\C(C)=C\c1cccnc1 Amb24085616 [0,1,0,0,0,0|2,0,1]=4 2082 B11R1.40 C=C\C(C)=C\c1ccncc1 Amb24103157 [0,1,0,0,0,0|2,0,1]=4 2083 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [0,1,0,0,0,0|2,0,1]=4 2084 B11R1.40 CC(C#N)Nc1ccccc1 Amb17399903 [0,1,0,0,0,0|1,0,1]=3 2085 B11R1.40 CC(C#N)Nc1ccccn1 Amb18644336 [0,1,0,0,0,0|2,0,1]=4 2086 B11R1.40 CC(C#N)Oc1ccccc1 Amb5780982 [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,1,0,0,0,0|2,0,1]=4 2088 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [0,1,0,0,0,0|2,0,0]=3 2089 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [0,1,0,0,0,0|3,0,0]=4 2090 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [0,1,0,0,0,0|3,0,0]=4 2091 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|2,0,0]=3 2092 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|2,0,0]=3 2093 B11R1.40 CC(C=O)Sc1ccccn1 Amb35652165 [0,1,0,0,0,0|3,0,0]=4 2094 B11R1.40 CC(C=O)Sc1ccncc1 Amb35652166 [0,1,0,0,0,0|3,0,0]=4 2095 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,1,0,0,0,0|2,0,1]=4 2096 B11R1.40 CC(CBr)Oc1ccccc1 Amb17241866 [0,1,0,0,0,0|2,0,1]=4 2097 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [0,1,0,0,0,0|2,0,1]=4 2098 B11R1.40 CC(CCl)Oc1ccccc1 Amb17232796 [0,1,0,0,0,0|2,0,1]=4 2099 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,1,0,0,0,0|2,0,1]=4 2100 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [0,1,0,0,0,0|2,0,1]=4 2101 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,1,0,0,0,0|1,0,1]=3 2102 B11R1.40 CC(CN)Oc1ccccc1 Amb3938897 [0,1,0,0,0,0|2,0,1]=4 2103 B11R1.40 CC(CN)Oc1ccccc1 Amb6365930 [0,1,0,0,0,0|2,0,1]=4 2104 B11R1.40 CC(CN)Sc1ccccc1 Amb17485971 [0,1,0,0,0,0|2,0,1]=4 2105 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,1,0,0,0,0|1,0,1]=3 2107 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [0,1,0,0,0,0|2,0,1]=4 2108 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [0,1,0,0,0,0|3,0,0]=4 2109 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [0,1,0,0,0,0|3,0,0]=4 2110 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [0,1,0,0,0,0|3,0,0]=4 2111 B11R1.40 CC(Nc1ccccc1)=S=O Amb27592896 [0,1,0,0,0,0|2,0,1]=4 2112 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,1,0,0,0,0|0,0,3]=4 2113 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,1,0,0,0,0|1,0,2]=4 2114 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [0,1,0,0,0,0|0,0,2]=3 2115 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,1,0,0,0,0|1,0,2]=4 2116 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,1,0,0,0,0|1,0,2]=4 2117 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,1,0,0,0,0|1,0,2]=4 2118 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [0,1,0,0,0,0|1,0,2]=4 2119 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [0,1,0,0,0,0|1,0,2]=4 2120 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [0,1,0,0,0,0|1,0,2]=4 2121 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,1,0,0,0,0|1,0,2]=4 2122 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,1,0,0,0,0|1,0,2]=4 2123 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [0,1,0,0,0,0|1,0,2]=4 2124 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,1,0,0,0,0|1,0,2]=4 2125 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [0,1,0,0,0,0|1,0,2]=4 2126 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [0,1,0,0,0,0|3,0,0]=4 2127 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [0,1,0,0,0,0|1,0,2]=4 2128 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [0,1,0,0,0,0|1,0,2]=4 2129 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [0,1,0,0,0,0|2,0,1]=4 2130 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [0,1,0,0,0,0|2,0,1]=4 2131 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [0,1,0,0,0,0|2,0,1]=4 2132 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [0,1,0,0,0,0|2,0,1]=4 2133 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,1,0,0,0,0|1,0,2]=4 2134 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [0,1,0,0,0,0|1,0,2]=4 2135 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,1,0,0,0,0|1,0,2]=4 2136 B11R1.40 CSC(=S)Nc1ccccc1 Amb5716125 [0,1,0,0,0,0|1,0,2]=4 2137 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|2,0,0]=3 2138 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [0,1,0,0,0,0|2,0,1]=4 2139 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [0,1,0,0,0,0|2,0,1]=4 2140 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,1,0,0,0,0|2,0,1]=4 2141 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [0,1,0,0,0,0|2,0,1]=4 2142 B11R1.40 C[C@@H](CO)Nc1ccncc1 Amb28137825 [0,1,0,0,0,0|2,0,1]=4 2143 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [0,1,0,0,0,0|2,0,1]=4 2144 B11R1.40 C[C@H](CN)Oc1ccccc1 Amb27803833 [0,1,0,0,0,0|2,0,1]=4 2145 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,1,0,0,0,0|2,0,1]=4 2146 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [0,1,0,0,0,0|2,0,1]=4 2147 B11R1.40 C\C(=N\N)Nc1ccccc1 Amb27198359 [0,1,0,0,0,0|2,0,1]=4 2148 B11R1.40 C\C(=N\O)Nc1ccccc1 Amb2610722 [0,1,0,0,0,0|2,0,1]=4 2149 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,1,0,0,0,0|2,0,1]=4 2150 B11R1.40 C\C=C(\C)Nc1ccccc1 Amb27597055 [0,1,0,0,0,0|0,0,2]=3 2151 B11R1.40 Cl\C=C(/Cl)Oc1ccccc1 Amb34048810 [0,1,0,0,0,0|2,0,1]=4 2152 B11R1.40 Cl\C=C(\Cl)Cc1ccccc1 Amb27657562 [0,1,0,0,0,0|2,0,1]=4 2153 B11R1.40 Cl\C=C(\Cl)Oc1ccccc1 Amb25968444 [0,1,0,0,0,0|2,0,1]=4 2154 B11R1.40 FCC(Cl)Sc1ccccc1 Amb27607707 [0,1,0,0,0,0|2,0,1]=4 2155 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,1,0,0,0,0|2,0,1]=4 2156 B11R1.40 F\C(=C\Cl)Oc1ccccc1 Amb27477898 [0,1,0,0,0,0|2,0,1]=4 2157 B11R1.40 F\C(=C\Cl)Sc1ccccc1 Amb28383507 [0,1,0,0,0,0|2,0,1]=4 2158 B11R1.40 N#CC(=O)Nc1ccccc1 Amb4006113 [0,1,0,0,0,0|1,0,2]=4 2159 B11R1.40 N#CC(=S)Nc1ccccc1 Amb8515443 [0,1,0,0,0,0|1,0,2]=4 2160 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [0,1,0,0,0,0|2,0,1]=4 2161 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [0,1,0,0,0,0|2,0,1]=4 2162 B11R1.40 N#CC(Cl)Sc1ccccc1 Amb27955178 [0,1,0,0,0,0|2,0,1]=4 2163 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,1,0,0,0,0|2,0,1]=4 2164 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [0,1,0,0,0,0|2,0,1]=4 2165 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [0,1,0,0,0,0|2,0,1]=4 2166 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [0,1,0,0,0,0|2,0,1]=4 2167 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [0,1,0,0,0,0|2,0,1]=4 2168 B11R1.40 N=C(CCl)Nc1ccccc1 Amb27234641 [0,1,0,0,0,0|1,0,2]=4 2169 B11R1.40 N=C(CF)Nc1ccccc1 Amb27863862 [0,1,0,0,0,0|1,0,2]=4 2170 B11R1.40 N=C(CO)Nc1ccccc1 Amb28062227 [0,1,0,0,0,0|1,0,2]=4 2171 B11R1.40 N=C(NN)Nc1ccccc1 Amb32712057 [0,1,0,0,0,0|2,0,1]=4 2172 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [0,1,0,0,0,0|2,0,1]=4 2173 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [0,1,0,0,0,0|2,0,1]=4 2174 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [0,1,0,0,0,0|2,0,1]=4 2175 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [0,1,0,0,0,0|2,0,1]=4 2176 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,1,0,0,0,0|1,0,2]=4 2177 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,1,0,0,0,0|1,0,2]=4 2178 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [0,1,0,0,0,0|2,0,1]=4 2179 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [0,1,0,0,0,0|2,0,1]=4 2180 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [0,1,0,0,0,0|2,0,1]=4 2181 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [0,1,0,0,0,0|2,0,1]=4 2182 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,1,0,0,0,0|2,0,1]=4 2183 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [0,1,0,0,0,0|2,0,1]=4 2184 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [0,1,0,0,0,0|2,0,1]=4 2185 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,1,0,0,0,0|2,0,1]=4 2186 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|2,0,1]=4 2187 B11R1.40 NNC(=O)Nc1ccccc1 Amb9825866 [0,1,0,0,0,0|2,0,1]=4 2188 B11R1.40 NNC(=S)Nc1ccccc1 Amb6335759 [0,1,0,0,0,0|2,0,1]=4 2189 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [0,1,0,0,0,0|2,0,1]=4 2190 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [0,1,0,0,0,0|2,0,1]=4 2191 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [0,1,0,0,0,0|2,0,1]=4 2192 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [0,1,0,0,0,0|2,0,0]=3 2193 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [0,1,0,0,0,0|2,0,1]=4 2194 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [0,1,0,0,0,0|2,0,1]=4 2195 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb18799378 [0,1,0,0,0,0|2,0,1]=4 2196 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb33743404 [0,1,0,0,0,0|2,0,1]=4 2197 B11R1.40 N\C(=N\Cl)Nc1ccccc1 Amb27244827 [0,1,0,0,0,0|2,0,1]=4 2198 B11R1.40 N\N=C(\N)Nc1ccccc1 Amb25046170 [0,1,0,0,0,0|2,0,1]=4 2199 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|1,0,2]=4 2200 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,1,0,0,0,0|1,0,2]=4 2201 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|1,0,2]=4 2202 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|1,0,2]=4 2203 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,2]=4 2204 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,0,2]=4 2205 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,1,0,0,0,0|2,0,1]=4 2206 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|2,0,1]=4 2207 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,1,0,0,0,0|1,0,1]=3 2208 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [0,1,0,0,0,0|2,0,0]=3 2209 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [0,1,0,0,0,0|3,0,0]=4 2210 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [0,1,0,0,0,0|2,0,0]=3 2211 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [0,1,0,0,0,0|3,0,0]=4 2212 B11R1.40 O=CN(O)Cc1ccccc1 Amb27873557 [0,1,0,0,0,0|3,0,0]=4 2213 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [0,1,0,0,0,0|2,0,0]=3 2214 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [0,1,0,0,0,0|2,0,0]=3 2215 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [0,1,0,0,0,0|2,0,0]=3 2216 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,0|2,0,1]=4 2217 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,1,0,0,0,0|2,0,1]=4 2218 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,1,0,0,0,0|2,0,1]=4 2219 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,1,0,0,0,0|2,0,1]=4 2220 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,1,0,0,0,0|2,0,1]=4 2221 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [0,1,0,0,0,0|2,0,1]=4 2222 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,1,0,0,0,0|2,0,1]=4 2223 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [0,1,0,0,0,0|2,0,1]=4 2224 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,1,0,0,0,0|2,0,1]=4 2225 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [0,1,0,0,0,0|2,0,1]=4 2226 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,1,0,0,0,0|2,0,1]=4 2227 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [0,1,0,0,0,0|2,0,1]=4 2228 B11R1.40 OCC(O)Oc1ccccc1 Amb28344634 [0,1,0,0,0,0|2,0,1]=4 2229 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [0,1,0,0,0,0|2,0,1]=4 2230 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [0,1,0,0,0,0|2,0,1]=4 2231 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [0,1,0,0,0,0|2,0,1]=4 2232 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [0,1,0,0,0,0|2,0,1]=4 2233 B11R1.40 ONC(=S)Nc1ccccc1 Amb9824829 [0,1,0,0,0,0|2,0,1]=4 2234 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [0,1,0,0,0,0|2,0,1]=4 2235 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,1,0,0,0,0|2,0,1]=4 2236 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,1,0,0,0,0|2,0,1]=4 2237 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [0,1,0,0,0,0|2,0,1]=4 2238 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [0,1,0,0,0,0|2,0,1]=4 2239 B11R1.91 C=C(Br)CNc1ccccc1 Amb4303983 [0,1,0,0,0,0|0,0,0]=1 2240 B11R1.91 C=C(Br)CNc1cccnn1 Amb27249149 [0,1,0,0,0,0|2,0,0]=3 2241 B11R1.91 C=C(Br)CSc1ccncc1 Amb27840224 [0,1,0,0,0,0|2,0,0]=3 2242 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [0,1,0,0,0,0|1,0,0]=2 2243 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [0,1,0,0,0,0|0,0,0]=1 2244 B11R1.91 C=C(C)CNc1ccccn1 Amb24486042 [0,1,0,0,0,0|1,0,0]=2 2245 B11R1.91 C=C(C)CNc1ccncn1 Amb28348081 [0,1,0,0,0,0|2,0,0]=3 2246 B11R1.91 C=C(C)CNc1ncccn1 Amb28284943 [0,1,0,0,0,0|2,0,0]=3 2247 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|1,0,0]=2 2248 B11R1.91 C=C(C)COc1cccnc1 Amb27485111 [0,1,0,0,0,0|2,0,0]=3 2249 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [0,1,0,0,0,0|1,0,0]=2 2250 B11R1.91 C=C(C)CSc1cnccn1 Amb27883388 [0,1,0,0,0,0|3,0,0]=4 2251 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [0,1,0,0,0,0|2,0,0]=3 2252 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|2,0,0]=3 2253 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [0,1,0,0,0,0|1,0,1]=3 2254 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|0,0,0]=1 2255 B11R1.91 C=C(Cl)CNc1ccccn1 Amb28119235 [0,1,0,0,0,0|1,0,0]=2 2256 B11R1.91 C=C(Cl)CNc1ccncn1 Amb27249148 [0,1,0,0,0,0|2,0,0]=3 2257 B11R1.91 C=C(Cl)CNc1ncccn1 Amb27403606 [0,1,0,0,0,0|2,0,0]=3 2258 B11R1.91 C=C(Cl)CSc1ccccc1 Amb4013517 [0,1,0,0,0,0|1,0,0]=2 2259 B11R1.91 C=C(Cl)CSc1cccnn1 Amb27255890 [0,1,0,0,0,0|3,0,0]=4 2260 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,1,0,0,0,0|2,0,0]=3 2261 B11R1.91 C=[ClH](C)COc1ccccc1 Amb28059898 [0,1,0,0,0,0|2,0,0]=3 2262 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|2,0,1]=4 2263 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|2,0,1]=4 2264 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [0,1,0,0,0,0|1,0,2]=4 2265 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [0,1,0,0,0,0|1,0,1]=3 2266 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,0,0,0,0|2,0,1]=4 2267 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,0,0,0,0|2,0,1]=4 2268 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,0,0,0,0|2,0,1]=4 2269 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [0,1,0,0,0,0|2,0,1]=4 2270 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|0,0,1]=2 2271 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [0,1,0,0,0,0|1,0,1]=3 2272 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,1,0,0,0,0|1,0,1]=3 2273 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [0,1,0,0,0,0|2,0,1]=4 2274 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [0,1,0,0,0,0|1,0,1]=3 2275 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [0,1,0,0,0,0|2,0,1]=4 2277 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|2,0,1]=4 2278 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [0,1,0,0,0,0|1,0,1]=3 2279 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [0,1,0,0,0,0|2,0,1]=4 2280 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [0,1,0,0,0,0|2,0,1]=4 2281 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [0,1,0,0,0,0|2,0,1]=4 2282 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,0,0,0,0|1,0,2]=4 2283 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [0,1,0,0,0,0|1,0,2]=4 2284 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,1,0,0,0,0|1,0,2]=4 2285 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|2,0,1]=4 2286 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [0,1,0,0,0,0|1,0,2]=4 2287 B11R1.91 CC(Br)CNc1ccccc1 Amb28428528 [0,1,0,0,0,0|0,0,2]=3 2288 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [0,1,0,0,0,0|1,0,2]=4 2289 B11R1.91 CC(Br)CSc1ccccc1 Amb27628746 [0,1,0,0,0,0|1,0,2]=4 2290 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [0,1,0,0,0,0|1,0,2]=4 2291 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [0,1,0,0,0,0|1,0,2]=4 2292 B11R1.91 CC(C)=CSc1ccccc1 Amb27767952 [0,1,0,0,0,0|1,0,2]=4 2293 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [0,1,0,0,0,0|2,0,1]=4 2294 B11R1.91 CC(C)=NNc1cccnc1 Amb27652794 [0,1,0,0,0,0|2,0,1]=4 2295 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [0,1,0,0,0,0|1,0,2]=4 2296 B11R1.91 CC(C)CNc1ccccc1 Amb28960302 [0,1,0,0,0,0|0,0,2]=3 2297 B11R1.91 CC(C)CNc1ccccc1 Amb4304155 [0,1,0,0,0,0|0,0,2]=3 2298 B11R1.91 CC(C)CNc1cccnc1 Amb33527398 [0,1,0,0,0,0|1,0,2]=4 2299 B11R1.91 CC(C)COc1ccccc1 Amb27668259 [0,1,0,0,0,0|1,0,2]=4 2300 B11R1.91 CC(C)CSc1ccccc1 Amb4016673 [0,1,0,0,0,0|1,0,2]=4 2301 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [0,1,0,0,0,0|1,0,2]=4 2302 B11R1.91 CC(Cl)CNc1ccncc1 Amb27980943 [0,1,0,0,0,0|1,0,2]=4 2303 B11R1.91 CC(F)CNc1ccccc1 Amb27872143 [0,1,0,0,0,0|0,0,2]=3 2304 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [0,1,0,0,0,0|1,0,2]=4 2305 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [0,1,0,0,0,0|1,0,2]=4 2306 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [0,1,0,0,0,0|0,0,2]=3 2307 B11R1.91 CC(N)CNc1ccccn1 Amb18125324 [0,1,0,0,0,0|1,0,2]=4 2308 B11R1.91 CC(N)COc1ccccc1 Amb10609380 [0,1,0,0,0,0|1,0,2]=4 2309 B11R1.91 CC(N)COc1ccccc1 Amb9756346 [0,1,0,0,0,0|1,0,2]=4 2310 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [0,1,0,0,0,0|1,0,2]=4 2311 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [0,1,0,0,0,0|1,0,2]=4 2312 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [0,1,0,0,0,0|1,0,2]=4 2313 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [0,1,0,0,0,0|0,0,2]=3 2314 B11R1.91 CC(O)CNc1ccncc1 Amb9248479 [0,1,0,0,0,0|1,0,2]=4 2315 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [0,1,0,0,0,0|1,0,2]=4 2316 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [0,1,0,0,0,0|0,1,2]=4 2317 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [0,1,0,0,0,0|1,0,2]=4 2318 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [0,1,0,0,0,0|1,0,2]=4 2319 B11R1.91 CC(S)COc1ccccc1 Amb29854435 [0,1,0,0,0,0|1,0,2]=4 2320 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [0,1,0,0,0,0|2,0,1]=4 2321 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [0,1,0,0,0,0|2,0,1]=4 2322 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [0,1,0,0,0,0|2,0,1]=4 2323 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [0,1,0,0,0,0|1,0,2]=4 2324 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [0,1,0,0,0,0|1,0,2]=4 2325 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [0,1,0,0,0,0|1,0,2]=4 2326 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [0,1,0,0,0,0|0,0,2]=3 2327 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [0,1,0,0,0,0|1,0,2]=4 2328 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [0,1,0,0,0,0|1,0,2]=4 2329 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [0,1,0,0,0,0|1,0,2]=4 2330 B11R1.91 C[C@H](N)COc1ccccc1 Amb17232092 [0,1,0,0,0,0|1,0,2]=4 2331 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [0,1,0,0,0,0|1,0,2]=4 2332 B11R1.91 ClC(Cl)CSc1ccccc1 Amb28129316 [0,1,0,0,0,0|2,0,1]=4 2333 B11R1.91 FC(Cl)CSc1ccccc1 Amb27847576 [0,1,0,0,0,0|2,0,1]=4 2334 B11R1.91 FC(F)CNc1ccccc1 Amb18791799 [0,1,0,0,0,0|1,0,1]=3 2335 B11R1.91 FC(F)CNc1ccccc1 Amb20623918 [0,1,0,0,0,0|1,0,1]=3 2336 B11R1.91 FC(F)CNc1cccnc1 Amb35751399 [0,1,0,0,0,0|2,0,1]=4 2337 B11R1.91 FC(F)CNc1ccncc1 Amb26058483 [0,1,0,0,0,0|2,0,1]=4 2338 B11R1.91 FC(F)CNc1ccncc1 Amb33528958 [0,1,0,0,0,0|2,0,1]=4 2339 B11R1.91 FC(F)COc1ccccc1 Amb22008298 [0,1,0,0,0,0|2,0,1]=4 2340 B11R1.91 N=C(/N)SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|3,0,0]=4 2341 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [0,1,0,0,0,0|2,0,0]=3 2342 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [0,1,0,0,0,0|2,0,0]=3 2343 B11R1.91 N=C(N)CCc1cccnc1 Amb2700054 [0,1,0,0,0,0|3,0,0]=4 2344 B11R1.91 N=C(N)COc1ccccc1 Amb2725000 [0,1,0,0,0,0|2,0,0]=3 2345 B11R1.91 N=C(N)COc1ccccc1 Amb33551040 [0,1,0,0,0,0|2,0,0]=3 2346 B11R1.91 N=C(N)CSc1ccccc1 Amb2726049 [0,1,0,0,0,0|2,0,0]=3 2347 B11R1.91 N=C(N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|3,0,0]=4 2348 B11R1.91 N=C(N)NCc1ccccc1 Amb602728 [0,1,0,0,0,0|3,0,0]=4 2349 B11R1.91 N=C(N)NCc1ccccc1 Amb7990388 [0,1,0,0,0,0|3,0,0]=4 2350 B11R1.91 N=C(N)OCc1ccccc1 Amb6773970 [0,1,0,0,0,0|3,0,0]=4 2351 B11R1.91 N=C(N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|3,0,0]=4 2352 B11R1.91 N=C(N)SCc1ccccc1 Amb2609643 [0,1,0,0,0,0|3,0,0]=4 2353 B11R1.91 N=C(N)SCc1ccccc1 Amb6296081 [0,1,0,0,0,0|3,0,0]=4 2354 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,0|2,0,1]=4 2355 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|3,0,0]=4 2356 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [0,1,0,0,0,0|2,0,1]=4 2357 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [0,1,0,0,0,0|3,0,0]=4 2358 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [0,1,0,0,0,0|2,0,0]=3 2359 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,0,0,0,0|3,0,0]=4 2360 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,0,0,0,0|3,0,0]=4 2361 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [0,1,0,0,0,0|1,0,0]=2 2362 B11R1.91 NC(=O)CNc1ccccn1 Amb6658788 [0,1,0,0,0,0|2,0,0]=3 2363 B11R1.91 NC(=O)CNc1cccnc1 Amb27482670 [0,1,0,0,0,0|2,0,0]=3 2364 B11R1.91 NC(=O)CNc1cccnn1 Amb18298645 [0,1,0,0,0,0|3,0,0]=4 2365 B11R1.91 NC(=O)CNc1ccncn1 Amb18973884 [0,1,0,0,0,0|3,0,0]=4 2366 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,1,0,0,0,0|2,0,0]=3 2367 B11R1.91 NC(=O)COc1ccccn1 Amb27878790 [0,1,0,0,0,0|3,0,0]=4 2368 B11R1.91 NC(=O)COc1cccnc1 Amb6739850 [0,1,0,0,0,0|3,0,0]=4 2369 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [0,1,0,0,0,0|2,0,0]=3 2370 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,1,0,0,0,0|3,0,0]=4 2371 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|3,0,0]=4 2372 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [0,1,0,0,0,0|2,0,0]=3 2373 B11R1.91 NC(=O)NNc1ccccn1 Amb28119875 [0,1,0,0,0,0|3,0,0]=4 2374 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [0,1,0,0,0,0|3,0,0]=4 2375 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [0,1,0,0,0,0|3,0,0]=4 2376 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [0,1,0,0,0,0|3,0,0]=4 2377 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [0,1,0,0,0,0|2,0,1]=4 2378 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [0,1,0,0,0,0|2,0,1]=4 2379 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [0,1,0,0,0,0|2,0,1]=4 2380 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [0,1,0,0,0,0|3,0,0]=4 2381 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|2,0,0]=3 2382 B11R1.91 NC(=S)CCc1ccccn1 Amb6752547 [0,1,0,0,0,0|3,0,0]=4 2383 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [0,1,0,0,0,0|3,0,0]=4 2384 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|2,0,0]=3 2385 B11R1.91 NC(=S)COc1cccnc1 Amb29848721 [0,1,0,0,0,0|3,0,0]=4 2386 B11R1.91 NC(=S)CSc1ccccc1 Amb6572429 [0,1,0,0,0,0|2,0,0]=3 2387 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.91 NC(=S)NCc1ccccc1 Amb32644733 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.91 NC(=S)NNc1ccccc1 Amb3429340 [0,1,0,0,0,0|2,0,0]=3 2390 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,0|2,0,1]=4 2391 B11R1.91 NC(=S)\N=N\c1ccccc1 Amb27984870 [0,1,0,0,0,0|2,0,1]=4 2392 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|3,0,0]=4 2393 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|3,0,0]=4 2394 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,1,0,0,0,0|2,0,0]=3 2395 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [0,1,0,0,0,0|2,0,0]=3 2396 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [0,1,0,0,0,0|3,0,0]=4 2397 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [0,1,0,0,0,0|3,0,0]=4 2398 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,1,0,0,0,0|2,0,0]=3 2399 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [0,1,0,0,0,0|2,0,0]=3 2400 B11R1.91 O=C(Cl)CSc1ccccn1 Amb19650937 [0,1,0,0,0,0|3,0,0]=4 2401 B11R1.91 O=C(Cl)CSc1ccncc1 Amb22396542 [0,1,0,0,0,0|3,0,0]=4 2402 B11R1.91 O=C(Cl)CSc1ccncc1 Amb8629347 [0,1,0,0,0,0|3,0,0]=4 2403 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [0,1,0,0,0,0|3,0,0]=4 2404 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [0,1,0,0,0,0|2,0,1]=4 2405 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [0,1,0,0,0,0|3,0,0]=4 2406 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [0,1,0,0,0,0|2,0,1]=4 2407 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [0,1,0,0,0,0|3,0,0]=4 2408 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,1,0,0,0,0|2,0,0]=3 2409 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [0,1,0,0,0,0|3,0,0]=4 2410 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [0,1,0,0,0,0|3,0,0]=4 2411 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [0,1,0,0,0,0|3,0,0]=4 2412 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|3,0,0]=4 2413 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|3,0,0]=4 2414 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,1,0,0,0,0|1,0,0]=2 2415 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [0,1,0,0,0,0|2,0,0]=3 2416 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [0,1,0,0,0,0|2,0,0]=3 2417 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,0]=3 2418 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [0,1,0,0,0,0|2,0,0]=3 2419 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [0,1,0,0,0,0|2,0,0]=3 2420 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [0,1,0,0,0,0|2,0,0]=3 2421 B11R1.91 O=C(O)CNc1ccncn1 Amb18973871 [0,1,0,0,0,0|3,0,0]=4 2422 B11R1.91 O=C(O)CNc1cnccn1 Amb6256346 [0,1,0,0,0,0|3,0,0]=4 2423 B11R1.91 O=C(O)CNc1cncnc1 Amb18933571 [0,1,0,0,0,0|3,0,0]=4 2424 B11R1.91 O=C(O)CNc1ncccn1 Amb2372087 [0,1,0,0,0,0|3,0,0]=4 2425 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|2,0,0]=3 2426 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|2,0,0]=3 2427 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [0,1,0,0,0,0|3,0,0]=4 2428 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [0,1,0,0,0,0|3,0,0]=4 2429 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [0,1,0,0,0,0|3,0,0]=4 2430 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [0,1,0,0,0,0|3,0,0]=4 2431 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [0,1,0,0,0,0|3,0,0]=4 2432 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [0,1,0,0,0,0|3,0,0]=4 2433 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|2,0,0]=3 2434 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|3,0,0]=4 2435 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [0,1,0,0,0,0|3,0,0]=4 2436 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [0,1,0,0,0,0|3,0,0]=4 2437 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,0,0,0,0|2,0,1]=4 2438 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,0,0,0,0|2,0,1]=4 2439 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,0,0,0,0|2,0,1]=4 2440 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [0,1,0,0,0,0|3,0,0]=4 2441 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,0]=2 2442 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [0,1,0,0,0,0|1,0,0]=2 2443 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,1,0,0,0,0|2,0,0]=3 2444 B11R1.91 O=C([O-])COc1ccccn1 Amb30584712 [0,1,0,0,0,0|3,0,0]=4 2445 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [0,1,0,0,0,0|2,0,1]=4 2446 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [0,1,0,0,0,0|2,0,1]=4 2447 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [0,1,0,0,0,0|2,0,1]=4 2448 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [0,1,0,0,0,0|3,0,0]=4 2449 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [0,1,0,0,0,0|3,0,0]=4 2450 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|3,0,0]=4 2451 B11R1.91 O=[N+]([O-])NNc1ccccc1 Amb21953657 [0,1,0,0,0,0|3,0,0]=4 2452 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [0,1,0,0,0,0|3,0,0]=4 2453 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [0,1,0,0,0,0|3,0,0]=4 2454 B11R1.91 OB(O)CSc1ccccc1 Amb27450702 [0,1,0,0,0,0|3,0,0]=4 2455 B11R1.91 OC(Cl)CNc1ccccc1 Amb28291556 [0,1,0,0,0,0|1,0,1]=3 2456 B11R1.91 S=C(Cl)NCc1ccccc1 Amb28436734 [0,1,0,0,0,0|3,0,0]=4 2457 B11R1.91 S=C(S)NCc1ccccc1 Amb26372903 [0,1,0,0,0,0|3,0,0]=4 2458 B11R1.91 S=C([S-])NCc1ccccc1 Amb33249792 [0,1,0,0,0,0|3,0,0]=4 2459 B9R0.18 C=CCCC(=O)NCC=C Amb27226174 [0,0,1,0,0,0|1,0,2]=4 2460 B9R0.18 C=CCNC(=O)NCC=C Amb2779874 [0,0,1,0,0,0|2,0,1]=4 2461 B9R0.18 C=CCNC(=O)OCC=C Amb25359097 [0,0,1,0,0,0|2,0,1]=4 2462 B9R0.18 C=CCNC(=O)\C=C\CC Amb27977640 [0,0,1,0,0,0|1,0,2]=4 2463 B9R0.18 C=CCNC(=S)SCC=C Amb27462104 [0,0,1,0,0,0|2,0,1]=4 2464 B9R0.40 C=CCNC(C=C)CC=C Amb28240412 [0,0,1,0,0,0|0,0,2]=3 2465 B9R0.45 C=CC\C=C\CCCC=C Amb4035041 [0,0,1,0,0,0|1,0,2]=4 2466 B9R0.45 C=C\C=C\C=C\C=C\C=O Amb27841284 [0,0,1,0,0,0|2,0,1]=4 2467 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [0,0,0,1,0,0|2,0,1]=4 2468 B11R2.1 BrC1CCc2ccccc21 Amb33528718 [0,0,0,1,0,0|2,0,1]=4 2469 B11R2.1 Brc1coc2ccccc12 Amb6344810 [0,0,0,1,0,0|2,0,1]=4 2470 B11R2.1 Brc1csc2ccccc12 Amb2720075 [0,0,0,1,0,0|2,0,1]=4 2471 B11R2.1 Brc1noc2ccccc12 Amb18187786 [0,0,0,1,0,0|3,0,0]=4 2472 B11R2.1 Brc1nsc2ccccc12 Amb18769624 [0,0,0,1,0,0|3,0,0]=4 2473 B11R2.1 Brc1snc2ccccc12 Amb22496211 [0,0,0,1,0,0|2,0,1]=4 2474 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|1,0,0]=2 2475 B11R2.1 C=C1CCc2cccnc21 Amb28289851 [0,0,0,1,0,0|2,0,0]=3 2476 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,1,0,0|0,0,0]=1 2477 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [0,0,0,1,0,0|1,0,2]=4 2478 B11R2.1 CC1CCc2ccccc21 Amb28050187 [0,0,0,1,0,0|1,0,2]=4 2479 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|0,0,2]=3 2480 B11R2.1 CC1CNc2ccccc21 Amb9197981 [0,0,0,1,0,0|0,0,2]=3 2481 B11R2.1 CC1CNc2cnccc21 Amb33742877 [0,0,0,1,0,0|1,0,2]=4 2482 B11R2.1 CC1COc2ccccc21 Amb27617216 [0,0,0,1,0,0|1,0,2]=4 2483 B11R2.1 CN1CCc2ccccc21 Amb15691717 [0,0,0,1,0,0|2,0,1]=4 2484 B11R2.1 C[C@H]1CNc2ccccc21 Amb27222357 [0,0,0,1,0,0|0,0,2]=3 2485 B11R2.1 Cc1coc2ccccc12 Amb2684177 [0,0,0,1,0,0|1,0,2]=4 2486 B11R2.1 Cc1csc2ccccc12 Amb2689330 [0,0,0,1,0,0|1,0,2]=4 2487 B11R2.1 Cc1noc2ccccc12 Amb445022 [0,0,0,1,0,0|2,0,1]=4 2488 B11R2.1 Cc1nsc2ccccc12 Amb26599921 [0,0,0,1,0,0|2,0,1]=4 2489 B11R2.1 Cc1onc2ccccc12 Amb4120114 [0,0,0,1,0,0|1,0,2]=4 2490 B11R2.1 ClC1CCc2ccccc21 Amb8630739 [0,0,0,1,0,0|2,0,1]=4 2491 B11R2.1 ClC1COc2ccccc21 Amb27233528 [0,0,0,1,0,0|2,0,1]=4 2492 B11R2.1 Clc1coc2ccccc12 Amb21963868 [0,0,0,1,0,0|2,0,1]=4 2493 B11R2.1 Clc1csc2ccccc12 Amb5494165 [0,0,0,1,0,0|2,0,1]=4 2494 B11R2.1 Clc1noc2ccccc12 Amb2724801 [0,0,0,1,0,0|3,0,0]=4 2495 B11R2.1 Clc1nsc2ccccc12 Amb1105427 [0,0,0,1,0,0|3,0,0]=4 2496 B11R2.1 Clc1snc2ccccc12 Amb13952486 [0,0,0,1,0,0|2,0,1]=4 2497 B11R2.1 Fc1csc2ccccc12 Amb27667159 [0,0,0,1,0,0|2,0,1]=4 2498 B11R2.1 Fc1noc2ccccc12 Amb35642438 [0,0,0,1,0,0|3,0,0]=4 2499 B11R2.1 Fc1snc2ccccc12 Amb30034029 [0,0,0,1,0,0|2,0,1]=4 2500 B11R2.1 Ic1coc2ccccc12 Amb24622374 [0,0,0,1,0,0|2,0,1]=4 2501 B11R2.1 Ic1csc2ccccc12 Amb22002561 [0,0,0,1,0,0|2,0,1]=4 2502 B11R2.1 Ic1snc2ccccc12 Amb27406455 [0,0,0,1,0,0|2,0,1]=4 2503 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [0,0,0,1,0,0|3,0,0]=4 2504 B11R2.1 NC1=NCc2ccccc21 Amb534105 [0,0,0,1,0,0|3,0,0]=4 2505 B11R2.1 NC1CCc2ccccc21 Amb1158023 [0,0,0,1,0,0|2,0,1]=4 2506 B11R2.1 NC1CCc2ccccc21 Amb16233857 [0,0,0,1,0,0|2,0,1]=4 2507 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,1]=4 2508 B11R2.1 NC1CCc2ccccc21 Amb9677422 [0,0,0,1,0,0|2,0,1]=4 2509 B11R2.1 NC1COc2ccccc21 Amb13951643 [0,0,0,1,0,0|2,0,1]=4 2510 B11R2.1 NC1COc2ccccc21 Amb2383232 [0,0,0,1,0,0|2,0,1]=4 2511 B11R2.1 NC1CSc2ccccc21 Amb33531788 [0,0,0,1,0,0|2,0,1]=4 2512 B11R2.1 NN1CCc2ccccc21 Amb2691266 [0,0,0,1,0,0|3,0,0]=4 2513 B11R2.1 NN1CCc2ccccc21 Amb836793 [0,0,0,1,0,0|3,0,0]=4 2514 B11R2.1 N[C@@H]1CCc2ccccc21 Amb16233854 [0,0,0,1,0,0|2,0,1]=4 2515 B11R2.1 N[C@@H]1CCc2ccccc21 Amb3940189 [0,0,0,1,0,0|2,0,1]=4 2516 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|2,0,1]=4 2517 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|2,0,1]=4 2518 B11R2.1 N[C@@H]1CSc2ccccc21 Amb27192844 [0,0,0,1,0,0|2,0,1]=4 2519 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,1]=4 2520 B11R2.1 N[C@H]1CCc2ccccc21 Amb3940190 [0,0,0,1,0,0|2,0,1]=4 2521 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|2,0,1]=4 2522 B11R2.1 N[C@H]1COc2ccccc21 Amb33813746 [0,0,0,1,0,0|2,0,1]=4 2523 B11R2.1 N[C@H]1COc2ccccc21 Amb33872471 [0,0,0,1,0,0|2,0,1]=4 2524 B11R2.1 N[C@H]1CSc2ccccc21 Amb27487071 [0,0,0,1,0,0|2,0,1]=4 2525 B11R2.1 Nc1coc2ccccc12 Amb24371464 [0,0,0,1,0,0|2,0,1]=4 2526 B11R2.1 Nc1csc2ccccc12 Amb13890519 [0,0,0,1,0,0|2,0,1]=4 2527 B11R2.1 Nc1csc2ccccc12 Amb19957699 [0,0,0,1,0,0|2,0,1]=4 2528 B11R2.1 Nc1noc2ccccc12 Amb1323334 [0,0,0,1,0,0|3,0,0]=4 2529 B11R2.1 Nc1nsc2ccccc12 Amb1147286 [0,0,0,1,0,0|3,0,0]=4 2530 B11R2.1 Nc1nsc2ccccc12 Amb32665266 [0,0,0,1,0,0|3,0,0]=4 2531 B11R2.1 Nc1onc2ccccc12 Amb21857107 [0,0,0,1,0,0|2,0,1]=4 2532 B11R2.1 Nc1snc2ccccc12 Amb33542957 [0,0,0,1,0,0|2,0,1]=4 2533 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,1,0,0|2,0,1]=4 2534 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,1,0,0|2,0,0]=3 2535 B11R2.1 O=C1CCc2cccnc21 Amb10602809 [0,0,0,1,0,0|3,0,0]=4 2536 B11R2.1 O=C1CCc2ccncc21 Amb22491415 [0,0,0,1,0,0|3,0,0]=4 2537 B11R2.1 O=C1CCc2ccncc21 Amb5719663 [0,0,0,1,0,0|3,0,0]=4 2538 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [0,0,0,1,0,0|3,0,0]=4 2539 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [0,0,0,1,0,0|3,0,0]=4 2540 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [0,0,0,1,0,0|3,0,0]=4 2541 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [0,0,0,1,0,0|3,0,0]=4 2542 B11R2.1 O=C1CN=C2NC=CC=C12 Amb22491902 [0,0,0,1,0,0|2,0,1]=4 2543 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [0,0,0,1,0,0|2,0,0]=3 2544 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,1,0,0|1,0,0]=2 2545 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,1,0,0|2,0,0]=3 2546 B11R2.1 O=C1COc2cccnc21 Amb22372216 [0,0,0,1,0,0|3,0,0]=4 2547 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,1,0,0|3,0,0]=4 2548 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,1,0,0|3,0,0]=4 2549 B11R2.1 O=C1COc2ncccc21 Amb20242022 [0,0,0,1,0,0|3,0,0]=4 2550 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,1,0,0|2,0,0]=3 2551 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [0,0,0,1,0,0|3,0,0]=4 2552 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [0,0,0,1,0,0|3,0,0]=4 2553 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,1,0,0|3,0,0]=4 2554 B11R2.1 O=C1NCc2ccccc21 Amb773532 [0,0,0,1,0,0|3,0,0]=4 2555 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,1,0,0|2,0,0]=3 2556 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [0,0,0,1,0,0|3,0,0]=4 2557 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [0,0,0,1,0,0|3,0,0]=4 2558 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [0,0,0,1,0,0|3,0,0]=4 2559 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,1,0,0|3,0,0]=4 2560 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [0,0,0,1,0,0|3,0,0]=4 2561 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [0,0,0,1,0,0|2,0,0]=3 2562 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [0,0,0,1,0,0|3,0,0]=4 2563 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,1,0,0|2,0,0]=3 2564 B11R2.1 OC1CCc2ccccc21 Amb9703194 [0,0,0,1,0,0|2,0,1]=4 2565 B11R2.1 OC1COc2ccccc21 Amb33548779 [0,0,0,1,0,0|2,0,1]=4 2566 B11R2.1 OC1CSc2ccccc21 Amb27174921 [0,0,0,1,0,0|2,0,1]=4 2567 B11R2.1 O[C@@H]1CCc2ccccc21 Amb13953023 [0,0,0,1,0,0|2,0,1]=4 2568 B11R2.1 O[C@@H]1COc2ccccc21 Amb27191568 [0,0,0,1,0,0|2,0,1]=4 2569 B11R2.1 O[C@@H]1CSc2ccccc21 Amb28315859 [0,0,0,1,0,0|2,0,1]=4 2570 B11R2.1 O[C@H]1CCc2ccccc21 Amb13953022 [0,0,0,1,0,0|2,0,1]=4 2571 B11R2.1 O[C@H]1COc2ccccc21 Amb27946875 [0,0,0,1,0,0|2,0,1]=4 2572 B11R2.1 Oc1coc2ccccc12 Amb24097480 [0,0,0,1,0,0|2,0,1]=4 2573 B11R2.1 Oc1csc2ccccc12 Amb4009443 [0,0,0,1,0,0|2,0,1]=4 2574 B11R2.1 Oc1noc2ccccc12 Amb2725155 [0,0,0,1,0,0|3,0,0]=4 2575 B11R2.1 Oc1nsc2ccccc12 Amb22166851 [0,0,0,1,0,0|3,0,0]=4 2576 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,1,0,0|1,0,0]=2 2577 B11R2.1 S=c1nnc2ccccc12 Amb24082861 [0,0,0,1,0,0|2,0,1]=4 2578 B11R2.1 SC1CCc2ccccc21 Amb9208023 [0,0,0,1,0,0|2,0,1]=4 2579 B11R2.1 SC1CSc2ccccc21 Amb32788664 [0,0,0,1,0,0|2,0,1]=4 2580 B11R2.1 Sc1coc2ccccc12 Amb24061893 [0,0,0,1,0,0|2,0,1]=4 2581 B11R2.1 Sc1csc2ccccc12 Amb24396652 [0,0,0,1,0,0|2,0,1]=4 2582 B11R2.1 Sc1nsc2ccccc12 Amb1136898 [0,0,0,1,0,0|3,0,0]=4 2583 B11R2.1 [N-]=[N+]1ONc2ccccc21 Amb21953654 [0,0,0,1,0,0|3,0,0]=4 2584 B11R2.1 [NH3+]C1=NCc2ccccc21 Amb4239931 [0,0,0,1,0,0|3,0,0]=4 2585 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|2,0,1]=4 2586 B11R2.4 BrC1C[C@H]1c2ccccc2 Amb27392259 [0,0,0,1,0,0|2,0,1]=4 2587 B11R2.4 Br[C@@H]1C[C@@H]1c2ccccc2 Amb28383883 [0,0,0,1,0,0|2,0,1]=4 2588 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|2,0,1]=4 2589 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [0,0,0,1,0,0|2,0,1]=4 2590 B11R2.4 CN1C[C@@H]1c2ccccc2 Amb33621244 [0,0,0,1,0,0|2,0,1]=4 2591 B11R2.4 CN1C[C@H]1c2ccccc2 Amb33621243 [0,0,0,1,0,0|2,0,1]=4 2592 B11R2.4 Cl[C@H]1C[C@@H]1c2ccccc2 Amb28142329 [0,0,0,1,0,0|2,0,1]=4 2593 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|2,0,1]=4 2594 B11R2.4 NC1CC1c2ccccc2 Amb33548983 [0,0,0,1,0,0|2,0,1]=4 2595 B11R2.4 NC1CC1c2ccccc2 Amb9284785 [0,0,0,1,0,0|2,0,1]=4 2596 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|3,0,0]=4 2597 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|2,0,1]=4 2598 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|2,0,1]=4 2599 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|2,0,1]=4 2600 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|2,0,1]=4 2601 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb2720223 [0,0,0,1,0,0|2,0,1]=4 2602 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb8387302 [0,0,0,1,0,0|2,0,1]=4 2603 B11R2.4 N[C@H]1CC1c2ccccc2 Amb34916480 [0,0,0,1,0,0|2,0,1]=4 2604 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|2,0,1]=4 2605 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb597420 [0,0,0,1,0,0|2,0,1]=4 2606 B11R2.4 N[C@H]1C[C@H]1c2ccccc2 Amb33806281 [0,0,0,1,0,0|2,0,1]=4 2607 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|2,0,1]=4 2608 B11R2.4 O[C@@H]1C[C@@H]1c2ccccc2 Amb27486613 [0,0,0,1,0,0|2,0,1]=4 2609 B11R2.4 O[C@H]1C[C@H]1c2ccccc2 Amb27972540 [0,0,0,1,0,0|2,0,1]=4 2610 B11R2.20 C1=CC2=CCCC=C2C=N1 Amb24612787 [0,0,0,1,0,0|2,0,1]=4 2611 B11R2.20 C1=CC2=CN=CNC2=CO1 Amb24505153 [0,0,0,1,0,0|2,0,1]=4 2612 B11R2.20 C1=CC2=CN=CNC2=CS1 Amb27251381 [0,0,0,1,0,0|2,0,1]=4 2613 B11R2.20 C1=CC2=COCN=C2C=N1 Amb27597990 [0,0,0,1,0,0|2,0,1]=4 2614 B11R2.20 C1=CC2=COCN=C2N=C1 Amb27948434 [0,0,0,1,0,0|2,0,1]=4 2615 B11R2.20 C1=CC2=CON=CC2=NC1 Amb28437130 [0,0,0,1,0,0|2,0,1]=4 2616 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [0,0,0,1,0,0|1,0,2]=4 2617 B11R2.20 C1=CNC2=CSN=CC2=C1 Amb25943274 [0,0,0,1,0,0|2,0,1]=4 2618 B11R2.20 C1=CNc2ccncc2C1 Amb25933564 [0,0,0,1,0,0|1,0,2]=4 2619 B11R2.20 C1=COC2=CN=CNC2=C1 Amb24564703 [0,0,0,1,0,0|2,0,1]=4 2620 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [0,0,0,1,0,0|1,0,1]=3 2621 B11R2.20 C1=COc2cccnc2N1 Amb27403264 [0,0,0,1,0,0|2,0,1]=4 2622 B11R2.20 C1=CSC2=CN=CNC2=C1 Amb27245769 [0,0,0,1,0,0|2,0,1]=4 2623 B11R2.20 C1=CSc2ncccc2N1 Amb27954664 [0,0,0,1,0,0|2,0,1]=4 2624 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [0,0,0,1,0,0|1,0,0]=2 2625 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [0,0,0,1,0,0|2,0,0]=3 2626 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [0,0,0,1,0,0|2,0,0]=3 2627 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [0,0,0,1,0,0|0,0,0]=1 2628 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [0,0,0,1,0,0|1,0,0]=2 2629 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [0,0,0,1,0,0|1,0,0]=2 2630 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [0,0,0,1,0,0|2,0,0]=3 2631 B11R2.20 C1=NCNc2nccnc21 Amb27617630 [0,0,0,1,0,0|3,0,0]=4 2632 B11R2.20 C1=NCOc2ccncc21 Amb27945623 [0,0,0,1,0,0|3,0,0]=4 2633 B11R2.20 C1=NCOc2cnccc21 Amb27838869 [0,0,0,1,0,0|3,0,0]=4 2634 B11R2.20 C1=NCc2ccccc2N1 Amb19374085 [0,0,0,1,0,0|1,0,2]=4 2635 B11R2.20 C1=NNc2cccnc2O1 Amb28291339 [0,0,0,1,0,0|3,0,0]=4 2636 B11R2.20 C1=Nc2ccccc2NC1 Amb10174686 [0,0,0,1,0,0|1,0,0]=2 2637 B11R2.20 C1=Nc2ccccc2OC1 Amb28456926 [0,0,0,1,0,0|2,0,0]=3 2638 B11R2.20 C1=Nc2ccccc2SC1 Amb10976509 [0,0,0,1,0,0|2,0,0]=3 2639 B11R2.20 C1=Nc2ccncc2NN1 Amb25254888 [0,0,0,1,0,0|3,0,0]=4 2640 B11R2.20 C1=Nc2cncnc2NC1 Amb25066994 [0,0,0,1,0,0|3,0,0]=4 2641 B11R2.20 c1cc2c(cn1)CCCN2 Amb9174240 [0,0,0,1,0,0|1,0,2]=4 2642 B11R2.20 c1cc2c(cn1)NCCC2 Amb21864834 [0,0,0,1,0,0|1,0,2]=4 2643 B11R2.20 c1cc2c(cn1)NCCN2 Amb20622788 [0,0,0,1,0,0|2,0,1]=4 2644 B11R2.20 c1cc2c(cn1)NCCO2 Amb20622566 [0,0,0,1,0,0|2,0,1]=4 2645 B11R2.20 c1cc2c(cn1)NCCO2 Amb28555496 [0,0,0,1,0,0|2,0,1]=4 2646 B11R2.20 c1cc2c(cn1)NCCO2 Amb32661585 [0,0,0,1,0,0|2,0,1]=4 2647 B11R2.20 c1cc2c(cn1)NCCS2 Amb20667582 [0,0,0,1,0,0|2,0,1]=4 2648 B11R2.20 c1cc2c(cn1)OCCN2 Amb13890252 [0,0,0,1,0,0|2,0,1]=4 2649 B11R2.20 c1cc2c(cn1)SCCN2 Amb27972680 [0,0,0,1,0,0|2,0,1]=4 2650 B11R2.20 c1cc2ccncc2cn1 Amb20240662 [0,0,0,1,0,0|3,0,0]=4 2651 B11R2.20 c1cc2ccncc2cn1 Amb33456122 [0,0,0,1,0,0|3,0,0]=4 2652 B11R2.20 c1cc2cnccc2cn1 Amb10573720 [0,0,0,1,0,0|3,0,0]=4 2653 B11R2.20 c1cc[n+]2cccnc2c1 Amb2603162 [0,0,0,1,0,0|1,0,2]=4 2654 B11R2.20 c1ccc2[nH+]cccc2c1 Amb10839799 [0,0,0,1,0,0|0,0,2]=3 2655 B11R2.20 c1ccc2c(c1)CCCC2 Amb6608921 [0,0,0,1,0,0|1,0,2]=4 2656 B11R2.20 c1ccc2c(c1)CCCN2 Amb1869492 [0,0,0,1,0,0|0,0,2]=3 2657 B11R2.20 c1ccc2c(c1)CCCO2 Amb9677672 [0,0,0,1,0,0|1,0,2]=4 2658 B11R2.20 c1ccc2c(c1)CCNC2 Amb2383348 [0,0,0,1,0,0|2,0,1]=4 2659 B11R2.20 c1ccc2c(c1)CCNC2 Amb2720224 [0,0,0,1,0,0|2,0,1]=4 2660 B11R2.20 c1ccc2c(c1)CCNS2 Amb27421368 [0,0,0,1,0,0|3,0,0]=4 2661 B11R2.20 c1ccc2c(c1)CCOC2 Amb2725513 [0,0,0,1,0,0|2,0,1]=4 2662 B11R2.20 c1ccc2c(c1)CCSO2 Amb27965466 [0,0,0,1,0,0|3,0,0]=4 2663 B11R2.20 c1ccc2c(c1)CNCN2 Amb25147572 [0,0,0,1,0,0|1,0,1]=3 2664 B11R2.20 c1ccc2c(c1)CSCN2 Amb27412411 [0,0,0,1,0,0|1,0,1]=3 2665 B11R2.20 c1ccc2c(c1)NCCN2 Amb6537963 [0,0,0,1,0,0|1,0,1]=3 2666 B11R2.20 c1ccc2c(c1)NCCO2 Amb2371970 [0,0,0,1,0,0|1,0,1]=3 2667 B11R2.20 c1ccc2c(c1)NCCO2 Amb29844650 [0,0,0,1,0,0|1,0,1]=3 2668 B11R2.20 c1ccc2c(c1)NCCS2 Amb1104964 [0,0,0,1,0,0|1,0,1]=3 2669 B11R2.20 c1ccc2c(c1)OCCO2 Amb2722914 [0,0,0,1,0,0|2,0,1]=4 2670 B11R2.20 c1ccc2c(c1)OCCS2 Amb19374957 [0,0,0,1,0,0|2,0,1]=4 2671 B11R2.20 c1ccc2c(c1)SCCS2 Amb2781726 [0,0,0,1,0,0|2,0,1]=4 2672 B11R2.20 c1ccc2ccccc2c1 Amb6608803 [0,0,0,1,0,0|1,0,1]=3 2673 B11R2.20 c1ccc2cnccc2c1 Amb2609970 [0,0,0,1,0,0|2,0,0]=3 2674 B11R2.20 c1ccc2cnncc2c1 Amb10552942 [0,0,0,1,0,0|3,0,0]=4 2675 B11R2.20 c1ccc2cnncc2c1 Amb8384453 [0,0,0,1,0,0|3,0,0]=4 2676 B11R2.20 c1ccc2ncccc2c1 Amb22002632 [0,0,0,1,0,0|0,0,2]=3 2677 B11R2.20 c1ccc2ncccc2c1 Amb2610545 [0,0,0,1,0,0|0,0,2]=3 2678 B11R2.20 c1ccc2nccnc2c1 Amb2099438 [0,0,0,1,0,0|1,0,2]=4 2679 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [0,0,0,1,0,0|1,0,2]=4 2680 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [0,0,0,1,0,0|1,0,1]=3 2681 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [0,0,0,1,0,0|1,0,1]=3 2682 B11R2.20 c1cnc2c(c1)CCCN2 Amb15692065 [0,0,0,1,0,0|1,0,2]=4 2683 B11R2.20 c1cnc2c(c1)NCCC2 Amb488375 [0,0,0,1,0,0|1,0,2]=4 2684 B11R2.20 c1cnc2c(c1)NCCN2 Amb10603351 [0,0,0,1,0,0|2,0,1]=4 2685 B11R2.20 c1cnc2c(c1)NCCO2 Amb13890253 [0,0,0,1,0,0|2,0,1]=4 2686 B11R2.20 c1cnc2c(c1)NCCS2 Amb19148121 [0,0,0,1,0,0|2,0,1]=4 2687 B11R2.20 c1cnc2c(c1)OCCN2 Amb2724103 [0,0,0,1,0,0|2,0,1]=4 2688 B11R2.20 c1cnc2cccnc2c1 Amb1106274 [0,0,0,1,0,0|1,0,2]=4 2689 B11R2.20 c1cnc2ccncc2c1 Amb6565155 [0,0,0,1,0,0|1,0,2]=4 2690 B11R2.20 c1cnc2ccnnc2c1 Amb27470418 [0,0,0,1,0,0|2,0,1]=4 2691 B11R2.20 c1cnc2cnccc2c1 Amb4560929 [0,0,0,1,0,0|1,0,2]=4 2692 B11R2.20 c1cnc2ncccc2c1 Amb15692873 [0,0,0,1,0,0|1,0,2]=4 2693 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [0,0,0,1,0,0|1,0,2]=4 2694 B11R2.238 c1cc(NC2CC2)ccn1 Amb6625922 [0,0,0,1,0,0|1,0,2]=4 2695 B11R2.238 c1ccc(CC2CC2)cc1 Amb22490220 [0,0,0,1,0,0|1,0,2]=4 2696 B11R2.238 c1ccc(CC2CO2)cc1 Amb3940775 [0,0,0,1,0,0|2,0,1]=4 2697 B11R2.238 c1ccc(C[C@@H]2CO2)cc1 Amb25916397 [0,0,0,1,0,0|2,0,1]=4 2698 B11R2.238 c1ccc(C[C@H]2CN2)cc1 Amb15690958 [0,0,0,1,0,0|2,0,1]=4 2699 B11R2.238 c1ccc(C[C@H]2CO2)cc1 Amb27150158 [0,0,0,1,0,0|2,0,1]=4 2700 B11R2.238 c1ccc(NC2CC2)cc1 Amb18270529 [0,0,0,1,0,0|0,0,2]=3 2701 B11R2.238 c1ccc(NC2CC2)cc1 Amb32663098 [0,0,0,1,0,0|0,0,2]=3 2702 B11R2.238 c1ccc(SC2CC2)cc1 Amb8514420 [0,0,0,1,0,0|1,0,2]=4 2703 B11R2.238 c1cncc(NC2CC2)c1 Amb18270523 [0,0,0,1,0,0|1,0,2]=4 2704 B11R2.239 C1=C(c2cccnc2)CC1 Amb32668896 [0,0,0,1,0,0|2,0,1]=4 2705 B11R2.239 c1ccc(C2CCC2)cc1 Amb27466141 [0,0,0,1,0,0|1,0,2]=4 2706 B11R2.239 c1ccc(C2CCN2)cc1 Amb34912959 [0,0,0,1,0,0|2,0,1]=4 2707 B11R2.239 c1ccc(C2CCN2)cc1 Amb6893889 [0,0,0,1,0,0|2,0,1]=4 2708 B11R2.239 c1ccc(C2CCS2)cc1 Amb27839415 [0,0,0,1,0,0|2,0,1]=4 2709 B11R2.239 c1ccc(C2CNC2)cc1 Amb10603719 [0,0,0,1,0,0|2,0,1]=4 2710 B11R2.239 c1ccc(C2CNC2)cc1 Amb4124710 [0,0,0,1,0,0|2,0,1]=4 2711 B11R2.239 c1ccc([C@@H]2CCO2)cc1 Amb25721124 [0,0,0,1,0,0|2,0,1]=4 2712 B11R2.239 c1ccc([C@H]2CCN2)cc1 Amb27874787 [0,0,0,1,0,0|2,0,1]=4 2713 B11R2.988 C=CC1Cc2ccccc21 Amb17778869 [0,0,0,1,0,0|1,0,0]=2 2714 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|1,0,2]=4 2715 B11R2.988 CNC1Cc2ccccc21 Amb28315966 [0,0,0,1,0,0|2,0,1]=4 2716 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,1]=4 2717 B11R2.988 N#CC1Cc2ccccc21 Amb2778424 [0,0,0,1,0,0|2,0,1]=4 2718 B11R2.988 NCC1Cc2ccccc21 Amb10609227 [0,0,0,1,0,0|2,0,1]=4 2719 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [0,0,0,1,0,0|2,0,0]=3 2720 B11R2.988 OCC1Cc2ccccc21 Amb8395939 [0,0,0,1,0,0|2,0,1]=4 2721 B11R2.988 SCC1Cc2ccccc21 Amb27866792 [0,0,0,1,0,0|2,0,1]=4 2722 B9R1.12 C=CCCc1ccco1 Amb35680299 [0,0,0,0,1,0|2,0,0]=3 2723 B9R1.12 C=CCCc1cccs1 Amb27476978 [0,0,0,0,1,0|2,0,0]=3 2724 B9R1.12 C=CCCc1ccns1 Amb29867199 [0,0,0,0,1,0|3,0,0]=4 2725 B9R1.12 C=CCCc1ccoc1 Amb35680294 [0,0,0,0,1,0|2,0,0]=3 2726 B9R1.12 C=CCCc1ccsc1 Amb28342746 [0,0,0,0,1,0|2,0,0]=3 2727 B9R1.12 C=CCCc1ccsn1 Amb35715622 [0,0,0,0,1,0|3,0,0]=4 2728 B9R1.12 C=CCCc1cnsc1 Amb35731371 [0,0,0,0,1,0|3,0,0]=4 2729 B9R1.12 C=CCCc1nccs1 Amb27834255 [0,0,0,0,1,0|3,0,0]=4 2730 B9R1.12 C=CCCn1cccc1 Amb27463173 [0,0,0,0,1,0|2,0,0]=3 2731 B9R1.12 C=CCCn1cccn1 Amb24340287 [0,0,0,0,1,0|3,0,0]=4 2732 B9R1.12 C=CCCn1ccnc1 Amb26624962 [0,0,0,0,1,0|3,0,0]=4 2733 B9R1.12 C=CCNC1C=CCC1 Amb35713400 [0,0,0,0,1,0|0,0,3]=4 2734 B9R1.12 C=CCNC1CC=CC1 Amb28384037 [0,0,0,0,1,0|0,0,3]=4 2735 B9R1.12 C=CCOn1ccnc1 Amb2410573 [0,0,0,0,1,0|3,0,0]=4 2736 B9R1.12 C=CCSc1ccoc1 Amb27209283 [0,0,0,0,1,0|2,0,0]=3 2737 B9R1.12 C=CCSc1ccsc1 Amb28198678 [0,0,0,0,1,0|2,0,0]=3 2738 B9R1.12 C=CCSc1ncco1 Amb27956580 [0,0,0,0,1,0|3,0,0]=4 2739 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [0,0,0,0,1,0|2,0,1]=4 2740 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [0,0,0,0,1,0|2,0,1]=4 2741 B9R1.12 C=C\N=C\c1cccs1 Amb27240018 [0,0,0,0,1,0|3,0,0]=4 2742 B9R1.12 C=NCCc1cccs1 Amb27442437 [0,0,0,0,1,0|3,0,0]=4 2743 B9R1.12 C=NCCc1ccsc1 Amb27612947 [0,0,0,0,1,0|3,0,0]=4 2744 B9R1.12 CCCNn1cccc1 Amb28401503 [0,0,0,0,1,0|1,0,2]=4 2745 B9R1.12 FCCNn1cccc1 Amb27838516 [0,0,0,0,1,0|2,0,1]=4 2746 B9R1.12 N#CCNc1ccco1 Amb28247716 [0,0,0,0,1,0|2,0,1]=4 2747 B9R1.12 N#CCNc1ccsc1 Amb27468626 [0,0,0,0,1,0|2,0,1]=4 2748 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,1,0|3,0,0]=4 2749 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,1,0|3,0,0]=4 2750 B9R1.12 O=CCCc1ccoc1 Amb8394152 [0,0,0,0,1,0|3,0,0]=4 2751 B9R1.12 O=CCCc1ccsc1 Amb26961096 [0,0,0,0,1,0|3,0,0]=4 2752 B9R1.12 O=CCOc1ccsc1 Amb27191888 [0,0,0,0,1,0|3,0,0]=4 2753 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,0,0,0,1,0|3,0,0]=4 2754 B9R1.12 OCCNc1ccco1 Amb27246618 [0,0,0,0,1,0|2,0,1]=4 2755 B9R1.12 OCCNc1cccs1 Amb27174142 [0,0,0,0,1,0|2,0,1]=4 2756 B11R1.203 O=CCCC1C=CC=CC=C1 Amb27401095 [0,0,0,0,0,1|2,0,1]=4 2757 B8R0.1 C=CCNC(=O)CC=C Amb26874605 [1,0,1,0,0,0|1,0,1]=4 2758 B8R0.1 C=CCNC(=S)CC=C Amb27961186 [1,0,1,0,0,0|1,0,1]=4 2759 B8R0.1 C=C\C=C\C(=C)CC=O Amb26851275 [1,0,1,0,0,0|1,0,0]=3 2760 B8R0.4 C=CC\N=C\NCC=C Amb24629164 [1,0,1,0,0,0|1,0,1]=4 2761 B8R0.4 C=C\C=C\C=C\CCC Amb22641675 [1,0,1,0,0,0|0,0,2]=4 2762 B8R0.4 O=C\C=C\C=C/CC=O Amb28285297 [1,0,1,0,0,0|2,0,0]=4 2763 B8R0.4 O=C\C=C\C=C\CC=O Amb27841285 [1,0,1,0,0,0|2,0,0]=4 2764 B8R1.2 BrCc1ccccc1 Amb3939707 [2,0,0,0,0,0|1,0,0]=3 2765 B8R1.2 BrCc1ccccn1 Amb3939990 [2,0,0,0,0,0|2,0,0]=4 2766 B8R1.2 BrCc1ccccn1 Amb8393294 [2,0,0,0,0,0|2,0,0]=4 2767 B8R1.2 BrCc1cccnc1 Amb3939989 [2,0,0,0,0,0|2,0,0]=4 2768 B8R1.2 BrCc1cccnc1 Amb9826052 [2,0,0,0,0,0|2,0,0]=4 2769 B8R1.2 BrCc1ccncc1 Amb3939991 [2,0,0,0,0,0|2,0,0]=4 2770 B8R1.2 BrCc1ccncc1 Amb9826062 [2,0,0,0,0,0|2,0,0]=4 2771 B8R1.2 Br[Se]c1ccccc1 Amb8514629 [2,0,0,0,0,0|2,0,0]=4 2772 B8R1.2 C#Cc1ccccc1 Amb2793084 [2,0,0,0,0,0|0,0,2]=4 2773 B8R1.2 C=Cc1ccccc1 Amb6608811 [2,0,0,0,0,0|0,0,0]=2 2774 B8R1.2 C=Cc1ccccn1 Amb6600549 [2,0,0,0,0,0|1,0,0]=3 2775 B8R1.2 C=Cc1cccnc1 Amb33544464 [2,0,0,0,0,0|1,0,0]=3 2776 B8R1.2 C=Cc1cccnn1 Amb25026421 [2,0,0,0,0,0|2,0,0]=4 2777 B8R1.2 C=Cc1ccncc1 Amb3940417 [2,0,0,0,0,0|1,0,0]=3 2778 B8R1.2 C=Cc1ccncn1 Amb24056360 [2,0,0,0,0,0|2,0,0]=4 2779 B8R1.2 C=Cc1cnccn1 Amb2695475 [2,0,0,0,0,0|2,0,0]=4 2780 B8R1.2 C=Cc1cncnc1 Amb24056355 [2,0,0,0,0,0|2,0,0]=4 2781 B8R1.2 C=Cc1ncccn1 Amb23411991 [2,0,0,0,0,0|2,0,0]=4 2782 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|0,0,1]=3 2783 B8R1.2 C=Nc1ccccn1 Amb26956421 [2,0,0,0,0,0|1,0,1]=4 2784 B8R1.2 CC[n+]1ccccc1 Amb8516219 [2,0,0,0,0,0|1,0,1]=4 2785 B8R1.2 CC[n+]1ccccc1 Amb8516636 [2,0,0,0,0,0|1,0,1]=4 2786 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,1]=3 2787 B8R1.2 CCc1ccccn1 Amb6608978 [2,0,0,0,0,0|1,0,1]=4 2788 B8R1.2 CCc1cccnc1 Amb4037096 [2,0,0,0,0,0|1,0,1]=4 2789 B8R1.2 CCc1ccncc1 Amb8513449 [2,0,0,0,0,0|1,0,1]=4 2790 B8R1.2 CNC1=CC[N-]C=C1 Amb26860853 [2,0,0,0,0,0|1,0,1]=4 2791 B8R1.2 CNc1ccccc1 Amb2721038 [2,0,0,0,0,0|0,0,0]=2 2792 B8R1.2 CNc1ccccc1 Amb4037054 [2,0,0,0,0,0|0,0,0]=2 2793 B8R1.2 CNc1ccccn1 Amb3429849 [2,0,0,0,0,0|1,0,0]=3 2794 B8R1.2 CNc1cccnc1 Amb8396762 [2,0,0,0,0,0|1,0,0]=3 2795 B8R1.2 CNc1cccnn1 Amb18947507 [2,0,0,0,0,0|2,0,0]=4 2796 B8R1.2 CNc1ccncc1 Amb2610661 [2,0,0,0,0,0|1,0,0]=3 2797 B8R1.2 CNc1ccncn1 Amb18944730 [2,0,0,0,0,0|2,0,0]=4 2798 B8R1.2 CNc1ccnnc1 Amb23560757 [2,0,0,0,0,0|2,0,0]=4 2799 B8R1.2 CNc1cnccn1 Amb1102655 [2,0,0,0,0,0|2,0,0]=4 2800 B8R1.2 CNc1cncnc1 Amb18268827 [2,0,0,0,0,0|2,0,0]=4 2801 B8R1.2 CNc1ncccn1 Amb2609521 [2,0,0,0,0,0|2,0,0]=4 2802 B8R1.2 COc1ccccc1 Amb2842269 [2,0,0,0,0,0|1,0,0]=3 2803 B8R1.2 COc1ccccn1 Amb4037280 [2,0,0,0,0,0|2,0,0]=4 2804 B8R1.2 COc1cccnc1 Amb8517634 [2,0,0,0,0,0|2,0,0]=4 2805 B8R1.2 COc1ccncc1 Amb2609546 [2,0,0,0,0,0|2,0,0]=4 2806 B8R1.2 COc1ccncc1 Amb28991347 [2,0,0,0,0,0|2,0,0]=4 2807 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|0,1,0]=3 2808 B8R1.2 CSc1ccccc1 Amb2690593 [2,0,0,0,0,0|1,0,0]=3 2809 B8R1.2 CSc1ccccn1 Amb8392843 [2,0,0,0,0,0|2,0,0]=4 2810 B8R1.2 CSc1cccnc1 Amb24087396 [2,0,0,0,0,0|2,0,0]=4 2811 B8R1.2 CSc1ccncc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 2812 B8R1.2 ClCc1cc[nH+]cc1 Amb4258486 [2,0,0,0,0,0|2,0,0]=4 2813 B8R1.2 ClCc1ccccc1 Amb2792911 [2,0,0,0,0,0|1,0,0]=3 2814 B8R1.2 ClCc1ccccn1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 2815 B8R1.2 ClCc1ccccn1 Amb534985 [2,0,0,0,0,0|2,0,0]=4 2816 B8R1.2 ClCc1ccccn1 Amb6296082 [2,0,0,0,0,0|2,0,0]=4 2817 B8R1.2 ClCc1cccnc1 Amb2725600 [2,0,0,0,0,0|2,0,0]=4 2818 B8R1.2 ClCc1cccnc1 Amb534994 [2,0,0,0,0,0|2,0,0]=4 2819 B8R1.2 ClCc1ccncc1 Amb2715054 [2,0,0,0,0,0|2,0,0]=4 2820 B8R1.2 Cl[Se]c1ccccc1 Amb8513798 [2,0,0,0,0,0|2,0,0]=4 2821 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 2822 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 2823 B8R1.2 FCc1cccnc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 2824 B8R1.2 FCc1ccncc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 2825 B8R1.2 ICc1ccccc1 Amb4006861 [2,0,0,0,0,0|1,0,0]=3 2826 B8R1.2 ICc1ccccn1 Amb26963503 [2,0,0,0,0,0|2,0,0]=4 2827 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 2828 B8R1.2 ICc1cccnc1 Amb33527054 [2,0,0,0,0,0|2,0,0]=4 2829 B8R1.2 ICc1ccncc1 Amb33552994 [2,0,0,0,0,0|2,0,0]=4 2830 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 2831 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 2832 B8R1.2 N#Cc1ccccc1 Amb2793082 [2,0,0,0,0,0|1,0,1]=4 2833 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|1,0,1]=4 2834 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 2835 B8R1.2 NCc1ccccc1 Amb2725314 [2,0,0,0,0,0|1,0,0]=3 2836 B8R1.2 NCc1ccccc1 Amb2792834 [2,0,0,0,0,0|1,0,0]=3 2837 B8R1.2 NCc1ccccc1 Amb6383294 [2,0,0,0,0,0|1,0,0]=3 2838 B8R1.2 NCc1ccccn1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 2839 B8R1.2 NCc1ccccn1 Amb2684477 [2,0,0,0,0,0|2,0,0]=4 2840 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 2841 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 2842 B8R1.2 NCc1cccnc1 Amb6383332 [2,0,0,0,0,0|2,0,0]=4 2843 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 2844 B8R1.2 NCc1ccncc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 2845 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|1,0,0]=3 2846 B8R1.2 NNc1ccccc1 Amb2793062 [2,0,0,0,0,0|1,0,0]=3 2847 B8R1.2 NNc1ccccc1 Amb8513467 [2,0,0,0,0,0|1,0,0]=3 2848 B8R1.2 NNc1ccccn1 Amb1104567 [2,0,0,0,0,0|2,0,0]=4 2849 B8R1.2 NNc1ccccn1 Amb6297231 [2,0,0,0,0,0|2,0,0]=4 2850 B8R1.2 NNc1cccnc1 Amb10177783 [2,0,0,0,0,0|2,0,0]=4 2851 B8R1.2 NNc1cccnc1 Amb16192849 [2,0,0,0,0,0|2,0,0]=4 2852 B8R1.2 NNc1cccnc1 Amb2092671 [2,0,0,0,0,0|2,0,0]=4 2853 B8R1.2 NNc1ccncc1 Amb32409472 [2,0,0,0,0,0|2,0,0]=4 2854 B8R1.2 NNc1ccncc1 Amb5494094 [2,0,0,0,0,0|2,0,0]=4 2855 B8R1.2 NNc1ccncc1 Amb6296706 [2,0,0,0,0,0|2,0,0]=4 2856 B8R1.2 NNc1ccncc1 Amb6297752 [2,0,0,0,0,0|2,0,0]=4 2857 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 2858 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 2859 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|2,0,0]=4 2860 B8R1.2 O=Cc1ccccc1 Amb2792754 [2,0,0,0,0,0|1,0,0]=3 2861 B8R1.2 O=Cc1ccccn1 Amb2720349 [2,0,0,0,0,0|2,0,0]=4 2862 B8R1.2 O=Cc1cccnc1 Amb2720350 [2,0,0,0,0,0|2,0,0]=4 2863 B8R1.2 O=Cc1ccncc1 Amb932832 [2,0,0,0,0,0|2,0,0]=4 2864 B8R1.2 O=Nc1ccccc1 Amb9785158 [2,0,0,0,0,0|1,0,1]=4 2865 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [2,0,0,0,0,0|2,0,0]=4 2866 B8R1.2 OCc1ccccc1 Amb3939216 [2,0,0,0,0,0|1,0,0]=3 2867 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|2,0,0]=4 2868 B8R1.2 OCc1ccccn1 Amb2610526 [2,0,0,0,0,0|2,0,0]=4 2869 B8R1.2 OCc1cccnc1 Amb2720347 [2,0,0,0,0,0|2,0,0]=4 2870 B8R1.2 OCc1ccncc1 Amb24183964 [2,0,0,0,0,0|2,0,0]=4 2871 B8R1.2 OCc1ccncc1 Amb2720348 [2,0,0,0,0,0|2,0,0]=4 2872 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,0]=3 2873 B8R1.2 ONc1ccncc1 Amb27829868 [2,0,0,0,0,0|2,0,0]=4 2874 B8R1.2 SCc1ccccc1 Amb6608752 [2,0,0,0,0,0|1,0,0]=3 2875 B8R1.2 SCc1ccccn1 Amb33542790 [2,0,0,0,0,0|2,0,0]=4 2876 B8R1.2 SCc1cccnc1 Amb21984718 [2,0,0,0,0,0|2,0,0]=4 2877 B8R1.2 SCc1ccncc1 Amb22008603 [2,0,0,0,0,0|2,0,0]=4 2878 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|0,0,2]=4 2879 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 2880 B8R1.2 [NH3+]Cc1ccccc1 Amb8488224 [2,0,0,0,0,0|1,0,0]=3 2881 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 2882 B10R0.78 C=CCNC(=O)\C=C/C(=O)O Amb2551348 [0,1,1,0,0,0|2,0,0]=4 2883 B10R0.78 C=CCNC(=O)\C=C\C(=O)O Amb1155200 [0,1,1,0,0,0|2,0,0]=4 2884 B10R0.78 C=CCNC(=O)\C=C\C(C)=O Amb28080105 [0,1,1,0,0,0|1,0,1]=4 2885 B10R0.91 C=C\C=C\NC(=O)CCC=C Amb28080111 [0,1,1,0,0,0|2,0,0]=4 2886 B10R0.71 O=C\C=C\C=C\N\C=C\C=O Amb27986127 [0,1,1,0,0,0|1,0,1]=4 2887 B10R1.1 BrCCc1ccc(Br)cc1 Amb6296138 [1,1,0,0,0,0|1,0,1]=4 2888 B10R1.1 Br[Zn]Cc1ccc(Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 2889 B10R1.1 Br\C=C/c1ccc(Br)cc1 Amb25976770 [1,1,0,0,0,0|1,0,1]=4 2890 B10R1.1 Br\C=C\c1ccc(Br)cc1 Amb17609929 [1,1,0,0,0,0|1,0,1]=4 2891 B10R1.1 Br\C=C\c1ccc(I)cc1 Amb8392460 [1,1,0,0,0,0|1,0,1]=4 2892 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,1]=4 2893 B10R1.1 C#CCc1ccc(Br)cc1 Amb26366342 [1,1,0,0,0,0|0,0,2]=4 2894 B10R1.1 C#CCc1ccc(C)cc1 Amb33359821 [1,1,0,0,0,0|0,0,2]=4 2895 B10R1.1 C#CCc1ccc(Cl)cc1 Amb26067166 [1,1,0,0,0,0|0,0,2]=4 2896 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|0,0,2]=4 2897 B10R1.1 C#CCc1ccc(I)cc1 Amb25921305 [1,1,0,0,0,0|0,0,2]=4 2898 B10R1.1 C#CCc1ccc(N)cc1 Amb26455672 [1,1,0,0,0,0|0,0,2]=4 2899 B10R1.1 C#CCc1ccc(O)cc1 Amb33079384 [1,1,0,0,0,0|0,0,2]=4 2900 B10R1.1 C#NCc1ccc(Br)cc1 Amb31112143 [1,1,0,0,0,0|1,0,1]=4 2901 B10R1.1 C#NCc1ccc(C)cc1 Amb31132460 [1,1,0,0,0,0|1,0,1]=4 2902 B10R1.1 C#NCc1ccc(Cl)cc1 Amb31111984 [1,1,0,0,0,0|1,0,1]=4 2903 B10R1.1 C#NCc1ccc(F)cc1 Amb31132462 [1,1,0,0,0,0|1,0,1]=4 2904 B10R1.1 C=CC[n+]1ccc(C)cc1 Amb27764615 [1,1,0,0,0,0|1,0,0]=3 2905 B10R1.1 C=CCc1ccc(Br)cc1 Amb6298955 [1,1,0,0,0,0|0,0,0]=2 2906 B10R1.1 C=CCc1ccc(Br)nc1 Amb27974565 [1,1,0,0,0,0|1,0,0]=3 2907 B10R1.1 C=CCc1ccc(C)cc1 Amb6298999 [1,1,0,0,0,0|0,0,0]=2 2908 B10R1.1 C=CCc1ccc(C)nc1 Amb27450290 [1,1,0,0,0,0|1,0,0]=3 2909 B10R1.1 C=CCc1ccc(Cl)cc1 Amb6298977 [1,1,0,0,0,0|0,0,0]=2 2910 B10R1.1 C=CCc1ccc(F)cc1 Amb6299104 [1,1,0,0,0,0|0,0,0]=2 2911 B10R1.1 C=CCc1ccc(N)cc1 Amb27168671 [1,1,0,0,0,0|0,0,0]=2 2912 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|0,0,0]=2 2913 B10R1.1 C=CCc1cnc(N)cn1 Amb28067641 [1,1,0,0,0,0|2,0,0]=4 2914 B10R1.1 C=CNc1ncc(N)cn1 Amb1981393 [1,1,0,0,0,0|2,0,0]=4 2915 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|1,0,0]=3 2916 B10R1.1 C=COc1ccc(C)cc1 Amb17674188 [1,1,0,0,0,0|1,0,0]=3 2917 B10R1.1 C=COc1ccc(Cl)cc1 Amb28422277 [1,1,0,0,0,0|1,0,0]=3 2918 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|1,0,0]=3 2919 B10R1.1 C=COc1ccc(N)cc1 Amb2721808 [1,1,0,0,0,0|1,0,0]=3 2920 B10R1.1 C=CSc1ccc(Br)cc1 Amb25890192 [1,1,0,0,0,0|1,0,0]=3 2921 B10R1.1 C=CSc1ccc(C)cc1 Amb24375563 [1,1,0,0,0,0|1,0,0]=3 2922 B10R1.1 C=CSc1ccc(Cl)cc1 Amb27838962 [1,1,0,0,0,0|1,0,0]=3 2923 B10R1.1 C=NCc1ccc(Cl)nc1 Amb27632304 [1,1,0,0,0,0|2,0,0]=4 2924 B10R1.1 CCCc1ccc(Br)cc1 Amb3939169 [1,1,0,0,0,0|0,0,2]=4 2925 B10R1.1 CCCc1ccc(C)cc1 Amb22227992 [1,1,0,0,0,0|0,0,2]=4 2926 B10R1.1 CCCc1ccc(F)cc1 Amb10845722 [1,1,0,0,0,0|0,0,2]=4 2927 B10R1.1 CCCc1ccc(I)cc1 Amb8976891 [1,1,0,0,0,0|0,0,2]=4 2928 B10R1.1 CCCc1ccc(N)cc1 Amb2721145 [1,1,0,0,0,0|0,0,2]=4 2929 B10R1.1 CCCc1ccc(O)cc1 Amb3939332 [1,1,0,0,0,0|0,0,2]=4 2930 B10R1.1 CCCc1ccc(S)cc1 Amb2690418 [1,1,0,0,0,0|0,0,2]=4 2931 B10R1.1 CCNc1ccc(Br)cc1 Amb19959109 [1,1,0,0,0,0|0,0,1]=3 2932 B10R1.1 CCNc1ccc(Br)cc1 Amb4313300 [1,1,0,0,0,0|0,0,1]=3 2933 B10R1.1 CCNc1ccc(Br)cn1 Amb6624559 [1,1,0,0,0,0|1,0,1]=4 2934 B10R1.1 CCNc1ccc(Br)nc1 Amb27648588 [1,1,0,0,0,0|1,0,1]=4 2935 B10R1.1 CCNc1ccc(C)cc1 Amb4313293 [1,1,0,0,0,0|0,0,1]=3 2936 B10R1.1 CCNc1ccc(C)cn1 Amb6640922 [1,1,0,0,0,0|1,0,1]=4 2937 B10R1.1 CCNc1ccc(C)nc1 Amb28322511 [1,1,0,0,0,0|1,0,1]=4 2938 B10R1.1 CCNc1ccc(Cl)cc1 Amb32752525 [1,1,0,0,0,0|0,0,1]=3 2939 B10R1.1 CCNc1ccc(Cl)cc1 Amb4018546 [1,1,0,0,0,0|0,0,1]=3 2940 B10R1.1 CCNc1ccc(Cl)cn1 Amb6622107 [1,1,0,0,0,0|1,0,1]=4 2941 B10R1.1 CCNc1ccc(Cl)nc1 Amb24672881 [1,1,0,0,0,0|1,0,1]=4 2942 B10R1.1 CCNc1ccc(F)cc1 Amb1214999 [1,1,0,0,0,0|0,0,1]=3 2943 B10R1.1 CCNc1ccc(F)cc1 Amb33189232 [1,1,0,0,0,0|0,0,1]=3 2944 B10R1.1 CCNc1ccc(N)cc1 Amb33551705 [1,1,0,0,0,0|0,0,1]=3 2945 B10R1.1 CCNc1ccc(N)cc1 Amb7767528 [1,1,0,0,0,0|0,0,1]=3 2946 B10R1.1 CCNc1ccc(N)cn1 Amb22737072 [1,1,0,0,0,0|1,0,1]=4 2947 B10R1.1 CCNc1ccc(N)cn1 Amb33536653 [1,1,0,0,0,0|1,0,1]=4 2948 B10R1.1 CCNc1ccc(N)nc1 Amb7767524 [1,1,0,0,0,0|1,0,1]=4 2949 B10R1.1 CCNc1ccc(O)cc1 Amb28555423 [1,1,0,0,0,0|0,0,1]=3 2950 B10R1.1 CCNc1ccc(O)cc1 Amb9608869 [1,1,0,0,0,0|0,0,1]=3 2951 B10R1.1 CCNc1ccc(S)cc1 Amb27242310 [1,1,0,0,0,0|0,0,1]=3 2952 B10R1.1 CCOc1ccc(Br)cc1 Amb2691855 [1,1,0,0,0,0|1,0,1]=4 2953 B10R1.1 CCOc1ccc(C)cc1 Amb4016279 [1,1,0,0,0,0|1,0,1]=4 2954 B10R1.1 CCOc1ccc(Cl)cc1 Amb2793039 [1,1,0,0,0,0|1,0,1]=4 2955 B10R1.1 CCOc1ccc(F)cc1 Amb2688289 [1,1,0,0,0,0|1,0,1]=4 2956 B10R1.1 CCOc1ccc(I)cc1 Amb6296147 [1,1,0,0,0,0|1,0,1]=4 2957 B10R1.1 CCOc1ccc(N)cc1 Amb1235495 [1,1,0,0,0,0|1,0,1]=4 2958 B10R1.1 CCOc1ccc(N)cc1 Amb32644735 [1,1,0,0,0,0|1,0,1]=4 2959 B10R1.1 CCOc1ccc(N)cc1 Amb6383245 [1,1,0,0,0,0|1,0,1]=4 2960 B10R1.1 CCOc1ccc(O)cc1 Amb1808385 [1,1,0,0,0,0|1,0,1]=4 2961 B10R1.1 CCOc1ccc(S)cc1 Amb459607 [1,1,0,0,0,0|1,0,1]=4 2962 B10R1.1 CCSc1ccc(Br)cc1 Amb3939596 [1,1,0,0,0,0|1,0,1]=4 2963 B10R1.1 CCSc1ccc(C)cc1 Amb3542302 [1,1,0,0,0,0|1,0,1]=4 2964 B10R1.1 CCSc1ccc(F)cc1 Amb24621814 [1,1,0,0,0,0|1,0,1]=4 2965 B10R1.1 CCSc1ccc(N)cc1 Amb13949222 [1,1,0,0,0,0|1,0,1]=4 2966 B10R1.1 CCSc1ccc(N)cc1 Amb2099645 [1,1,0,0,0,0|1,0,1]=4 2967 B10R1.1 CCSc1ccc(O)cc1 Amb17202382 [1,1,0,0,0,0|1,0,1]=4 2968 B10R1.1 CCSc1ccc(S)cc1 Amb2687964 [1,1,0,0,0,0|1,0,1]=4 2969 B10R1.1 CNCc1ccc(Br)cc1 Amb1209641 [1,1,0,0,0,0|1,0,1]=4 2970 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|1,0,1]=4 2971 B10R1.1 CNCc1ccc(C)cc1 Amb1241142 [1,1,0,0,0,0|1,0,1]=4 2972 B10R1.1 CNCc1ccc(C)cc1 Amb8503283 [1,1,0,0,0,0|1,0,1]=4 2973 B10R1.1 CNCc1ccc(Cl)cc1 Amb1648458 [1,1,0,0,0,0|1,0,1]=4 2974 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|1,0,1]=4 2975 B10R1.1 CNCc1ccc(F)cc1 Amb1105922 [1,1,0,0,0,0|1,0,1]=4 2976 B10R1.1 CNCc1ccc(F)cc1 Amb9677313 [1,1,0,0,0,0|1,0,1]=4 2977 B10R1.1 CNCc1ccc(N)cc1 Amb2691278 [1,1,0,0,0,0|1,0,1]=4 2978 B10R1.1 CNCc1ccc(O)cc1 Amb1116278 [1,1,0,0,0,0|1,0,1]=4 2979 B10R1.1 CNCc1ccc(O)cc1 Amb7969770 [1,1,0,0,0,0|1,0,1]=4 2980 B10R1.1 CNCc1ccc(O)cc1 Amb8428171 [1,1,0,0,0,0|1,0,1]=4 2981 B10R1.1 CNCc1ccc(S)cc1 Amb28079262 [1,1,0,0,0,0|1,0,1]=4 2982 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|1,0,1]=4 2983 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|1,0,1]=4 2984 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|1,0,1]=4 2985 B10R1.1 COCc1ccc(N)cc1 Amb1137167 [1,1,0,0,0,0|1,0,1]=4 2986 B10R1.1 COCc1ccc(O)cc1 Amb3939459 [1,1,0,0,0,0|1,0,1]=4 2987 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|1,0,1]=4 2988 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|1,0,1]=4 2989 B10R1.1 CSCc1ccc(C)cc1 Amb16185125 [1,1,0,0,0,0|1,0,1]=4 2990 B10R1.1 CSCc1ccc(Cl)cc1 Amb4013182 [1,1,0,0,0,0|1,0,1]=4 2991 B10R1.1 CSCc1ccc(F)cc1 Amb27162448 [1,1,0,0,0,0|1,0,1]=4 2992 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|1,0,1]=4 2993 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|1,0,1]=4 2994 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb34050082 [1,1,0,0,0,0|0,0,2]=4 2995 B10R1.1 C\C=C\c1ccc(N)cc1 Amb26370017 [1,1,0,0,0,0|0,0,2]=4 2996 B10R1.1 C\C=C\c1ccc(N)cc1 Amb32653072 [1,1,0,0,0,0|0,0,2]=4 2997 B10R1.1 C\C=N\c1ccc(Cl)cc1 Amb27173616 [1,1,0,0,0,0|0,0,2]=4 2998 B10R1.1 Cc1ccc(CC#N)cc1 Amb6251339 [1,1,0,0,0,0|1,0,1]=4 2999 B10R1.1 Cc1ccc(CC=O)cc1 Amb3941002 [1,1,0,0,0,0|1,0,0]=3 3000 B10R1.1 Cc1ccc(CC=O)cn1 Amb26327214 [1,1,0,0,0,0|2,0,0]=4 3001 B10R1.1 Cc1ccc(CC=O)nc1 Amb28315857 [1,1,0,0,0,0|2,0,0]=4 3002 B10R1.1 Cc1ccc(CCBr)cc1 Amb2685165 [1,1,0,0,0,0|1,0,1]=4 3003 B10R1.1 Cc1ccc(CCCl)cc1 Amb9004312 [1,1,0,0,0,0|1,0,1]=4 3004 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,1]=4 3005 B10R1.1 Cc1ccc(CCN)cc1 Amb1129454 [1,1,0,0,0,0|1,0,1]=4 3006 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,1]=4 3007 B10R1.1 Cc1ccc(CCO)cc1 Amb3939097 [1,1,0,0,0,0|1,0,1]=4 3008 B10R1.1 Cc1ccc(CCS)cc1 Amb16183304 [1,1,0,0,0,0|1,0,1]=4 3009 B10R1.1 Cc1ccc(CNN)cc1 Amb1112560 [1,1,0,0,0,0|2,0,0]=4 3010 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 3011 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 3012 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|2,0,0]=4 3013 B10R1.1 Cc1ccc(CON)cc1 Amb1946246 [1,1,0,0,0,0|2,0,0]=4 3014 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 3015 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 3016 B10R1.1 Cc1ccc(NC=O)cc1 Amb2613776 [1,1,0,0,0,0|1,0,0]=3 3017 B10R1.1 Cc1ccc(NC=O)cn1 Amb28049376 [1,1,0,0,0,0|2,0,0]=4 3018 B10R1.1 Cc1ccc(NCN)cc1 Amb17117016 [1,1,0,0,0,0|1,0,0]=3 3019 B10R1.1 Cc1ccc(OC=O)cc1 Amb25248584 [1,1,0,0,0,0|2,0,0]=4 3020 B10R1.1 Cc1ccc(SCCl)cc1 Amb2694974 [1,1,0,0,0,0|2,0,0]=4 3021 B10R1.1 Cc1ccc(\C=C\Br)cc1 Amb25987077 [1,1,0,0,0,0|1,0,1]=4 3022 B10R1.1 ClCCc1ccc(Br)cc1 Amb8860568 [1,1,0,0,0,0|1,0,1]=4 3023 B10R1.1 ClCCc1ccc(Cl)cc1 Amb9004318 [1,1,0,0,0,0|1,0,1]=4 3024 B10R1.1 ClCOc1ccc(Br)cc1 Amb26369456 [1,1,0,0,0,0|2,0,0]=4 3025 B10R1.1 ClCOc1ccc(Cl)cc1 Amb8513685 [1,1,0,0,0,0|2,0,0]=4 3026 B10R1.1 ClCOc1ccc(I)cc1 Amb26337011 [1,1,0,0,0,0|2,0,0]=4 3027 B10R1.1 ClCSc1ccc(Br)cc1 Amb25237152 [1,1,0,0,0,0|2,0,0]=4 3028 B10R1.1 ClCSc1ccc(Cl)cc1 Amb22351380 [1,1,0,0,0,0|2,0,0]=4 3029 B10R1.1 ClCSc1ccc(I)cc1 Amb26640379 [1,1,0,0,0,0|2,0,0]=4 3030 B10R1.1 Cl[Zn]Cc1ccc(Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 3031 B10R1.1 Cl\C=C\c1ccc(Cl)cc1 Amb10573154 [1,1,0,0,0,0|1,0,1]=4 3032 B10R1.1 Clc1ccc(CCBr)cc1 Amb2685157 [1,1,0,0,0,0|1,0,1]=4 3033 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,1]=4 3034 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,1]=4 3035 B10R1.1 FCOc1ccc(Br)cc1 Amb25918920 [1,1,0,0,0,0|2,0,0]=4 3036 B10R1.1 FCSc1ccc(Br)cc1 Amb27239229 [1,1,0,0,0,0|2,0,0]=4 3037 B10R1.1 FNNc1ccc(Cl)cc1 Amb28142277 [1,1,0,0,0,0|2,0,0]=4 3038 B10R1.1 Fc1ccc(CCBr)cc1 Amb2685160 [1,1,0,0,0,0|1,0,1]=4 3039 B10R1.1 Fc1ccc(CCCl)cc1 Amb2685902 [1,1,0,0,0,0|1,0,1]=4 3040 B10R1.1 Fc1ccc(CCI)cc1 Amb28315757 [1,1,0,0,0,0|1,0,1]=4 3041 B10R1.1 Fc1ccc(CCS)cc1 Amb17400005 [1,1,0,0,0,0|1,0,1]=4 3042 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 3043 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 3044 B10R1.1 Fc1ccc(OCCl)cc1 Amb24538040 [1,1,0,0,0,0|2,0,0]=4 3045 B10R1.1 Fc1ccc(SCCl)cc1 Amb26585309 [1,1,0,0,0,0|2,0,0]=4 3046 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb33291355 [1,1,0,0,0,0|1,0,1]=4 3047 B10R1.1 N#CCc1ccc(Br)cc1 Amb1130758 [1,1,0,0,0,0|1,0,1]=4 3048 B10R1.1 N#CCc1ccc(Cl)cc1 Amb1883007 [1,1,0,0,0,0|1,0,1]=4 3049 B10R1.1 N#CCc1ccc(F)cc1 Amb1154069 [1,1,0,0,0,0|1,0,1]=4 3050 B10R1.1 N#CCc1ccc(I)cc1 Amb3939808 [1,1,0,0,0,0|1,0,1]=4 3051 B10R1.1 N#CCc1ccc(N)cc1 Amb1215260 [1,1,0,0,0,0|1,0,1]=4 3052 B10R1.1 N#CCc1ccc(N)cc1 Amb6297246 [1,1,0,0,0,0|1,0,1]=4 3053 B10R1.1 N#CCc1ccc(O)cc1 Amb1154109 [1,1,0,0,0,0|1,0,1]=4 3054 B10R1.1 N#CNc1ccc(F)cc1 Amb20080178 [1,1,0,0,0,0|1,0,1]=4 3055 B10R1.1 N#CNc1ccc(I)cc1 Amb27754034 [1,1,0,0,0,0|1,0,1]=4 3056 B10R1.1 N#CNc1ccc(O)cc1 Amb17593412 [1,1,0,0,0,0|1,0,1]=4 3057 B10R1.1 NCCc1ccc(Br)cc1 Amb10808111 [1,1,0,0,0,0|1,0,1]=4 3058 B10R1.1 NCCc1ccc(Br)cc1 Amb2685385 [1,1,0,0,0,0|1,0,1]=4 3059 B10R1.1 NCCc1ccc(Br)cc1 Amb3938967 [1,1,0,0,0,0|1,0,1]=4 3060 B10R1.1 NCCc1ccc(Cl)cc1 Amb1212558 [1,1,0,0,0,0|1,0,1]=4 3061 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,1]=4 3062 B10R1.1 NCCc1ccc(F)cc1 Amb1215262 [1,1,0,0,0,0|1,0,1]=4 3063 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,1]=4 3064 B10R1.1 NCCc1ccc(I)cc1 Amb28555584 [1,1,0,0,0,0|1,0,1]=4 3065 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,1]=4 3066 B10R1.1 NCCc1ccc(N)cc1 Amb4037003 [1,1,0,0,0,0|1,0,1]=4 3067 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,1]=4 3068 B10R1.1 NCCc1ccc(O)cc1 Amb33540244 [1,1,0,0,0,0|1,0,1]=4 3069 B10R1.1 NCCc1ccc(O)cc1 Amb533726 [1,1,0,0,0,0|1,0,1]=4 3070 B10R1.1 NNCc1ccc(Br)cc1 Amb1114984 [1,1,0,0,0,0|2,0,0]=4 3071 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 3072 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 3073 B10R1.1 NNCc1ccc(Cl)cc1 Amb1121233 [1,1,0,0,0,0|2,0,0]=4 3074 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 3075 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 3076 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 3077 B10R1.1 NNCc1ccc(F)cc1 Amb10841872 [1,1,0,0,0,0|2,0,0]=4 3078 B10R1.1 NNCc1ccc(F)cc1 Amb1112880 [1,1,0,0,0,0|2,0,0]=4 3079 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 3080 B10R1.1 NNCc1ccc(O)cc1 Amb27814030 [1,1,0,0,0,0|2,0,0]=4 3081 B10R1.1 NNCc1ccc(O)cc1 Amb32655872 [1,1,0,0,0,0|2,0,0]=4 3082 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 3083 B10R1.1 NOCc1ccc(Br)cc1 Amb8471896 [1,1,0,0,0,0|2,0,0]=4 3084 B10R1.1 NOCc1ccc(Cl)cc1 Amb10607411 [1,1,0,0,0,0|2,0,0]=4 3085 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 3086 B10R1.1 NOCc1ccc(F)cc1 Amb17091427 [1,1,0,0,0,0|2,0,0]=4 3087 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 3088 B10R1.1 NOCc1ccc(N)cc1 Amb28184708 [1,1,0,0,0,0|2,0,0]=4 3089 B10R1.1 NOCc1ccc(O)cc1 Amb8391701 [1,1,0,0,0,0|2,0,0]=4 3090 B10R1.1 Nc1ccc(CCBr)cc1 Amb17595296 [1,1,0,0,0,0|1,0,1]=4 3091 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,1]=4 3092 B10R1.1 Nc1ccc(CCO)cc1 Amb594608 [1,1,0,0,0,0|1,0,1]=4 3093 B10R1.1 Nc1ccc(NC=O)cc1 Amb17334152 [1,1,0,0,0,0|1,0,0]=3 3094 B10R1.1 Nc1ccc(NC=O)nc1 Amb26358579 [1,1,0,0,0,0|2,0,0]=4 3095 B10R1.1 Nc1ccc(OCF)cc1 Amb25887737 [1,1,0,0,0,0|2,0,0]=4 3096 B10R1.1 Nc1ccc(SCCl)cc1 Amb25281595 [1,1,0,0,0,0|2,0,0]=4 3097 B10R1.1 O=CCc1ccc(Br)cc1 Amb16230450 [1,1,0,0,0,0|1,0,0]=3 3098 B10R1.1 O=CCc1ccc(Br)cn1 Amb26008746 [1,1,0,0,0,0|2,0,0]=4 3099 B10R1.1 O=CCc1ccc(Br)nc1 Amb24068700 [1,1,0,0,0,0|2,0,0]=4 3100 B10R1.1 O=CCc1ccc(Cl)cc1 Amb10603161 [1,1,0,0,0,0|1,0,0]=3 3101 B10R1.1 O=CCc1ccc(Cl)cn1 Amb33390547 [1,1,0,0,0,0|2,0,0]=4 3102 B10R1.1 O=CCc1ccc(Cl)nc1 Amb27473344 [1,1,0,0,0,0|2,0,0]=4 3103 B10R1.1 O=CCc1ccc(F)cc1 Amb16230451 [1,1,0,0,0,0|1,0,0]=3 3104 B10R1.1 O=CCc1ccc(F)cn1 Amb33449540 [1,1,0,0,0,0|2,0,0]=4 3105 B10R1.1 O=CCc1ccc(F)nc1 Amb33426162 [1,1,0,0,0,0|2,0,0]=4 3106 B10R1.1 O=CCc1ccc(O)cc1 Amb9782679 [1,1,0,0,0,0|1,0,0]=3 3107 B10R1.1 O=CNc1ccc(Br)cc1 Amb6365477 [1,1,0,0,0,0|1,0,0]=3 3108 B10R1.1 O=CNc1ccc(Cl)cc1 Amb2720270 [1,1,0,0,0,0|1,0,0]=3 3109 B10R1.1 O=CNc1ccc(Cl)cn1 Amb3319172 [1,1,0,0,0,0|2,0,0]=4 3110 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,0]=3 3111 B10R1.1 O=CNc1ccc(F)cn1 Amb27192712 [1,1,0,0,0,0|2,0,0]=4 3112 B10R1.1 O=CNc1ccc(O)cc1 Amb2370690 [1,1,0,0,0,0|1,0,0]=3 3113 B10R1.1 OBCc1ccc(Cl)cc1 Amb28457057 [1,1,0,0,0,0|2,0,0]=4 3114 B10R1.1 OBCc1ccc(F)cc1 Amb27650835 [1,1,0,0,0,0|2,0,0]=4 3115 B10R1.1 OCCc1ccc(Br)cc1 Amb2726152 [1,1,0,0,0,0|1,0,1]=4 3116 B10R1.1 OCCc1ccc(Cl)cc1 Amb2780043 [1,1,0,0,0,0|1,0,1]=4 3117 B10R1.1 OCCc1ccc(F)cc1 Amb3939063 [1,1,0,0,0,0|1,0,1]=4 3118 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|1,0,1]=4 3119 B10R1.1 OCCc1ccc(O)cc1 Amb2725510 [1,1,0,0,0,0|1,0,1]=4 3120 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|2,0,0]=4 3121 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|2,0,0]=4 3122 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|2,0,0]=4 3123 B10R1.1 ONCc1ccc(O)cc1 Amb23449449 [1,1,0,0,0,0|2,0,0]=4 3124 B10R1.1 Oc1ccc(CCBr)cc1 Amb5718179 [1,1,0,0,0,0|1,0,1]=4 3125 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,1]=4 3126 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|1,0,1]=4 3127 B10R1.1 Oc1ccc(OCF)cc1 Amb27599328 [1,1,0,0,0,0|2,0,0]=4 3128 B10R1.1 Oc1ccc(SCCl)cc1 Amb25936639 [1,1,0,0,0,0|2,0,0]=4 3129 B10R1.1 Oc1ccc(\C=C\Br)cc1 Amb25945264 [1,1,0,0,0,0|1,0,1]=4 3130 B10R1.1 Oc1ccc(\C=C\I)cc1 Amb27985402 [1,1,0,0,0,0|1,0,1]=4 3131 B10R1.1 SCCc1ccc(Br)cc1 Amb17404679 [1,1,0,0,0,0|1,0,1]=4 3132 B10R1.1 SCCc1ccc(Cl)cc1 Amb17400376 [1,1,0,0,0,0|1,0,1]=4 3133 B10R1.1 [C-]#[N+]Cc1ccc(Br)cc1 Amb2684960 [1,1,0,0,0,0|1,0,1]=4 3134 B10R1.1 [C-]#[N+]Cc1ccc(C)cc1 Amb1981066 [1,1,0,0,0,0|1,0,1]=4 3135 B10R1.1 [C-]#[N+]Cc1ccc(Cl)cc1 Amb2235910 [1,1,0,0,0,0|1,0,1]=4 3136 B10R1.1 [C-]#[N+]Cc1ccc(F)cc1 Amb1981065 [1,1,0,0,0,0|1,0,1]=4 3137 B10R1.4 BrCCc1ccccc1Br Amb19515770 [1,1,0,0,0,0|1,0,1]=4 3138 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,1]=4 3139 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,1]=4 3140 B10R1.4 Brc1ccccc1\C=C\I Amb27843450 [1,1,0,0,0,0|1,0,1]=4 3141 B10R1.4 C#CCc1ccccc1Br Amb33451964 [1,1,0,0,0,0|0,0,2]=4 3142 B10R1.4 C#CCc1ccccc1C Amb33449990 [1,1,0,0,0,0|0,0,2]=4 3143 B10R1.4 C#CCc1ccccc1Cl Amb33052524 [1,1,0,0,0,0|0,0,2]=4 3144 B10R1.4 C#CCc1ccccc1F Amb33456146 [1,1,0,0,0,0|0,0,2]=4 3145 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|0,0,2]=4 3146 B10R1.4 C#NCc1ccccc1Br Amb31112144 [1,1,0,0,0,0|1,0,1]=4 3147 B10R1.4 C#NCc1ccccc1C Amb31132458 [1,1,0,0,0,0|1,0,1]=4 3148 B10R1.4 C#NCc1ccccc1Cl Amb31111982 [1,1,0,0,0,0|1,0,1]=4 3149 B10R1.4 C#NCc1ccccc1F Amb31132461 [1,1,0,0,0,0|1,0,1]=4 3150 B10R1.4 C=C=Cc1ccccc1O Amb26562140 [1,1,0,0,0,0|0,0,2]=4 3151 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|1,0,0]=3 3152 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|1,0,0]=3 3153 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|1,0,0]=3 3154 B10R1.4 C=CCN1C=CN=CC1=S Amb26001392 [1,1,0,0,0,0|2,0,0]=4 3155 B10R1.4 C=CCN1N=CC=CC1=O Amb25847497 [1,1,0,0,0,0|2,0,0]=4 3156 B10R1.4 C=CC[n+]1ccccc1C Amb27804600 [1,1,0,0,0,0|1,0,0]=3 3157 B10R1.4 C=CC[n+]1ccccc1F Amb28249373 [1,1,0,0,0,0|1,0,0]=3 3158 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|1,0,0]=3 3159 B10R1.4 C=CCc1ccccc1Br Amb26451399 [1,1,0,0,0,0|0,0,0]=2 3160 B10R1.4 C=CCc1ccccc1C Amb6298985 [1,1,0,0,0,0|0,0,0]=2 3161 B10R1.4 C=CCc1ccccc1Cl Amb6298963 [1,1,0,0,0,0|0,0,0]=2 3162 B10R1.4 C=CCc1ccccc1F Amb6299090 [1,1,0,0,0,0|0,0,0]=2 3163 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|0,0,0]=2 3164 B10R1.4 C=CCc1ccncc1Br Amb27483136 [1,1,0,0,0,0|1,0,0]=3 3165 B10R1.4 C=CCc1cnccc1C Amb28346870 [1,1,0,0,0,0|1,0,0]=3 3166 B10R1.4 C=CCc1ncccc1O Amb20248276 [1,1,0,0,0,0|1,0,0]=3 3167 B10R1.4 C=CCc1ncncc1Br Amb28049402 [1,1,0,0,0,0|2,0,0]=4 3168 B10R1.4 C=CNc1ccccc1C Amb27596514 [1,1,0,0,0,0|0,0,0]=2 3169 B10R1.4 C=COc1ccccc1Cl Amb28126760 [1,1,0,0,0,0|1,0,0]=3 3170 B10R1.4 C=COc1ccccc1F Amb26369650 [1,1,0,0,0,0|1,0,0]=3 3171 B10R1.4 C=COc1ccccc1I Amb27234455 [1,1,0,0,0,0|1,0,0]=3 3172 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|1,0,0]=3 3173 B10R1.4 C=COc1cccnc1C Amb28049671 [1,1,0,0,0,0|2,0,0]=4 3174 B10R1.4 C=CSc1ncccc1O Amb18644573 [1,1,0,0,0,0|2,0,0]=4 3175 B10R1.4 C=NNc1ccccc1N Amb27459715 [1,1,0,0,0,0|1,0,0]=3 3176 B10R1.4 CCCc1ccccc1Br Amb26623759 [1,1,0,0,0,0|0,0,2]=4 3177 B10R1.4 CCCc1ccccc1C Amb22227985 [1,1,0,0,0,0|0,0,2]=4 3178 B10R1.4 CCCc1ccccc1Cl Amb28049677 [1,1,0,0,0,0|0,0,2]=4 3179 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|0,0,2]=4 3180 B10R1.4 CCCc1ccccc1N Amb2724372 [1,1,0,0,0,0|0,0,2]=4 3181 B10R1.4 CCCc1ccccc1O Amb2726171 [1,1,0,0,0,0|0,0,2]=4 3182 B10R1.4 CCCc1ccccc1S Amb32688038 [1,1,0,0,0,0|0,0,2]=4 3183 B10R1.4 CCNc1ccccc1Br Amb6696453 [1,1,0,0,0,0|0,0,1]=3 3184 B10R1.4 CCNc1ccccc1C Amb4037021 [1,1,0,0,0,0|0,0,1]=3 3185 B10R1.4 CCNc1ccccc1Cl Amb32651858 [1,1,0,0,0,0|0,0,1]=3 3186 B10R1.4 CCNc1ccccc1Cl Amb4313295 [1,1,0,0,0,0|0,0,1]=3 3187 B10R1.4 CCNc1ccccc1F Amb2688341 [1,1,0,0,0,0|0,0,1]=3 3188 B10R1.4 CCNc1ccccc1I Amb9203660 [1,1,0,0,0,0|0,0,1]=3 3189 B10R1.4 CCNc1ccccc1N Amb29847532 [1,1,0,0,0,0|0,0,1]=3 3190 B10R1.4 CCNc1ccccc1N Amb7767530 [1,1,0,0,0,0|0,0,1]=3 3191 B10R1.4 CCNc1ccccc1O Amb18643152 [1,1,0,0,0,0|0,0,1]=3 3192 B10R1.4 CCNc1cccnc1Br Amb27616234 [1,1,0,0,0,0|1,0,1]=4 3193 B10R1.4 CCNc1cccnc1C Amb27224954 [1,1,0,0,0,0|1,0,1]=4 3194 B10R1.4 CCNc1cccnc1F Amb35725079 [1,1,0,0,0,0|1,0,1]=4 3195 B10R1.4 CCNc1cccnc1N Amb23557979 [1,1,0,0,0,0|1,0,1]=4 3196 B10R1.4 CCNc1cccnc1O Amb30633550 [1,1,0,0,0,0|1,0,1]=4 3197 B10R1.4 CCNc1ccncc1Br Amb28386593 [1,1,0,0,0,0|1,0,1]=4 3198 B10R1.4 CCNc1ccncc1N Amb9205237 [1,1,0,0,0,0|1,0,1]=4 3199 B10R1.4 CCNc1cnccc1C Amb26957116 [1,1,0,0,0,0|1,0,1]=4 3200 B10R1.4 CCNc1cnccc1C Amb28555476 [1,1,0,0,0,0|1,0,1]=4 3201 B10R1.4 CCNc1ncccc1Br Amb18955277 [1,1,0,0,0,0|1,0,1]=4 3202 B10R1.4 CCNc1ncccc1C Amb33529830 [1,1,0,0,0,0|1,0,1]=4 3203 B10R1.4 CCNc1ncccc1F Amb18963791 [1,1,0,0,0,0|1,0,1]=4 3204 B10R1.4 CCNc1ncccc1N Amb10609970 [1,1,0,0,0,0|1,0,1]=4 3205 B10R1.4 CCNc1ncccc1N Amb8630465 [1,1,0,0,0,0|1,0,1]=4 3206 B10R1.4 CCOc1ccccc1Br Amb4010257 [1,1,0,0,0,0|1,0,1]=4 3207 B10R1.4 CCOc1ccccc1C Amb9787457 [1,1,0,0,0,0|1,0,1]=4 3208 B10R1.4 CCOc1ccccc1Cl Amb9787476 [1,1,0,0,0,0|1,0,1]=4 3209 B10R1.4 CCOc1ccccc1F Amb2688288 [1,1,0,0,0,0|1,0,1]=4 3210 B10R1.4 CCOc1ccccc1I Amb19888234 [1,1,0,0,0,0|1,0,1]=4 3211 B10R1.4 CCOc1ccccc1N Amb840072 [1,1,0,0,0,0|1,0,1]=4 3212 B10R1.4 CCOc1ccccc1O Amb3939539 [1,1,0,0,0,0|1,0,1]=4 3213 B10R1.4 CCOc1ccccc1S Amb20242711 [1,1,0,0,0,0|1,0,1]=4 3214 B10R1.4 CCPc1ccccc1N Amb27637691 [1,1,0,0,0,0|0,1,1]=4 3215 B10R1.4 CCSc1ccccc1Br Amb20242712 [1,1,0,0,0,0|1,0,1]=4 3216 B10R1.4 CCSc1ccccc1C Amb27259108 [1,1,0,0,0,0|1,0,1]=4 3217 B10R1.4 CCSc1ccccc1Cl Amb26500521 [1,1,0,0,0,0|1,0,1]=4 3218 B10R1.4 CCSc1ccccc1F Amb24480376 [1,1,0,0,0,0|1,0,1]=4 3219 B10R1.4 CCSc1ccccc1N Amb10609429 [1,1,0,0,0,0|1,0,1]=4 3220 B10R1.4 CCSc1ccccc1N Amb6281496 [1,1,0,0,0,0|1,0,1]=4 3221 B10R1.4 CCSc1ccccc1O Amb33529393 [1,1,0,0,0,0|1,0,1]=4 3222 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|1,0,1]=4 3223 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|1,0,1]=4 3224 B10R1.4 CNCc1ccccc1C Amb6865246 [1,1,0,0,0,0|1,0,1]=4 3225 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|1,0,1]=4 3226 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|1,0,1]=4 3227 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|1,0,1]=4 3228 B10R1.4 CNCc1ccccc1N Amb20239390 [1,1,0,0,0,0|1,0,1]=4 3229 B10R1.4 CNCc1ccccc1N Amb7173572 [1,1,0,0,0,0|1,0,1]=4 3230 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|1,0,1]=4 3231 B10R1.4 CNCc1ccccc1O Amb7969802 [1,1,0,0,0,0|1,0,1]=4 3232 B10R1.4 COCc1ccccc1Br Amb8517636 [1,1,0,0,0,0|1,0,1]=4 3233 B10R1.4 COCc1ccccc1Cl Amb27425949 [1,1,0,0,0,0|1,0,1]=4 3234 B10R1.4 COCc1ccccc1F Amb28050262 [1,1,0,0,0,0|1,0,1]=4 3235 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|1,0,1]=4 3236 B10R1.4 COCc1ccccc1N Amb6249470 [1,1,0,0,0,0|1,0,1]=4 3237 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|1,0,1]=4 3238 B10R1.4 CSCc1ccccc1Br Amb4012755 [1,1,0,0,0,0|1,0,1]=4 3239 B10R1.4 CSCc1ccccc1Cl Amb27600716 [1,1,0,0,0,0|1,0,1]=4 3240 B10R1.4 CSCc1ccccc1F Amb27146597 [1,1,0,0,0,0|1,0,1]=4 3241 B10R1.4 CSCc1ccccc1I Amb26472202 [1,1,0,0,0,0|1,0,1]=4 3242 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|1,0,1]=4 3243 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|1,0,1]=4 3244 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|0,0,2]=4 3245 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [1,1,0,0,0,0|0,0,2]=4 3246 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|0,0,2]=4 3247 B10R1.4 Cc1ccccc1CC#N Amb1651450 [1,1,0,0,0,0|1,0,1]=4 3248 B10R1.4 Cc1ccccc1CC=O Amb10844840 [1,1,0,0,0,0|1,0,0]=3 3249 B10R1.4 Cc1ccccc1CCBr Amb2685163 [1,1,0,0,0,0|1,0,1]=4 3250 B10R1.4 Cc1ccccc1CCCl Amb9004323 [1,1,0,0,0,0|1,0,1]=4 3251 B10R1.4 Cc1ccccc1CCI Amb27246006 [1,1,0,0,0,0|1,0,1]=4 3252 B10R1.4 Cc1ccccc1CCN Amb1212557 [1,1,0,0,0,0|1,0,1]=4 3253 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,1]=4 3254 B10R1.4 Cc1ccccc1CCO Amb3939095 [1,1,0,0,0,0|1,0,1]=4 3255 B10R1.4 Cc1ccccc1CCS Amb17399938 [1,1,0,0,0,0|1,0,1]=4 3256 B10R1.4 Cc1ccccc1CNN Amb1118964 [1,1,0,0,0,0|2,0,0]=4 3257 B10R1.4 Cc1ccccc1CNN Amb6892665 [1,1,0,0,0,0|2,0,0]=4 3258 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|2,0,0]=4 3259 B10R1.4 Cc1ccccc1CON Amb17091424 [1,1,0,0,0,0|2,0,0]=4 3260 B10R1.4 Cc1ccccc1CON Amb33715629 [1,1,0,0,0,0|2,0,0]=4 3261 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 3262 B10R1.4 Cc1ccccc1NC#N Amb9783275 [1,1,0,0,0,0|1,0,1]=4 3263 B10R1.4 Cc1ccccc1NC=O Amb6366246 [1,1,0,0,0,0|1,0,0]=3 3264 B10R1.4 Cc1ccccc1NC=S Amb27407682 [1,1,0,0,0,0|1,0,0]=3 3265 B10R1.4 Cc1ccccc1OCCl Amb27494113 [1,1,0,0,0,0|2,0,0]=4 3266 B10R1.4 Cc1ccccc1\C=C\Br Amb8392461 [1,1,0,0,0,0|1,0,1]=4 3267 B10R1.4 Cc1ccccc1\C=C\Cl Amb8392459 [1,1,0,0,0,0|1,0,1]=4 3268 B10R1.4 Cc1cccnc1CC=O Amb33428807 [1,1,0,0,0,0|2,0,0]=4 3269 B10R1.4 Cc1cccnc1NC=O Amb3319169 [1,1,0,0,0,0|2,0,0]=4 3270 B10R1.4 Cc1ccncc1CC=O Amb26369782 [1,1,0,0,0,0|2,0,0]=4 3271 B10R1.4 Cc1cnccc1CC=O Amb25368595 [1,1,0,0,0,0|2,0,0]=4 3272 B10R1.4 Cc1ncccc1CC=O Amb32879665 [1,1,0,0,0,0|2,0,0]=4 3273 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,1]=4 3274 B10R1.4 ClCCc1ccccc1Cl Amb8860565 [1,1,0,0,0,0|1,0,1]=4 3275 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,1]=4 3276 B10R1.4 ClCOc1ccccc1Br Amb26889271 [1,1,0,0,0,0|2,0,0]=4 3277 B10R1.4 ClCOc1ccccc1Cl Amb22227923 [1,1,0,0,0,0|2,0,0]=4 3278 B10R1.4 ClCOc1ccccc1I Amb28187723 [1,1,0,0,0,0|2,0,0]=4 3279 B10R1.4 ClCSc1ccccc1Br Amb25887879 [1,1,0,0,0,0|2,0,0]=4 3280 B10R1.4 ClCSc1ccccc1Cl Amb28137812 [1,1,0,0,0,0|2,0,0]=4 3281 B10R1.4 ClCSc1ccccc1I Amb27641365 [1,1,0,0,0,0|2,0,0]=4 3282 B10R1.4 Cl[Zn]Cc1ccccc1Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 3283 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,1]=4 3284 B10R1.4 Clc1ccccc1CCBr Amb2685155 [1,1,0,0,0,0|1,0,1]=4 3285 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,1]=4 3286 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,1]=4 3287 B10R1.4 Fc1ccccc1CCBr Amb2685159 [1,1,0,0,0,0|1,0,1]=4 3288 B10R1.4 Fc1ccccc1CCCl Amb8860569 [1,1,0,0,0,0|1,0,1]=4 3289 B10R1.4 Fc1ccccc1CCI Amb28248386 [1,1,0,0,0,0|1,0,1]=4 3290 B10R1.4 Fc1ccccc1CCS Amb17400004 [1,1,0,0,0,0|1,0,1]=4 3291 B10R1.4 Fc1ccccc1C[Mg]Cl Amb6300393 [1,1,0,0,0,0|2,0,0]=4 3292 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 3293 B10R1.4 Fc1ccccc1OCCl Amb25356820 [1,1,0,0,0,0|2,0,0]=4 3294 B10R1.4 Fc1ccccc1SCCl Amb27447816 [1,1,0,0,0,0|2,0,0]=4 3295 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,1]=4 3296 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 3297 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 3298 B10R1.4 N#CCc1ccccc1F Amb2688304 [1,1,0,0,0,0|1,0,1]=4 3299 B10R1.4 N#CCc1ccccc1I Amb3939789 [1,1,0,0,0,0|1,0,1]=4 3300 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 3301 B10R1.4 N#CCc1ccccc1N Amb3997244 [1,1,0,0,0,0|1,0,1]=4 3302 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 3303 B10R1.4 N#CCc1ccccc1S Amb27490861 [1,1,0,0,0,0|1,0,1]=4 3304 B10R1.4 N#CNc1ccccc1Cl Amb33529026 [1,1,0,0,0,0|1,0,1]=4 3305 B10R1.4 N#CNc1ccccc1F Amb33529027 [1,1,0,0,0,0|1,0,1]=4 3306 B10R1.4 N#CNc1ccccc1N Amb8439658 [1,1,0,0,0,0|1,0,1]=4 3307 B10R1.4 N#CNc1ccccc1O Amb28457893 [1,1,0,0,0,0|1,0,1]=4 3308 B10R1.4 N=CCc1ccccc1N Amb27175164 [1,1,0,0,0,0|1,0,0]=3 3309 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,1]=4 3310 B10R1.4 NCCc1ccccc1Br Amb4605963 [1,1,0,0,0,0|1,0,1]=4 3311 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,1]=4 3312 B10R1.4 NCCc1ccccc1Cl Amb2686343 [1,1,0,0,0,0|1,0,1]=4 3313 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,1]=4 3314 B10R1.4 NCCc1ccccc1F Amb421247 [1,1,0,0,0,0|1,0,1]=4 3315 B10R1.4 NCCc1ccccc1I Amb27796258 [1,1,0,0,0,0|1,0,1]=4 3316 B10R1.4 NCCc1ccccc1N Amb8631277 [1,1,0,0,0,0|1,0,1]=4 3317 B10R1.4 NCCc1ccccc1N Amb8631278 [1,1,0,0,0,0|1,0,1]=4 3318 B10R1.4 NCCc1ccccc1O Amb33549438 [1,1,0,0,0,0|1,0,1]=4 3319 B10R1.4 NCCc1ccccc1O Amb6246475 [1,1,0,0,0,0|1,0,1]=4 3320 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 3321 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 3322 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 3323 B10R1.4 NNCc1ccccc1Cl Amb4008405 [1,1,0,0,0,0|2,0,0]=4 3324 B10R1.4 NNCc1ccccc1Cl Amb5400451 [1,1,0,0,0,0|2,0,0]=4 3325 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 3326 B10R1.4 NNCc1ccccc1F Amb33553561 [1,1,0,0,0,0|2,0,0]=4 3327 B10R1.4 NNCc1ccccc1F Amb6247906 [1,1,0,0,0,0|2,0,0]=4 3328 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 3329 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 3330 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 3331 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 3332 B10R1.4 NOCc1ccccc1Cl Amb8471898 [1,1,0,0,0,0|2,0,0]=4 3333 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 3334 B10R1.4 NOCc1ccccc1F Amb8471897 [1,1,0,0,0,0|2,0,0]=4 3335 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 3336 B10R1.4 NOCc1ccccc1I Amb27445122 [1,1,0,0,0,0|2,0,0]=4 3337 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 3338 B10R1.4 N\C=N\c1ccccc1Cl Amb27803970 [1,1,0,0,0,0|1,0,1]=4 3339 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,1]=4 3340 B10R1.4 Nc1ccccc1CCCl Amb28204640 [1,1,0,0,0,0|1,0,1]=4 3341 B10R1.4 Nc1ccccc1CCO Amb33733822 [1,1,0,0,0,0|1,0,1]=4 3342 B10R1.4 Nc1ccccc1CCO Amb4605841 [1,1,0,0,0,0|1,0,1]=4 3343 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,0]=3 3344 B10R1.4 Nc1ccccc1SCCl Amb25720293 [1,1,0,0,0,0|2,0,0]=4 3345 B10R1.4 Nc1ccccc1\C=C\Cl Amb27223253 [1,1,0,0,0,0|1,0,1]=4 3346 B10R1.4 Nc1cccnc1NC=S Amb28457907 [1,1,0,0,0,0|2,0,0]=4 3347 B10R1.4 Nc1cnccc1NC=O Amb27195027 [1,1,0,0,0,0|2,0,0]=4 3348 B10R1.4 O=CCc1cccc[n+]1[O-] Amb28383494 [1,1,0,0,0,0|2,0,0]=4 3349 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|1,0,0]=3 3350 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|1,0,0]=3 3351 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|1,0,0]=3 3352 B10R1.4 O=CCc1ccccc1O Amb6739922 [1,1,0,0,0,0|1,0,0]=3 3353 B10R1.4 O=CCc1cccnc1Br Amb24746150 [1,1,0,0,0,0|2,0,0]=4 3354 B10R1.4 O=CCc1cccnc1Cl Amb25768390 [1,1,0,0,0,0|2,0,0]=4 3355 B10R1.4 O=CCc1cccnc1F Amb33377654 [1,1,0,0,0,0|2,0,0]=4 3356 B10R1.4 O=CCc1ccncc1Br Amb26618713 [1,1,0,0,0,0|2,0,0]=4 3357 B10R1.4 O=CCc1ccncc1Cl Amb25250526 [1,1,0,0,0,0|2,0,0]=4 3358 B10R1.4 O=CCc1ccncc1F Amb24553979 [1,1,0,0,0,0|2,0,0]=4 3359 B10R1.4 O=CCc1ncccc1Br Amb28187085 [1,1,0,0,0,0|2,0,0]=4 3360 B10R1.4 O=CCc1ncccc1F Amb27837919 [1,1,0,0,0,0|2,0,0]=4 3361 B10R1.4 O=CNc1ccccc1Br Amb33718582 [1,1,0,0,0,0|1,0,0]=3 3362 B10R1.4 O=CNc1ccccc1Br Amb3988017 [1,1,0,0,0,0|1,0,0]=3 3363 B10R1.4 O=CNc1ccccc1Cl Amb2720271 [1,1,0,0,0,0|1,0,0]=3 3364 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,0]=3 3365 B10R1.4 O=CNc1ccccc1I Amb27770393 [1,1,0,0,0,0|1,0,0]=3 3366 B10R1.4 O=CNc1ccccc1O Amb3939439 [1,1,0,0,0,0|1,0,0]=3 3367 B10R1.4 O=CNc1cccnc1Cl Amb4035002 [1,1,0,0,0,0|2,0,0]=4 3368 B10R1.4 O=CNc1cccnc1F Amb30018365 [1,1,0,0,0,0|2,0,0]=4 3369 B10R1.4 O=CNc1ccncc1Br Amb28126797 [1,1,0,0,0,0|2,0,0]=4 3370 B10R1.4 O=CNc1ncccc1Cl Amb27809589 [1,1,0,0,0,0|2,0,0]=4 3371 B10R1.4 O=COc1ccccc1Cl Amb27878912 [1,1,0,0,0,0|2,0,0]=4 3372 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|2,0,0]=4 3373 B10R1.4 OCCc1ccccc1Br Amb3939212 [1,1,0,0,0,0|1,0,1]=4 3374 B10R1.4 OCCc1ccccc1Cl Amb3939106 [1,1,0,0,0,0|1,0,1]=4 3375 B10R1.4 OCCc1ccccc1F Amb2688283 [1,1,0,0,0,0|1,0,1]=4 3376 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|1,0,1]=4 3377 B10R1.4 OCCc1ccccc1O Amb3940101 [1,1,0,0,0,0|1,0,1]=4 3378 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|2,0,0]=4 3379 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|2,0,0]=4 3380 B10R1.4 ONCc1ccccc1Cl Amb32679300 [1,1,0,0,0,0|2,0,0]=4 3381 B10R1.4 ONCc1ccccc1F Amb27252972 [1,1,0,0,0,0|2,0,0]=4 3382 B10R1.4 ONCc1ccccc1O Amb25128279 [1,1,0,0,0,0|2,0,0]=4 3383 B10R1.4 Oc1ccccc1CCBr Amb33549255 [1,1,0,0,0,0|1,0,1]=4 3384 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,1]=4 3385 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|1,0,1]=4 3386 B10R1.4 Oc1ccccc1SCCl Amb28204207 [1,1,0,0,0,0|2,0,0]=4 3387 B10R1.4 Oc1ccccc1\C=C\Br Amb33134797 [1,1,0,0,0,0|1,0,1]=4 3388 B10R1.4 Oc1ccccc1\C=C\Cl Amb28244760 [1,1,0,0,0,0|1,0,1]=4 3389 B10R1.4 S=CNc1ccccc1Cl Amb27478105 [1,1,0,0,0,0|1,0,0]=3 3390 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|1,0,1]=4 3391 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|1,0,1]=4 3392 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|1,0,1]=4 3393 B10R1.4 Sc1ccccc1CCBr Amb27450103 [1,1,0,0,0,0|1,0,1]=4 3394 B10R1.4 Sc1ccccc1CCCl Amb27776252 [1,1,0,0,0,0|1,0,1]=4 3395 B10R1.4 [C-]#[N+]Cc1ccccc1Br Amb3973085 [1,1,0,0,0,0|1,0,1]=4 3396 B10R1.4 [C-]#[N+]Cc1ccccc1C Amb2689349 [1,1,0,0,0,0|1,0,1]=4 3397 B10R1.4 [C-]#[N+]Cc1ccccc1Cl Amb2685776 [1,1,0,0,0,0|1,0,1]=4 3398 B10R1.4 [C-]#[N+]Cc1ccccc1F Amb2688050 [1,1,0,0,0,0|1,0,1]=4 3399 B10R1.4 [C-]#[N+]Cc1ccccc1O Amb28048077 [1,1,0,0,0,0|1,0,1]=4 3400 B10R1.4 [NH3+]CCc1ccccc1Cl Amb33512987 [1,1,0,0,0,0|1,0,1]=4 3401 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 3402 B10R1.10 BrCCc1cccc(Br)c1 Amb18048758 [1,1,0,0,0,0|1,0,1]=4 3403 B10R1.10 Brc1cccc(\C=C/I)c1 Amb22231752 [1,1,0,0,0,0|1,0,1]=4 3404 B10R1.10 Brc1cccc(\C=C\I)c1 Amb27865347 [1,1,0,0,0,0|1,0,1]=4 3405 B10R1.10 C#CCc1cccc(Br)c1 Amb27148208 [1,1,0,0,0,0|0,0,2]=4 3406 B10R1.10 C#CCc1cccc(C)c1 Amb33429151 [1,1,0,0,0,0|0,0,2]=4 3407 B10R1.10 C#CCc1cccc(Cl)c1 Amb26953104 [1,1,0,0,0,0|0,0,2]=4 3408 B10R1.10 C#CCc1cccc(F)c1 Amb27405697 [1,1,0,0,0,0|0,0,2]=4 3409 B10R1.10 C#CCc1cccc(I)c1 Amb26078060 [1,1,0,0,0,0|0,0,2]=4 3410 B10R1.10 C#CCc1cccc(O)c1 Amb33310924 [1,1,0,0,0,0|0,0,2]=4 3411 B10R1.10 C#NCc1cccc(Br)c1 Amb31112142 [1,1,0,0,0,0|1,0,1]=4 3412 B10R1.10 C#NCc1cccc(C)c1 Amb31132459 [1,1,0,0,0,0|1,0,1]=4 3413 B10R1.10 C#NCc1cccc(Cl)c1 Amb31111983 [1,1,0,0,0,0|1,0,1]=4 3414 B10R1.10 C#NCc1cccc(F)c1 Amb31132463 [1,1,0,0,0,0|1,0,1]=4 3415 B10R1.10 C=CCc1cccc(Br)c1 Amb6298947 [1,1,0,0,0,0|0,0,0]=2 3416 B10R1.10 C=CCc1cccc(C)c1 Amb2689628 [1,1,0,0,0,0|0,0,0]=2 3417 B10R1.10 C=CCc1cccc(C)n1 Amb6299552 [1,1,0,0,0,0|1,0,0]=3 3418 B10R1.10 C=CCc1cccc(Cl)c1 Amb2686405 [1,1,0,0,0,0|0,0,0]=2 3419 B10R1.10 C=CCc1cccc(F)c1 Amb2688385 [1,1,0,0,0,0|0,0,0]=2 3420 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|0,0,0]=2 3421 B10R1.10 C=CCc1cccc(N)c1 Amb32698606 [1,1,0,0,0,0|0,0,0]=2 3422 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|0,0,0]=2 3423 B10R1.10 C=CCc1cncc(Br)c1 Amb26510579 [1,1,0,0,0,0|1,0,0]=3 3424 B10R1.10 C=CCc1nccc(Cl)n1 Amb33250315 [1,1,0,0,0,0|2,0,0]=4 3425 B10R1.10 C=COc1cccc(C)c1 Amb17674187 [1,1,0,0,0,0|1,0,0]=3 3426 B10R1.10 C=COc1cccc(F)c1 Amb27869917 [1,1,0,0,0,0|1,0,0]=3 3427 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|1,0,0]=3 3428 B10R1.10 CCCc1cccc(Br)c1 Amb25736130 [1,1,0,0,0,0|0,0,2]=4 3429 B10R1.10 CCCc1cccc(C)c1 Amb22232362 [1,1,0,0,0,0|0,0,2]=4 3430 B10R1.10 CCCc1cccc(Cl)c1 Amb8393606 [1,1,0,0,0,0|0,0,2]=4 3431 B10R1.10 CCCc1cccc(N)c1 Amb18643014 [1,1,0,0,0,0|0,0,2]=4 3432 B10R1.10 CCCc1cccc(N)c1 Amb33172785 [1,1,0,0,0,0|0,0,2]=4 3433 B10R1.10 CCCc1cccc(O)c1 Amb3941016 [1,1,0,0,0,0|0,0,2]=4 3434 B10R1.10 CCNc1cc(C)ccn1 Amb18283607 [1,1,0,0,0,0|1,0,1]=4 3435 B10R1.10 CCNc1cc(Cl)ccn1 Amb15692076 [1,1,0,0,0,0|1,0,1]=4 3436 B10R1.10 CCNc1cc(N)ccn1 Amb17334158 [1,1,0,0,0,0|1,0,1]=4 3437 B10R1.10 CCNc1ccc[n+]([O-])c1 Amb27770407 [1,1,0,0,0,0|1,0,1]=4 3438 B10R1.10 CCNc1cccc(Br)c1 Amb6696674 [1,1,0,0,0,0|0,0,1]=3 3439 B10R1.10 CCNc1cccc(Br)c1 Amb7969585 [1,1,0,0,0,0|0,0,1]=3 3440 B10R1.10 CCNc1cccc(Br)n1 Amb22271124 [1,1,0,0,0,0|1,0,1]=4 3441 B10R1.10 CCNc1cccc(Br)n1 Amb22411595 [1,1,0,0,0,0|1,0,1]=4 3442 B10R1.10 CCNc1cccc(C)c1 Amb4440919 [1,1,0,0,0,0|0,0,1]=3 3443 B10R1.10 CCNc1cccc(C)c1 Amb6540783 [1,1,0,0,0,0|0,0,1]=3 3444 B10R1.10 CCNc1cccc(C)n1 Amb10553057 [1,1,0,0,0,0|1,0,1]=4 3445 B10R1.10 CCNc1cccc(Cl)c1 Amb6695730 [1,1,0,0,0,0|0,0,1]=3 3446 B10R1.10 CCNc1cccc(F)c1 Amb10609458 [1,1,0,0,0,0|0,0,1]=3 3447 B10R1.10 CCNc1cccc(F)c1 Amb6695887 [1,1,0,0,0,0|0,0,1]=3 3448 B10R1.10 CCNc1cccc(F)n1 Amb18951804 [1,1,0,0,0,0|1,0,1]=4 3449 B10R1.10 CCNc1cccc(I)c1 Amb9203673 [1,1,0,0,0,0|0,0,1]=3 3450 B10R1.10 CCNc1cccc(N)c1 Amb8825439 [1,1,0,0,0,0|0,0,1]=3 3451 B10R1.10 CCNc1cccc(O)c1 Amb22168804 [1,1,0,0,0,0|0,0,1]=3 3452 B10R1.10 CCNc1cccc(O)c1 Amb6734927 [1,1,0,0,0,0|0,0,1]=3 3453 B10R1.10 CCNc1ccnc(Cl)c1 Amb13952186 [1,1,0,0,0,0|1,0,1]=4 3454 B10R1.10 CCNc1ccnc(N)c1 Amb27619768 [1,1,0,0,0,0|1,0,1]=4 3455 B10R1.10 CCNc1cncc(Cl)c1 Amb29849410 [1,1,0,0,0,0|1,0,1]=4 3456 B10R1.10 CCNc1cncc(O)c1 Amb27629206 [1,1,0,0,0,0|1,0,1]=4 3457 B10R1.10 CCOc1cccc(Br)c1 Amb3938998 [1,1,0,0,0,0|1,0,1]=4 3458 B10R1.10 CCOc1cccc(F)c1 Amb2684175 [1,1,0,0,0,0|1,0,1]=4 3459 B10R1.10 CCOc1cccc(I)c1 Amb19196001 [1,1,0,0,0,0|1,0,1]=4 3460 B10R1.10 CCOc1cccc(N)c1 Amb1124598 [1,1,0,0,0,0|1,0,1]=4 3461 B10R1.10 CCOc1cccc(O)c1 Amb2720441 [1,1,0,0,0,0|1,0,1]=4 3462 B10R1.10 CCOc1cccc(S)c1 Amb10070967 [1,1,0,0,0,0|1,0,1]=4 3463 B10R1.10 CCSc1cccc(Br)c1 Amb10067418 [1,1,0,0,0,0|1,0,1]=4 3464 B10R1.10 CCSc1cccc(C)c1 Amb25328608 [1,1,0,0,0,0|1,0,1]=4 3465 B10R1.10 CCSc1cccc(Cl)c1 Amb26318573 [1,1,0,0,0,0|1,0,1]=4 3466 B10R1.10 CCSc1cccc(F)c1 Amb25063729 [1,1,0,0,0,0|1,0,1]=4 3467 B10R1.10 CCSc1cccc(N)c1 Amb18950176 [1,1,0,0,0,0|1,0,1]=4 3468 B10R1.10 CCSc1cccc(O)c1 Amb18644674 [1,1,0,0,0,0|1,0,1]=4 3469 B10R1.10 CNCc1cccc(Br)c1 Amb1114712 [1,1,0,0,0,0|1,0,1]=4 3470 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|1,0,1]=4 3471 B10R1.10 CNCc1cccc(C)c1 Amb33536586 [1,1,0,0,0,0|1,0,1]=4 3472 B10R1.10 CNCc1cccc(Cl)c1 Amb1648830 [1,1,0,0,0,0|1,0,1]=4 3473 B10R1.10 CNCc1cccc(F)c1 Amb1647905 [1,1,0,0,0,0|1,0,1]=4 3474 B10R1.10 CNCc1cccc(F)c1 Amb30625686 [1,1,0,0,0,0|1,0,1]=4 3475 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|1,0,1]=4 3476 B10R1.10 CNCc1cccc(N)c1 Amb7173577 [1,1,0,0,0,0|1,0,1]=4 3477 B10R1.10 CNCc1cccc(O)c1 Amb1131158 [1,1,0,0,0,0|1,0,1]=4 3478 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|1,0,1]=4 3479 B10R1.10 CNCc1cccc(S)c1 Amb27598823 [1,1,0,0,0,0|1,0,1]=4 3480 B10R1.10 CNNc1cccc(Cl)c1 Amb27445146 [1,1,0,0,0,0|1,0,1]=4 3481 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|1,0,1]=4 3482 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|1,0,1]=4 3483 B10R1.10 COCc1cccc(N)c1 Amb29847725 [1,1,0,0,0,0|1,0,1]=4 3484 B10R1.10 COCc1cccc(N)c1 Amb6250686 [1,1,0,0,0,0|1,0,1]=4 3485 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|1,0,1]=4 3486 B10R1.10 COCc1cccc(S)c1 Amb33226901 [1,1,0,0,0,0|1,0,1]=4 3487 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|1,0,1]=4 3488 B10R1.10 CSCc1cccc(Cl)c1 Amb27469155 [1,1,0,0,0,0|1,0,1]=4 3489 B10R1.10 CSCc1cccc(F)c1 Amb25978150 [1,1,0,0,0,0|1,0,1]=4 3490 B10R1.10 CSCc1cccc(I)c1 Amb32685575 [1,1,0,0,0,0|1,0,1]=4 3491 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|1,0,1]=4 3492 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|1,0,1]=4 3493 B10R1.10 C\C=C\c1cccc(N)c1 Amb27162745 [1,1,0,0,0,0|0,0,2]=4 3494 B10R1.10 Cc1cc(CC=O)ccn1 Amb32732937 [1,1,0,0,0,0|2,0,0]=4 3495 B10R1.10 Cc1cc(NC=O)ccn1 Amb28199358 [1,1,0,0,0,0|2,0,0]=4 3496 B10R1.10 Cc1cccc(CC#N)c1 Amb3939783 [1,1,0,0,0,0|1,0,1]=4 3497 B10R1.10 Cc1cccc(CC=O)c1 Amb16230453 [1,1,0,0,0,0|1,0,0]=3 3498 B10R1.10 Cc1cccc(CC=O)n1 Amb27473724 [1,1,0,0,0,0|2,0,0]=4 3499 B10R1.10 Cc1cccc(CCBr)c1 Amb2685164 [1,1,0,0,0,0|1,0,1]=4 3500 B10R1.10 Cc1cccc(CCCl)c1 Amb18181942 [1,1,0,0,0,0|1,0,1]=4 3501 B10R1.10 Cc1cccc(CCI)c1 Amb26332327 [1,1,0,0,0,0|1,0,1]=4 3502 B10R1.10 Cc1cccc(CCN)c1 Amb1126573 [1,1,0,0,0,0|1,0,1]=4 3503 B10R1.10 Cc1cccc(CCN)c1 Amb13952645 [1,1,0,0,0,0|1,0,1]=4 3504 B10R1.10 Cc1cccc(CCO)c1 Amb3939096 [1,1,0,0,0,0|1,0,1]=4 3505 B10R1.10 Cc1cccc(CCS)c1 Amb17399939 [1,1,0,0,0,0|1,0,1]=4 3506 B10R1.10 Cc1cccc(CNN)c1 Amb1116333 [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.10 Cc1cccc(CNN)c1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.10 Cc1cccc(CNN)c1 Amb33527910 [1,1,0,0,0,0|2,0,0]=4 3509 B10R1.10 Cc1cccc(CNO)c1 Amb25784359 [1,1,0,0,0,0|2,0,0]=4 3510 B10R1.10 Cc1cccc(CON)c1 Amb17091425 [1,1,0,0,0,0|2,0,0]=4 3511 B10R1.10 Cc1cccc(C[Zn]Cl)c1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 3512 B10R1.10 Cc1cccc(NC#N)c1 Amb9783276 [1,1,0,0,0,0|1,0,1]=4 3513 B10R1.10 Cc1cccc(NC=O)n1 Amb3319171 [1,1,0,0,0,0|2,0,0]=4 3514 B10R1.10 Cc1cccc(NC=S)c1 Amb27624548 [1,1,0,0,0,0|1,0,0]=3 3515 B10R1.10 Cc1cccc(OCCl)c1 Amb27618304 [1,1,0,0,0,0|2,0,0]=4 3516 B10R1.10 Cc1cccc(SCCl)c1 Amb24423887 [1,1,0,0,0,0|2,0,0]=4 3517 B10R1.10 Cc1cccc(\C=C/Cl)c1 Amb27823592 [1,1,0,0,0,0|1,0,1]=4 3518 B10R1.10 Cc1cccc(\C=C\Br)c1 Amb27260630 [1,1,0,0,0,0|1,0,1]=4 3519 B10R1.10 Cc1cccc(\C=C\Cl)c1 Amb27231853 [1,1,0,0,0,0|1,0,1]=4 3520 B10R1.10 Cc1ccnc(CC=O)c1 Amb33318101 [1,1,0,0,0,0|2,0,0]=4 3521 B10R1.10 Cc1cncc(CC=O)c1 Amb26596943 [1,1,0,0,0,0|2,0,0]=4 3522 B10R1.10 ClCCc1cccc(Br)c1 Amb24502263 [1,1,0,0,0,0|1,0,1]=4 3523 B10R1.10 ClCCc1cccc(Cl)c1 Amb18185798 [1,1,0,0,0,0|1,0,1]=4 3524 B10R1.10 ClCCc1cccc(I)c1 Amb27771694 [1,1,0,0,0,0|1,0,1]=4 3525 B10R1.10 ClCOc1cccc(Br)c1 Amb26977241 [1,1,0,0,0,0|2,0,0]=4 3526 B10R1.10 ClCOc1cccc(Cl)c1 Amb24482267 [1,1,0,0,0,0|2,0,0]=4 3527 B10R1.10 ClCOc1cccc(I)c1 Amb25272062 [1,1,0,0,0,0|2,0,0]=4 3528 B10R1.10 ClCSc1cccc(Br)c1 Amb24479383 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.10 ClCSc1cccc(I)c1 Amb28041639 [1,1,0,0,0,0|2,0,0]=4 3530 B10R1.10 Cl[Zn]Cc1cccc(Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 3531 B10R1.10 Clc1cccc(CCBr)c1 Amb2685156 [1,1,0,0,0,0|1,0,1]=4 3532 B10R1.10 Clc1cccc(CCI)c1 Amb27804535 [1,1,0,0,0,0|1,0,1]=4 3533 B10R1.10 Clc1cccc(\C=C\Br)c1 Amb25262044 [1,1,0,0,0,0|1,0,1]=4 3534 B10R1.10 FNNc1cccc(Cl)c1 Amb27969262 [1,1,0,0,0,0|2,0,0]=4 3535 B10R1.10 Fc1cccc(CCBr)c1 Amb2688284 [1,1,0,0,0,0|1,0,1]=4 3536 B10R1.10 Fc1cccc(CCCl)c1 Amb9004325 [1,1,0,0,0,0|1,0,1]=4 3537 B10R1.10 Fc1cccc(CCI)c1 Amb25766475 [1,1,0,0,0,0|1,0,1]=4 3538 B10R1.10 Fc1cccc(CCS)c1 Amb17400006 [1,1,0,0,0,0|1,0,1]=4 3539 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 3540 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 3541 B10R1.10 Fc1cccc(OCCl)c1 Amb24401502 [1,1,0,0,0,0|2,0,0]=4 3542 B10R1.10 Fc1cccc(SCCl)c1 Amb26651935 [1,1,0,0,0,0|2,0,0]=4 3543 B10R1.10 Fc1cccc(\C=C\Br)c1 Amb26010127 [1,1,0,0,0,0|1,0,1]=4 3544 B10R1.10 N#CCc1cccc(Br)c1 Amb1138679 [1,1,0,0,0,0|1,0,1]=4 3545 B10R1.10 N#CCc1cccc(Cl)c1 Amb1651451 [1,1,0,0,0,0|1,0,1]=4 3546 B10R1.10 N#CCc1cccc(F)c1 Amb528107 [1,1,0,0,0,0|1,0,1]=4 3547 B10R1.10 N#CCc1cccc(I)c1 Amb2688871 [1,1,0,0,0,0|1,0,1]=4 3548 B10R1.10 N#CCc1cccc(N)c1 Amb1215231 [1,1,0,0,0,0|1,0,1]=4 3549 B10R1.10 N#CCc1cccc(N)c1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 3550 B10R1.10 N#CCc1cccc(O)c1 Amb6298167 [1,1,0,0,0,0|1,0,1]=4 3551 B10R1.10 N#CCc1cccc(S)c1 Amb27265918 [1,1,0,0,0,0|1,0,1]=4 3552 B10R1.10 N#CNc1cccc(Cl)c1 Amb33529028 [1,1,0,0,0,0|1,0,1]=4 3553 B10R1.10 N#CNc1cccc(F)c1 Amb26610054 [1,1,0,0,0,0|1,0,1]=4 3554 B10R1.10 NCCc1cccc(Br)c1 Amb22900947 [1,1,0,0,0,0|1,0,1]=4 3555 B10R1.10 NCCc1cccc(Br)c1 Amb6365736 [1,1,0,0,0,0|1,0,1]=4 3556 B10R1.10 NCCc1cccc(Cl)c1 Amb1212556 [1,1,0,0,0,0|1,0,1]=4 3557 B10R1.10 NCCc1cccc(F)c1 Amb838765 [1,1,0,0,0,0|1,0,1]=4 3558 B10R1.10 NCCc1cccc(I)c1 Amb25096322 [1,1,0,0,0,0|1,0,1]=4 3559 B10R1.10 NCCc1cccc(N)c1 Amb8631279 [1,1,0,0,0,0|1,0,1]=4 3560 B10R1.10 NCCc1cccc(N)c1 Amb8631364 [1,1,0,0,0,0|1,0,1]=4 3561 B10R1.10 NCCc1cccc(O)c1 Amb2688778 [1,1,0,0,0,0|1,0,1]=4 3562 B10R1.10 NCCc1cccc(O)c1 Amb6243326 [1,1,0,0,0,0|1,0,1]=4 3563 B10R1.10 NCCc1cccc(O)c1 Amb6297567 [1,1,0,0,0,0|1,0,1]=4 3564 B10R1.10 NCCc1cccc(S)c1 Amb27862515 [1,1,0,0,0,0|1,0,1]=4 3565 B10R1.10 NNCc1cccc(Br)c1 Amb1119246 [1,1,0,0,0,0|2,0,0]=4 3566 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 3567 B10R1.10 NNCc1cccc(Br)c1 Amb33537274 [1,1,0,0,0,0|2,0,0]=4 3568 B10R1.10 NNCc1cccc(Cl)c1 Amb1111798 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.10 NNCc1cccc(Cl)c1 Amb13949121 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.10 NNCc1cccc(Cl)c1 Amb33714445 [1,1,0,0,0,0|2,0,0]=4 3571 B10R1.10 NNCc1cccc(F)c1 Amb1121411 [1,1,0,0,0,0|2,0,0]=4 3572 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 3573 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 3574 B10R1.10 NNCc1cccc(N)c1 Amb27810603 [1,1,0,0,0,0|2,0,0]=4 3575 B10R1.10 NNCc1cccc(O)c1 Amb3940160 [1,1,0,0,0,0|2,0,0]=4 3576 B10R1.10 NNCc1cccc(O)c1 Amb6336419 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.10 NOCc1cccc(Br)c1 Amb17091429 [1,1,0,0,0,0|2,0,0]=4 3578 B10R1.10 NOCc1cccc(Cl)c1 Amb17091428 [1,1,0,0,0,0|2,0,0]=4 3579 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 3580 B10R1.10 NOCc1cccc(F)c1 Amb17091426 [1,1,0,0,0,0|2,0,0]=4 3581 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 3582 B10R1.10 NOCc1cccc(I)c1 Amb27626521 [1,1,0,0,0,0|2,0,0]=4 3583 B10R1.10 NOCc1cccc(O)c1 Amb27476207 [1,1,0,0,0,0|2,0,0]=4 3584 B10R1.10 Nc1cccc(CCF)c1 Amb26318675 [1,1,0,0,0,0|1,0,1]=4 3585 B10R1.10 Nc1cccc(CCO)c1 Amb21857105 [1,1,0,0,0,0|1,0,1]=4 3586 B10R1.10 Nc1cccc(NC=O)c1 Amb26052512 [1,1,0,0,0,0|1,0,0]=3 3587 B10R1.10 O=CCc1cc(F)ccn1 Amb33320277 [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.10 O=CCc1cccc(Br)c1 Amb16230449 [1,1,0,0,0,0|1,0,0]=3 3589 B10R1.10 O=CCc1cccc(Br)n1 Amb21858958 [1,1,0,0,0,0|2,0,0]=4 3590 B10R1.10 O=CCc1cccc(Cl)c1 Amb10844835 [1,1,0,0,0,0|1,0,0]=3 3591 B10R1.10 O=CCc1cccc(Cl)n1 Amb33222659 [1,1,0,0,0,0|2,0,0]=4 3592 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|1,0,0]=3 3593 B10R1.10 O=CCc1cccc(O)c1 Amb17089543 [1,1,0,0,0,0|1,0,0]=3 3594 B10R1.10 O=CCc1ccnc(Cl)c1 Amb33407331 [1,1,0,0,0,0|2,0,0]=4 3595 B10R1.10 O=CCc1cncc(Br)c1 Amb27967852 [1,1,0,0,0,0|2,0,0]=4 3596 B10R1.10 O=CCc1cncc(F)c1 Amb26079176 [1,1,0,0,0,0|2,0,0]=4 3597 B10R1.10 O=CNc1cc(Br)ccn1 Amb26369777 [1,1,0,0,0,0|2,0,0]=4 3598 B10R1.10 O=CNc1cc(Cl)ccn1 Amb27256931 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,0]=3 3600 B10R1.10 O=CNc1cccc(Br)n1 Amb24371374 [1,1,0,0,0,0|2,0,0]=4 3601 B10R1.10 O=CNc1cccc(Cl)c1 Amb4007703 [1,1,0,0,0,0|1,0,0]=3 3602 B10R1.10 O=CNc1cccc(O)c1 Amb371592 [1,1,0,0,0,0|1,0,0]=3 3603 B10R1.10 O=CNc1cncc(Cl)c1 Amb3319174 [1,1,0,0,0,0|2,0,0]=4 3604 B10R1.10 OCCc1cccc(Br)c1 Amb3939211 [1,1,0,0,0,0|1,0,1]=4 3605 B10R1.10 OCCc1cccc(Cl)c1 Amb3939105 [1,1,0,0,0,0|1,0,1]=4 3606 B10R1.10 OCCc1cccc(F)c1 Amb3939215 [1,1,0,0,0,0|1,0,1]=4 3607 B10R1.10 OCCc1cccc(I)c1 Amb24524319 [1,1,0,0,0,0|1,0,1]=4 3608 B10R1.10 OCCc1cccc(O)c1 Amb3940102 [1,1,0,0,0,0|1,0,1]=4 3609 B10R1.10 OCCc1cccc(S)c1 Amb27961582 [1,1,0,0,0,0|1,0,1]=4 3610 B10R1.10 OCNc1cccc(F)c1 Amb27168168 [1,1,0,0,0,0|1,0,0]=3 3611 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|2,0,0]=4 3612 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|2,0,0]=4 3613 B10R1.10 ONCc1cccc(F)c1 Amb26060054 [1,1,0,0,0,0|2,0,0]=4 3614 B10R1.10 ONCc1cccc(I)c1 Amb28077250 [1,1,0,0,0,0|2,0,0]=4 3615 B10R1.10 ONCc1cccc(O)c1 Amb24524626 [1,1,0,0,0,0|2,0,0]=4 3616 B10R1.10 Oc1cccc(CCBr)c1 Amb18130690 [1,1,0,0,0,0|1,0,1]=4 3617 B10R1.10 Oc1cccc(CCF)c1 Amb27411445 [1,1,0,0,0,0|1,0,1]=4 3618 B10R1.10 Oc1cccc(CCI)c1 Amb27494566 [1,1,0,0,0,0|1,0,1]=4 3619 B10R1.10 Oc1cccc(CCS)c1 Amb33310795 [1,1,0,0,0,0|1,0,1]=4 3620 B10R1.10 Oc1cccc(SCCl)c1 Amb24368844 [1,1,0,0,0,0|2,0,0]=4 3621 B10R1.10 Oc1cccc(\C=C\Br)c1 Amb24518614 [1,1,0,0,0,0|1,0,1]=4 3622 B10R1.10 S=CNc1cccc(Br)c1 Amb27239434 [1,1,0,0,0,0|1,0,0]=3 3623 B10R1.10 SCCc1cccc(Br)c1 Amb17404678 [1,1,0,0,0,0|1,0,1]=4 3624 B10R1.10 SCCc1cccc(Cl)c1 Amb17400375 [1,1,0,0,0,0|1,0,1]=4 3625 B10R1.10 Sc1cccc(CCBr)c1 Amb27628134 [1,1,0,0,0,0|1,0,1]=4 3626 B10R1.10 Sc1cccc(\C=C\Br)c1 Amb33135147 [1,1,0,0,0,0|1,0,1]=4 3627 B10R1.10 [C-]#[N+]Cc1cccc(Br)c1 Amb3973086 [1,1,0,0,0,0|1,0,1]=4 3628 B10R1.10 [C-]#[N+]Cc1cccc(C)c1 Amb2689350 [1,1,0,0,0,0|1,0,1]=4 3629 B10R1.10 [C-]#[N+]Cc1cccc(Cl)c1 Amb2685777 [1,1,0,0,0,0|1,0,1]=4 3630 B10R1.10 [C-]#[N+]Cc1cccc(F)c1 Amb2688051 [1,1,0,0,0,0|1,0,1]=4 3631 B10R1.10 [NH3+]OCc1cccc(F)c1 Amb2424153 [1,1,0,0,0,0|2,0,0]=4 3632 B10R1.15 BP(CO)c1ccccc1 Amb27652937 [1,1,0,0,0,0|1,1,0]=4 3633 B10R1.15 B[PH](CO)c1ccccc1 Amb27826578 [1,1,0,0,0,0|1,1,0]=4 3634 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [1,1,0,0,0,0|1,0,1]=4 3635 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [1,1,0,0,0,0|1,0,1]=4 3636 B10R1.15 C#CC(Br)c1ccccc1 Amb28121035 [1,1,0,0,0,0|0,0,2]=4 3637 B10R1.15 C#CC(C)c1ccccc1 Amb24106607 [1,1,0,0,0,0|0,0,2]=4 3638 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,1,0,0,0,0|0,0,2]=4 3639 B10R1.15 C#CC(N)c1ccccc1 Amb33204420 [1,1,0,0,0,0|0,0,2]=4 3640 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [1,1,0,0,0,0|0,0,2]=4 3641 B10R1.15 C#C[C@@H](N)c1ccccc1 Amb27599946 [1,1,0,0,0,0|0,0,2]=4 3642 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [1,1,0,0,0,0|0,0,2]=4 3643 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,1,0,0,0,0|0,0,2]=4 3644 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [1,1,0,0,0,0|1,0,1]=4 3645 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [1,1,0,0,0,0|2,0,0]=4 3646 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [1,1,0,0,0,0|2,0,0]=4 3647 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [1,1,0,0,0,0|2,0,0]=4 3648 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [1,1,0,0,0,0|2,0,0]=4 3649 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [1,1,0,0,0,0|2,0,0]=4 3650 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [1,1,0,0,0,0|0,0,1]=3 3651 B10R1.15 C=CC(=C)c1cccnc1 Amb27591416 [1,1,0,0,0,0|1,0,1]=4 3652 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [1,1,0,0,0,0|0,0,1]=3 3653 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [1,1,0,0,0,0|1,0,1]=4 3654 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [1,1,0,0,0,0|1,0,1]=4 3655 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [1,1,0,0,0,0|1,0,1]=4 3656 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [1,1,0,0,0,0|0,0,0]=2 3657 B10R1.15 C=CC(C)c1ccccn1 Amb27838866 [1,1,0,0,0,0|1,0,0]=3 3658 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [1,1,0,0,0,0|0,0,0]=2 3659 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [1,1,0,0,0,0|0,0,0]=2 3660 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|0,0,0]=2 3661 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|0,0,0]=2 3662 B10R1.15 C=CC(N)c1ccccn1 Amb24561652 [1,1,0,0,0,0|1,0,0]=3 3663 B10R1.15 C=CC(N)c1cccnc1 Amb28193260 [1,1,0,0,0,0|1,0,0]=3 3664 B10R1.15 C=CC(N)c1ccncc1 Amb25789567 [1,1,0,0,0,0|1,0,0]=3 3665 B10R1.15 C=CC(N)c1ccncn1 Amb27638795 [1,1,0,0,0,0|2,0,0]=4 3666 B10R1.15 C=CC(N)c1cncnc1 Amb27461360 [1,1,0,0,0,0|2,0,0]=4 3667 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|0,0,0]=2 3668 B10R1.15 C=CC(O)c1ccccn1 Amb26021512 [1,1,0,0,0,0|1,0,0]=3 3669 B10R1.15 C=CC(O)c1cccnc1 Amb26845235 [1,1,0,0,0,0|1,0,0]=3 3670 B10R1.15 C=CC(O)c1ccncc1 Amb24546417 [1,1,0,0,0,0|1,0,0]=3 3671 B10R1.15 C=CC(O)c1ccncn1 Amb24382233 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.15 C=CC(O)c1cnccn1 Amb24353873 [1,1,0,0,0,0|2,0,0]=4 3673 B10R1.15 C=CC(O)c1cncnc1 Amb27807465 [1,1,0,0,0,0|2,0,0]=4 3674 B10R1.15 C=CC(O)c1ncccn1 Amb26635548 [1,1,0,0,0,0|2,0,0]=4 3675 B10R1.15 C=CN(C)c1ccccc1 Amb27878913 [1,1,0,0,0,0|0,0,0]=2 3676 B10R1.15 C=CN(C)c1ccncc1 Amb26031722 [1,1,0,0,0,0|1,0,0]=3 3677 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,1,0,0,0,0|1,0,0]=3 3678 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [1,1,0,0,0,0|0,0,0]=2 3679 B10R1.15 C=C[C@@H](N)c1cccnc1 Amb28289124 [1,1,0,0,0,0|1,0,0]=3 3680 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|0,0,0]=2 3681 B10R1.15 C=C[C@H](N)c1ccccn1 Amb25237215 [1,1,0,0,0,0|1,0,0]=3 3682 B10R1.15 C=C[C@H](N)c1cccnc1 Amb28280521 [1,1,0,0,0,0|1,0,0]=3 3683 B10R1.15 C=C[C@H](N)c1ccncc1 Amb27770577 [1,1,0,0,0,0|1,0,0]=3 3684 B10R1.15 C=C[C@H](N)c1cnccn1 Amb28314103 [1,1,0,0,0,0|2,0,0]=4 3685 B10R1.15 C=C[SiH](C)c1ccccc1 Amb8515879 [1,1,0,0,0,0|0,1,0]=3 3686 B10R1.15 C=NC(C)c1ccccn1 Amb28204098 [1,1,0,0,0,0|2,0,0]=4 3687 B10R1.15 CC(C#N)c1ccccc1 Amb2387010 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [1,1,0,0,0,0|1,0,0]=3 3689 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [1,1,0,0,0,0|2,0,0]=4 3690 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [1,1,0,0,0,0|2,0,0]=4 3691 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [1,1,0,0,0,0|2,0,0]=4 3692 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [1,1,0,0,0,0|1,0,1]=4 3693 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [1,1,0,0,0,0|1,0,1]=4 3694 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [1,1,0,0,0,0|1,0,1]=4 3695 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [1,1,0,0,0,0|1,0,1]=4 3698 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [1,1,0,0,0,0|1,0,1]=4 3699 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [1,1,0,0,0,0|2,0,0]=4 3700 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [1,1,0,0,0,0|2,0,0]=4 3701 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [1,1,0,0,0,0|2,0,0]=4 3702 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [1,1,0,0,0,0|2,0,0]=4 3703 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [1,1,0,0,0,0|2,0,0]=4 3704 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,1,0,0,0,0|2,0,0]=4 3705 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [1,1,0,0,0,0|1,0,1]=4 3706 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [1,1,0,0,0,0|0,0,2]=4 3707 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [1,1,0,0,0,0|0,0,2]=4 3708 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [1,1,0,0,0,0|0,0,2]=4 3709 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,1,0,0,0,0|0,0,2]=4 3710 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [1,1,0,0,0,0|0,0,2]=4 3711 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [1,1,0,0,0,0|0,0,2]=4 3712 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [1,1,0,0,0,0|0,0,2]=4 3713 B10R1.15 CCN(C)c1ccccn1 Amb26564265 [1,1,0,0,0,0|1,0,1]=4 3714 B10R1.15 CCN(N)c1ccccc1 Amb836839 [1,1,0,0,0,0|0,0,1]=3 3715 B10R1.15 CCN(N)c1ccccn1 Amb18643189 [1,1,0,0,0,0|1,0,1]=4 3716 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [1,1,0,0,0,0|0,1,1]=4 3717 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,1,0,0,0,0|1,0,1]=4 3718 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [1,1,0,0,0,0|0,0,2]=4 3719 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,1,0,0,0,0|0,0,2]=4 3720 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [1,1,0,0,0,0|0,0,2]=4 3721 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [1,1,0,0,0,0|0,0,2]=4 3722 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [1,1,0,0,0,0|0,0,2]=4 3723 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [1,1,0,0,0,0|0,0,2]=4 3724 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,1,0,0,0,0|0,0,2]=4 3725 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [1,1,0,0,0,0|0,0,2]=4 3726 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [1,1,0,0,0,0|0,0,2]=4 3727 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [1,1,0,0,0,0|1,0,1]=4 3728 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [1,1,0,0,0,0|1,0,0]=3 3729 B10R1.15 CN(C=O)c1ccccn1 Amb8396240 [1,1,0,0,0,0|2,0,0]=4 3730 B10R1.15 CN(C=O)c1cccnc1 Amb27262216 [1,1,0,0,0,0|2,0,0]=4 3731 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [1,1,0,0,0,0|1,0,1]=4 3733 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [1,1,0,0,0,0|1,0,1]=4 3734 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [1,1,0,0,0,0|1,0,1]=4 3735 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [1,1,0,0,0,0|1,0,1]=4 3737 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,1,0,0,0,0|1,0,1]=4 3738 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [1,1,0,0,0,0|1,1,0]=4 3739 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|1,0,0]=3 3740 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [1,1,0,0,0,0|1,0,1]=4 3741 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [1,1,0,0,0,0|1,0,1]=4 3742 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [1,1,0,0,0,0|1,0,1]=4 3743 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,1,0,0,0,0|2,0,0]=4 3744 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,1,0,0,0,0|2,0,0]=4 3745 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,1,0,0,0,0|2,0,0]=4 3746 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,1,0,0,0,0|2,0,0]=4 3747 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [1,1,0,0,0,0|2,0,0]=4 3748 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|1,0,0]=3 3749 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [1,1,0,0,0,0|1,0,1]=4 3750 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [1,1,0,0,0,0|1,0,1]=4 3751 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [1,1,0,0,0,0|2,0,0]=4 3752 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [1,1,0,0,0,0|2,0,0]=4 3753 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [1,1,0,0,0,0|2,0,0]=4 3754 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [1,1,0,0,0,0|1,0,1]=4 3755 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [1,1,0,0,0,0|1,0,1]=4 3756 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [1,1,0,0,0,0|1,0,1]=4 3757 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [1,1,0,0,0,0|1,0,1]=4 3758 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [1,1,0,0,0,0|0,0,2]=4 3759 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [1,1,0,0,0,0|0,0,2]=4 3760 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,1,0,0,0,0|0,0,2]=4 3761 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [1,1,0,0,0,0|0,0,2]=4 3762 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [1,1,0,0,0,0|1,0,1]=4 3763 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [1,1,0,0,0,0|1,0,1]=4 3764 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,1,0,0,0,0|1,0,1]=4 3765 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [1,1,0,0,0,0|1,0,1]=4 3766 B10R1.15 N#CC(Br)c1ccccc1 Amb9787616 [1,1,0,0,0,0|1,0,1]=4 3767 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,1,0,0,0,0|1,0,1]=4 3768 B10R1.15 N#CC(N)c1ccccc1 Amb3940545 [1,1,0,0,0,0|1,0,1]=4 3769 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [1,1,0,0,0,0|1,0,1]=4 3770 B10R1.15 N#CC([NH3+])c1ccccc1 Amb6365971 [1,1,0,0,0,0|1,0,1]=4 3771 B10R1.15 N#CN(N)c1ccccc1 Amb10552759 [1,1,0,0,0,0|1,0,1]=4 3772 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,1,0,0,0,0|1,0,1]=4 3773 B10R1.15 N#C[C@@H](N)c1ccccc1 Amb17399826 [1,1,0,0,0,0|1,0,1]=4 3774 B10R1.15 N#C[C@H](Cl)c1ccccc1 Amb27184041 [1,1,0,0,0,0|1,0,1]=4 3775 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,1,0,0,0,0|1,0,1]=4 3776 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [1,1,0,0,0,0|1,0,1]=4 3777 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [1,1,0,0,0,0|1,0,0]=3 3778 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [1,1,0,0,0,0|1,0,1]=4 3780 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [1,1,0,0,0,0|1,0,1]=4 3781 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [1,1,0,0,0,0|1,0,1]=4 3782 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|2,0,0]=4 3783 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [1,1,0,0,0,0|2,0,0]=4 3784 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [1,1,0,0,0,0|1,0,1]=4 3785 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,1,0,0,0,0|1,0,1]=4 3786 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [1,1,0,0,0,0|1,0,1]=4 3787 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,1,0,0,0,0|1,0,1]=4 3788 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [1,1,0,0,0,0|1,0,1]=4 3789 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [1,1,0,0,0,0|1,0,1]=4 3790 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [1,1,0,0,0,0|1,0,1]=4 3791 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [1,1,0,0,0,0|1,0,1]=4 3792 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,1,0,0,0,0|1,0,1]=4 3793 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [1,1,0,0,0,0|1,0,1]=4 3794 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,1,0,0,0,0|1,0,1]=4 3795 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [1,1,0,0,0,0|1,0,1]=4 3796 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [1,1,0,0,0,0|1,0,1]=4 3797 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [1,1,0,0,0,0|1,0,1]=4 3798 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [1,1,0,0,0,0|1,1,0]=4 3799 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [1,1,0,0,0,0|1,0,1]=4 3800 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,1,0,0,0,0|1,0,1]=4 3801 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,1,0,0,0,0|1,0,1]=4 3802 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [1,1,0,0,0,0|1,0,1]=4 3803 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [1,1,0,0,0,0|1,0,1]=4 3804 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [1,1,0,0,0,0|1,0,1]=4 3805 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [1,1,0,0,0,0|1,0,1]=4 3806 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [1,1,0,0,0,0|1,0,1]=4 3807 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [1,1,0,0,0,0|2,0,0]=4 3809 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [1,1,0,0,0,0|2,0,0]=4 3810 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|2,0,0]=4 3811 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [1,1,0,0,0,0|2,0,0]=4 3812 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [1,1,0,0,0,0|2,0,0]=4 3813 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [1,1,0,0,0,0|1,0,1]=4 3814 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [1,1,0,0,0,0|1,0,1]=4 3815 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|1,0,0]=3 3816 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|1,0,0]=3 3817 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [1,1,0,0,0,0|1,0,0]=3 3818 B10R1.15 O=CC(O)c1ccccn1 Amb28321322 [1,1,0,0,0,0|2,0,0]=4 3819 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [1,1,0,0,0,0|1,0,0]=3 3820 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [1,1,0,0,0,0|1,0,0]=3 3821 B10R1.15 O=NN(O)c1ccccc1 Amb17666641 [1,1,0,0,0,0|2,0,0]=4 3822 B10R1.15 O=NN([O-])c1ccccc1 Amb34915564 [1,1,0,0,0,0|2,0,0]=4 3823 B10R1.15 O=NN([O-])c1ccccc1 Amb8514053 [1,1,0,0,0,0|2,0,0]=4 3824 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,1,0,0,0,0|2,0,0]=4 3825 B10R1.15 O=S(CO)c1ccccc1 Amb27617047 [1,1,0,0,0,0|2,0,0]=4 3826 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [1,1,0,0,0,0|1,0,1]=4 3827 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [1,1,0,0,0,0|1,0,1]=4 3828 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,1,0,0,0,0|1,0,1]=4 3829 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [1,1,0,0,0,0|1,0,1]=4 3830 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [1,1,0,0,0,0|1,0,1]=4 3831 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [1,1,0,0,0,0|1,0,1]=4 3832 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [1,1,0,0,0,0|1,0,1]=4 3833 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,1,0,0,0,0|1,0,1]=4 3834 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [1,1,0,0,0,0|1,0,1]=4 3835 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,1,0,0,0,0|1,0,1]=4 3836 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [1,1,0,0,0,0|1,0,1]=4 3837 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [1,1,0,0,0,0|1,0,1]=4 3838 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [1,1,0,0,0,0|1,0,1]=4 3839 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [1,1,0,0,0,0|1,0,1]=4 3840 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [1,1,0,0,0,0|1,0,1]=4 3841 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,1,0,0,0,0|1,0,1]=4 3842 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [1,1,0,0,0,0|1,0,1]=4 3843 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,1,0,0,0,0|1,0,1]=4 3844 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [1,1,0,0,0,0|1,0,1]=4 3845 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,1,0,0,0,0|1,0,1]=4 3846 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [1,1,0,0,0,0|1,0,1]=4 3847 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,1,0,0,0,0|1,0,1]=4 3848 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [1,1,0,0,0,0|1,0,1]=4 3849 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [1,1,0,0,0,0|2,0,0]=4 3850 B10R1.15 [C-]#[N+]C(C)c1ccccc1 Amb2688979 [1,1,0,0,0,0|1,0,1]=4 3851 B10R1.15 [C-]#[N+][C@@H](C)c1ccccc1 Amb2684311 [1,1,0,0,0,0|1,0,1]=4 3852 B10R1.15 [C-]#[N+][C@H](C)c1ccccc1 Amb2684310 [1,1,0,0,0,0|1,0,1]=4 3853 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [1,1,0,0,0,0|2,0,0]=4 3854 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,1,0,0,0,0|1,0,1]=4 3855 B10R1.18 BrC(Br)Cc1ccccc1 Amb28049679 [1,1,0,0,0,0|1,0,1]=4 3856 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [1,1,0,0,0,0|0,0,0]=2 3857 B10R1.18 C=C(C)Cc1cccnc1 Amb27624891 [1,1,0,0,0,0|1,0,0]=3 3858 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [1,1,0,0,0,0|0,0,0]=2 3859 B10R1.18 C=C(Cl)Cc1ccccn1 Amb6299557 [1,1,0,0,0,0|1,0,0]=3 3860 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [1,1,0,0,0,0|0,0,0]=2 3861 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|0,0,1]=3 3862 B10R1.18 CC(=N)Nc1ccccn1 Amb28050174 [1,1,0,0,0,0|1,0,1]=4 3863 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,1]=4 3864 B10R1.18 CC(=O)C[n+]1ccccc1 Amb4018023 [1,1,0,0,0,0|1,0,1]=4 3865 B10R1.18 CC(=O)C[n+]1ccccc1 Amb6366487 [1,1,0,0,0,0|1,0,1]=4 3866 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [1,1,0,0,0,0|0,0,1]=3 3867 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [1,1,0,0,0,0|1,0,1]=4 3868 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,1]=4 3869 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [1,1,0,0,0,0|1,0,1]=4 3870 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,1]=4 3871 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [1,1,0,0,0,0|1,0,1]=4 3872 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [1,1,0,0,0,0|0,0,1]=3 3873 B10R1.18 CC(=O)Nc1ccccn1 Amb6374183 [1,1,0,0,0,0|1,0,1]=4 3874 B10R1.18 CC(=O)Nc1cccnc1 Amb6608635 [1,1,0,0,0,0|1,0,1]=4 3875 B10R1.18 CC(=O)Nc1ccncc1 Amb6395765 [1,1,0,0,0,0|1,0,1]=4 3876 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,1]=4 3877 B10R1.18 CC(=S)Cc1ccncc1 Amb27184042 [1,1,0,0,0,0|1,0,1]=4 3878 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [1,1,0,0,0,0|0,0,1]=3 3879 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [1,1,0,0,0,0|0,0,2]=4 3880 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [1,1,0,0,0,0|0,0,2]=4 3881 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [1,1,0,0,0,0|0,0,2]=4 3882 B10R1.18 CC(C)Nc1ccccc1 Amb2720884 [1,1,0,0,0,0|0,0,1]=3 3883 B10R1.18 CC(C)Nc1ccccn1 Amb1104052 [1,1,0,0,0,0|1,0,1]=4 3884 B10R1.18 CC(C)Nc1cccnc1 Amb16231494 [1,1,0,0,0,0|1,0,1]=4 3885 B10R1.18 CC(C)Nc1cccnc1 Amb2382996 [1,1,0,0,0,0|1,0,1]=4 3886 B10R1.18 CC(C)Nc1ccncc1 Amb16231495 [1,1,0,0,0,0|1,0,1]=4 3887 B10R1.18 CC(C)Oc1ccccc1 Amb3429104 [1,1,0,0,0,0|1,0,1]=4 3888 B10R1.18 CC(C)Sc1ccccc1 Amb5721900 [1,1,0,0,0,0|1,0,1]=4 3889 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [1,1,0,0,0,0|0,0,2]=4 3890 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [1,1,0,0,0,0|0,0,2]=4 3891 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [1,1,0,0,0,0|0,0,2]=4 3892 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [1,1,0,0,0,0|0,0,1]=3 3893 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [1,1,0,0,0,0|1,0,1]=4 3894 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,0,2]=4 3895 B10R1.18 CN(C)Cc1ccccc1 Amb6608891 [1,1,0,0,0,0|1,0,1]=4 3896 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [1,1,0,0,0,0|1,0,1]=4 3897 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [1,1,0,0,0,0|1,0,1]=4 3898 B10R1.18 CP(C)Cc1ccccc1 Amb26928754 [1,1,0,0,0,0|1,0,1]=4 3899 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 3900 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [1,1,0,0,0,0|1,0,1]=4 3901 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [1,1,0,0,0,0|0,0,2]=4 3902 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [1,1,0,0,0,0|0,0,2]=4 3903 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [1,1,0,0,0,0|0,0,2]=4 3904 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,2]=4 3905 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [1,1,0,0,0,0|0,0,2]=4 3906 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [1,1,0,0,0,0|0,0,2]=4 3907 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [1,1,0,0,0,0|0,0,2]=4 3908 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [1,1,0,0,0,0|0,0,2]=4 3909 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|0,1,1]=4 3910 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|0,1,1]=4 3911 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 3912 B10R1.18 ClC(Cl)=Cc1ccccc1 Amb26554175 [1,1,0,0,0,0|1,0,1]=4 3913 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,1,0,0,0,0|1,0,1]=4 3914 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,1]=4 3915 B10R1.18 ClC(Cl)Oc1ccccc1 Amb27758700 [1,1,0,0,0,0|2,0,0]=4 3916 B10R1.18 ClC(Cl)[SH2]c1ccccc1 Amb28396623 [1,1,0,0,0,0|2,0,0]=4 3917 B10R1.18 FC(F)Oc1ccccc1 Amb2687045 [1,1,0,0,0,0|2,0,0]=4 3918 B10R1.18 FC(F)Sc1ccccc1 Amb17232315 [1,1,0,0,0,0|2,0,0]=4 3919 B10R1.18 F\C(Br)=C\c1ccccc1 Amb24053589 [1,1,0,0,0,0|1,0,1]=4 3920 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [1,1,0,0,0,0|1,0,0]=3 3921 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [1,1,0,0,0,0|1,0,0]=3 3922 B10R1.18 N=C(N)Cc1ccccn1 Amb2696371 [1,1,0,0,0,0|2,0,0]=4 3923 B10R1.18 N=C(N)Cc1ccccn1 Amb6760428 [1,1,0,0,0,0|2,0,0]=4 3924 B10R1.18 N=C(N)Cc1ccccn1 Amb8630194 [1,1,0,0,0,0|2,0,0]=4 3925 B10R1.18 N=C(N)Cc1cccnc1 Amb19890175 [1,1,0,0,0,0|2,0,0]=4 3926 B10R1.18 N=C(N)Cc1cccnc1 Amb2696372 [1,1,0,0,0,0|2,0,0]=4 3927 B10R1.18 N=C(N)Cc1cccnc1 Amb6760493 [1,1,0,0,0,0|2,0,0]=4 3928 B10R1.18 N=C(N)Cc1ccncc1 Amb28555413 [1,1,0,0,0,0|2,0,0]=4 3929 B10R1.18 N=C(N)Cc1ccncc1 Amb33533992 [1,1,0,0,0,0|2,0,0]=4 3930 B10R1.18 N=C(N)Cc1ccncc1 Amb4297103 [1,1,0,0,0,0|2,0,0]=4 3931 B10R1.18 N=C(N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|1,0,0]=3 3932 B10R1.18 N=C(N)Nc1ccccc1 Amb30982925 [1,1,0,0,0,0|1,0,0]=3 3933 B10R1.18 N=C(N)Nc1ccccc1 Amb8384582 [1,1,0,0,0,0|1,0,0]=3 3934 B10R1.18 N=C(N)Nc1ccccc1 Amb8629200 [1,1,0,0,0,0|1,0,0]=3 3935 B10R1.18 N=C(N)Nc1ccncc1 Amb22752815 [1,1,0,0,0,0|2,0,0]=4 3936 B10R1.18 N=C(N)Sc1ccccc1 Amb27837617 [1,1,0,0,0,0|2,0,0]=4 3937 B10R1.18 N=C(N)[NH2+]c1ccccc1 Amb27773651 [1,1,0,0,0,0|1,0,1]=4 3938 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,0]=3 3939 B10R1.18 NC(=O)C[n+]1ccccc1 Amb2684428 [1,1,0,0,0,0|2,0,0]=4 3940 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|1,0,0]=3 3941 B10R1.18 NC(=O)Cc1cccnc1 Amb21856113 [1,1,0,0,0,0|2,0,0]=4 3942 B10R1.18 NC(=O)Cc1ccncc1 Amb4010849 [1,1,0,0,0,0|2,0,0]=4 3943 B10R1.18 NC(=O)Nc1ccccc1 Amb3106756 [1,1,0,0,0,0|1,0,0]=3 3944 B10R1.18 NC(=O)Nc1ccccn1 Amb2691587 [1,1,0,0,0,0|2,0,0]=4 3945 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,1,0,0,0,0|2,0,0]=4 3946 B10R1.18 NC(=O)Nc1ccncc1 Amb23581130 [1,1,0,0,0,0|2,0,0]=4 3947 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [1,1,0,0,0,0|2,0,0]=4 3948 B10R1.18 NC(=O)Sc1ccccc1 Amb28182472 [1,1,0,0,0,0|2,0,0]=4 3949 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,1,0,0,0,0|2,0,0]=4 3950 B10R1.18 NC(=S)C[n+]1ccccc1 Amb31127628 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|1,0,0]=3 3952 B10R1.18 NC(=S)Cc1ccccn1 Amb33532901 [1,1,0,0,0,0|2,0,0]=4 3953 B10R1.18 NC(=S)Cc1cccnc1 Amb6248428 [1,1,0,0,0,0|2,0,0]=4 3954 B10R1.18 NC(=S)Cc1ccncc1 Amb6252363 [1,1,0,0,0,0|2,0,0]=4 3955 B10R1.18 NC(=S)Nc1ccccc1 Amb6356934 [1,1,0,0,0,0|1,0,0]=3 3956 B10R1.18 NC(=S)Nc1ccccn1 Amb1162454 [1,1,0,0,0,0|2,0,0]=4 3957 B10R1.18 NC(=S)Nc1cccnc1 Amb2690442 [1,1,0,0,0,0|2,0,0]=4 3958 B10R1.18 NC(=S)Nc1ccncc1 Amb2725753 [1,1,0,0,0,0|2,0,0]=4 3959 B10R1.18 NC(=S)Oc1ccccc1 Amb27453485 [1,1,0,0,0,0|2,0,0]=4 3960 B10R1.18 NC(=S)Sc1ccccc1 Amb27407677 [1,1,0,0,0,0|2,0,0]=4 3961 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|1,0,0]=3 3962 B10R1.18 NC(N)=Nc1ccccc1 Amb2722869 [1,1,0,0,0,0|1,0,1]=4 3963 B10R1.18 NC(N)Cc1ccccc1 Amb27823264 [1,1,0,0,0,0|1,0,1]=4 3964 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|1,0,1]=4 3965 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [1,1,0,0,0,0|2,0,0]=4 3966 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [1,1,0,0,0,0|1,0,0]=3 3967 B10R1.18 O=C(Br)Nc1ccccc1 Amb27229968 [1,1,0,0,0,0|1,0,0]=3 3968 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [1,1,0,0,0,0|1,0,0]=3 3969 B10R1.18 O=C(Cl)Cc1ccccn1 Amb26458529 [1,1,0,0,0,0|2,0,0]=4 3970 B10R1.18 O=C(Cl)Cc1cccnc1 Amb24605722 [1,1,0,0,0,0|2,0,0]=4 3971 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,1,0,0,0,0|1,0,0]=3 3972 B10R1.18 O=C(Cl)Nc1cccnc1 Amb35637042 [1,1,0,0,0,0|2,0,0]=4 3973 B10R1.18 O=C(Cl)Nc1ccncc1 Amb32789666 [1,1,0,0,0,0|2,0,0]=4 3974 B10R1.18 O=C(Cl)Oc1ccccc1 Amb6296594 [1,1,0,0,0,0|2,0,0]=4 3975 B10R1.18 O=C(Cl)Sc1ccccc1 Amb4006578 [1,1,0,0,0,0|2,0,0]=4 3976 B10R1.18 O=C(Cl)[NH2+]c1ccccc1 Amb9787354 [1,1,0,0,0,0|1,0,1]=4 3977 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,1,0,0,0,0|1,0,0]=3 3978 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|2,0,0]=4 3979 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [1,1,0,0,0,0|1,0,0]=3 3982 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [1,1,0,0,0,0|2,0,0]=4 3983 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [1,1,0,0,0,0|2,0,0]=4 3984 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [1,1,0,0,0,0|2,0,0]=4 3985 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [1,1,0,0,0,0|2,0,0]=4 3986 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [1,1,0,0,0,0|2,0,0]=4 3987 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [1,1,0,0,0,0|2,0,0]=4 3988 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [1,1,0,0,0,0|1,0,0]=3 3989 B10R1.18 O=C(O)Nc1cccnc1 Amb24102579 [1,1,0,0,0,0|2,0,0]=4 3990 B10R1.18 O=C(O)Nc1ccncc1 Amb24070647 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|1,0,0]=3 3992 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|1,0,0]=3 3993 B10R1.18 O=C([O-])Cc1ccccn1 Amb22000882 [1,1,0,0,0,0|2,0,0]=4 3994 B10R1.18 O=C([O-])Cc1cccnc1 Amb33513106 [1,1,0,0,0,0|2,0,0]=4 3995 B10R1.18 O=C([O-])Oc1ccccc1 Amb5540415 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [1,1,0,0,0,0|2,0,0]=4 3998 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [1,1,0,0,0,0|2,0,0]=4 3999 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|2,0,0]=4 4000 B10R1.18 O=[N+]([O-])Nc1ccccc1 Amb17939349 [1,1,0,0,0,0|2,0,0]=4 4001 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.18 OB(O)Cc1ccccc1 Amb10071580 [1,1,0,0,0,0|2,0,0]=4 4003 B10R1.18 OB(O)Nc1ccccc1 Amb27630373 [1,1,0,0,0,0|2,0,0]=4 4004 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|1,0,0]=3 4005 B10R1.18 OC(Cl)Cc1ccccc1 Amb27228646 [1,1,0,0,0,0|1,0,1]=4 4006 B10R1.18 OC(Cl)Oc1ccccc1 Amb28255528 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|1,0,1]=4 4008 B10R1.18 OC(O)Oc1ccccc1 Amb27790325 [1,1,0,0,0,0|2,0,0]=4 4009 B10R1.18 S=C(Cl)Cc1ccccc1 Amb28203639 [1,1,0,0,0,0|1,0,0]=3 4010 B10R1.18 S=C(Cl)Oc1ccccc1 Amb6365789 [1,1,0,0,0,0|2,0,0]=4 4011 B10R1.18 S=C(Cl)Sc1ccccc1 Amb9800285 [1,1,0,0,0,0|2,0,0]=4 4012 B10R1.18 S=C(S)Nc1ccccc1 Amb28049925 [1,1,0,0,0,0|1,0,0]=3 4013 B10R1.18 S=C(S)Nc1ccncc1 Amb28436723 [1,1,0,0,0,0|2,0,0]=4 4014 B10R1.11 C=CCC(=O)c1ccco1 Amb10562220 [0,1,0,0,1,0|2,0,0]=4 4015 B10R1.11 C=CCC(=O)c1cccs1 Amb10574830 [0,1,0,0,1,0|2,0,0]=4 4016 B10R1.11 C=CCC(=O)n1cccc1 Amb26481289 [0,1,0,0,1,0|2,0,0]=4 4017 B10R1.11 C=CCC(N)c1cccs1 Amb18977588 [0,1,0,0,1,0|2,0,0]=4 4018 B10R1.11 C=CCC(O)c1ccco1 Amb22360627 [0,1,0,0,1,0|2,0,0]=4 4019 B10R1.11 C=CCC(O)c1cccs1 Amb18787527 [0,1,0,0,1,0|2,0,0]=4 4020 B10R1.11 C=CCC(O)c1ccsc1 Amb18787528 [0,1,0,0,1,0|2,0,0]=4 4021 B10R1.11 C=CCN(C)c1nccs1 Amb28381503 [0,1,0,0,1,0|2,0,0]=4 4022 B10R1.11 C=CC[C@@H](N)c1ccsc1 Amb27258714 [0,1,0,0,1,0|2,0,0]=4 4023 B10R1.11 C=CC[C@@H](O)c1cccs1 Amb28065806 [0,1,0,0,1,0|2,0,0]=4 4024 B10R1.11 C=CC[C@@H](O)c1ccoc1 Amb27214127 [0,1,0,0,1,0|2,0,0]=4 4025 B10R1.11 C=CC[C@H](O)c1ccoc1 Amb27948216 [0,1,0,0,1,0|2,0,0]=4 4026 B10R1.16 C=CCCc1cc(Br)cs1 Amb27758441 [0,1,0,0,1,0|2,0,0]=4 4027 B10R1.16 C=CCCc1ccc(C)o1 Amb22339450 [0,1,0,0,1,0|2,0,0]=4 4028 B10R1.16 C=CCCc1ccc(C)s1 Amb35715632 [0,1,0,0,1,0|2,0,0]=4 4029 B10R1.16 C=CCCc1csc(Cl)c1 Amb27768788 [0,1,0,0,1,0|2,0,0]=4 4030 B10R1.16 C=CCNC1=CC(=O)CC1 Amb28437148 [0,1,0,0,1,0|0,0,2]=4 4031 B10R1.16 C=CCNc1cc(N)ns1 Amb27839436 [0,1,0,0,1,0|2,0,0]=4 4032 B10R1.16 C=CCNc1cnn(C)c1 Amb27619101 [0,1,0,0,1,0|2,0,0]=4 4033 B10R1.16 C=CCNc1nc(Cl)cs1 Amb27232176 [0,1,0,0,1,0|2,0,0]=4 4034 B10R1.16 C=CCNc1ncc(Br)s1 Amb25997480 [0,1,0,0,1,0|2,0,0]=4 4035 B10R1.16 C=CCNc1ncc(Cl)s1 Amb27826563 [0,1,0,0,1,0|2,0,0]=4 4036 B10R1.16 C=CCNc1ncc(N)s1 Amb27239451 [0,1,0,0,1,0|2,0,0]=4 4037 B10R1.16 C=CCSc1ccc(Br)s1 Amb27200644 [0,1,0,0,1,0|2,0,0]=4 4038 B10R1.16 C=CCSc1ccc(C)s1 Amb27816705 [0,1,0,0,1,0|2,0,0]=4 4039 B10R1.21 C=CCCCC1=CCC=C1 Amb27816709 [0,1,0,0,1,0|1,0,1]=4 4040 B10R1.21 C=CCCCc1cccs1 Amb27758442 [0,1,0,0,1,0|2,0,0]=4 4041 B10R1.21 C=CCCCn1cccc1 Amb26551919 [0,1,0,0,1,0|2,0,0]=4 4042 B10R1.21 C=CCNCc1ccco1 Amb19890257 [0,1,0,0,1,0|1,0,0]=3 4043 B10R1.21 C=CCNCc1ccco1 Amb5261474 [0,1,0,0,1,0|1,0,0]=3 4044 B10R1.21 C=CCNCc1cccs1 Amb1153881 [0,1,0,0,1,0|1,0,0]=3 4045 B10R1.21 C=CCNCc1cccs1 Amb19890259 [0,1,0,0,1,0|1,0,0]=3 4046 B10R1.21 C=CCNCc1ccsc1 Amb5262480 [0,1,0,0,1,0|1,0,0]=3 4047 B10R1.21 C=CCNCc1ccsc1 Amb6868341 [0,1,0,0,1,0|1,0,0]=3 4048 B10R1.21 C=CCNCc1cscn1 Amb18305311 [0,1,0,0,1,0|2,0,0]=4 4049 B10R1.21 C=CCNCc1nccs1 Amb17334368 [0,1,0,0,1,0|2,0,0]=4 4050 B10R1.21 C=CCSCc1ccco1 Amb26336655 [0,1,0,0,1,0|2,0,0]=4 4051 B10R1.21 C=COCCc1cccs1 Amb28342200 [0,1,0,0,1,0|2,0,0]=4 4052 B10R1.27 C=CC(C)Nc1nccs1 Amb28069912 [0,1,0,0,1,0|2,0,0]=4 4053 B10R1.27 C=CC(O)Cc1cccs1 Amb27405415 [0,1,0,0,1,0|2,0,0]=4 4054 B10R1.27 C=CC(O)Cc1ccsc1 Amb28138912 [0,1,0,0,1,0|2,0,0]=4 4055 B10R1.29 C=CCCc1ccsc1C Amb29863400 [0,1,0,0,1,0|2,0,0]=4 4056 B10R1.29 C=CCCc1ccsc1Cl Amb29867187 [0,1,0,0,1,0|2,0,0]=4 4057 B10R1.29 C=CCCc1cocc1C Amb35711110 [0,1,0,0,1,0|2,0,0]=4 4058 B10R1.29 C=CCCc1cscc1Br Amb29863973 [0,1,0,0,1,0|2,0,0]=4 4059 B10R1.29 C=CCCc1occc1Br Amb29863834 [0,1,0,0,1,0|2,0,0]=4 4060 B10R1.29 C=CCCc1sccc1C Amb29863520 [0,1,0,0,1,0|2,0,0]=4 4061 B10R1.29 C=CCOc1ccsc1C Amb28287811 [0,1,0,0,1,0|2,0,0]=4 4062 B10R1.66 C=C(Br)CNc1nccs1 Amb27250166 [0,1,0,0,1,0|2,0,0]=4 4063 B10R1.66 C=C(C)CNc1ccsc1 Amb27634797 [0,1,0,0,1,0|1,0,0]=3 4064 B10R1.66 C=C(Cl)CNc1ccsc1 Amb28290266 [0,1,0,0,1,0|1,0,0]=3 4065 B10R1.66 NC(=O)CNn1cccc1 Amb27618368 [0,1,0,0,1,0|2,0,0]=4 4066 B10R1.66 O=C(O)CNc1ccco1 Amb27846560 [0,1,0,0,1,0|2,0,0]=4 4067 B10R1.66 O=C(O)CNc1cccs1 Amb26516474 [0,1,0,0,1,0|2,0,0]=4 4068 B10R1.66 O=C(O)CNc1ccsc1 Amb25322129 [0,1,0,0,1,0|2,0,0]=4 4069 B12R1.18 C\C=N\NC1=CC=CC=CC1=O Amb26563220 [0,1,0,0,0,1|1,0,1]=4 4070 B12R1.18 NCCNC1=CC=CC=CC1=O Amb27191827 [0,1,0,0,0,1|1,0,1]=4 4071 B12R1.1414 O=C\C=C\C=C1C=CC=CC=C1 Amb26393515 [0,1,0,0,0,1|1,0,1]=4 4072 B12R1.1 C#CCCNc1ccc(Br)cc1 Amb27426594 [0,2,0,0,0,0|0,0,2]=4 4073 B12R1.1 C#CCCNc1ccc(C)cc1 Amb27229825 [0,2,0,0,0,0|0,0,2]=4 4074 B12R1.1 C#CCNCc1ccc(Br)cc1 Amb21969141 [0,2,0,0,0,0|0,0,2]=4 4075 B12R1.1 C#CCNCc1ccc(Br)cc1 Amb6683533 [0,2,0,0,0,0|0,0,2]=4 4076 B12R1.1 C#CCNCc1ccc(C)cc1 Amb5262677 [0,2,0,0,0,0|0,0,2]=4 4077 B12R1.1 C#CCNCc1ccc(C)cc1 Amb6868393 [0,2,0,0,0,0|0,0,2]=4 4078 B12R1.1 C#CCNCc1ccc(Cl)cc1 Amb21979448 [0,2,0,0,0,0|0,0,2]=4 4079 B12R1.1 C#CCNCc1ccc(Cl)cc1 Amb6683534 [0,2,0,0,0,0|0,0,2]=4 4080 B12R1.1 C#CCNCc1ccc(F)cc1 Amb13951349 [0,2,0,0,0,0|0,0,2]=4 4081 B12R1.1 C#CCNCc1ccc(F)cc1 Amb5262816 [0,2,0,0,0,0|0,0,2]=4 4082 B12R1.1 C=CCCCc1ccc(Br)cc1 Amb33456175 [0,2,0,0,0,0|1,0,0]=3 4083 B12R1.1 C=CCCNc1ncc(I)cn1 Amb27167149 [0,2,0,0,0,0|2,0,0]=4 4084 B12R1.1 C=CCCOc1ccc(Br)cc1 Amb33069058 [0,2,0,0,0,0|1,0,0]=3 4085 B12R1.1 C=CCCOc1ccc(Cl)cc1 Amb32664342 [0,2,0,0,0,0|1,0,0]=3 4086 B12R1.1 C=CCCOc1ccc(N)cc1 Amb24102791 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.1 C=CCCOc1ccc(O)cc1 Amb32410854 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.1 C=CCNCc1ccc(Br)cc1 Amb1923349 [0,2,0,0,0,0|0,0,0]=2 4089 B12R1.1 C=CCNCc1ccc(Br)cc1 Amb6864767 [0,2,0,0,0,0|0,0,0]=2 4090 B12R1.1 C=CCNCc1ccc(C)cc1 Amb6683787 [0,2,0,0,0,0|0,0,0]=2 4091 B12R1.1 C=CCNCc1ccc(C)cc1 Amb6864765 [0,2,0,0,0,0|0,0,0]=2 4092 B12R1.1 C=CCNCc1ccc(Cl)cc1 Amb1923348 [0,2,0,0,0,0|0,0,0]=2 4093 B12R1.1 C=CCNCc1ccc(Cl)cc1 Amb6864766 [0,2,0,0,0,0|0,0,0]=2 4094 B12R1.1 C=CCNCc1ccc(F)cc1 Amb6683771 [0,2,0,0,0,0|0,0,0]=2 4095 B12R1.1 C=CCNCc1ccc(F)cc1 Amb6864768 [0,2,0,0,0,0|0,0,0]=2 4096 B12R1.1 C=CCNCc1ccc(O)cc1 Amb19890782 [0,2,0,0,0,0|0,0,0]=2 4097 B12R1.1 C=CCNCc1ccc(O)cc1 Amb6683767 [0,2,0,0,0,0|0,0,0]=2 4098 B12R1.1 C=CCSCc1ccc(N)cc1 Amb17498006 [0,2,0,0,0,0|1,0,0]=3 4099 B12R1.1 C=CC\C=C\c1ccc(C)cc1 Amb8394000 [0,2,0,0,0,0|1,0,0]=3 4100 B12R1.1 C=CC\C=C\c1ccc(Cl)cc1 Amb8393999 [0,2,0,0,0,0|1,0,0]=3 4101 B12R1.1 C=NCCNc1ccc(C)cc1 Amb27453488 [0,2,0,0,0,0|0,0,1]=3 4102 B12R1.1 C=NCCNc1ccc(Cl)cc1 Amb27865458 [0,2,0,0,0,0|0,0,1]=3 4103 B12R1.1 CCCCNc1ccc(Br)cc1 Amb4313695 [0,2,0,0,0,0|0,0,2]=4 4104 B12R1.1 CCCCNc1ccc(C)cc1 Amb4313688 [0,2,0,0,0,0|0,0,2]=4 4105 B12R1.1 CCCCNc1ccc(Cl)cc1 Amb4313690 [0,2,0,0,0,0|0,0,2]=4 4106 B12R1.1 CCCCNc1ccc(F)cc1 Amb4313696 [0,2,0,0,0,0|0,0,2]=4 4107 B12R1.1 CCCCNc1ccc(I)cc1 Amb7759888 [0,2,0,0,0,0|0,0,2]=4 4108 B12R1.1 CCCCNc1ccc(O)cc1 Amb9608868 [0,2,0,0,0,0|0,0,2]=4 4109 B12R1.1 CCCNCc1ccc(Br)cc1 Amb19890387 [0,2,0,0,0,0|0,0,2]=4 4110 B12R1.1 CCCNCc1ccc(Br)cc1 Amb837679 [0,2,0,0,0,0|0,0,2]=4 4111 B12R1.1 CCCNCc1ccc(C)cc1 Amb1215690 [0,2,0,0,0,0|0,0,2]=4 4112 B12R1.1 CCCNCc1ccc(C)cc1 Amb19890384 [0,2,0,0,0,0|0,0,2]=4 4113 B12R1.1 CCCNCc1ccc(Cl)cc1 Amb10782093 [0,2,0,0,0,0|0,0,2]=4 4114 B12R1.1 CCCNCc1ccc(Cl)cc1 Amb838374 [0,2,0,0,0,0|0,0,2]=4 4115 B12R1.1 CCCNCc1ccc(F)cc1 Amb6864724 [0,2,0,0,0,0|0,0,2]=4 4116 B12R1.1 CCCNCc1ccc(F)cc1 Amb838017 [0,2,0,0,0,0|0,0,2]=4 4117 B12R1.1 CCCNCc1ccc(O)cc1 Amb2445168 [0,2,0,0,0,0|0,0,2]=4 4118 B12R1.1 CCCNCc1ccc(O)cc1 Amb6264703 [0,2,0,0,0,0|0,0,2]=4 4119 B12R1.1 COCCNc1ccc(Br)cc1 Amb6712196 [0,2,0,0,0,0|0,0,2]=4 4120 B12R1.1 COCCNc1ccc(C)cc1 Amb6714070 [0,2,0,0,0,0|0,0,2]=4 4121 B12R1.1 COCCNc1ccc(Cl)cc1 Amb6711958 [0,2,0,0,0,0|0,0,2]=4 4122 B12R1.1 COCCNc1ccc(F)cc1 Amb6712307 [0,2,0,0,0,0|0,0,2]=4 4123 B12R1.1 COCCNc1ccc(N)cc1 Amb10610074 [0,2,0,0,0,0|0,0,2]=4 4124 B12R1.1 COCCNc1ccc(N)cc1 Amb9205203 [0,2,0,0,0,0|0,0,2]=4 4125 B12R1.1 CSCCNc1ccc(F)cc1 Amb18312643 [0,2,0,0,0,0|0,0,2]=4 4126 B12R1.1 CSCCNc1ccc(I)cc1 Amb27245585 [0,2,0,0,0,0|0,0,2]=4 4127 B12R1.1 CSCCNc1ccc(N)cc1 Amb27233343 [0,2,0,0,0,0|0,0,2]=4 4128 B12R1.1 C\C=C\C=C\c1ccc(O)cc1 Amb28285927 [0,2,0,0,0,0|1,0,1]=4 4129 B12R1.1 C\C=C\C=N\c1ccc(O)cc1 Amb27626909 [0,2,0,0,0,0|0,0,2]=4 4130 B12R1.1 C\C=C\CNc1ccc(Br)cn1 Amb28199563 [0,2,0,0,0,0|1,0,0]=3 4131 B12R1.1 C\C=C\CNc1ccc(C)cc1 Amb4017479 [0,2,0,0,0,0|0,0,0]=2 4132 B12R1.1 C\C=C\CNc1ccc(Cl)cc1 Amb28458551 [0,2,0,0,0,0|0,0,0]=2 4133 B12R1.1 C\C=C\CNc1ccc(N)cn1 Amb27422871 [0,2,0,0,0,0|1,0,0]=3 4134 B12R1.1 C\C=C\CNc1ccc(N)nc1 Amb27428404 [0,2,0,0,0,0|1,0,0]=3 4135 B12R1.1 C\C=C\CNc1cnc(Br)cn1 Amb27212981 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.1 C\C=C\CNc1ncc(C)cn1 Amb28246777 [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.1 C\C=C\CNc1ncc(Cl)cn1 Amb27855136 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.1 C\C=C\CNc1ncc(I)cn1 Amb27859139 [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.1 C\C=C\CNc1ncc(N)cn1 Amb27422873 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.1 C\C=C\COc1ccc(Br)cc1 Amb9727095 [0,2,0,0,0,0|1,0,0]=3 4141 B12R1.1 C\C=C\COc1ccc(Br)nc1 Amb28461432 [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.1 C\C=C\COc1ccc(C)cc1 Amb27586223 [0,2,0,0,0,0|1,0,0]=3 4143 B12R1.1 C\C=C\COc1ccc(Cl)nc1 Amb27868083 [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.1 C\C=C\COc1ccc(F)nc1 Amb27251117 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.1 C\C=C\COc1ccc(I)nc1 Amb27835523 [0,2,0,0,0,0|2,0,0]=4 4146 B12R1.1 C\C=C\CSc1ccc(Cl)cc1 Amb28126400 [0,2,0,0,0,0|1,0,0]=3 4147 B12R1.1 C\C=C\CSc1ccc(Cl)cn1 Amb27205958 [0,2,0,0,0,0|2,0,0]=4 4148 B12R1.1 C\C=C\CSc1ccc(F)cc1 Amb27588597 [0,2,0,0,0,0|1,0,0]=3 4149 B12R1.1 Cc1ccc(C#C\C=C\Cl)cc1 Amb24634236 [0,2,0,0,0,0|1,0,1]=4 4150 B12R1.1 Cc1ccc(C=C=CC=O)cc1 Amb27797313 [0,2,0,0,0,0|1,0,1]=4 4151 B12R1.1 Cc1ccc(CCCC=O)cc1 Amb17089167 [0,2,0,0,0,0|1,0,1]=4 4152 B12R1.1 Cc1ccc(CNCC#N)cc1 Amb6713684 [0,2,0,0,0,0|1,0,1]=4 4153 B12R1.1 Cc1ccc(CNCCCl)cc1 Amb17335658 [0,2,0,0,0,0|1,0,1]=4 4154 B12R1.1 Cc1ccc(CNCCN)cc1 Amb9174051 [0,2,0,0,0,0|1,0,1]=4 4155 B12R1.1 Cc1ccc(CNCCO)cc1 Amb6864509 [0,2,0,0,0,0|1,0,1]=4 4156 B12R1.1 Cc1ccc(CNCCO)cc1 Amb838343 [0,2,0,0,0,0|1,0,1]=4 4157 B12R1.1 Cc1ccc(NCCC#N)cc1 Amb1643630 [0,2,0,0,0,0|0,0,2]=4 4158 B12R1.1 Cc1ccc(NCCCN)cc1 Amb17057723 [0,2,0,0,0,0|0,0,2]=4 4159 B12R1.1 Cc1ccc(NCCCO)cc1 Amb17306885 [0,2,0,0,0,0|0,0,2]=4 4160 B12R1.1 Cc1ccc(N\C=C/C=O)cc1 Amb27268477 [0,2,0,0,0,0|0,0,1]=3 4161 B12R1.1 Cc1ccc(OCCC=O)cc1 Amb5731761 [0,2,0,0,0,0|1,0,1]=4 4162 B12R1.1 Cc1ccc(OC\C=C/Cl)cc1 Amb28365557 [0,2,0,0,0,0|1,0,0]=3 4163 B12R1.1 Cc1ccc(SCCC=O)cc1 Amb17082944 [0,2,0,0,0,0|1,0,1]=4 4164 B12R1.1 Cc1ccc(SCNC=O)cc1 Amb28368453 [0,2,0,0,0,0|2,0,0]=4 4165 B12R1.1 Cc1ccc(SC\C=C\Cl)cc1 Amb27762218 [0,2,0,0,0,0|1,0,0]=3 4166 B12R1.1 Cl\C=C\CNc1ccc(I)cc1 Amb28123810 [0,2,0,0,0,0|0,0,0]=2 4167 B12R1.1 Cl\C=C\COc1ccc(Cl)cc1 Amb6334883 [0,2,0,0,0,0|1,0,0]=3 4168 B12R1.1 Fc1ccc(NCCCCl)cc1 Amb28121086 [0,2,0,0,0,0|0,0,2]=4 4169 B12R1.1 Fc1ccc(NC\C=C\Cl)cc1 Amb27635095 [0,2,0,0,0,0|0,0,0]=2 4170 B12R1.1 Fc1ccc(OC\C=C\Cl)cc1 Amb27229704 [0,2,0,0,0,0|1,0,0]=3 4171 B12R1.1 N#CCCNc1ccc(Br)cc1 Amb1149927 [0,2,0,0,0,0|0,0,2]=4 4172 B12R1.1 N#CCCNc1ccc(Cl)cc1 Amb1647287 [0,2,0,0,0,0|0,0,2]=4 4173 B12R1.1 N#CCCNc1ccc(F)cc1 Amb1103894 [0,2,0,0,0,0|0,0,2]=4 4174 B12R1.1 N#CCCNc1ccc(I)cc1 Amb9202490 [0,2,0,0,0,0|0,0,2]=4 4175 B12R1.1 N#CCNCc1ccc(Cl)cc1 Amb29844620 [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.1 N#CCNCc1ccc(Cl)cc1 Amb6738095 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.1 N#CCNCc1ccc(F)cc1 Amb2416263 [0,2,0,0,0,0|1,0,1]=4 4178 B12R1.1 N#C\C=N\Nc1ccc(Br)cc1 Amb27981516 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.1 N#C\C=N\Nc1ccc(Cl)cc1 Amb27774694 [0,2,0,0,0,0|1,0,1]=4 4180 B12R1.1 N#C\C=N\Nc1ccc(F)cc1 Amb27178749 [0,2,0,0,0,0|1,0,1]=4 4181 B12R1.1 NCCCNc1ccc(Br)cc1 Amb17057730 [0,2,0,0,0,0|0,0,2]=4 4182 B12R1.1 NCCCNc1ccc(Cl)cc1 Amb17057729 [0,2,0,0,0,0|0,0,2]=4 4183 B12R1.1 NCCCNc1ccc(F)cc1 Amb17057726 [0,2,0,0,0,0|0,0,2]=4 4184 B12R1.1 NCCCNc1ccc(F)cc1 Amb32718813 [0,2,0,0,0,0|0,0,2]=4 4185 B12R1.1 NCCCNc1ccc(O)cc1 Amb27792819 [0,2,0,0,0,0|0,0,2]=4 4186 B12R1.1 NCCNCc1ccc(Br)cc1 Amb19012729 [0,2,0,0,0,0|1,0,1]=4 4187 B12R1.1 NCCNCc1ccc(Cl)cc1 Amb10075508 [0,2,0,0,0,0|1,0,1]=4 4188 B12R1.1 NCCNCc1ccc(Cl)cc1 Amb29844474 [0,2,0,0,0,0|1,0,1]=4 4189 B12R1.1 NCCNCc1ccc(F)cc1 Amb10075507 [0,2,0,0,0,0|1,0,1]=4 4190 B12R1.1 NCCNCc1ccc(F)cc1 Amb29844476 [0,2,0,0,0,0|1,0,1]=4 4191 B12R1.1 Nc1ccc(CNCCO)cc1 Amb34915874 [0,2,0,0,0,0|1,0,1]=4 4192 B12R1.1 O=CCCCc1ccc(Br)cc1 Amb17089176 [0,2,0,0,0,0|1,0,1]=4 4193 B12R1.1 O=CCCCc1ccc(Cl)cc1 Amb17089175 [0,2,0,0,0,0|1,0,1]=4 4194 B12R1.1 O=CCCCc1ccc(F)cc1 Amb17089174 [0,2,0,0,0,0|1,0,1]=4 4195 B12R1.1 O=CCCCc1ccc(O)cc1 Amb33359533 [0,2,0,0,0,0|1,0,1]=4 4196 B12R1.1 O=CCCOc1ccc(Cl)cc1 Amb5731776 [0,2,0,0,0,0|1,0,1]=4 4197 B12R1.1 O=CCCOc1ccc(F)cc1 Amb5731762 [0,2,0,0,0,0|1,0,1]=4 4198 B12R1.1 O=CCCSc1ccc(Br)cc1 Amb17082947 [0,2,0,0,0,0|1,0,1]=4 4199 B12R1.1 O=CCCSc1ccc(Cl)cc1 Amb17082946 [0,2,0,0,0,0|1,0,1]=4 4200 B12R1.1 O=CCCSc1ccc(F)cc1 Amb17082945 [0,2,0,0,0,0|1,0,1]=4 4201 B12R1.1 O=CCSCc1ccc(Cl)cc1 Amb32683088 [0,2,0,0,0,0|2,0,0]=4 4202 B12R1.1 O=CC\C=C\c1ccc(F)cc1 Amb33203072 [0,2,0,0,0,0|2,0,0]=4 4203 B12R1.1 O=CNCCc1ccc(Br)cc1 Amb28366607 [0,2,0,0,0,0|2,0,0]=4 4204 B12R1.1 O=CNCCc1ccc(F)cc1 Amb27267670 [0,2,0,0,0,0|2,0,0]=4 4205 B12R1.1 O=CNCCc1ccc(O)cc1 Amb8399387 [0,2,0,0,0,0|2,0,0]=4 4206 B12R1.1 O=C\C=C\Nc1ccc(Cl)cc1 Amb18648566 [0,2,0,0,0,0|0,0,1]=3 4207 B12R1.1 OCCCNc1ccc(Br)cc1 Amb17306798 [0,2,0,0,0,0|0,0,2]=4 4208 B12R1.1 OCCCNc1ccc(Cl)cc1 Amb17307252 [0,2,0,0,0,0|0,0,2]=4 4209 B12R1.1 OCCCNc1ccc(F)cc1 Amb17306196 [0,2,0,0,0,0|0,0,2]=4 4210 B12R1.1 OCCCNc1ccc(I)cc1 Amb17306250 [0,2,0,0,0,0|0,0,2]=4 4211 B12R1.1 OCCNCc1ccc(Br)cc1 Amb6857145 [0,2,0,0,0,0|1,0,1]=4 4212 B12R1.1 OCCNCc1ccc(Br)cc1 Amb8598766 [0,2,0,0,0,0|1,0,1]=4 4213 B12R1.1 OCCNCc1ccc(Cl)cc1 Amb6383150 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.1 OCCNCc1ccc(Cl)cc1 Amb837738 [0,2,0,0,0,0|1,0,1]=4 4215 B12R1.1 OCCNCc1ccc(F)cc1 Amb5837372 [0,2,0,0,0,0|1,0,1]=4 4216 B12R1.1 OCCNCc1ccc(F)cc1 Amb838081 [0,2,0,0,0,0|1,0,1]=4 4217 B12R1.1 OCCNCc1ccc(O)cc1 Amb7757010 [0,2,0,0,0,0|1,0,1]=4 4218 B12R1.16 C=CCC(=O)c1ccc(Br)cc1 Amb17343203 [0,2,0,0,0,0|1,0,0]=3 4219 B12R1.16 C=CCC(=O)c1ccc(C)cc1 Amb10563159 [0,2,0,0,0,0|1,0,0]=3 4220 B12R1.16 C=CCC(=O)c1ccc(Cl)cc1 Amb17335459 [0,2,0,0,0,0|1,0,0]=3 4221 B12R1.16 C=CCC(=O)c1ccc(F)cc1 Amb17334601 [0,2,0,0,0,0|1,0,0]=3 4222 B12R1.16 C=CCC(=O)c1ccc(I)cc1 Amb27171953 [0,2,0,0,0,0|1,0,0]=3 4223 B12R1.16 C=CCC(=O)c1ccc(O)cc1 Amb17334557 [0,2,0,0,0,0|1,0,0]=3 4224 B12R1.16 C=CCC(C)c1ccc(C)cc1 Amb24556400 [0,2,0,0,0,0|1,0,0]=3 4225 B12R1.16 C=CCC(C)c1ccc(O)cc1 Amb27614507 [0,2,0,0,0,0|1,0,0]=3 4226 B12R1.16 C=CCC(N)c1ccc(Br)nc1 Amb28383420 [0,2,0,0,0,0|2,0,0]=4 4227 B12R1.16 C=CCC(N)c1ccc(C)nc1 Amb28423441 [0,2,0,0,0,0|2,0,0]=4 4228 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,2,0,0,0,0|1,0,0]=3 4229 B12R1.16 C=CCC(N)c1ccc(I)cc1 Amb27229949 [0,2,0,0,0,0|1,0,0]=3 4230 B12R1.16 C=CCC(N)c1ccc(I)cn1 Amb27770059 [0,2,0,0,0,0|2,0,0]=4 4231 B12R1.16 C=CCC(N)c1ccc(I)nc1 Amb28123440 [0,2,0,0,0,0|2,0,0]=4 4232 B12R1.16 C=CCC(N)c1ccc(O)cn1 Amb28046474 [0,2,0,0,0,0|2,0,0]=4 4233 B12R1.16 C=CCC(O)c1ccc(Br)cc1 Amb2685397 [0,2,0,0,0,0|1,0,0]=3 4234 B12R1.16 C=CCC(O)c1ccc(C)cc1 Amb18177785 [0,2,0,0,0,0|1,0,0]=3 4235 B12R1.16 C=CCC(O)c1ccc(Cl)cc1 Amb2686332 [0,2,0,0,0,0|1,0,0]=3 4236 B12R1.16 C=CCC(O)c1ccc(Cl)cn1 Amb28247815 [0,2,0,0,0,0|2,0,0]=4 4237 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,2,0,0,0,0|1,0,0]=3 4238 B12R1.16 C=CCC(O)c1ccc(F)cn1 Amb27203237 [0,2,0,0,0,0|2,0,0]=4 4239 B12R1.16 C=CCC(O)c1ccc(N)cc1 Amb27955305 [0,2,0,0,0,0|1,0,0]=3 4240 B12R1.16 C=CCC(O)c1ccc(N)cn1 Amb35622099 [0,2,0,0,0,0|2,0,0]=4 4241 B12R1.16 C=CCN(C)c1ccc(C)cc1 Amb28064452 [0,2,0,0,0,0|0,0,0]=2 4242 B12R1.16 C=CCN(C)c1ccc(Cl)nn1 Amb35677334 [0,2,0,0,0,0|2,0,0]=4 4243 B12R1.16 C=CCN(C)c1ccc(N)cc1 Amb27434700 [0,2,0,0,0,0|0,0,0]=2 4244 B12R1.16 C=CCN(C)c1ccc(N)cn1 Amb28201303 [0,2,0,0,0,0|1,0,0]=3 4245 B12R1.16 C=CCN(C)c1ccc(N)nc1 Amb24524848 [0,2,0,0,0,0|1,0,0]=3 4246 B12R1.16 C=CCN(C)c1ccc(N)nn1 Amb27631205 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.16 C=CCN(C)c1cnc(Br)cn1 Amb35677337 [0,2,0,0,0,0|2,0,0]=4 4248 B12R1.16 C=CCN(C)c1cnc(Cl)cn1 Amb35610897 [0,2,0,0,0,0|2,0,0]=4 4249 B12R1.16 C=CCN(C)c1cnc(N)cn1 Amb27395589 [0,2,0,0,0,0|2,0,0]=4 4250 B12R1.16 C=CCN(C)c1ncc(Br)cn1 Amb27176199 [0,2,0,0,0,0|2,0,0]=4 4251 B12R1.16 C=CCN(C)c1ncc(Cl)cn1 Amb27219997 [0,2,0,0,0,0|2,0,0]=4 4252 B12R1.16 C=CCN(C)c1ncc(I)cn1 Amb27753364 [0,2,0,0,0,0|2,0,0]=4 4253 B12R1.16 C=CCN(C)c1ncc(N)cn1 Amb27771095 [0,2,0,0,0,0|2,0,0]=4 4254 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,2,0,0,0,0|1,0,0]=3 4255 B12R1.16 C=CC[C@@H](N)c1ccc(Br)nc1 Amb27209540 [0,2,0,0,0,0|2,0,0]=4 4256 B12R1.16 C=CC[C@@H](N)c1ccc(C)cc1 Amb27468576 [0,2,0,0,0,0|1,0,0]=3 4257 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)nc1 Amb27202755 [0,2,0,0,0,0|2,0,0]=4 4258 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,2,0,0,0,0|1,0,0]=3 4259 B12R1.16 C=CC[C@@H](N)c1ccc(F)cn1 Amb27173653 [0,2,0,0,0,0|2,0,0]=4 4260 B12R1.16 C=CC[C@@H](N)c1ccc(I)cn1 Amb27462214 [0,2,0,0,0,0|2,0,0]=4 4261 B12R1.16 C=CC[C@@H](N)c1ccc(N)cc1 Amb27468664 [0,2,0,0,0,0|1,0,0]=3 4262 B12R1.16 C=CC[C@@H](O)c1ccc(Br)cc1 Amb28457059 [0,2,0,0,0,0|1,0,0]=3 4263 B12R1.16 C=CC[C@@H](O)c1ccc(C)cc1 Amb28142668 [0,2,0,0,0,0|1,0,0]=3 4264 B12R1.16 C=CC[C@@H](O)c1ccc(Cl)cc1 Amb27193055 [0,2,0,0,0,0|1,0,0]=3 4265 B12R1.16 C=CC[C@@H](O)c1ccc(F)cc1 Amb28255493 [0,2,0,0,0,0|1,0,0]=3 4266 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cn1 Amb28043088 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.16 C=CC[C@H](N)c1ccc(F)cc1 Amb26841094 [0,2,0,0,0,0|1,0,0]=3 4268 B12R1.16 C=CC[C@H](N)c1ccc(F)cn1 Amb27975691 [0,2,0,0,0,0|2,0,0]=4 4269 B12R1.16 C=CC[C@H](N)c1ccc(F)nc1 Amb27815100 [0,2,0,0,0,0|2,0,0]=4 4270 B12R1.16 C=CC[C@H](N)c1ccc(N)cc1 Amb27639872 [0,2,0,0,0,0|1,0,0]=3 4271 B12R1.16 C=CC[C@H](N)c1ccc(N)nc1 Amb27810858 [0,2,0,0,0,0|2,0,0]=4 4272 B12R1.16 C=CC[C@H](N)c1ccc(S)cc1 Amb27461406 [0,2,0,0,0,0|1,0,0]=3 4273 B12R1.16 C=CC[C@H](O)c1ccc(C)cc1 Amb8392357 [0,2,0,0,0,0|1,0,0]=3 4274 B12R1.16 C=CC[C@H](O)c1ccc(F)cc1 Amb8392359 [0,2,0,0,0,0|1,0,0]=3 4275 B12R1.16 C=COC(=O)c1ccc(O)cc1 Amb18645955 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.16 CC(CC=O)c1ccc(F)cc1 Amb27827352 [0,2,0,0,0,0|2,0,0]=4 4277 B12R1.16 CC(CC=O)c1ccc(I)cc1 Amb27416593 [0,2,0,0,0,0|2,0,0]=4 4278 B12R1.16 CCCN(C)c1ccc(Cl)cc1 Amb27804750 [0,2,0,0,0,0|0,0,2]=4 4279 B12R1.16 CCCN(C)c1ccc(F)cc1 Amb27653560 [0,2,0,0,0,0|0,0,2]=4 4280 B12R1.16 CCCN(C)c1ccc(O)cc1 Amb28064673 [0,2,0,0,0,0|0,0,2]=4 4281 B12R1.16 CN(CC#N)c1ccc(Br)cc1 Amb17343205 [0,2,0,0,0,0|1,0,1]=4 4282 B12R1.16 CN(CC#N)c1ccc(Cl)cc1 Amb17335465 [0,2,0,0,0,0|1,0,1]=4 4283 B12R1.16 CN(CC#N)c1ccc(F)cc1 Amb17334603 [0,2,0,0,0,0|1,0,1]=4 4284 B12R1.16 CN(CC#N)c1ccc(O)cc1 Amb5781400 [0,2,0,0,0,0|1,0,1]=4 4285 B12R1.16 CN(CCCl)c1ccc(Br)cc1 Amb17351918 [0,2,0,0,0,0|1,0,1]=4 4286 B12R1.16 CN(CCCl)c1ccc(Cl)cc1 Amb17338057 [0,2,0,0,0,0|1,0,1]=4 4287 B12R1.16 CN(CCCl)c1ccc(F)cc1 Amb17335952 [0,2,0,0,0,0|1,0,1]=4 4288 B12R1.16 CN(CCCl)c1ccc(N)cc1 Amb27592197 [0,2,0,0,0,0|1,0,1]=4 4289 B12R1.16 CN(CCF)c1ccc(F)cc1 Amb28185618 [0,2,0,0,0,0|1,0,1]=4 4290 B12R1.16 CN(CCN)c1ccc(Br)cc1 Amb17059648 [0,2,0,0,0,0|1,0,1]=4 4291 B12R1.16 CN(CCN)c1ccc(Cl)cc1 Amb17059647 [0,2,0,0,0,0|1,0,1]=4 4292 B12R1.16 CN(CCN)c1ccc(F)cc1 Amb17059644 [0,2,0,0,0,0|1,0,1]=4 4293 B12R1.16 CN(CCN)c1ccc(I)cc1 Amb27762292 [0,2,0,0,0,0|1,0,1]=4 4294 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,2,0,0,0,0|1,0,1]=4 4295 B12R1.16 CN(CCO)c1ccc(Br)cc1 Amb17344450 [0,2,0,0,0,0|1,0,1]=4 4296 B12R1.16 CN(CCO)c1ccc(Cl)cc1 Amb17335812 [0,2,0,0,0,0|1,0,1]=4 4297 B12R1.16 CN(CCO)c1ccc(F)cc1 Amb17334764 [0,2,0,0,0,0|1,0,1]=4 4298 B12R1.16 CN(CCO)c1ccc(N)cc1 Amb7765984 [0,2,0,0,0,0|1,0,1]=4 4299 B12R1.16 Cc1ccc(C(=O)CC=O)cc1 Amb9204941 [0,2,0,0,0,0|2,0,0]=4 4300 B12R1.16 Cc1ccc(C(C)CC=O)cc1 Amb18645706 [0,2,0,0,0,0|2,0,0]=4 4301 B12R1.16 Cc1ccc(N(C)CC#N)cc1 Amb17334503 [0,2,0,0,0,0|1,0,1]=4 4302 B12R1.16 Cc1ccc(N(C)CCCl)cc1 Amb17335672 [0,2,0,0,0,0|1,0,1]=4 4303 B12R1.16 Cc1ccc(N(C)CCN)cc1 Amb13893182 [0,2,0,0,0,0|1,0,1]=4 4304 B12R1.16 Cc1ccc(N(C)CCO)cc1 Amb17334645 [0,2,0,0,0,0|1,0,1]=4 4305 B12R1.16 O=CCC(=O)c1ccc(Br)cc1 Amb9204942 [0,2,0,0,0,0|2,0,0]=4 4306 B12R1.16 O=CCC(=O)c1ccc(Cl)cc1 Amb5717711 [0,2,0,0,0,0|2,0,0]=4 4307 B12R1.16 O=CCC(=O)c1ccc(F)cc1 Amb9204897 [0,2,0,0,0,0|2,0,0]=4 4308 B12R1.16 O=CCC(=O)c1ccc(I)cc1 Amb24748951 [0,2,0,0,0,0|2,0,0]=4 4309 B12R1.16 O=CCC(=O)c1ccc(O)cc1 Amb27168149 [0,2,0,0,0,0|2,0,0]=4 4310 B12R1.16 O=CCC(=S)c1ccc(Cl)cc1 Amb27268390 [0,2,0,0,0,0|2,0,0]=4 4311 B12R1.16 O=CCC(O)c1ccc(I)cc1 Amb27954814 [0,2,0,0,0,0|2,0,0]=4 4312 B12R1.16 O=CCS(=O)c1ccc(Br)cc1 Amb28366521 [0,2,0,0,0,0|2,0,0]=4 4313 B12R1.16 O=CCS(=O)c1ccc(F)cc1 Amb27641790 [0,2,0,0,0,0|2,0,0]=4 4314 B12R1.16 O=CC[C@@H](O)c1ccc(Cl)cc1 Amb27770788 [0,2,0,0,0,0|2,0,0]=4 4315 B12R1.21 C=C(Br)CNc1ccc(Br)cn1 Amb23666556 [0,2,0,0,0,0|1,0,0]=3 4316 B12R1.21 C=C(Br)CNc1ccc(C)nn1 Amb28320639 [0,2,0,0,0,0|2,0,0]=4 4317 B12R1.21 C=C(Br)CNc1ccc(Cl)nn1 Amb28385233 [0,2,0,0,0,0|2,0,0]=4 4318 B12R1.21 C=C(Br)CNc1ccc(N)nn1 Amb27440761 [0,2,0,0,0,0|2,0,0]=4 4319 B12R1.21 C=C(Br)CNc1ncc(Cl)cn1 Amb28127125 [0,2,0,0,0,0|2,0,0]=4 4320 B12R1.21 C=C(Br)CNc1ncc(N)cn1 Amb27476710 [0,2,0,0,0,0|2,0,0]=4 4321 B12R1.21 C=C(Br)COc1ccc(Br)nc1 Amb28324665 [0,2,0,0,0,0|2,0,0]=4 4322 B12R1.21 C=C(Br)COc1ccc(C)cc1 Amb27436097 [0,2,0,0,0,0|1,0,0]=3 4323 B12R1.21 C=C(Br)COc1ccc(C)cn1 Amb28316256 [0,2,0,0,0,0|2,0,0]=4 4324 B12R1.21 C=C(Br)COc1ccc(Cl)nc1 Amb27413398 [0,2,0,0,0,0|2,0,0]=4 4325 B12R1.21 C=C(Br)COc1ccc(I)cc1 Amb27601637 [0,2,0,0,0,0|1,0,0]=3 4326 B12R1.21 C=C(Br)COc1ccc(I)nc1 Amb27218857 [0,2,0,0,0,0|2,0,0]=4 4327 B12R1.21 C=C(Br)COc1ccc(N)cc1 Amb18971535 [0,2,0,0,0,0|1,0,0]=3 4328 B12R1.21 C=C(Br)CSc1ccc(N)cn1 Amb18969576 [0,2,0,0,0,0|2,0,0]=4 4329 B12R1.21 C=C(Br)CSc1ccc(N)nc1 Amb18969577 [0,2,0,0,0,0|2,0,0]=4 4330 B12R1.21 C=C(C)CCN1C=CC(=O)C=C1 Amb27840572 [0,2,0,0,0,0|2,0,0]=4 4331 B12R1.21 C=C(C)CNc1ccc(Br)cc1 Amb17306797 [0,2,0,0,0,0|0,0,0]=2 4332 B12R1.21 C=C(C)CNc1ccc(C)cn1 Amb27975064 [0,2,0,0,0,0|1,0,0]=3 4333 B12R1.21 C=C(C)CNc1ccc(Cl)cc1 Amb17307251 [0,2,0,0,0,0|0,0,0]=2 4334 B12R1.21 C=C(C)CNc1ccc(N)cc1 Amb27831320 [0,2,0,0,0,0|0,0,0]=2 4335 B12R1.21 C=C(C)CNc1ccc(N)cn1 Amb27392928 [0,2,0,0,0,0|1,0,0]=3 4336 B12R1.21 C=C(C)CNc1ccc(N)nc1 Amb27840769 [0,2,0,0,0,0|1,0,0]=3 4337 B12R1.21 C=C(C)CNc1ccc(O)cc1 Amb27200322 [0,2,0,0,0,0|0,0,0]=2 4338 B12R1.21 C=C(C)CNc1cnc(Cl)cn1 Amb27877147 [0,2,0,0,0,0|2,0,0]=4 4339 B12R1.21 C=C(C)CNc1cnc(N)cn1 Amb27840764 [0,2,0,0,0,0|2,0,0]=4 4340 B12R1.21 C=C(C)CNc1ncc(F)cn1 Amb27859917 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.21 C=C(C)COc1ccc(Br)cc1 Amb6268759 [0,2,0,0,0,0|1,0,0]=3 4342 B12R1.21 C=C(C)COc1ccc(Br)nc1 Amb27432779 [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.21 C=C(C)COc1ccc(C)cc1 Amb27662937 [0,2,0,0,0,0|1,0,0]=3 4344 B12R1.21 C=C(C)COc1ccc(F)cc1 Amb2444928 [0,2,0,0,0,0|1,0,0]=3 4345 B12R1.21 C=C(C)COc1ccc(N)cc1 Amb2081541 [0,2,0,0,0,0|1,0,0]=3 4346 B12R1.21 C=C(C)COc1ccc(N)cc1 Amb9172210 [0,2,0,0,0,0|1,0,0]=3 4347 B12R1.21 C=C(C)COc1ccc(O)cc1 Amb8837285 [0,2,0,0,0,0|1,0,0]=3 4348 B12R1.21 C=C(C)CSc1ccc(Br)cn1 Amb27484259 [0,2,0,0,0,0|2,0,0]=4 4349 B12R1.21 C=C(C)CSc1ccc(N)nc1 Amb8933254 [0,2,0,0,0,0|2,0,0]=4 4350 B12R1.21 C=C(Cl)CNc1ccc(Cl)nn1 Amb27640893 [0,2,0,0,0,0|2,0,0]=4 4351 B12R1.21 C=C(Cl)CNc1ccc(I)cc1 Amb28410889 [0,2,0,0,0,0|0,0,0]=2 4352 B12R1.21 C=C(Cl)CNc1ccc(N)nc1 Amb27645076 [0,2,0,0,0,0|1,0,0]=3 4353 B12R1.21 C=C(Cl)CNc1ncc(C)cn1 Amb27806523 [0,2,0,0,0,0|2,0,0]=4 4354 B12R1.21 C=C(Cl)COc1ccc(Br)cc1 Amb6265854 [0,2,0,0,0,0|1,0,0]=3 4355 B12R1.21 C=C(Cl)COc1ccc(F)nc1 Amb28399834 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.21 C=C(Cl)COc1ccc(I)cc1 Amb27806181 [0,2,0,0,0,0|1,0,0]=3 4357 B12R1.21 C=C(Cl)COc1ccc(I)nc1 Amb27403948 [0,2,0,0,0,0|2,0,0]=4 4358 B12R1.21 C=C(Cl)COc1ccc(O)cc1 Amb8837283 [0,2,0,0,0,0|1,0,0]=3 4359 B12R1.21 C=C(Cl)CSc1ccc(C)cc1 Amb27589714 [0,2,0,0,0,0|1,0,0]=3 4360 B12R1.21 C=C(F)COc1ccc(Br)cc1 Amb23570540 [0,2,0,0,0,0|1,0,0]=3 4361 B12R1.21 C=C(F)COc1ccc(N)cn1 Amb23570553 [0,2,0,0,0,0|2,0,0]=4 4362 B12R1.21 CC(=O)CCc1ccc(Br)cc1 Amb5740059 [0,2,0,0,0,0|1,0,1]=4 4363 B12R1.21 CC(=O)CCc1ccc(C)cc1 Amb5740050 [0,2,0,0,0,0|1,0,1]=4 4364 B12R1.21 CC(=O)CCc1ccc(Cl)cc1 Amb5740058 [0,2,0,0,0,0|1,0,1]=4 4365 B12R1.21 CC(=O)CCc1ccc(F)cc1 Amb5740057 [0,2,0,0,0,0|1,0,1]=4 4366 B12R1.21 CC(=O)CCc1ccc(I)cc1 Amb26325783 [0,2,0,0,0,0|1,0,1]=4 4367 B12R1.21 CC(=O)CCc1ccc(N)cc1 Amb27637738 [0,2,0,0,0,0|1,0,1]=4 4368 B12R1.21 CC(=O)CCc1ccc(O)cc1 Amb533055 [0,2,0,0,0,0|1,0,1]=4 4369 B12R1.21 CC(=O)COc1ccc(Cl)cc1 Amb1094739 [0,2,0,0,0,0|1,0,1]=4 4370 B12R1.21 CC(=O)COc1ccc(F)cc1 Amb9269853 [0,2,0,0,0,0|1,0,1]=4 4371 B12R1.21 CC(=O)COc1ccc(I)cc1 Amb26363908 [0,2,0,0,0,0|1,0,1]=4 4372 B12R1.21 CC(=O)COc1ccc(N)cc1 Amb17110083 [0,2,0,0,0,0|1,0,1]=4 4373 B12R1.21 CC(=O)CSc1ccc(Br)cc1 Amb2608948 [0,2,0,0,0,0|1,0,1]=4 4374 B12R1.21 CC(=O)CSc1ccc(C)cc1 Amb2725052 [0,2,0,0,0,0|1,0,1]=4 4375 B12R1.21 CC(=O)CSc1ccc(Cl)cc1 Amb2686419 [0,2,0,0,0,0|1,0,1]=4 4376 B12R1.21 CC(=O)CSc1ccc(F)cc1 Amb3429089 [0,2,0,0,0,0|1,0,1]=4 4377 B12R1.21 CC(=O)CSc1ccc(N)cc1 Amb28255271 [0,2,0,0,0,0|1,0,1]=4 4378 B12R1.21 CC(=O)NNc1ccc(Br)cc1 Amb1040272 [0,2,0,0,0,0|1,0,1]=4 4379 B12R1.21 CC(=O)NNc1ccc(F)cc1 Amb4362485 [0,2,0,0,0,0|1,0,1]=4 4380 B12R1.21 CC(=O)NNc1ccc(I)cc1 Amb4362486 [0,2,0,0,0,0|1,0,1]=4 4381 B12R1.21 CC(C)=NNc1ccc(Cl)cc1 Amb27853679 [0,2,0,0,0,0|1,0,1]=4 4382 B12R1.21 CC(C)=NNc1ccc(F)cc1 Amb25126734 [0,2,0,0,0,0|1,0,1]=4 4383 B12R1.21 CC(C)CNc1ccc(Br)cc1 Amb6696487 [0,2,0,0,0,0|0,0,2]=4 4384 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb20669276 [0,2,0,0,0,0|0,0,2]=4 4385 B12R1.21 CC(C)CNc1ccc(Cl)cc1 Amb6695926 [0,2,0,0,0,0|0,0,2]=4 4386 B12R1.21 CC(C)CNc1ccc(F)cc1 Amb6696720 [0,2,0,0,0,0|0,0,2]=4 4387 B12R1.21 CC(C)CNc1ccc(I)cc1 Amb7785056 [0,2,0,0,0,0|0,0,2]=4 4388 B12R1.21 CC(C)CNc1ccc(N)cc1 Amb9205219 [0,2,0,0,0,0|0,0,2]=4 4389 B12R1.21 CC(N)CNc1ccc(Br)cc1 Amb27755338 [0,2,0,0,0,0|0,0,2]=4 4390 B12R1.21 CC(N)CNc1ccc(Cl)cc1 Amb25962673 [0,2,0,0,0,0|0,0,2]=4 4391 B12R1.21 CC(N)CNc1ccc(F)cc1 Amb25237265 [0,2,0,0,0,0|0,0,2]=4 4392 B12R1.21 CC(O)CNc1ccc(Br)cc1 Amb17142609 [0,2,0,0,0,0|0,0,2]=4 4393 B12R1.21 CC(O)CNc1ccc(Cl)cc1 Amb17139127 [0,2,0,0,0,0|0,0,2]=4 4394 B12R1.21 CC(O)CNc1ccc(F)cc1 Amb17138651 [0,2,0,0,0,0|0,0,2]=4 4395 B12R1.21 CC(O)CNc1ccc(I)cc1 Amb28044330 [0,2,0,0,0,0|0,0,2]=4 4396 B12R1.21 C[C@@H](O)CNc1ccc(Br)cc1 Amb28244267 [0,2,0,0,0,0|0,0,2]=4 4397 B12R1.21 C[C@@H](O)CNc1ccc(Cl)cc1 Amb27490489 [0,2,0,0,0,0|0,0,2]=4 4398 B12R1.21 C[C@@H](O)CNc1ccc(I)cc1 Amb27478276 [0,2,0,0,0,0|0,0,2]=4 4399 B12R1.21 C[C@H](O)CNc1ccc(Cl)cc1 Amb27658434 [0,2,0,0,0,0|0,0,2]=4 4400 B12R1.21 C[C@H](O)CNc1ccc(I)cc1 Amb27603771 [0,2,0,0,0,0|0,0,2]=4 4401 B12R1.21 Cc1ccc(CCC(=N)N)cc1 Amb18065466 [0,2,0,0,0,0|2,0,0]=4 4402 B12R1.21 Cc1ccc(CCC(=O)Cl)cc1 Amb17142993 [0,2,0,0,0,0|2,0,0]=4 4403 B12R1.21 Cc1ccc(CCC(=O)O)cc1 Amb1225383 [0,2,0,0,0,0|2,0,0]=4 4404 B12R1.21 Cc1ccc(CCC(N)=O)cc1 Amb8998651 [0,2,0,0,0,0|2,0,0]=4 4405 B12R1.21 Cc1ccc(NCC(=O)Cl)cc1 Amb27425242 [0,2,0,0,0,0|1,0,0]=3 4406 B12R1.21 Cc1ccc(NCC(=O)O)cc1 Amb1106469 [0,2,0,0,0,0|1,0,0]=3 4407 B12R1.21 Cc1ccc(NCC(C)C)cc1 Amb32663758 [0,2,0,0,0,0|0,0,2]=4 4408 B12R1.21 Cc1ccc(NCC(C)C)cc1 Amb6700775 [0,2,0,0,0,0|0,0,2]=4 4409 B12R1.21 Cc1ccc(NCC(C)N)cc1 Amb22410806 [0,2,0,0,0,0|0,0,2]=4 4410 B12R1.21 Cc1ccc(NCC(C)O)cc1 Amb17138594 [0,2,0,0,0,0|0,0,2]=4 4411 B12R1.21 Cc1ccc(NCC(F)F)cc1 Amb16229928 [0,2,0,0,0,0|1,0,1]=4 4412 B12R1.21 Cc1ccc(NCC(N)=O)cc1 Amb845278 [0,2,0,0,0,0|1,0,0]=3 4413 B12R1.21 Cc1ccc(NCC(N)=S)cc1 Amb17233761 [0,2,0,0,0,0|1,0,0]=3 4414 B12R1.21 Cc1ccc(NCC(O)O)cc1 Amb28385053 [0,2,0,0,0,0|1,0,1]=4 4415 B12R1.21 Cc1ccc(NC[C@H](C)O)cc1 Amb28342717 [0,2,0,0,0,0|0,0,2]=4 4416 B12R1.21 Cc1ccc(NNC(=N)N)cc1 Amb27607117 [0,2,0,0,0,0|2,0,0]=4 4417 B12R1.21 Cc1ccc(NNC(N)=O)cc1 Amb24585130 [0,2,0,0,0,0|2,0,0]=4 4418 B12R1.21 Cc1ccc(NNC(N)=S)cc1 Amb3427739 [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.21 Cc1ccc(OCC(=O)Cl)cc1 Amb10880011 [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.21 Cc1ccc(OCC(=O)O)cc1 Amb6336447 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.21 Cc1ccc(OCC(N)=O)cc1 Amb6346004 [0,2,0,0,0,0|2,0,0]=4 4422 B12R1.21 Cc1ccc(OCC(N)=S)cc1 Amb5542109 [0,2,0,0,0,0|2,0,0]=4 4423 B12R1.21 Cc1ccc(SCC(=N)N)cc1 Amb6678204 [0,2,0,0,0,0|2,0,0]=4 4424 B12R1.21 Cc1ccc(SCC(=O)O)cc1 Amb1197696 [0,2,0,0,0,0|2,0,0]=4 4425 B12R1.21 Cc1ccc(SCC(N)=O)cc1 Amb3836116 [0,2,0,0,0,0|2,0,0]=4 4426 B12R1.21 Fc1ccc(NCC(F)F)cc1 Amb18795535 [0,2,0,0,0,0|1,0,1]=4 4427 B12R1.21 N=C(N)CCc1ccc(Br)cc1 Amb18571448 [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.21 N=C(N)CCc1ccc(Cl)cc1 Amb18564231 [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.21 N=C(N)CCc1ccc(Cl)cc1 Amb33465354 [0,2,0,0,0,0|2,0,0]=4 4430 B12R1.21 N=C(N)CCc1ccc(F)cc1 Amb18563719 [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.21 N=C(N)CCc1ccc(O)cc1 Amb13883011 [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.21 N=C(N)CCc1ccc(O)cc1 Amb2696225 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.21 N=C(N)COc1ccc(Br)cc1 Amb6260282 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.21 N=C(N)COc1ccc(Br)cc1 Amb8626962 [0,2,0,0,0,0|2,0,0]=4 4435 B12R1.21 N=C(N)COc1ccc(Cl)cc1 Amb2697781 [0,2,0,0,0,0|2,0,0]=4 4436 B12R1.21 N=C(N)COc1ccc(Cl)cc1 Amb6259791 [0,2,0,0,0,0|2,0,0]=4 4437 B12R1.21 N=C(N)COc1ccc(F)cc1 Amb19894602 [0,2,0,0,0,0|2,0,0]=4 4438 B12R1.21 N=C(N)COc1ccc(F)cc1 Amb6268607 [0,2,0,0,0,0|2,0,0]=4 4439 B12R1.21 N=C(N)COc1ccc(N)cc1 Amb27810600 [0,2,0,0,0,0|2,0,0]=4 4440 B12R1.21 N=C(N)CSc1ccc(Cl)cc1 Amb2772772 [0,2,0,0,0,0|2,0,0]=4 4441 B12R1.21 N=C(N)NNc1ccc(Br)cc1 Amb27187873 [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.21 NC(=O)CCc1ccc(Br)cc1 Amb17407065 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.21 NC(=O)CCc1ccc(Cl)cc1 Amb17142998 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.21 NC(=O)CCc1ccc(F)cc1 Amb33545740 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.21 NC(=O)CCc1ccc(N)cc1 Amb8941624 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.21 NC(=O)CCc1ccc(O)cc1 Amb3939533 [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.21 NC(=O)CNc1ccc(Br)cc1 Amb6712185 [0,2,0,0,0,0|1,0,0]=3 4448 B12R1.21 NC(=O)CNc1ccc(Cl)cc1 Amb6711941 [0,2,0,0,0,0|1,0,0]=3 4449 B12R1.21 NC(=O)CNc1ccc(F)cc1 Amb6712287 [0,2,0,0,0,0|1,0,0]=3 4450 B12R1.21 NC(=O)CNc1ccc(I)cc1 Amb7758090 [0,2,0,0,0,0|1,0,0]=3 4451 B12R1.21 NC(=O)CNc1ccc(N)nc1 Amb7767532 [0,2,0,0,0,0|2,0,0]=4 4452 B12R1.21 NC(=O)CNc1ccc(O)cc1 Amb27814221 [0,2,0,0,0,0|1,0,0]=3 4453 B12R1.21 NC(=O)COc1ccc(Br)cc1 Amb6275646 [0,2,0,0,0,0|2,0,0]=4 4454 B12R1.21 NC(=O)COc1ccc(Cl)cc1 Amb2772617 [0,2,0,0,0,0|2,0,0]=4 4455 B12R1.21 NC(=O)COc1ccc(F)cc1 Amb2456996 [0,2,0,0,0,0|2,0,0]=4 4456 B12R1.21 NC(=O)COc1ccc(I)cc1 Amb173371 [0,2,0,0,0,0|2,0,0]=4 4457 B12R1.21 NC(=O)COc1ccc(N)cc1 Amb33536515 [0,2,0,0,0,0|2,0,0]=4 4458 B12R1.21 NC(=O)COc1ccc(O)cc1 Amb8837230 [0,2,0,0,0,0|2,0,0]=4 4459 B12R1.21 NC(=O)CSc1ccc(Br)cc1 Amb1218433 [0,2,0,0,0,0|2,0,0]=4 4460 B12R1.21 NC(=O)CSc1ccc(Cl)cc1 Amb1530887 [0,2,0,0,0,0|2,0,0]=4 4461 B12R1.21 NC(=O)CSc1ccc(F)cc1 Amb1646201 [0,2,0,0,0,0|2,0,0]=4 4462 B12R1.21 NC(=O)CSc1ccc(N)cc1 Amb8930380 [0,2,0,0,0,0|2,0,0]=4 4463 B12R1.21 NC(=O)NNc1ccc(F)cc1 Amb9786687 [0,2,0,0,0,0|2,0,0]=4 4464 B12R1.21 NC(=S)CCc1ccc(Br)cc1 Amb17256980 [0,2,0,0,0,0|2,0,0]=4 4465 B12R1.21 NC(=S)CCc1ccc(F)cc1 Amb17234011 [0,2,0,0,0,0|2,0,0]=4 4466 B12R1.21 NC(=S)COc1ccc(Cl)cc1 Amb2770306 [0,2,0,0,0,0|2,0,0]=4 4467 B12R1.21 NC(=S)COc1ccc(F)cc1 Amb1106123 [0,2,0,0,0,0|2,0,0]=4 4468 B12R1.21 NC(=S)CSc1ccc(Cl)cc1 Amb27257328 [0,2,0,0,0,0|2,0,0]=4 4469 B12R1.21 NC(=S)NNc1ccc(Br)cc1 Amb18070591 [0,2,0,0,0,0|2,0,0]=4 4470 B12R1.21 NC(=S)NNc1ccc(Cl)cc1 Amb6383960 [0,2,0,0,0,0|2,0,0]=4 4471 B12R1.21 NC(=S)NNc1ccc(F)cc1 Amb2756165 [0,2,0,0,0,0|2,0,0]=4 4472 B12R1.21 NC(=S)NNc1ccc(N)cc1 Amb27389300 [0,2,0,0,0,0|2,0,0]=4 4473 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb30588024 [0,2,0,0,0,0|2,0,0]=4 4474 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb6315800 [0,2,0,0,0,0|2,0,0]=4 4475 B12R1.21 Nc1ccc(NCC(=O)O)cc1 Amb18296058 [0,2,0,0,0,0|1,0,0]=3 4476 B12R1.21 Nc1ccc(NCC(=O)O)cn1 Amb18987715 [0,2,0,0,0,0|2,0,0]=4 4477 B12R1.21 Nc1ccc(NCC(=O)O)nc1 Amb17041212 [0,2,0,0,0,0|2,0,0]=4 4478 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb1034889 [0,2,0,0,0,0|2,0,0]=4 4479 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb2608856 [0,2,0,0,0,0|2,0,0]=4 4480 B12R1.21 Nc1ccc(SCC(=O)O)cc1 Amb2684510 [0,2,0,0,0,0|2,0,0]=4 4481 B12R1.21 O=C(Cl)CCc1ccc(Br)cc1 Amb28240937 [0,2,0,0,0,0|2,0,0]=4 4482 B12R1.21 O=C(Cl)CCc1ccc(Cl)cc1 Amb17143273 [0,2,0,0,0,0|2,0,0]=4 4483 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.21 O=C(Cl)CCc1ccc(I)cc1 Amb27973226 [0,2,0,0,0,0|2,0,0]=4 4485 B12R1.21 O=C(Cl)COc1ccc(Br)cc1 Amb16186415 [0,2,0,0,0,0|2,0,0]=4 4486 B12R1.21 O=C(Cl)COc1ccc(Cl)cc1 Amb2716229 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.21 O=C(Cl)COc1ccc(F)cc1 Amb844299 [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.21 O=C(Cl)COc1ccc(I)cc1 Amb28131033 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.21 O=C(Cl)CSc1ccc(Br)cc1 Amb27770810 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.21 O=C(Cl)CSc1ccc(Cl)cc1 Amb17143821 [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.21 O=C(Cl)CSc1ccc(F)cc1 Amb9174973 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.21 O=C(O)CCc1ccc(Br)cc1 Amb1220330 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.21 O=C(O)CCc1ccc(Cl)cc1 Amb1093991 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.21 O=C(O)CCc1ccc(F)cc1 Amb1214879 [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.21 O=C(O)CCc1ccc(I)cc1 Amb6297807 [0,2,0,0,0,0|2,0,0]=4 4496 B12R1.21 O=C(O)CCc1ccc(O)cc1 Amb533172 [0,2,0,0,0,0|2,0,0]=4 4497 B12R1.21 O=C(O)CCc1ccc(S)cc1 Amb6296145 [0,2,0,0,0,0|2,0,0]=4 4498 B12R1.21 O=C(O)CNc1ccc(Br)cc1 Amb1981434 [0,2,0,0,0,0|1,0,0]=3 4499 B12R1.21 O=C(O)CNc1ccc(Cl)cc1 Amb1486152 [0,2,0,0,0,0|1,0,0]=3 4500 B12R1.21 O=C(O)CNc1ccc(F)cc1 Amb840523 [0,2,0,0,0,0|1,0,0]=3 4501 B12R1.21 O=C(O)CNc1ccc(I)cc1 Amb4598598 [0,2,0,0,0,0|1,0,0]=3 4502 B12R1.21 O=C(O)CNc1ccc(O)cc1 Amb1950558 [0,2,0,0,0,0|1,0,0]=3 4503 B12R1.21 O=C(O)COc1ccc(Br)cc1 Amb6336449 [0,2,0,0,0,0|2,0,0]=4 4504 B12R1.21 O=C(O)COc1ccc(Cl)cc1 Amb1830178 [0,2,0,0,0,0|2,0,0]=4 4505 B12R1.21 O=C(O)COc1ccc(F)cc1 Amb1210357 [0,2,0,0,0,0|2,0,0]=4 4506 B12R1.21 O=C(O)COc1ccc(I)cc1 Amb1152251 [0,2,0,0,0,0|2,0,0]=4 4507 B12R1.21 O=C(O)COc1ccc(O)cc1 Amb2819510 [0,2,0,0,0,0|2,0,0]=4 4508 B12R1.21 O=C(O)CSc1ccc(Br)cc1 Amb1208368 [0,2,0,0,0,0|2,0,0]=4 4509 B12R1.21 O=C(O)CSc1ccc(Cl)cc1 Amb6335201 [0,2,0,0,0,0|2,0,0]=4 4510 B12R1.21 O=C(O)CSc1ccc(F)cc1 Amb1209262 [0,2,0,0,0,0|2,0,0]=4 4511 B12R1.21 O=C(O)CSc1ccc(O)cc1 Amb18291566 [0,2,0,0,0,0|2,0,0]=4 4512 B12R1.21 O=C([O-])CCc1ccc(F)cc1 Amb33513062 [0,2,0,0,0,0|2,0,0]=4 4513 B12R1.21 O=C([O-])COc1ccc(Cl)cc1 Amb8383883 [0,2,0,0,0,0|2,0,0]=4 4514 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb2371026 [0,2,0,0,0,0|2,0,0]=4 4515 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb44363 [0,2,0,0,0,0|2,0,0]=4 4516 B12R1.21 O=C1C=CC(=NCC(=O)O)C=C1 Amb26847942 [0,2,0,0,0,0|1,0,1]=4 4517 B12R1.49 C=CC(=O)Cc1ccc(F)cc1 Amb2699674 [0,2,0,0,0,0|1,0,1]=4 4518 B12R1.49 C=CC(=O)Cc1ccc(I)cc1 Amb27412684 [0,2,0,0,0,0|1,0,1]=4 4519 B12R1.49 C=CC(=O)Cc1ccc(O)cc1 Amb27164620 [0,2,0,0,0,0|1,0,1]=4 4520 B12R1.49 C=CC(=O)NC1=CNC(=O)C=C1 Amb27864718 [0,2,0,0,0,0|1,0,1]=4 4521 B12R1.49 C=CC(=O)Nc1ccc(Br)cc1 Amb6843658 [0,2,0,0,0,0|0,0,1]=3 4522 B12R1.49 C=CC(=O)Nc1ccc(C)cc1 Amb6843669 [0,2,0,0,0,0|0,0,1]=3 4523 B12R1.49 C=CC(=O)Nc1ccc(C)cn1 Amb33532242 [0,2,0,0,0,0|1,0,1]=4 4524 B12R1.49 C=CC(=O)Nc1ccc(Cl)cc1 Amb33532238 [0,2,0,0,0,0|0,0,1]=3 4525 B12R1.49 C=CC(=O)Nc1ccc(Cl)nc1 Amb28184572 [0,2,0,0,0,0|1,0,1]=4 4526 B12R1.49 C=CC(=O)Nc1ccc(F)cc1 Amb6843679 [0,2,0,0,0,0|0,0,1]=3 4527 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,2,0,0,0,0|1,0,1]=4 4528 B12R1.49 C=CC(=O)Oc1ccc(I)cc1 Amb28188352 [0,2,0,0,0,0|1,0,1]=4 4529 B12R1.49 C=CC(=O)Oc1ccc(O)cc1 Amb27668978 [0,2,0,0,0,0|1,0,1]=4 4530 B12R1.49 C=CC(C)NC1=NNC(=O)C=C1 Amb27414337 [0,2,0,0,0,0|2,0,0]=4 4531 B12R1.49 C=CC(C)Nc1ccc(C)cc1 Amb27650694 [0,2,0,0,0,0|0,0,0]=2 4532 B12R1.49 C=CC(C)Nc1ccc(C)nn1 Amb28396435 [0,2,0,0,0,0|2,0,0]=4 4533 B12R1.49 C=CC(C)Nc1ccc(F)cc1 Amb27273562 [0,2,0,0,0,0|0,0,0]=2 4534 B12R1.49 C=CC(C)Nc1ccc(I)cc1 Amb27984516 [0,2,0,0,0,0|0,0,0]=2 4535 B12R1.49 C=CC(C)Nc1ccc(N)cc1 Amb27410792 [0,2,0,0,0,0|0,0,0]=2 4536 B12R1.49 C=CC(C)Nc1ccc(N)cn1 Amb27247201 [0,2,0,0,0,0|1,0,0]=3 4537 B12R1.49 C=CC(C)Nc1cnc(Br)cn1 Amb27416949 [0,2,0,0,0,0|2,0,0]=4 4538 B12R1.49 C=CC(C)Nc1cnc(N)cn1 Amb27272674 [0,2,0,0,0,0|2,0,0]=4 4539 B12R1.49 C=CC(C)Oc1ccc(Br)cc1 Amb25893737 [0,2,0,0,0,0|1,0,0]=3 4540 B12R1.49 C=CC(C)Oc1ccc(Cl)nc1 Amb27811555 [0,2,0,0,0,0|2,0,0]=4 4541 B12R1.49 C=CC(C)Oc1ccc(F)cc1 Amb27807106 [0,2,0,0,0,0|1,0,0]=3 4542 B12R1.49 C=CC(C)Oc1ccc(F)nc1 Amb27465505 [0,2,0,0,0,0|2,0,0]=4 4543 B12R1.49 C=CC(C)Oc1ccc(N)cc1 Amb18990276 [0,2,0,0,0,0|1,0,0]=3 4544 B12R1.49 C=CC(C)Oc1ccc(O)cc1 Amb18798279 [0,2,0,0,0,0|1,0,0]=3 4545 B12R1.49 C=CC(C)Sc1ccc(Br)cc1 Amb28206880 [0,2,0,0,0,0|1,0,0]=3 4546 B12R1.49 C=CC(C)Sc1ccc(Cl)cn1 Amb28281553 [0,2,0,0,0,0|2,0,0]=4 4547 B12R1.49 C=CC(Cl)Cc1ccc(Br)cc1 Amb27178578 [0,2,0,0,0,0|1,0,0]=3 4548 B12R1.49 C=CC(N)Cc1ccc(C)cc1 Amb28197514 [0,2,0,0,0,0|1,0,0]=3 4549 B12R1.49 C=CC(O)Cc1ccc(N)cc1 Amb35588601 [0,2,0,0,0,0|1,0,0]=3 4550 B12R1.49 C=CN(C)Cc1ccc(O)cc1 Amb24408917 [0,2,0,0,0,0|2,0,0]=4 4551 B12R1.49 CC(C#N)Nc1ccc(Br)cc1 Amb17406666 [0,2,0,0,0,0|1,0,1]=4 4552 B12R1.49 CC(C#N)Nc1ccc(Cl)cc1 Amb17400853 [0,2,0,0,0,0|1,0,1]=4 4553 B12R1.49 CC(C#N)Nc1ccc(F)cc1 Amb17400148 [0,2,0,0,0,0|1,0,1]=4 4554 B12R1.49 CC(C=O)Cc1ccc(Br)cc1 Amb25060263 [0,2,0,0,0,0|2,0,0]=4 4555 B12R1.49 CC(C=O)Cc1ccc(Cl)cc1 Amb18648716 [0,2,0,0,0,0|2,0,0]=4 4556 B12R1.49 CC(C=O)Cc1ccc(F)cc1 Amb26011993 [0,2,0,0,0,0|2,0,0]=4 4557 B12R1.49 CC(C=O)Cc1ccc(I)cc1 Amb28187361 [0,2,0,0,0,0|2,0,0]=4 4558 B12R1.49 CC(C=O)Cc1ccc(N)cc1 Amb27398345 [0,2,0,0,0,0|2,0,0]=4 4559 B12R1.49 CC(C=O)Oc1ccc(Br)cc1 Amb30020612 [0,2,0,0,0,0|2,0,0]=4 4560 B12R1.49 CC(C=O)Oc1ccc(Cl)cc1 Amb27619207 [0,2,0,0,0,0|2,0,0]=4 4561 B12R1.49 CC(C=O)Oc1ccc(F)cc1 Amb30020594 [0,2,0,0,0,0|2,0,0]=4 4562 B12R1.49 CC(C=O)Oc1ccc(I)cc1 Amb30020617 [0,2,0,0,0,0|2,0,0]=4 4563 B12R1.49 CC(C=O)Sc1ccc(Br)cc1 Amb30020877 [0,2,0,0,0,0|2,0,0]=4 4564 B12R1.49 CC(C=O)Sc1ccc(Cl)cc1 Amb30020870 [0,2,0,0,0,0|2,0,0]=4 4565 B12R1.49 CC(C=O)Sc1ccc(F)cc1 Amb30020862 [0,2,0,0,0,0|2,0,0]=4 4566 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,2,0,0,0,0|1,0,1]=4 4567 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,2,0,0,0,0|1,0,1]=4 4568 B12R1.49 CC(CN)Nc1ccc(I)cc1 Amb28322506 [0,2,0,0,0,0|1,0,1]=4 4569 B12R1.49 CC(CN)Nc1ccc(O)cc1 Amb27614615 [0,2,0,0,0,0|1,0,1]=4 4570 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,2,0,0,0,0|1,0,1]=4 4571 B12R1.49 CC(CO)Nc1ccc(N)cc1 Amb9359036 [0,2,0,0,0,0|1,0,1]=4 4572 B12R1.49 CCC(C)Nc1ccc(Br)cc1 Amb6696561 [0,2,0,0,0,0|0,0,2]=4 4573 B12R1.49 CCC(C)Nc1ccc(C)cc1 Amb6700867 [0,2,0,0,0,0|0,0,2]=4 4574 B12R1.49 CCC(C)Nc1ccc(Cl)cc1 Amb6695985 [0,2,0,0,0,0|0,0,2]=4 4575 B12R1.49 CCC(C)Nc1ccc(F)cc1 Amb6696817 [0,2,0,0,0,0|0,0,2]=4 4576 B12R1.49 CCC(C)Nc1ccc(N)cc1 Amb7767483 [0,2,0,0,0,0|0,0,2]=4 4577 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|2,0,0]=4 4578 B12R1.49 Cc1ccc(CC(Cl)C=O)cc1 Amb17204328 [0,2,0,0,0,0|2,0,0]=4 4579 B12R1.49 Cc1ccc(NC(C)C#N)cc1 Amb17400078 [0,2,0,0,0,0|1,0,1]=4 4580 B12R1.49 Cc1ccc(NC(C)CN)cc1 Amb18646166 [0,2,0,0,0,0|1,0,1]=4 4581 B12R1.49 Cc1ccc(OC(C)C=O)cc1 Amb27827460 [0,2,0,0,0,0|2,0,0]=4 4582 B12R1.49 Cc1ccc(SC(C)C=O)cc1 Amb18648416 [0,2,0,0,0,0|2,0,0]=4 4583 B12R1.49 NC(C=O)Cc1ccc(O)cc1 Amb28208235 [0,2,0,0,0,0|2,0,0]=4 4584 B12R1.49 O=CC(=O)Nc1ccc(O)cc1 Amb27748423 [0,2,0,0,0,0|1,0,1]=4 4585 B12R1.49 O=CC(Cl)Cc1ccc(Br)cc1 Amb17204706 [0,2,0,0,0,0|2,0,0]=4 4586 B12R1.49 O=CC(Cl)Cc1ccc(Cl)cc1 Amb17204403 [0,2,0,0,0,0|2,0,0]=4 4587 B12R1.49 O=CC(Cl)Cc1ccc(F)cc1 Amb17204342 [0,2,0,0,0,0|2,0,0]=4 4588 B12R1.69 C#CCNc1ccc(C)cc1C Amb18800152 [0,2,0,0,0,0|0,0,2]=4 4589 B12R1.69 C#CCNc1ccc(C)cc1Cl Amb18809274 [0,2,0,0,0,0|0,0,2]=4 4590 B12R1.69 C#CCNc1ccc(Cl)cc1Br Amb28207704 [0,2,0,0,0,0|0,0,2]=4 4591 B12R1.69 C#CCNc1ccc(F)cc1F Amb17307301 [0,2,0,0,0,0|0,0,2]=4 4592 B12R1.69 C#CCNc1ccc(I)cc1Br Amb27628305 [0,2,0,0,0,0|0,0,2]=4 4593 B12R1.69 C#CCNc1ccc(I)cc1F Amb35597035 [0,2,0,0,0,0|0,0,2]=4 4594 B12R1.69 C#CCNc1ccc(O)cc1Cl Amb35719498 [0,2,0,0,0,0|0,0,2]=4 4595 B12R1.69 C=CCCc1ccc(Br)cc1F Amb28368315 [0,2,0,0,0,0|1,0,0]=3 4596 B12R1.69 C=CCCc1ccc(C)cc1C Amb6299298 [0,2,0,0,0,0|1,0,0]=3 4597 B12R1.69 C=CCCc1ccc(C)cc1Cl Amb27954390 [0,2,0,0,0,0|1,0,0]=3 4598 B12R1.69 C=CCCc1ccc(Cl)cc1F Amb27831897 [0,2,0,0,0,0|1,0,0]=3 4599 B12R1.69 C=CCCc1ccc(F)cc1C Amb28186153 [0,2,0,0,0,0|1,0,0]=3 4600 B12R1.69 C=CCNC1C=CC(=O)NC1=O Amb27393657 [0,2,0,0,0,0|1,0,1]=4 4601 B12R1.69 C=CCNc1ccc(Br)cc1Br Amb27760816 [0,2,0,0,0,0|0,0,0]=2 4602 B12R1.69 C=CCNc1ccc(C)cc1C Amb17306740 [0,2,0,0,0,0|0,0,0]=2 4603 B12R1.69 C=CCNc1ccc(C)cc1Cl Amb18181534 [0,2,0,0,0,0|0,0,0]=2 4604 B12R1.69 C=CCNc1ccc(C)cc1N Amb18299130 [0,2,0,0,0,0|0,0,0]=2 4605 B12R1.69 C=CCNc1ccc(Cl)cc1C Amb17305814 [0,2,0,0,0,0|0,0,0]=2 4606 B12R1.69 C=CCNc1ccc(Cl)cc1Cl Amb17306788 [0,2,0,0,0,0|0,0,0]=2 4607 B12R1.69 C=CCNc1ccc(F)cc1F Amb17307293 [0,2,0,0,0,0|0,0,0]=2 4608 B12R1.69 C=CCNc1ccc(F)cc1I Amb27881382 [0,2,0,0,0,0|0,0,0]=2 4609 B12R1.69 C=CCNc1ccc(I)cc1Cl Amb27398987 [0,2,0,0,0,0|0,0,0]=2 4610 B12R1.69 C=CCNc1ccc(I)cc1F Amb35736229 [0,2,0,0,0,0|0,0,0]=2 4611 B12R1.69 C=CCNc1ccc(N)cc1C Amb18992169 [0,2,0,0,0,0|0,0,0]=2 4612 B12R1.69 C=CCNc1ccc(N)cc1F Amb18992168 [0,2,0,0,0,0|0,0,0]=2 4613 B12R1.69 C=CCNc1ccc(N)cc1I Amb28381479 [0,2,0,0,0,0|0,0,0]=2 4614 B12R1.69 C=CCNc1cnc(O)nc1O Amb27178753 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.69 C=CCNc1ncc(Br)cc1Cl Amb18228817 [0,2,0,0,0,0|1,0,0]=3 4616 B12R1.69 C=CCNc1ncc(Br)cc1N Amb17209020 [0,2,0,0,0,0|1,0,0]=3 4617 B12R1.69 C=CCNc1ncc(C)cc1Br Amb18227512 [0,2,0,0,0,0|1,0,0]=3 4618 B12R1.69 C=CCNc1ncc(C)cc1N Amb17209077 [0,2,0,0,0,0|1,0,0]=3 4619 B12R1.69 C=CCNc1ncc(Cl)cc1Br Amb27812685 [0,2,0,0,0,0|1,0,0]=3 4620 B12R1.69 C=CCNc1ncc(Cl)cc1C Amb35676658 [0,2,0,0,0,0|1,0,0]=3 4621 B12R1.69 C=CCNc1ncc(Cl)cc1Cl Amb27425208 [0,2,0,0,0,0|1,0,0]=3 4622 B12R1.69 C=CCNc1ncc(Cl)cc1F Amb27961037 [0,2,0,0,0,0|1,0,0]=3 4623 B12R1.69 C=CCNc1ncc(Cl)cc1N Amb17208955 [0,2,0,0,0,0|1,0,0]=3 4624 B12R1.69 C=CCNc1ncc(F)cc1F Amb28255963 [0,2,0,0,0,0|1,0,0]=3 4625 B12R1.69 C=CCNc1ncc(F)cc1N Amb27960743 [0,2,0,0,0,0|1,0,0]=3 4626 B12R1.69 C=CCNc1ncc(N)cc1Br Amb17213703 [0,2,0,0,0,0|1,0,0]=3 4627 B12R1.69 C=CCNc1ncc(N)cc1C Amb17210918 [0,2,0,0,0,0|1,0,0]=3 4628 B12R1.69 C=CCNc1ncc(N)cc1Cl Amb18863075 [0,2,0,0,0,0|1,0,0]=3 4629 B12R1.69 C=CCOc1ccc(Br)cc1Br Amb4422144 [0,2,0,0,0,0|1,0,0]=3 4630 B12R1.69 C=CCOc1ccc(Br)cc1C Amb27400844 [0,2,0,0,0,0|1,0,0]=3 4631 B12R1.69 C=CCOc1ccc(Br)cc1Cl Amb4013345 [0,2,0,0,0,0|1,0,0]=3 4632 B12R1.69 C=CCOc1ccc(Br)cc1F Amb27482572 [0,2,0,0,0,0|1,0,0]=3 4633 B12R1.69 C=CCOc1ccc(Br)cc1N Amb33548633 [0,2,0,0,0,0|1,0,0]=3 4634 B12R1.69 C=CCOc1ccc(C)cc1Br Amb6717110 [0,2,0,0,0,0|1,0,0]=3 4635 B12R1.69 C=CCOc1ccc(C)cc1N Amb17138556 [0,2,0,0,0,0|1,0,0]=3 4636 B12R1.69 C=CCOc1ccc(C)nc1N Amb18991660 [0,2,0,0,0,0|2,0,0]=4 4637 B12R1.69 C=CCOc1ccc(Cl)cc1Br Amb17259614 [0,2,0,0,0,0|1,0,0]=3 4638 B12R1.69 C=CCOc1ccc(Cl)cc1C Amb27448123 [0,2,0,0,0,0|1,0,0]=3 4639 B12R1.69 C=CCOc1ccc(Cl)cc1Cl Amb4016384 [0,2,0,0,0,0|1,0,0]=3 4640 B12R1.69 C=CCOc1ccc(Cl)cc1N Amb844282 [0,2,0,0,0,0|1,0,0]=3 4641 B12R1.69 C=CCOc1ccc(Cl)cc1O Amb27861307 [0,2,0,0,0,0|1,0,0]=3 4642 B12R1.69 C=CCOc1ccc(F)cc1Br Amb6278845 [0,2,0,0,0,0|1,0,0]=3 4643 B12R1.69 C=CCOc1ccc(F)cc1C Amb28321668 [0,2,0,0,0,0|1,0,0]=3 4644 B12R1.69 C=CCOc1ccc(F)cc1F Amb27604299 [0,2,0,0,0,0|1,0,0]=3 4645 B12R1.69 C=CCOc1ccc(F)cc1N Amb17232632 [0,2,0,0,0,0|1,0,0]=3 4646 B12R1.69 C=CCOc1ccc(N)cc1C Amb27637464 [0,2,0,0,0,0|1,0,0]=3 4647 B12R1.69 C=CCOc1ccc(N)cc1Cl Amb17139077 [0,2,0,0,0,0|1,0,0]=3 4648 B12R1.69 C=CCOc1ccc(O)cc1C Amb27255458 [0,2,0,0,0,0|1,0,0]=3 4649 B12R1.69 C=CCOc1ccc(O)cc1O Amb27409625 [0,2,0,0,0,0|1,0,0]=3 4650 B12R1.69 C=CCOc1cnc(Br)cc1C Amb28283554 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.69 C=CCOc1ncc(Br)cc1C Amb27258909 [0,2,0,0,0,0|2,0,0]=4 4652 B12R1.69 C=CCSc1ccc(C)cc1C Amb27213714 [0,2,0,0,0,0|1,0,0]=3 4653 B12R1.69 C=CCSc1ccc(Cl)cc1C Amb27607251 [0,2,0,0,0,0|1,0,0]=3 4654 B12R1.69 C=CCSc1ccc(F)cc1C Amb28250147 [0,2,0,0,0,0|1,0,0]=3 4655 B12R1.69 C=CCSc1ccc(F)cc1F Amb28283568 [0,2,0,0,0,0|1,0,0]=3 4656 B12R1.69 C=CCSc1ccc(I)cc1N Amb28429173 [0,2,0,0,0,0|1,0,0]=3 4657 B12R1.69 C=CCSc1ccc(N)cc1C Amb8933811 [0,2,0,0,0,0|1,0,0]=3 4658 B12R1.69 C=CCSc1ccc(N)cc1I Amb27948242 [0,2,0,0,0,0|1,0,0]=3 4659 B12R1.69 C=CCSc1ncc(Br)cc1Br Amb27978779 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.69 C=CCSc1ncc(C)cc1Br Amb25856342 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.69 C=CCSc1ncc(N)cc1Br Amb27805848 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.69 C=CCSc1ncc(N)cc1Cl Amb27264415 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.69 CCCNc1ccc(Br)cc1C Amb6690047 [0,2,0,0,0,0|0,0,2]=4 4664 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb30584837 [0,2,0,0,0,0|0,0,2]=4 4665 B12R1.69 CCCNc1ccc(Br)cc1Cl Amb9000418 [0,2,0,0,0,0|0,0,2]=4 4666 B12R1.69 CCCNc1ccc(Br)cc1N Amb7767450 [0,2,0,0,0,0|0,0,2]=4 4667 B12R1.69 CCCNc1ccc(C)cc1Br Amb6688269 [0,2,0,0,0,0|0,0,2]=4 4668 B12R1.69 CCCNc1ccc(C)cc1C Amb4313506 [0,2,0,0,0,0|0,0,2]=4 4669 B12R1.69 CCCNc1ccc(C)cc1Cl Amb7780594 [0,2,0,0,0,0|0,0,2]=4 4670 B12R1.69 CCCNc1ccc(C)cc1N Amb9002761 [0,2,0,0,0,0|0,0,2]=4 4671 B12R1.69 CCCNc1ccc(Cl)cc1C Amb6610047 [0,2,0,0,0,0|0,0,2]=4 4672 B12R1.69 CCCNc1ccc(Cl)cc1Cl Amb6639162 [0,2,0,0,0,0|0,0,2]=4 4673 B12R1.69 CCCNc1ccc(Cl)cc1F Amb9582472 [0,2,0,0,0,0|0,0,2]=4 4674 B12R1.69 CCCNc1ccc(Cl)cc1N Amb7767457 [0,2,0,0,0,0|0,0,2]=4 4675 B12R1.69 CCCNc1ccc(F)cc1Cl Amb7808035 [0,2,0,0,0,0|0,0,2]=4 4676 B12R1.69 CCCNc1ccc(F)cc1F Amb6698329 [0,2,0,0,0,0|0,0,2]=4 4677 B12R1.69 CCCNc1ccc(F)cc1I Amb27881381 [0,2,0,0,0,0|0,0,2]=4 4678 B12R1.69 CCCNc1ccc(F)cc1N Amb845869 [0,2,0,0,0,0|0,0,2]=4 4679 B12R1.69 CCCNc1ccc(I)cc1Br Amb27465186 [0,2,0,0,0,0|0,0,2]=4 4680 B12R1.69 CCCNc1ccc(I)cc1F Amb35597038 [0,2,0,0,0,0|0,0,2]=4 4681 B12R1.69 CCCNc1ccc(N)cc1F Amb845921 [0,2,0,0,0,0|0,0,2]=4 4682 B12R1.69 CCCNc1ccc(N)cc1I Amb27408784 [0,2,0,0,0,0|0,0,2]=4 4683 B12R1.69 CCCNc1ccc(O)cc1C Amb27614719 [0,2,0,0,0,0|0,0,2]=4 4684 B12R1.69 CCCNc1ccc(O)cc1Cl Amb35735282 [0,2,0,0,0,0|0,0,2]=4 4685 B12R1.69 C\C=N\Nc1ccc(F)cc1F Amb27972312 [0,2,0,0,0,0|1,0,1]=4 4686 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,2,0,0,0,0|2,0,0]=4 4687 B12R1.69 Cc1cc(Br)ccc1NCC#N Amb6709099 [0,2,0,0,0,0|1,0,1]=4 4688 B12R1.69 Cc1cc(Br)ccc1NCCCl Amb17351916 [0,2,0,0,0,0|1,0,1]=4 4689 B12R1.69 Cc1cc(Br)ccc1NCCN Amb17091076 [0,2,0,0,0,0|1,0,1]=4 4690 B12R1.69 Cc1cc(Br)ccc1NCCO Amb6709137 [0,2,0,0,0,0|1,0,1]=4 4691 B12R1.69 Cc1cc(Br)ccc1OCC=O Amb17099968 [0,2,0,0,0,0|2,0,0]=4 4692 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.69 Cc1cc(Cl)ccc1NCC#N Amb17400854 [0,2,0,0,0,0|1,0,1]=4 4694 B12R1.69 Cc1cc(Cl)ccc1NCCCl Amb17338053 [0,2,0,0,0,0|1,0,1]=4 4695 B12R1.69 Cc1cc(Cl)ccc1NCCN Amb17091059 [0,2,0,0,0,0|1,0,1]=4 4696 B12R1.69 Cc1cc(Cl)ccc1NCCO Amb17305825 [0,2,0,0,0,0|1,0,1]=4 4697 B12R1.69 Cc1cc(Cl)ccc1OCC=O Amb19075146 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.69 Cc1cc(F)ccc1NCC#N Amb6713496 [0,2,0,0,0,0|1,0,1]=4 4700 B12R1.69 Cc1cc(F)ccc1NCCCl Amb28121045 [0,2,0,0,0,0|1,0,1]=4 4701 B12R1.69 Cc1cc(F)ccc1SCC=O Amb17082917 [0,2,0,0,0,0|2,0,0]=4 4702 B12R1.69 Cc1cc(N)ccc1NCCF Amb27647272 [0,2,0,0,0,0|1,0,1]=4 4703 B12R1.69 Cc1cc(N)ccc1NCCN Amb18991506 [0,2,0,0,0,0|1,0,1]=4 4704 B12R1.69 Cc1cc(N)ccc1NCCO Amb8855787 [0,2,0,0,0,0|1,0,1]=4 4705 B12R1.69 Cc1cc(O)ccc1NCCN Amb27953715 [0,2,0,0,0,0|1,0,1]=4 4706 B12R1.69 Cc1cc(S)ccc1CCC=O Amb28246213 [0,2,0,0,0,0|2,0,0]=4 4707 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,2,0,0,0,0|2,0,0]=4 4708 B12R1.69 Cc1ccc(CCC=O)c(C)c1 Amb18563553 [0,2,0,0,0,0|2,0,0]=4 4709 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,2,0,0,0,0|2,0,0]=4 4710 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.69 Cc1ccc(NCC#N)c(Br)c1 Amb6708140 [0,2,0,0,0,0|1,0,1]=4 4714 B12R1.69 Cc1ccc(NCC#N)c(C)c1 Amb6706775 [0,2,0,0,0,0|1,0,1]=4 4715 B12R1.69 Cc1ccc(NCCCl)c(Br)c1 Amb17351915 [0,2,0,0,0,0|1,0,1]=4 4716 B12R1.69 Cc1ccc(NCCCl)c(C)c1 Amb17335661 [0,2,0,0,0,0|1,0,1]=4 4717 B12R1.69 Cc1ccc(NCCF)c(C)c1 Amb27961326 [0,2,0,0,0,0|1,0,1]=4 4718 B12R1.69 Cc1ccc(NCCN)c(Br)c1 Amb17091075 [0,2,0,0,0,0|1,0,1]=4 4719 B12R1.69 Cc1ccc(NCCN)c(C)c1 Amb17057764 [0,2,0,0,0,0|1,0,1]=4 4720 B12R1.69 Cc1ccc(NCCO)c(Br)c1 Amb6708181 [0,2,0,0,0,0|1,0,1]=4 4721 B12R1.69 Cc1ccc(NCCO)c(C)c1 Amb6706815 [0,2,0,0,0,0|1,0,1]=4 4722 B12R1.69 Cc1ccc(NCCO)c(N)c1 Amb9002809 [0,2,0,0,0,0|1,0,1]=4 4723 B12R1.69 Cc1ccc(OCC=O)c(Br)c1 Amb17099967 [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.69 Cc1ccc(OCC=O)c(C)c1 Amb5731828 [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.69 Cc1ccc(OCC=O)c(Cl)c1 Amb19069174 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.69 Cc1ccc(SCC=O)c(C)c1 Amb17082910 [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.69 ClCCNc1ccc(Cl)cc1Cl Amb17343163 [0,2,0,0,0,0|1,0,1]=4 4728 B12R1.69 FCCNc1ccc(Br)cc1Br Amb27984467 [0,2,0,0,0,0|1,0,1]=4 4729 B12R1.69 FCCNc1ccc(Br)cc1Cl Amb27781425 [0,2,0,0,0,0|1,0,1]=4 4730 B12R1.69 FCCNc1ccc(Cl)cc1Cl Amb27800524 [0,2,0,0,0,0|1,0,1]=4 4731 B12R1.69 FCCNc1ccc(F)cc1F Amb27389205 [0,2,0,0,0,0|1,0,1]=4 4732 B12R1.69 FCCNc1ccc(I)cc1F Amb35589463 [0,2,0,0,0,0|1,0,1]=4 4733 B12R1.69 N#CCNc1ccc(Br)cc1Br Amb27482452 [0,2,0,0,0,0|1,0,1]=4 4734 B12R1.69 N#CCNc1ccc(Br)cc1N Amb20671953 [0,2,0,0,0,0|1,0,1]=4 4735 B12R1.69 N#CCNc1ccc(Cl)cc1Cl Amb6709057 [0,2,0,0,0,0|1,0,1]=4 4736 B12R1.69 N#CCNc1ccc(Cl)cc1N Amb20671955 [0,2,0,0,0,0|1,0,1]=4 4737 B12R1.69 N#CCNc1ccc(F)cc1F Amb6712857 [0,2,0,0,0,0|1,0,1]=4 4738 B12R1.69 N#CCNc1ccc(I)cc1Br Amb27832873 [0,2,0,0,0,0|1,0,1]=4 4739 B12R1.69 N#CCNc1ccc(I)cc1F Amb35736227 [0,2,0,0,0,0|1,0,1]=4 4740 B12R1.69 NCCNc1ccc(Br)cc1Br Amb27416820 [0,2,0,0,0,0|1,0,1]=4 4741 B12R1.69 NCCNc1ccc(Cl)cc1Br Amb27416757 [0,2,0,0,0,0|1,0,1]=4 4742 B12R1.69 NCCNc1ccc(Cl)cc1Cl Amb17091081 [0,2,0,0,0,0|1,0,1]=4 4743 B12R1.69 NCCNc1ccc(Cl)cc1I Amb27416756 [0,2,0,0,0,0|1,0,1]=4 4744 B12R1.69 NCCNc1ccc(F)cc1F Amb17057761 [0,2,0,0,0,0|1,0,1]=4 4745 B12R1.69 NCCNc1ccc(I)cc1F Amb35597039 [0,2,0,0,0,0|1,0,1]=4 4746 B12R1.69 NCCNc1ccc(N)cc1F Amb18991505 [0,2,0,0,0,0|1,0,1]=4 4747 B12R1.69 NCCNc1ccc(O)cc1Cl Amb35735283 [0,2,0,0,0,0|1,0,1]=4 4748 B12R1.69 Nc1cc(Br)ccc1NCCF Amb28366400 [0,2,0,0,0,0|1,0,1]=4 4749 B12R1.69 Nc1cc(Br)ccc1NCCO Amb7768140 [0,2,0,0,0,0|1,0,1]=4 4750 B12R1.69 Nc1cc(Cl)ccc1NCCO Amb7768147 [0,2,0,0,0,0|1,0,1]=4 4751 B12R1.69 Nc1cc(F)ccc1CCC=O Amb28130009 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.69 Nc1cc(O)ccc1NCCO Amb28288398 [0,2,0,0,0,0|1,0,1]=4 4753 B12R1.69 Nc1ccc(CCC=O)c(Br)c1 Amb28196038 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.69 Nc1ccc(NCCO)c(F)c1 Amb7783383 [0,2,0,0,0,0|1,0,1]=4 4755 B12R1.69 O=CCCc1ccc(Br)cc1Br Amb25995251 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.69 O=CCCc1ccc(Br)cc1I Amb28398138 [0,2,0,0,0,0|2,0,0]=4 4759 B12R1.69 O=CCCc1ccc(Br)cc1O Amb25883424 [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.69 O=CCCc1ccc(Cl)cc1Cl Amb17612588 [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.69 O=CCCc1ccc(Cl)cc1I Amb26048883 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.69 O=CCCc1ccc(Cl)cc1O Amb27175625 [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,2,0,0,0,0|2,0,0]=4 4769 B12R1.69 O=CCCc1ccc(F)cc1O Amb26517520 [0,2,0,0,0,0|2,0,0]=4 4770 B12R1.69 O=CCCc1ccc(I)cc1Br Amb27461905 [0,2,0,0,0,0|2,0,0]=4 4771 B12R1.69 O=CCCc1ccc(I)cc1Cl Amb27461948 [0,2,0,0,0,0|2,0,0]=4 4772 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.69 O=CCCc1ccc(I)cc1O Amb27238630 [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.69 O=CCCc1ccc(I)cc1S Amb27423734 [0,2,0,0,0,0|2,0,0]=4 4775 B12R1.69 O=CCCc1ccc(O)cc1Cl Amb28291426 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.69 O=CCCc1ccc(O)cc1F Amb26880100 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.69 O=CCCc1ccc(O)cc1O Amb25993938 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.69 O=CCCc1ccc(S)cc1F Amb28287544 [0,2,0,0,0,0|2,0,0]=4 4779 B12R1.69 O=CCCc1ccc(S)cc1I Amb27647094 [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.69 O=CCOc1ccc(Br)cc1Cl Amb17099944 [0,2,0,0,0,0|2,0,0]=4 4781 B12R1.69 O=CCOc1ccc(Cl)cc1Cl Amb4035219 [0,2,0,0,0,0|2,0,0]=4 4782 B12R1.69 O=CCOc1ccc(F)cc1Cl Amb18330025 [0,2,0,0,0,0|2,0,0]=4 4783 B12R1.69 O=CCOc1ccc(F)cc1F Amb18807299 [0,2,0,0,0,0|2,0,0]=4 4784 B12R1.69 O=CCSc1ccc(Cl)cc1Cl Amb26845113 [0,2,0,0,0,0|2,0,0]=4 4785 B12R1.69 O=CCSc1ccc(F)cc1F Amb19077117 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.69 OCCNc1ccc(F)cc1F Amb6712905 [0,2,0,0,0,0|1,0,1]=4 4787 B12R1.69 OCCNc1ccc(F)cc1I Amb27881383 [0,2,0,0,0,0|1,0,1]=4 4788 B12R1.69 OCCNc1ccc(I)cc1F Amb35589462 [0,2,0,0,0,0|1,0,1]=4 4789 B12R1.71 C#CCNc1ccc(OC)cc1 Amb4139962 [0,2,0,0,0,0|0,0,2]=4 4790 B12R1.71 C#Cc1ccc(CCC=O)cc1 Amb32882245 [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.71 C#Cc1ccc(NCCO)cc1 Amb27981963 [0,2,0,0,0,0|1,0,1]=4 4792 B12R1.71 C=CCCc1ccc(C=O)cc1 Amb24102789 [0,2,0,0,0,0|1,0,0]=3 4793 B12R1.71 C=CCCc1ccc(OC)cc1 Amb6299125 [0,2,0,0,0,0|1,0,0]=3 4794 B12R1.71 C=CCNc1ccc(C#N)cn1 Amb6265614 [0,2,0,0,0,0|1,0,0]=3 4795 B12R1.71 C=CCNc1ccc(C#N)nc1 Amb26483861 [0,2,0,0,0,0|1,0,0]=3 4796 B12R1.71 C=CCNc1ccc(CC)cc1 Amb17306600 [0,2,0,0,0,0|0,0,0]=2 4797 B12R1.71 C=CCNc1ccc(CCl)cc1 Amb27853979 [0,2,0,0,0,0|0,0,0]=2 4798 B12R1.71 C=CCNc1ccc(CN)cn1 Amb18563589 [0,2,0,0,0,0|1,0,0]=3 4799 B12R1.71 C=CCNc1ccc(NC)cc1 Amb27668939 [0,2,0,0,0,0|0,0,0]=2 4800 B12R1.71 C=CCNc1ccc(OC)cc1 Amb6360349 [0,2,0,0,0,0|0,0,0]=2 4801 B12R1.71 C=CCNc1ccc(OC)cn1 Amb28137659 [0,2,0,0,0,0|1,0,0]=3 4802 B12R1.71 C=CCNc1ccc(OC)nc1 Amb18792566 [0,2,0,0,0,0|1,0,0]=3 4803 B12R1.71 C=CCOc1ccc(C#N)cc1 Amb6269982 [0,2,0,0,0,0|1,0,0]=3 4804 B12R1.71 C=CCOc1ccc(C#N)cn1 Amb9208749 [0,2,0,0,0,0|2,0,0]=4 4805 B12R1.71 C=CCOc1ccc(C=O)cc1 Amb1240568 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.71 C=CCOc1ccc(CN)cc1 Amb33528217 [0,2,0,0,0,0|1,0,0]=3 4807 B12R1.71 C=CCOc1ccc(CO)cc1 Amb33526741 [0,2,0,0,0,0|1,0,0]=3 4808 B12R1.71 C=CCOc1ccc(CS)cc1 Amb32788045 [0,2,0,0,0,0|1,0,0]=3 4809 B12R1.71 C=CCOc1ccc(OC)cc1 Amb4406979 [0,2,0,0,0,0|1,0,0]=3 4810 B12R1.71 C=CCSc1ccc(C#N)cn1 Amb27389393 [0,2,0,0,0,0|2,0,0]=4 4811 B12R1.71 C=COCc1ccc(OC)cc1 Amb32650209 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.71 C=C\C=C/c1ccc(C#N)cc1 Amb22546621 [0,2,0,0,0,0|1,0,1]=4 4813 B12R1.71 C=C\C=C/c1ccc(C=O)cc1 Amb24103176 [0,2,0,0,0,0|1,0,1]=4 4814 B12R1.71 C=C\C=C\c1ccc(OC)cc1 Amb22546592 [0,2,0,0,0,0|1,0,1]=4 4815 B12R1.71 C=Cc1ccc(NCCO)cc1 Amb28458549 [0,2,0,0,0,0|1,0,1]=4 4816 B12R1.71 CCCNc1ccc(C#N)cc1 Amb6679338 [0,2,0,0,0,0|0,0,2]=4 4817 B12R1.71 CCCNc1ccc(CC)cc1 Amb6698788 [0,2,0,0,0,0|0,0,2]=4 4818 B12R1.71 CCCNc1ccc(CCl)cc1 Amb28366603 [0,2,0,0,0,0|0,0,2]=4 4819 B12R1.71 CCCNc1ccc(CN)cc1 Amb18800849 [0,2,0,0,0,0|0,0,2]=4 4820 B12R1.71 CCCNc1ccc(OC)cc1 Amb4313500 [0,2,0,0,0,0|0,0,2]=4 4821 B12R1.71 CCc1ccc(CCC=O)cc1 Amb17081676 [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.71 CCc1ccc(NCC#N)cc1 Amb6713114 [0,2,0,0,0,0|1,0,1]=4 4823 B12R1.71 CCc1ccc(NCCCl)cc1 Amb17335668 [0,2,0,0,0,0|1,0,1]=4 4824 B12R1.71 CCc1ccc(NCCN)cc1 Amb17057758 [0,2,0,0,0,0|1,0,1]=4 4825 B12R1.71 CCc1ccc(NCCO)cc1 Amb6713158 [0,2,0,0,0,0|1,0,1]=4 4826 B12R1.71 CCc1ccc(OCC=O)cc1 Amb5731831 [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.71 CCc1ccc(SCC=O)cc1 Amb17082912 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.71 COc1ccc(CCC=O)cc1 Amb6306199 [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.71 COc1ccc(NCC#N)cc1 Amb6714188 [0,2,0,0,0,0|1,0,1]=4 4830 B12R1.71 COc1ccc(NCCCl)cc1 Amb17335808 [0,2,0,0,0,0|1,0,1]=4 4831 B12R1.71 COc1ccc(NCCN)cc1 Amb10604015 [0,2,0,0,0,0|1,0,1]=4 4832 B12R1.71 COc1ccc(NCCO)cc1 Amb6714233 [0,2,0,0,0,0|1,0,1]=4 4833 B12R1.71 COc1ccc(NCCS)cc1 Amb27268333 [0,2,0,0,0,0|1,0,1]=4 4834 B12R1.71 COc1ccc(OCC=O)cc1 Amb5731834 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.71 COc1ccc(SCC=O)cc1 Amb17082908 [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.71 CSc1ccc(CCC=O)cc1 Amb24093033 [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.71 CSc1ccc(NCCCl)cc1 Amb27800989 [0,2,0,0,0,0|1,0,1]=4 4838 B12R1.71 CSc1ccc(NCCF)cc1 Amb27949961 [0,2,0,0,0,0|1,0,1]=4 4839 B12R1.71 CSc1ccc(NCCN)cc1 Amb18243831 [0,2,0,0,0,0|1,0,1]=4 4840 B12R1.71 N#Cc1ccc(CCC=O)cc1 Amb24093122 [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.71 N#Cc1ccc(NCCCl)cc1 Amb17335462 [0,2,0,0,0,0|1,0,1]=4 4842 B12R1.71 N#Cc1ccc(NCCN)cc1 Amb6679323 [0,2,0,0,0,0|1,0,1]=4 4843 B12R1.71 N#Cc1ccc(NCCO)cc1 Amb33526948 [0,2,0,0,0,0|1,0,1]=4 4844 B12R1.71 N#Cc1ccc(OCC=O)cc1 Amb18800495 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.71 N=Nc1ccc(NCCO)cc1 Amb26954590 [0,2,0,0,0,0|1,0,1]=4 4846 B12R1.71 NCc1ccc(NCCF)cc1 Amb27635567 [0,2,0,0,0,0|1,0,1]=4 4847 B12R1.71 NCc1ccc(NCCO)cc1 Amb5786733 [0,2,0,0,0,0|1,0,1]=4 4848 B12R1.71 O=Cc1ccc(NCCO)cc1 Amb8394240 [0,2,0,0,0,0|1,0,1]=4 4849 B12R1.71 O=Nc1ccc(NCCO)cc1 Amb27482840 [0,2,0,0,0,0|1,0,1]=4 4850 B12R1.385 C#CCNc1ccc(F)c(Cl)c1 Amb27267561 [0,2,0,0,0,0|0,0,2]=4 4851 B12R1.385 C#CCNc1ccc(O)c(Cl)c1 Amb27791673 [0,2,0,0,0,0|0,0,2]=4 4852 B12R1.385 C=CCCN1C=CC(=O)C(C)=C1 Amb28345087 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.385 C=CCCN1C=CC(=O)C(N)=C1 Amb32705441 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.385 C=CCCc1ccc(C)c(C)c1 Amb6299318 [0,2,0,0,0,0|1,0,0]=3 4855 B12R1.385 C=CCCc1ccc(Cl)c(C)c1 Amb33252951 [0,2,0,0,0,0|1,0,0]=3 4856 B12R1.385 C=CCCc1ccc(F)c(F)c1 Amb6299385 [0,2,0,0,0,0|1,0,0]=3 4857 B12R1.385 C=CCCc1cnc(C)c(C)c1 Amb30012803 [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.385 C=CCNC1=CC(=O)N(C)C=C1 Amb27758918 [0,2,0,0,0,0|1,0,0]=3 4859 B12R1.385 C=CCNc1cc(C)c(N)cn1 Amb17213760 [0,2,0,0,0,0|1,0,0]=3 4860 B12R1.385 C=CCNc1ccc(Br)c(C)n1 Amb28363968 [0,2,0,0,0,0|1,0,0]=3 4861 B12R1.385 C=CCNc1ccc(Br)c(F)c1 Amb27614588 [0,2,0,0,0,0|0,0,0]=2 4862 B12R1.385 C=CCNc1ccc(C)c(Br)c1 Amb17307018 [0,2,0,0,0,0|0,0,0]=2 4863 B12R1.385 C=CCNc1ccc(C)c(C)c1 Amb17306087 [0,2,0,0,0,0|0,0,0]=2 4864 B12R1.385 C=CCNc1ccc(C)c(F)c1 Amb18792654 [0,2,0,0,0,0|0,0,0]=2 4865 B12R1.385 C=CCNc1ccc(F)c(Cl)c1 Amb17305851 [0,2,0,0,0,0|0,0,0]=2 4866 B12R1.385 C=CCNc1ccc(N)c(C)n1 Amb17213829 [0,2,0,0,0,0|1,0,0]=3 4867 B12R1.385 C=CCNc1ccc(N)c(N)n1 Amb27168533 [0,2,0,0,0,0|1,0,0]=3 4868 B12R1.385 C=CCNc1ncc(F)c(N)n1 Amb26484760 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.385 C=CCOc1cc(C)c(Br)cn1 Amb27979800 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.385 C=CCOc1cc(C)c(N)cn1 Amb28244678 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.385 C=CCOc1ccc(Br)c(C)c1 Amb25883721 [0,2,0,0,0,0|1,0,0]=3 4872 B12R1.385 C=CCOc1ccc(Br)c(Cl)c1 Amb28292626 [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.385 C=CCOc1ccc(Br)c(F)c1 Amb28189578 [0,2,0,0,0,0|1,0,0]=3 4874 B12R1.385 C=CCOc1ccc(C)[n+]([O-])c1 Amb27485803 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.385 C=CCOc1ccc(C)c(C)c1 Amb26605820 [0,2,0,0,0,0|1,0,0]=3 4876 B12R1.385 C=CCOc1ccc(C)c(N)c1 Amb17138559 [0,2,0,0,0,0|1,0,0]=3 4877 B12R1.385 C=CCOc1ccc(Cl)c(C)c1 Amb25283208 [0,2,0,0,0,0|1,0,0]=3 4878 B12R1.385 C=CCOc1ccc(Cl)c(Cl)c1 Amb24361907 [0,2,0,0,0,0|1,0,0]=3 4879 B12R1.385 C=CCOc1ccc(Cl)c(N)c1 Amb17139076 [0,2,0,0,0,0|1,0,0]=3 4880 B12R1.385 C=CCOc1ccc(F)c(Br)c1 Amb25328171 [0,2,0,0,0,0|1,0,0]=3 4881 B12R1.385 C=CCOc1ccc(F)c(Cl)c1 Amb24543710 [0,2,0,0,0,0|1,0,0]=3 4882 B12R1.385 C=CCOc1ccc(I)c(C)c1 Amb27774623 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.385 C=CCOc1ccc(I)c(Cl)c1 Amb27599239 [0,2,0,0,0,0|1,0,0]=3 4884 B12R1.385 C=CCOc1ccc(N)c(C)c1 Amb17138560 [0,2,0,0,0,0|1,0,0]=3 4885 B12R1.385 C=CCOc1ccc(N)c(F)c1 Amb18991658 [0,2,0,0,0,0|1,0,0]=3 4886 B12R1.385 C=CCOc1ccc(N)c(N)c1 Amb24377079 [0,2,0,0,0,0|1,0,0]=3 4887 B12R1.385 C=CCOc1ccc(S)c(O)c1 Amb28202385 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.385 C=CCSc1cc(C)c(Br)cn1 Amb26482022 [0,2,0,0,0,0|2,0,0]=4 4889 B12R1.385 C=CCSc1ccc(C)c(Cl)c1 Amb25321211 [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.385 C=CCSc1ccc(C)c(F)c1 Amb25114672 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.385 C=CCSc1ccc(Cl)c(C)c1 Amb25074497 [0,2,0,0,0,0|1,0,0]=3 4892 B12R1.385 C=CCSc1ccc(F)c(C)c1 Amb27803850 [0,2,0,0,0,0|1,0,0]=3 4893 B12R1.385 C=CCSc1ccc(F)c(Cl)c1 Amb25870342 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.385 C=CCSc1ccc(N)c(F)c1 Amb27875916 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.385 C=CCSc1ccc(N)c(N)c1 Amb27462179 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.385 CCCNc1ccc(Br)c(C)c1 Amb6691699 [0,2,0,0,0,0|0,0,2]=4 4897 B12R1.385 CCCNc1ccc(C)c(Br)c1 Amb17142401 [0,2,0,0,0,0|0,0,2]=4 4898 B12R1.385 CCCNc1ccc(C)c(C)c1 Amb33328942 [0,2,0,0,0,0|0,0,2]=4 4899 B12R1.385 CCCNc1ccc(C)c(C)c1 Amb4313504 [0,2,0,0,0,0|0,0,2]=4 4900 B12R1.385 CCCNc1ccc(C)c(Cl)c1 Amb33328911 [0,2,0,0,0,0|0,0,2]=4 4901 B12R1.385 CCCNc1ccc(C)c(Cl)c1 Amb6687850 [0,2,0,0,0,0|0,0,2]=4 4902 B12R1.385 CCCNc1ccc(C)c(O)c1 Amb28321168 [0,2,0,0,0,0|0,0,2]=4 4903 B12R1.385 CCCNc1ccc(Cl)c(C)c1 Amb27149944 [0,2,0,0,0,0|0,0,2]=4 4904 B12R1.385 CCCNc1ccc(Cl)c(C)c1 Amb33328912 [0,2,0,0,0,0|0,0,2]=4 4905 B12R1.385 CCCNc1ccc(Cl)c(Cl)c1 Amb30584829 [0,2,0,0,0,0|0,0,2]=4 4906 B12R1.385 CCCNc1ccc(Cl)c(Cl)c1 Amb4313514 [0,2,0,0,0,0|0,0,2]=4 4907 B12R1.385 CCCNc1ccc(Cl)c(O)c1 Amb27808716 [0,2,0,0,0,0|0,0,2]=4 4908 B12R1.385 CCCNc1ccc(F)c(Cl)c1 Amb7772586 [0,2,0,0,0,0|0,0,2]=4 4909 B12R1.385 CCCNc1ccc(F)c(F)c1 Amb6694998 [0,2,0,0,0,0|0,0,2]=4 4910 B12R1.385 CCCNc1ccc(N)c(N)c1 Amb27179602 [0,2,0,0,0,0|0,0,2]=4 4911 B12R1.385 CCCNc1ccc(O)c(Cl)c1 Amb27863348 [0,2,0,0,0,0|0,0,2]=4 4912 B12R1.385 CCCNc1ccc(O)c(F)c1 Amb28047172 [0,2,0,0,0,0|0,0,2]=4 4913 B12R1.385 COCNc1ccc(Cl)c(Cl)c1 Amb27873523 [0,2,0,0,0,0|1,0,1]=4 4914 B12R1.385 Cc1cc(CCC=O)ccc1Br Amb18070236 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.385 Cc1cc(CCC=O)ccc1Cl Amb28146066 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.385 Cc1cc(CCC=O)ccc1F Amb25682112 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.385 Cc1cc(CCC=O)ccc1I Amb24603486 [0,2,0,0,0,0|2,0,0]=4 4918 B12R1.385 Cc1cc(CCC=O)ccc1N Amb27616080 [0,2,0,0,0,0|2,0,0]=4 4919 B12R1.385 Cc1cc(NCC#N)ccc1Br Amb6709950 [0,2,0,0,0,0|1,0,1]=4 4920 B12R1.385 Cc1cc(NCC#N)ccc1Cl Amb27402694 [0,2,0,0,0,0|1,0,1]=4 4921 B12R1.385 Cc1cc(NCCCl)ccc1Br Amb17351917 [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.385 Cc1cc(NCCN)ccc1Br Amb17091077 [0,2,0,0,0,0|1,0,1]=4 4923 B12R1.385 Cc1cc(NCCN)ccc1O Amb27476632 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.385 Cc1cc(NCCO)ccc1Br Amb6709985 [0,2,0,0,0,0|1,0,1]=4 4925 B12R1.385 Cc1cc(NCCO)ccc1F Amb18301456 [0,2,0,0,0,0|1,0,1]=4 4926 B12R1.385 Cc1cc(OCC=O)ccc1Br Amb17099969 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.385 Cc1cc(OCC=O)ccc1Cl Amb5731848 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.385 Cc1cc(OCC=O)ccc1F Amb27825819 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.385 Cc1cc(SCC=O)ccc1Cl Amb17082933 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.385 Cc1cc(SCC=O)ccc1F Amb17082916 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.385 Cc1ccc(CCC=O)cc1Br Amb18069967 [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.385 Cc1ccc(CCC=O)cc1C Amb18798124 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.385 Cc1ccc(CCC=O)cc1Cl Amb18564229 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.385 Cc1ccc(CCC=O)cc1F Amb24093026 [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.385 Cc1ccc(CCC=O)cc1N Amb27962410 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.385 Cc1ccc(CCC=O)cc1O Amb26625979 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.385 Cc1ccc(NCC#N)cc1Br Amb17406667 [0,2,0,0,0,0|1,0,1]=4 4938 B12R1.385 Cc1ccc(NCC#N)cc1C Amb6711778 [0,2,0,0,0,0|1,0,1]=4 4939 B12R1.385 Cc1ccc(NCC#N)cc1Cl Amb6707892 [0,2,0,0,0,0|1,0,1]=4 4940 B12R1.385 Cc1ccc(NCCCl)cc1Br Amb17351914 [0,2,0,0,0,0|1,0,1]=4 4941 B12R1.385 Cc1ccc(NCCCl)cc1C Amb17335663 [0,2,0,0,0,0|1,0,1]=4 4942 B12R1.385 Cc1ccc(NCCCl)cc1Cl Amb17338054 [0,2,0,0,0,0|1,0,1]=4 4943 B12R1.385 Cc1ccc(NCCN)cc1Br Amb17091063 [0,2,0,0,0,0|1,0,1]=4 4944 B12R1.385 Cc1ccc(NCCN)cc1C Amb17091052 [0,2,0,0,0,0|1,0,1]=4 4945 B12R1.385 Cc1ccc(NCCN)cc1Cl Amb17091060 [0,2,0,0,0,0|1,0,1]=4 4946 B12R1.385 Cc1ccc(NCCO)cc1Br Amb17307023 [0,2,0,0,0,0|1,0,1]=4 4947 B12R1.385 Cc1ccc(NCCO)cc1C Amb6711821 [0,2,0,0,0,0|1,0,1]=4 4948 B12R1.385 Cc1ccc(NCCO)cc1Cl Amb6707927 [0,2,0,0,0,0|1,0,1]=4 4949 B12R1.385 Cc1ccc(NCCO)cc1O Amb8393230 [0,2,0,0,0,0|1,0,1]=4 4950 B12R1.385 Cc1ccc(OCC=O)cc1C Amb5731823 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.385 Cc1ccc(OCC=O)cc1F Amb27465764 [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.385 Cc1ccc(SCC=O)cc1C Amb17082909 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.385 ClCCNc1ccc(Cl)c(Cl)c1 Amb17343162 [0,2,0,0,0,0|1,0,1]=4 4954 B12R1.385 FCCNc1ccc(Br)c(I)c1 Amb28245116 [0,2,0,0,0,0|1,0,1]=4 4955 B12R1.385 FCCNc1ccc(I)c(Br)c1 Amb28423188 [0,2,0,0,0,0|1,0,1]=4 4956 B12R1.385 Fc1ccc(NCCCl)cc1Cl Amb17338959 [0,2,0,0,0,0|1,0,1]=4 4957 B12R1.385 N#CCNc1ccc(Cl)c(Cl)c1 Amb6710940 [0,2,0,0,0,0|1,0,1]=4 4958 B12R1.385 N#CCNc1ccc(F)c(Cl)c1 Amb17401045 [0,2,0,0,0,0|1,0,1]=4 4959 B12R1.385 N#CCNc1ccc(F)c(F)c1 Amb6711583 [0,2,0,0,0,0|1,0,1]=4 4960 B12R1.385 N#CCNc1ccc(I)c(Br)c1 Amb27831054 [0,2,0,0,0,0|1,0,1]=4 4961 B12R1.385 NCCNc1ccc(Cl)c(Cl)c1 Amb17091080 [0,2,0,0,0,0|1,0,1]=4 4962 B12R1.385 NCCNc1ccc(Cl)c(O)c1 Amb28119003 [0,2,0,0,0,0|1,0,1]=4 4963 B12R1.385 NCCNc1ccc(F)c(Cl)c1 Amb17057760 [0,2,0,0,0,0|1,0,1]=4 4964 B12R1.385 NCCNc1ccc(F)c(F)c1 Amb17057762 [0,2,0,0,0,0|1,0,1]=4 4965 B12R1.385 NCCNc1ccc(O)c(O)c1 Amb28140786 [0,2,0,0,0,0|1,0,1]=4 4966 B12R1.385 Nc1cc(CCC=O)ccc1F Amb27209902 [0,2,0,0,0,0|2,0,0]=4 4967 B12R1.385 Nc1cc(CCC=O)ccc1S Amb27864232 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.385 Nc1cc(NCCO)ccc1O Amb28141979 [0,2,0,0,0,0|1,0,1]=4 4969 B12R1.385 Nc1ccc(CCC=O)cc1Br Amb27847020 [0,2,0,0,0,0|2,0,0]=4 4970 B12R1.385 Nc1ccc(CCC=O)cc1F Amb27798934 [0,2,0,0,0,0|2,0,0]=4 4971 B12R1.385 Nc1ccc(CCC=O)cc1S Amb27792278 [0,2,0,0,0,0|2,0,0]=4 4972 B12R1.385 O=CCCc1ccc(Br)c(Br)c1 Amb25301219 [0,2,0,0,0,0|2,0,0]=4 4973 B12R1.385 O=CCCc1ccc(Br)c(Cl)c1 Amb26567218 [0,2,0,0,0,0|2,0,0]=4 4974 B12R1.385 O=CCCc1ccc(Br)c(F)c1 Amb25733243 [0,2,0,0,0,0|2,0,0]=4 4975 B12R1.385 O=CCCc1ccc(Br)c(I)c1 Amb25301482 [0,2,0,0,0,0|2,0,0]=4 4976 B12R1.385 O=CCCc1ccc(Br)c(O)c1 Amb24341987 [0,2,0,0,0,0|2,0,0]=4 4977 B12R1.385 O=CCCc1ccc(Br)c(S)c1 Amb27638357 [0,2,0,0,0,0|2,0,0]=4 4978 B12R1.385 O=CCCc1ccc(Cl)c(Br)c1 Amb24382161 [0,2,0,0,0,0|2,0,0]=4 4979 B12R1.385 O=CCCc1ccc(Cl)c(Cl)c1 Amb24093018 [0,2,0,0,0,0|2,0,0]=4 4980 B12R1.385 O=CCCc1ccc(Cl)c(F)c1 Amb25836345 [0,2,0,0,0,0|2,0,0]=4 4981 B12R1.385 O=CCCc1ccc(Cl)c(I)c1 Amb25690980 [0,2,0,0,0,0|2,0,0]=4 4982 B12R1.385 O=CCCc1ccc(F)c(Br)c1 Amb24093021 [0,2,0,0,0,0|2,0,0]=4 4983 B12R1.385 O=CCCc1ccc(F)c(Cl)c1 Amb18564403 [0,2,0,0,0,0|2,0,0]=4 4984 B12R1.385 O=CCCc1ccc(F)c(F)c1 Amb18563918 [0,2,0,0,0,0|2,0,0]=4 4985 B12R1.385 O=CCCc1ccc(F)c(O)c1 Amb25360910 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.385 O=CCCc1ccc(F)c(S)c1 Amb27263901 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.385 O=CCCc1ccc(I)c(Br)c1 Amb27606295 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.385 O=CCCc1ccc(I)c(Cl)c1 Amb25268272 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.385 O=CCCc1ccc(I)c(F)c1 Amb26995809 [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.385 O=CCCc1ccc(I)c(I)c1 Amb27208788 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.385 O=CCCc1ccc(I)c(O)c1 Amb26608948 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.385 O=CCCc1ccc(O)c(Br)c1 Amb27750842 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.385 O=CCCc1ccc(O)c(Cl)c1 Amb25150852 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.385 O=CCCc1ccc(O)c(F)c1 Amb26895467 [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.385 O=CCCc1ccc(O)c(I)c1 Amb24758933 [0,2,0,0,0,0|2,0,0]=4 4996 B12R1.385 O=CCCc1ccc(O)c(O)c1 Amb26948669 [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.385 O=CCOc1ccc(Cl)c(Cl)c1 Amb5731861 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.385 O=CCOc1ccc(F)c(Cl)c1 Amb18330026 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.385 O=CCOc1ccc(F)c(F)c1 Amb18807300 [0,2,0,0,0,0|2,0,0]=4 5000 B12R1.385 O=CCOc1ccc(O)c(Cl)c1 Amb27828941 [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.385 O=CCSc1ccc(Cl)c(Cl)c1 Amb17082918 [0,2,0,0,0,0|2,0,0]=4 5002 B12R1.385 O=CCSc1ccc(F)c(F)c1 Amb19077116 [0,2,0,0,0,0|2,0,0]=4 5003 B12R1.385 OCCNc1ccc(Cl)c(Cl)c1 Amb6710964 [0,2,0,0,0,0|1,0,1]=4 5004 B12R1.385 OCCNc1ccc(F)c(Cl)c1 Amb17305858 [0,2,0,0,0,0|1,0,1]=4 5005 B12R1.385 OCCNc1ccc(F)c(F)c1 Amb6711633 [0,2,0,0,0,0|1,0,1]=4 5006 B12R1.385 OCCNc1ccc(O)c(Cl)c1 Amb27403676 [0,2,0,0,0,0|1,0,1]=4 5007 B12R1.3 C=CCC(C#N)c1ccccc1 Amb17593937 [0,2,0,0,0,0|1,0,0]=3 5008 B12R1.3 C=CCC(C=O)c1ccccc1 Amb18645372 [0,2,0,0,0,0|1,0,0]=3 5009 B12R1.3 C=CCC(CBr)c1ccccc1 Amb32688906 [0,2,0,0,0,0|1,0,0]=3 5010 B12R1.3 C=CCC(CCl)c1ccccc1 Amb32688904 [0,2,0,0,0,0|1,0,0]=3 5011 B12R1.3 C=CCC(CN)c1ccccc1 Amb18126304 [0,2,0,0,0,0|1,0,0]=3 5012 B12R1.3 C=CCC(CO)c1ccccc1 Amb32665506 [0,2,0,0,0,0|1,0,0]=3 5013 B12R1.3 CCCN(C#N)c1ccccc1 Amb27434318 [0,2,0,0,0,0|0,0,2]=4 5014 B12R1.3 CCN(CCCl)c1ccccc1 Amb8392941 [0,2,0,0,0,0|1,0,1]=4 5015 B12R1.3 CCN(CCN)c1ccccc1 Amb1136918 [0,2,0,0,0,0|1,0,1]=4 5016 B12R1.3 CCN(CCN)c1ccccc1 Amb33266057 [0,2,0,0,0,0|1,0,1]=4 5017 B12R1.3 CCN(CCO)c1ccccc1 Amb1208392 [0,2,0,0,0,0|1,0,1]=4 5018 B12R1.3 CCN(CCS)c1ccccc1 Amb13881733 [0,2,0,0,0,0|1,0,1]=4 5019 B12R1.17 C=CCC(=O)c1cccc(Br)c1 Amb17343201 [0,2,0,0,0,0|1,0,0]=3 5020 B12R1.17 C=CCC(=O)c1cccc(C)c1 Amb17334498 [0,2,0,0,0,0|1,0,0]=3 5021 B12R1.17 C=CCC(=O)c1cccc(Cl)c1 Amb17335457 [0,2,0,0,0,0|1,0,0]=3 5022 B12R1.17 C=CCC(=O)c1cccc(F)c1 Amb18788273 [0,2,0,0,0,0|1,0,0]=3 5023 B12R1.17 C=CCC(=O)c1cccc(I)c1 Amb27601489 [0,2,0,0,0,0|1,0,0]=3 5024 B12R1.17 C=CCC(=O)c1cccc(N)n1 Amb27167757 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.17 C=CCC(=O)c1cccc(O)c1 Amb17334559 [0,2,0,0,0,0|1,0,0]=3 5026 B12R1.17 C=CCC(=O)c1ccnc(Cl)c1 Amb27173935 [0,2,0,0,0,0|2,0,0]=4 5027 B12R1.17 C=CCC(=O)c1cncc(C)c1 Amb27416378 [0,2,0,0,0,0|2,0,0]=4 5028 B12R1.17 C=CCC(=O)c1cncc(Cl)c1 Amb27760584 [0,2,0,0,0,0|2,0,0]=4 5029 B12R1.17 C=CCC(N)c1cc(Cl)ccn1 Amb25084587 [0,2,0,0,0,0|2,0,0]=4 5030 B12R1.17 C=CCC(N)c1cc(N)ccn1 Amb28287654 [0,2,0,0,0,0|2,0,0]=4 5031 B12R1.17 C=CCC(N)c1cccc(C)c1 Amb18977591 [0,2,0,0,0,0|1,0,0]=3 5032 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,2,0,0,0,0|1,0,0]=3 5033 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb33623157 [0,2,0,0,0,0|1,0,0]=3 5034 B12R1.17 C=CCC(N)c1cccc(Cl)n1 Amb27413047 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.17 C=CCC(N)c1cccc(N)n1 Amb28282666 [0,2,0,0,0,0|2,0,0]=4 5036 B12R1.17 C=CCC(N)c1cccc(O)n1 Amb28073966 [0,2,0,0,0,0|2,0,0]=4 5037 B12R1.17 C=CCC(N)c1ccnc(O)c1 Amb27832409 [0,2,0,0,0,0|2,0,0]=4 5038 B12R1.17 C=CCC(N)c1cncc(Br)c1 Amb25313265 [0,2,0,0,0,0|2,0,0]=4 5039 B12R1.17 C=CCC(N)c1cncc(Cl)c1 Amb27596530 [0,2,0,0,0,0|2,0,0]=4 5040 B12R1.17 C=CCC(N)c1cncc(F)c1 Amb28365608 [0,2,0,0,0,0|2,0,0]=4 5041 B12R1.17 C=CCC(O)c1cccc(Br)c1 Amb2685396 [0,2,0,0,0,0|1,0,0]=3 5042 B12R1.17 C=CCC(O)c1cccc(C)c1 Amb18177788 [0,2,0,0,0,0|1,0,0]=3 5043 B12R1.17 C=CCC(O)c1cccc(Cl)c1 Amb2686331 [0,2,0,0,0,0|1,0,0]=3 5044 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,2,0,0,0,0|1,0,0]=3 5045 B12R1.17 C=CCC(O)c1cccc(I)c1 Amb27878433 [0,2,0,0,0,0|1,0,0]=3 5046 B12R1.17 C=CCC(O)c1cccc(N)n1 Amb35743350 [0,2,0,0,0,0|2,0,0]=4 5047 B12R1.17 C=CCC(O)c1ccnc(Cl)c1 Amb27595961 [0,2,0,0,0,0|2,0,0]=4 5048 B12R1.17 C=CCC(O)c1cncc(Cl)c1 Amb27801368 [0,2,0,0,0,0|2,0,0]=4 5049 B12R1.17 C=CCN(C)c1cc(Br)ncn1 Amb35677338 [0,2,0,0,0,0|2,0,0]=4 5050 B12R1.17 C=CCN(C)c1cc(F)ncn1 Amb35677330 [0,2,0,0,0,0|2,0,0]=4 5051 B12R1.17 C=CCN(C)c1cc(N)ccn1 Amb28363648 [0,2,0,0,0,0|1,0,0]=3 5052 B12R1.17 C=CCN(C)c1cccc(Br)n1 Amb35677335 [0,2,0,0,0,0|1,0,0]=3 5053 B12R1.17 C=CCN(C)c1cccc(C)c1 Amb27604925 [0,2,0,0,0,0|0,0,0]=2 5054 B12R1.17 C=CCN(C)c1cccc(Cl)n1 Amb35677332 [0,2,0,0,0,0|1,0,0]=3 5055 B12R1.17 C=CCN(C)c1cccc(F)c1 Amb28063447 [0,2,0,0,0,0|0,0,0]=2 5056 B12R1.17 C=CCN(C)c1cccc(F)n1 Amb35677329 [0,2,0,0,0,0|1,0,0]=3 5057 B12R1.17 C=CCN(C)c1cccc(N)c1 Amb27208329 [0,2,0,0,0,0|0,0,0]=2 5058 B12R1.17 C=CCN(C)c1ccnc(Cl)c1 Amb35677331 [0,2,0,0,0,0|1,0,0]=3 5059 B12R1.17 C=CCN(C)c1ccnc(Cl)n1 Amb28189232 [0,2,0,0,0,0|2,0,0]=4 5060 B12R1.17 C=CCN(C)c1ccnc(F)c1 Amb35677328 [0,2,0,0,0,0|1,0,0]=3 5061 B12R1.17 C=CCN(C)c1ccnc(F)n1 Amb35610898 [0,2,0,0,0,0|2,0,0]=4 5062 B12R1.17 C=CCN(C)c1ccnc(N)c1 Amb27881225 [0,2,0,0,0,0|1,0,0]=3 5063 B12R1.17 C=CCN(C)c1ccnc(N)n1 Amb27972000 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.17 C=CCN(C)c1cncc(Br)c1 Amb35677336 [0,2,0,0,0,0|1,0,0]=3 5065 B12R1.17 C=CCN(C)c1cncc(Cl)n1 Amb27766191 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.17 C=CCN(C)c1cncc(F)n1 Amb35610900 [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.17 C=CCN(C)c1cncc(N)c1 Amb29854698 [0,2,0,0,0,0|1,0,0]=3 5068 B12R1.17 C=CCN(C)c1cncc(N)n1 Amb28313166 [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.17 C=CC[C@@H](N)c1cc(Cl)ccn1 Amb25680128 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.17 C=CC[C@@H](N)c1cccc(F)c1 Amb27595583 [0,2,0,0,0,0|1,0,0]=3 5071 B12R1.17 C=CC[C@@H](N)c1cccc(O)c1 Amb27810779 [0,2,0,0,0,0|1,0,0]=3 5072 B12R1.17 C=CC[C@@H](N)c1ccnc(Br)c1 Amb27799969 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.17 C=CC[C@@H](N)c1ccnc(Cl)c1 Amb27883360 [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.17 C=CC[C@@H](N)c1ccnc(N)c1 Amb28314332 [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.17 C=CC[C@@H](N)c1ccnc(O)c1 Amb27602747 [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.17 C=CC[C@@H](O)c1cccc(C)c1 Amb27244794 [0,2,0,0,0,0|1,0,0]=3 5077 B12R1.17 C=CC[C@@H](O)c1cccc(C)n1 Amb27981958 [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.17 C=CC[C@@H](O)c1cccc(Cl)c1 Amb27954584 [0,2,0,0,0,0|1,0,0]=3 5079 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,2,0,0,0,0|1,0,0]=3 5080 B12R1.17 C=CC[C@H](N)c1cccc(F)c1 Amb27170776 [0,2,0,0,0,0|1,0,0]=3 5081 B12R1.17 C=CC[C@H](N)c1cccc(N)c1 Amb27425199 [0,2,0,0,0,0|1,0,0]=3 5082 B12R1.17 C=CC[C@H](N)c1cccc(O)n1 Amb28340910 [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.17 C=CC[C@H](N)c1cccc(S)c1 Amb28146702 [0,2,0,0,0,0|1,0,0]=3 5084 B12R1.17 C=CC[C@H](N)c1ccnc(Br)c1 Amb27647592 [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.17 C=CC[C@H](N)c1ccnc(O)c1 Amb27602189 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.17 C=CC[C@H](N)c1cncc(C)c1 Amb27592481 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.17 C=CC[C@H](N)c1cncc(Cl)c1 Amb27389228 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.17 C=CC[C@H](N)c1cncc(O)c1 Amb27882726 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.17 C=CC[C@H](O)c1cccc(Br)c1 Amb28399563 [0,2,0,0,0,0|1,0,0]=3 5090 B12R1.17 CN(CC#N)c1cccc(Br)c1 Amb17343207 [0,2,0,0,0,0|1,0,1]=4 5091 B12R1.17 CN(CC#N)c1cccc(Cl)c1 Amb17335464 [0,2,0,0,0,0|1,0,1]=4 5092 B12R1.17 CN(CC#N)c1cccc(F)c1 Amb17334604 [0,2,0,0,0,0|1,0,1]=4 5093 B12R1.17 CN(CC#N)c1cccc(O)c1 Amb28281647 [0,2,0,0,0,0|1,0,1]=4 5094 B12R1.17 CN(CCCl)c1cccc(Br)c1 Amb17351920 [0,2,0,0,0,0|1,0,1]=4 5095 B12R1.17 CN(CCCl)c1cccc(Cl)c1 Amb17338056 [0,2,0,0,0,0|1,0,1]=4 5096 B12R1.17 CN(CCCl)c1cccc(F)c1 Amb17335953 [0,2,0,0,0,0|1,0,1]=4 5097 B12R1.17 CN(CCF)c1cccc(N)c1 Amb27614743 [0,2,0,0,0,0|1,0,1]=4 5098 B12R1.17 CN(CCN)c1cccc(Br)c1 Amb17059773 [0,2,0,0,0,0|1,0,1]=4 5099 B12R1.17 CN(CCN)c1cccc(Cl)c1 Amb17059646 [0,2,0,0,0,0|1,0,1]=4 5100 B12R1.17 CN(CCN)c1cccc(F)c1 Amb17059643 [0,2,0,0,0,0|1,0,1]=4 5101 B12R1.17 CN(CCO)c1cccc(Br)c1 Amb17344452 [0,2,0,0,0,0|1,0,1]=4 5102 B12R1.17 CN(CCO)c1cccc(Cl)c1 Amb17335811 [0,2,0,0,0,0|1,0,1]=4 5103 B12R1.17 CN(CCO)c1cccc(F)c1 Amb17334765 [0,2,0,0,0,0|1,0,1]=4 5104 B12R1.17 Cc1cccc(C(=O)CC=O)c1 Amb18788116 [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.17 Cc1cccc(N(C)CC#N)c1 Amb17334502 [0,2,0,0,0,0|1,0,1]=4 5106 B12R1.17 Cc1cccc(N(C)CCBr)c1 Amb27751471 [0,2,0,0,0,0|1,0,1]=4 5107 B12R1.17 Cc1cccc(N(C)CCCl)c1 Amb17335671 [0,2,0,0,0,0|1,0,1]=4 5108 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb17059641 [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.17 Cc1cccc(N(C)CCN)c1 Amb33446965 [0,2,0,0,0,0|1,0,1]=4 5110 B12R1.17 Cc1cccc(N(C)CCO)c1 Amb17334644 [0,2,0,0,0,0|1,0,1]=4 5111 B12R1.17 O=CCC(=O)c1cccc(Br)c1 Amb9204925 [0,2,0,0,0,0|2,0,0]=4 5112 B12R1.17 O=CCC(=O)c1cccc(Cl)c1 Amb7766342 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.17 O=CCC(=O)c1cccc(F)c1 Amb9204905 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.17 O=CCC(O)c1cccc(I)c1 Amb28066980 [0,2,0,0,0,0|2,0,0]=4 5115 B12R1.30 C#CCCN(C)c1ccccc1 Amb10559135 [0,2,0,0,0,0|0,0,2]=4 5116 B12R1.30 C#CCNC(=O)c1ccccc1 Amb4406905 [0,2,0,0,0,0|0,0,2]=4 5117 B12R1.30 C#CCNC(C)c1ccccc1 Amb2721857 [0,2,0,0,0,0|0,0,2]=4 5118 B12R1.30 C#CCN[C@H](C)c1ccccc1 Amb27389242 [0,2,0,0,0,0|0,0,2]=4 5119 B12R1.30 C=C=CCC(=O)c1ccccc1 Amb27177995 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.30 C=C=CCC(O)c1ccccc1 Amb27484788 [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.30 C=C=CC[C@@H](O)c1ccccc1 Amb27977896 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.30 C=CC#CC(=O)c1ccccc1 Amb27802550 [0,2,0,0,0,0|1,0,1]=4 5123 B12R1.30 C=CCCC(=O)c1ccccc1 Amb9031540 [0,2,0,0,0,0|1,0,0]=3 5124 B12R1.30 C=CCCC(C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|1,0,0]=3 5125 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|1,0,0]=3 5126 B12R1.30 C=CCCC(O)c1ccccc1 Amb18800658 [0,2,0,0,0,0|1,0,0]=3 5127 B12R1.30 C=CCCC(O)c1ccccn1 Amb2697236 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.30 C=CCCC(O)c1cccnc1 Amb2697234 [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.30 C=CCCC(O)c1ccncc1 Amb2697235 [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.30 C=CCNC(=N)c1ccccc1 Amb26517100 [0,2,0,0,0,0|0,0,0]=2 5131 B12R1.30 C=CCNC(=O)c1ccccc1 Amb3098985 [0,2,0,0,0,0|0,0,0]=2 5132 B12R1.30 C=CCNC(=O)c1ccccn1 Amb26950124 [0,2,0,0,0,0|1,0,0]=3 5133 B12R1.30 C=CCNC(=O)c1cccnc1 Amb17794173 [0,2,0,0,0,0|1,0,0]=3 5134 B12R1.30 C=CCNC(=S)c1ccccc1 Amb27482551 [0,2,0,0,0,0|0,0,0]=2 5135 B12R1.30 C=CCNC(C)c1ccccc1 Amb6683836 [0,2,0,0,0,0|0,0,0]=2 5136 B12R1.30 C=CCNC(C)c1ccccn1 Amb6683854 [0,2,0,0,0,0|1,0,0]=3 5137 B12R1.30 C=CCNC(C)c1cccnc1 Amb6683856 [0,2,0,0,0,0|1,0,0]=3 5138 B12R1.30 C=CCNC(C)c1ccncc1 Amb6683855 [0,2,0,0,0,0|1,0,0]=3 5139 B12R1.30 C=CCOC(=O)c1ccccc1 Amb4034453 [0,2,0,0,0,0|1,0,0]=3 5140 B12R1.30 C=CCOC(=O)c1cccnc1 Amb2780585 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.30 C=CCOC(=O)c1ccncc1 Amb22730922 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.30 C=C\C=C\C(=O)c1ccccc1 Amb27267134 [0,2,0,0,0,0|1,0,1]=4 5143 B12R1.30 C=C\C=C\N(C)c1ccccc1 Amb27875410 [0,2,0,0,0,0|0,0,1]=3 5144 B12R1.30 CC#CCN(C)c1ccccc1 Amb28197101 [0,2,0,0,0,0|0,0,2]=4 5145 B12R1.30 CC(CCC=O)c1ccccc1 Amb18645711 [0,2,0,0,0,0|1,0,1]=4 5146 B12R1.30 CC(CNC=O)c1ccccc1 Amb27776616 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.30 CC(NCC#N)c1ccccc1 Amb6706903 [0,2,0,0,0,0|1,0,1]=4 5148 B12R1.30 CC(NCCCl)c1ccccc1 Amb17335659 [0,2,0,0,0,0|1,0,1]=4 5149 B12R1.30 CC(NCCN)c1ccccc1 Amb17091024 [0,2,0,0,0,0|1,0,1]=4 5150 B12R1.30 CC(NCCO)c1ccccc1 Amb2092663 [0,2,0,0,0,0|1,0,1]=4 5151 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb33042868 [0,2,0,0,0,0|1,0,1]=4 5152 B12R1.30 CCCCN(N)c1ccccc1 Amb17226670 [0,2,0,0,0,0|0,0,2]=4 5153 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,2,0,0,0,0|0,0,2]=4 5154 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [0,2,0,0,0,0|0,0,2]=4 5155 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [0,2,0,0,0,0|0,0,2]=4 5156 B12R1.30 CN(C#CC=O)c1ccccc1 Amb27830078 [0,2,0,0,0,0|0,0,2]=4 5157 B12R1.30 CN(CCC#N)c1ccccc1 Amb6357793 [0,2,0,0,0,0|0,0,2]=4 5158 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664174 [0,2,0,0,0,0|0,0,2]=4 5159 B12R1.30 CN(CCCBr)c1ccccc1 Amb32664423 [0,2,0,0,0,0|0,0,2]=4 5160 B12R1.30 CN(CCCCl)c1ccccc1 Amb17335669 [0,2,0,0,0,0|0,0,2]=4 5161 B12R1.30 CN(CCCN)c1ccccc1 Amb2786601 [0,2,0,0,0,0|0,0,2]=4 5162 B12R1.30 CN(CCCO)c1ccccc1 Amb9246590 [0,2,0,0,0,0|0,0,2]=4 5163 B12R1.30 CN(CCON)c1ccccc1 Amb17104857 [0,2,0,0,0,0|1,0,1]=4 5164 B12R1.30 CN(C\C=C\Cl)c1ccccc1 Amb27409057 [0,2,0,0,0,0|0,0,0]=2 5165 B12R1.30 CN(\C=C/C=O)c1ccccc1 Amb27848292 [0,2,0,0,0,0|0,0,1]=3 5166 B12R1.30 CN(\C=C\C=O)c1ccccc1 Amb34006653 [0,2,0,0,0,0|0,0,1]=3 5167 B12R1.30 CNCCN(C)c1ccccc1 Amb6715077 [0,2,0,0,0,0|0,0,2]=4 5168 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [0,2,0,0,0,0|1,0,1]=4 5169 B12R1.30 CSCNC(=O)c1ccccc1 Amb28208358 [0,2,0,0,0,0|1,0,1]=4 5170 B12R1.30 C[C@@H](NCCCl)c1ccccc1 Amb30621967 [0,2,0,0,0,0|1,0,1]=4 5171 B12R1.30 C[C@@H](NCCO)c1ccccc1 Amb2721786 [0,2,0,0,0,0|1,0,1]=4 5172 B12R1.30 C[C@H](NCC#N)c1ccccc1 Amb27413002 [0,2,0,0,0,0|1,0,1]=4 5173 B12R1.30 C[C@H](NCCO)c1ccccc1 Amb2698698 [0,2,0,0,0,0|1,0,1]=4 5174 B12R1.30 C\C(=C\CC=O)c1ccccc1 Amb24757521 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.30 C\C=C/CC(N)c1ccccc1 Amb28140782 [0,2,0,0,0,0|1,0,0]=3 5176 B12R1.30 C\C=C\CC(C)c1ccccc1 Amb26891020 [0,2,0,0,0,0|1,0,0]=3 5177 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,2,0,0,0,0|0,0,0]=2 5178 B12R1.30 C\C=C\CS(=O)c1ccccc1 Amb28365911 [0,2,0,0,0,0|1,0,0]=3 5179 B12R1.30 C\C=C\CS(=O)c1ccccn1 Amb27665090 [0,2,0,0,0,0|2,0,0]=4 5180 B12R1.30 C\C=C\C[C@H](O)c1ccccc1 Amb28241948 [0,2,0,0,0,0|1,0,0]=3 5181 B12R1.30 C\C=C\NC(=O)c1ccccc1 Amb27800283 [0,2,0,0,0,0|0,0,2]=4 5182 B12R1.30 C\C=C\NC(C)c1ccccc1 Amb27791879 [0,2,0,0,0,0|0,0,2]=4 5183 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,2,0,0,0,0|1,0,1]=4 5184 B12R1.30 C\C=N\C[C@H](O)c1ccccc1 Amb27472643 [0,2,0,0,0,0|1,0,1]=4 5185 B12R1.30 C\C=N\NC(=O)c1ccccc1 Amb4431611 [0,2,0,0,0,0|1,0,1]=4 5186 B12R1.30 N#CCNC(=O)c1ccccc1 Amb6346069 [0,2,0,0,0,0|1,0,1]=4 5187 B12R1.30 N=C(NCCO)c1ccccc1 Amb26974089 [0,2,0,0,0,0|1,0,1]=4 5188 B12R1.30 N=CNNC(=O)c1ccccc1 Amb27179869 [0,2,0,0,0,0|2,0,0]=4 5189 B12R1.30 NCCNC(=O)c1ccccc1 Amb302802 [0,2,0,0,0,0|1,0,1]=4 5190 B12R1.30 NCCNC(=O)c1ccccc1 Amb6662646 [0,2,0,0,0,0|1,0,1]=4 5191 B12R1.30 O=C(NCCCl)c1ccccc1 Amb2414312 [0,2,0,0,0,0|1,0,1]=4 5192 B12R1.30 O=C(NCCI)c1ccccc1 Amb22753771 [0,2,0,0,0,0|1,0,1]=4 5193 B12R1.30 O=C(NCCO)c1ccccc1 Amb4318140 [0,2,0,0,0,0|1,0,1]=4 5194 B12R1.30 O=C(NCCS)c1ccccc1 Amb26616512 [0,2,0,0,0,0|1,0,1]=4 5195 B12R1.30 O=C(O\C=C\Cl)c1ccccc1 Amb26397046 [0,2,0,0,0,0|2,0,0]=4 5196 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,2,0,0,0,0|1,0,0]=3 5197 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,2,0,0,0,0|2,0,0]=4 5198 B12R1.30 O=CNCC(=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|2,0,0]=4 5199 B12R1.30 O=CNCC(O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|2,0,0]=4 5200 B12R1.30 O=CNNC(=O)c1ccccc1 Amb27406610 [0,2,0,0,0,0|2,0,0]=4 5201 B12R1.30 O=C\C=C\C(O)c1ccccc1 Amb18645664 [0,2,0,0,0,0|1,0,1]=4 5202 B12R1.30 O=C\C=C\[C@@H](O)c1ccccc1 Amb28239465 [0,2,0,0,0,0|1,0,1]=4 5203 B12R1.30 OC(C\C=C\Cl)c1ccccc1 Amb27419899 [0,2,0,0,0,0|1,0,0]=3 5204 B12R1.30 OC(C\C=C\F)c1ccccc1 Amb27766637 [0,2,0,0,0,0|1,0,0]=3 5205 B12R1.30 S=C(NCCCl)c1ccccc1 Amb28118876 [0,2,0,0,0,0|1,0,1]=4 5206 B12R1.34 C=CC(=C)[C@H](O)c1ccccc1 Amb28138679 [0,2,0,0,0,0|1,0,1]=4 5207 B12R1.34 C=CC(=O)C(C)c1ccccc1 Amb24537754 [0,2,0,0,0,0|1,0,1]=4 5208 B12R1.34 C=CC(=O)N(C)c1ccccc1 Amb9480405 [0,2,0,0,0,0|0,0,1]=3 5209 B12R1.34 C=CC(C)C(=O)c1ccccc1 Amb27749794 [0,2,0,0,0,0|1,0,0]=3 5210 B12R1.34 C=CC(C)C(N)c1ccccc1 Amb27392398 [0,2,0,0,0,0|1,0,0]=3 5211 B12R1.34 C=CC(C)C(O)c1ccccn1 Amb28190323 [0,2,0,0,0,0|2,0,0]=4 5212 B12R1.34 C=CC(C)N(C)c1ccccc1 Amb27979353 [0,2,0,0,0,0|0,0,0]=2 5213 B12R1.34 C=CC(Cl)C(=O)c1ccccc1 Amb27841407 [0,2,0,0,0,0|1,0,0]=3 5214 B12R1.34 C=CC(N)C(N)c1ccccc1 Amb27390654 [0,2,0,0,0,0|1,0,0]=3 5215 B12R1.34 C=CC(O)C(C)c1ccccc1 Amb25310831 [0,2,0,0,0,0|1,0,0]=3 5216 B12R1.34 C=CC(O)C(O)c1ccncc1 Amb28206049 [0,2,0,0,0,0|2,0,0]=4 5217 B12R1.34 C=C[C@@H](C)[C@@H](N)c1ccccn1 Amb27790727 [0,2,0,0,0,0|2,0,0]=4 5218 B12R1.34 C=C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27232990 [0,2,0,0,0,0|1,0,0]=3 5219 B12R1.34 C=C[C@@H](O)[C@H](O)c1ccccc1 Amb27615222 [0,2,0,0,0,0|1,0,0]=3 5220 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccccc1 Amb25071531 [0,2,0,0,0,0|1,0,0]=3 5221 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccncc1 Amb28242271 [0,2,0,0,0,0|2,0,0]=4 5222 B12R1.34 C=C[C@H](N)[C@H](O)c1ccccc1 Amb27876610 [0,2,0,0,0,0|1,0,0]=3 5223 B12R1.34 C=C[C@H](O)[C@@H](C)c1ccccc1 Amb27169905 [0,2,0,0,0,0|1,0,0]=3 5224 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,2,0,0,0,0|2,0,0]=4 5225 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [0,2,0,0,0,0|2,0,0]=4 5226 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [0,2,0,0,0,0|2,0,0]=4 5227 B12R1.34 CC(C=O)S(=O)c1ccccc1 Amb27224791 [0,2,0,0,0,0|2,0,0]=4 5228 B12R1.34 CC(CN)N(C)c1ccccc1 Amb1128364 [0,2,0,0,0,0|1,0,1]=4 5229 B12R1.34 CC(CN)N(C)c1ccccc1 Amb13949221 [0,2,0,0,0,0|1,0,1]=4 5230 B12R1.34 CC(CO)N(O)c1ccccc1 Amb28065271 [0,2,0,0,0,0|1,0,1]=4 5231 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [0,2,0,0,0,0|2,0,0]=4 5232 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [0,2,0,0,0,0|2,0,0]=4 5233 B12R1.34 CN(C(=O)C=O)c1ccccc1 Amb28287730 [0,2,0,0,0,0|1,0,1]=4 5234 B12R1.34 C[C@@H](CO)N(O)c1ccccc1 Amb28188881 [0,2,0,0,0,0|1,0,1]=4 5235 B12R1.34 C[C@H](C=O)N(O)c1ccccc1 Amb27780818 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [0,2,0,0,0,0|2,0,0]=4 5237 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [0,2,0,0,0,0|2,0,0]=4 5238 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.34 C\C=C(\Cl)N(C)c1ccccc1 Amb27619788 [0,2,0,0,0,0|0,0,2]=4 5240 B12R1.34 O=CC(Cl)C(=O)c1ccccc1 Amb28364135 [0,2,0,0,0,0|2,0,0]=4 5241 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [0,2,0,0,0,0|2,0,0]=4 5242 B12R1.34 O=CC(F)C(=O)c1ccccc1 Amb26485248 [0,2,0,0,0,0|2,0,0]=4 5243 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.39 C=CCC(C)(N)c1ccccc1 Amb28290415 [0,2,0,0,0,0|1,0,0]=3 5245 B12R1.39 C=CCC(C)(N)c1cccnc1 Amb28282549 [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.39 C=CCC(C)(O)c1ccccc1 Amb4035093 [0,2,0,0,0,0|1,0,0]=3 5247 B12R1.39 C=CCS(=N)(=O)c1ccccc1 Amb32992723 [0,2,0,0,0,0|1,0,0]=3 5248 B12R1.39 C=CCS(=N)(=O)c1ccccc1 Amb33096775 [0,2,0,0,0,0|1,0,0]=3 5249 B12R1.39 C=CCS(=O)(=O)c1ccccc1 Amb2782882 [0,2,0,0,0,0|1,0,0]=3 5250 B12R1.39 C=CC[S@](=N)(=O)c1ccccc1 Amb33744001 [0,2,0,0,0,0|1,0,0]=3 5251 B12R1.39 C=CC[Si](C)(C)c1ccccc1 Amb2389294 [0,2,0,0,0,0|1,0,0]=3 5252 B12R1.39 C=CC[Si](Cl)(Cl)c1ccccc1 Amb19894201 [0,2,0,0,0,0|1,0,0]=3 5253 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|2,0,0]=4 5254 B12R1.39 C[C@](O)(CC=O)c1ccccc1 Amb27855035 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.39 O=CCC(F)(F)c1ccccc1 Amb26558709 [0,2,0,0,0,0|2,0,0]=4 5256 B12R1.39 [BH3-][P@+](C)(CC=O)c1ccccc1 Amb27260522 [0,2,0,0,0,0|1,1,0]=4 5257 B12R1.39 [BH3-][P@@+](C)(CC=O)c1ccccc1 Amb27972984 [0,2,0,0,0,0|1,1,0]=4 5258 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [0,2,0,0,0,0|1,0,0]=3 5259 B12R1.107 C=C(C)CC(=O)c1ccccn1 Amb18563515 [0,2,0,0,0,0|2,0,0]=4 5260 B12R1.107 C=C(C)CC(=O)c1cccnc1 Amb18563516 [0,2,0,0,0,0|2,0,0]=4 5261 B12R1.107 C=C(C)CC(=O)c1ccncc1 Amb18563517 [0,2,0,0,0,0|2,0,0]=4 5262 B12R1.107 C=C(C)CN(C)c1cnccn1 Amb27485679 [0,2,0,0,0,0|2,0,0]=4 5263 B12R1.107 C=C(C)C[C@@H](N)c1ccccn1 Amb27196269 [0,2,0,0,0,0|2,0,0]=4 5264 B12R1.107 C=C(C)C[C@@H](O)c1ccccc1 Amb27396487 [0,2,0,0,0,0|1,0,0]=3 5265 B12R1.107 C=C(C)C[C@@H](O)c1ccccn1 Amb27652999 [0,2,0,0,0,0|2,0,0]=4 5266 B12R1.107 C=C(C)NC(C)c1ccccc1 Amb27616873 [0,2,0,0,0,0|2,0,0]=4 5267 B12R1.107 C=C(C)N[C@@H](C)c1ccccc1 Amb27858912 [0,2,0,0,0,0|2,0,0]=4 5268 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [0,2,0,0,0,0|1,0,1]=4 5269 B12R1.107 C=C(Cl)CC(N)c1ccccc1 Amb27259258 [0,2,0,0,0,0|1,0,0]=3 5270 B12R1.107 C=C(Cl)CN(C)c1ccccc1 Amb4009715 [0,2,0,0,0,0|0,0,0]=2 5271 B12R1.107 C=C(Cl)C[C@@H](O)c1ccccc1 Amb27834223 [0,2,0,0,0,0|1,0,0]=3 5272 B12R1.107 C=C(O)CC(C)c1ccncc1 Amb27163578 [0,2,0,0,0,0|2,0,0]=4 5273 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [0,2,0,0,0,0|1,0,1]=4 5274 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [0,2,0,0,0,0|1,0,1]=4 5275 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [0,2,0,0,0,0|1,0,1]=4 5276 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [0,2,0,0,0,0|1,0,1]=4 5277 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [0,2,0,0,0,0|1,0,1]=4 5278 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [0,2,0,0,0,0|1,0,1]=4 5279 B12R1.107 CC(=O)NN(C)c1ccccc1 Amb6400375 [0,2,0,0,0,0|1,0,1]=4 5280 B12R1.107 CC(C)CN(C)c1ccccc1 Amb17232437 [0,2,0,0,0,0|0,0,2]=4 5281 B12R1.107 CC(CC(=N)N)c1ccccc1 Amb25898810 [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.107 CC(CC(=O)Cl)c1ccccc1 Amb2690275 [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.107 CC(CC(N)=O)c1ccccc1 Amb3886650 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,2,0,0,0,0|2,0,0]=4 5286 B12R1.107 CC(N)CN(C)c1ccccc1 Amb10610213 [0,2,0,0,0,0|0,0,2]=4 5287 B12R1.107 CC(N)CN(C)c1ccccc1 Amb1137929 [0,2,0,0,0,0|0,0,2]=4 5288 B12R1.107 CC(O)CN(C)c1ccccc1 Amb17138595 [0,2,0,0,0,0|0,0,2]=4 5289 B12R1.107 CN(CC(=O)Cl)c1ccccc1 Amb17142999 [0,2,0,0,0,0|1,0,0]=3 5290 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [0,2,0,0,0,0|1,0,0]=3 5291 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [0,2,0,0,0,0|1,0,0]=3 5292 B12R1.107 CN(CC(=O)O)c1ccccn1 Amb22275945 [0,2,0,0,0,0|2,0,0]=4 5293 B12R1.107 CN(CC(=O)O)c1ccccn1 Amb6261942 [0,2,0,0,0,0|2,0,0]=4 5294 B12R1.107 CN(CC(=O)O)c1cccnc1 Amb18268673 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.107 CN(CC(=O)O)c1ccncc1 Amb33532730 [0,2,0,0,0,0|2,0,0]=4 5296 B12R1.107 CN(CC(F)Cl)c1ccccc1 Amb28118828 [0,2,0,0,0,0|1,0,1]=4 5297 B12R1.107 CN(CC(N)=O)c1ccccc1 Amb8342086 [0,2,0,0,0,0|1,0,0]=3 5298 B12R1.107 CN(CC(N)=O)c1ccncc1 Amb27178843 [0,2,0,0,0,0|2,0,0]=4 5299 B12R1.107 CN(CC(N)=S)c1ccccc1 Amb6269019 [0,2,0,0,0,0|1,0,0]=3 5300 B12R1.107 CN(NC(N)=O)c1ccccc1 Amb26620313 [0,2,0,0,0,0|2,0,0]=4 5301 B12R1.107 CN(NC(N)=S)c1ccccc1 Amb6384878 [0,2,0,0,0,0|2,0,0]=4 5302 B12R1.107 C[C@@H](CC(=O)Cl)c1ccccc1 Amb28139675 [0,2,0,0,0,0|2,0,0]=4 5303 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [0,2,0,0,0,0|2,0,0]=4 5304 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [0,2,0,0,0,0|2,0,0]=4 5305 B12R1.107 C[C@H](N)CN(C)c1ccccc1 Amb5782045 [0,2,0,0,0,0|0,0,2]=4 5306 B12R1.107 C[C@H](O)CN(C)c1ccccc1 Amb27615291 [0,2,0,0,0,0|0,0,2]=4 5307 B12R1.107 C\C(N)=N\N(C)c1ccccc1 Amb26589111 [0,2,0,0,0,0|1,0,1]=4 5308 B12R1.107 N=C(N)CC(=O)c1ccccc1 Amb26371399 [0,2,0,0,0,0|2,0,0]=4 5309 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [0,2,0,0,0,0|2,0,0]=4 5310 B12R1.107 NC(=O)CC(=S)c1ccccc1 Amb28384134 [0,2,0,0,0,0|2,0,0]=4 5311 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609847 [0,2,0,0,0,0|2,0,0]=4 5312 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609952 [0,2,0,0,0,0|2,0,0]=4 5313 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb6264599 [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.107 NC(=O)CS(=O)c1ccccc1 Amb26536440 [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|2,0,0]=4 5316 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb32661465 [0,2,0,0,0,0|2,0,0]=4 5317 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb28129120 [0,2,0,0,0,0|2,0,0]=4 5318 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb32661309 [0,2,0,0,0,0|2,0,0]=4 5319 B12R1.107 NC(=S)CC(=O)c1ccccc1 Amb26430207 [0,2,0,0,0,0|2,0,0]=4 5320 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,2,0,0,0,0|2,0,0]=4 5321 B12R1.107 NC(=S)CS(=O)c1ccccc1 Amb27635874 [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.107 NC(=S)C[C@@H](O)c1ccccc1 Amb27494152 [0,2,0,0,0,0|2,0,0]=4 5323 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [0,2,0,0,0,0|2,0,0]=4 5325 B12R1.107 NN(CC(=O)O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,0]=3 5326 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.107 O=C(O)CC(=S)c1ccccc1 Amb27433886 [0,2,0,0,0,0|2,0,0]=4 5331 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [0,2,0,0,0,0|2,0,0]=4 5332 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|2,0,0]=4 5333 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.107 O=C(O)CN(Cl)c1ccccc1 Amb27984830 [0,2,0,0,0,0|1,0,0]=3 5335 B12R1.107 O=C(O)CN(O)c1ccccc1 Amb27984844 [0,2,0,0,0,0|1,0,0]=3 5336 B12R1.107 O=C(O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [0,2,0,0,0,0|2,0,0]=4 5339 B12R1.107 O=C(S)CC(O)c1ccccc1 Amb27197171 [0,2,0,0,0,0|2,0,0]=4 5340 B12R1.308 C=CCC(=O)c1ccccc1C Amb17334496 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.308 C=CCC(=O)c1ccccc1Cl Amb17335455 [0,2,0,0,0,0|1,0,0]=3 5342 B12R1.308 C=CCC(=O)c1ccccc1F Amb17334599 [0,2,0,0,0,0|1,0,0]=3 5343 B12R1.308 C=CCC(=O)c1ccccc1N Amb28145692 [0,2,0,0,0,0|1,0,0]=3 5344 B12R1.308 C=CCC(=O)c1cccnc1N Amb27765351 [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.308 C=CCC(=O)c1ccncc1C Amb27494313 [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.308 C=CCC(=O)c1ncccc1Br Amb27799984 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.308 C=CCC(=O)c1ncccc1F Amb28188533 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.308 C=CCC(C)c1ccccc1O Amb27256380 [0,2,0,0,0,0|1,0,0]=3 5349 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,2,0,0,0,0|1,0,0]=3 5350 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,2,0,0,0,0|1,0,0]=3 5351 B12R1.308 C=CCC(N)c1cccnc1Br Amb27239831 [0,2,0,0,0,0|2,0,0]=4 5352 B12R1.308 C=CCC(N)c1ccncc1Br Amb27621578 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.308 C=CCC(N)c1cnccc1C Amb28119997 [0,2,0,0,0,0|2,0,0]=4 5354 B12R1.308 C=CCC(N)c1cnccc1Cl Amb27803661 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,2,0,0,0,0|1,0,0]=3 5356 B12R1.308 C=CCC(O)c1ccccc1C Amb18177787 [0,2,0,0,0,0|1,0,0]=3 5357 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,2,0,0,0,0|1,0,0]=3 5358 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,2,0,0,0,0|1,0,0]=3 5359 B12R1.308 C=CCC(O)c1ccncc1C Amb27177751 [0,2,0,0,0,0|2,0,0]=4 5360 B12R1.308 C=CCC(O)c1ccncc1F Amb27794235 [0,2,0,0,0,0|2,0,0]=4 5361 B12R1.308 C=CCC(O)c1cnccc1N Amb27416445 [0,2,0,0,0,0|2,0,0]=4 5362 B12R1.308 C=CCC(O)c1ncccc1N Amb35587559 [0,2,0,0,0,0|2,0,0]=4 5363 B12R1.308 C=CCN(C)c1cccnc1N Amb27476997 [0,2,0,0,0,0|1,0,0]=3 5364 B12R1.308 C=CCN(C)c1ncccc1N Amb26062380 [0,2,0,0,0,0|1,0,0]=3 5365 B12R1.308 C=CCN(C)c1nccnc1Cl Amb35677333 [0,2,0,0,0,0|2,0,0]=4 5366 B12R1.308 C=CCN(C)c1nccnc1F Amb35610895 [0,2,0,0,0,0|2,0,0]=4 5367 B12R1.308 C=CCN(C)c1ncncc1Cl Amb28189147 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.308 C=CC[C@@H](N)c1ccccc1O Amb27947600 [0,2,0,0,0,0|1,0,0]=3 5369 B12R1.308 C=CC[C@@H](N)c1ccncc1Cl Amb27413740 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.308 C=CC[C@@H](N)c1ccncc1N Amb27595594 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.308 C=CC[C@@H](N)c1ccncc1O Amb27435640 [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.308 C=CC[C@@H](N)c1cnccc1C Amb27630028 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.308 C=CC[C@@H](N)c1cnccc1Cl Amb28366467 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.308 C=CC[C@@H](N)c1ncccc1Cl Amb27831958 [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.308 C=CC[C@@H](N)c1ncccc1F Amb27254092 [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.308 C=CC[C@@H](O)c1ccccc1Br Amb28129784 [0,2,0,0,0,0|1,0,0]=3 5377 B12R1.308 C=CC[C@@H](O)c1ccccc1C Amb28188194 [0,2,0,0,0,0|1,0,0]=3 5378 B12R1.308 C=CC[C@@H](O)c1ccccc1F Amb27812041 [0,2,0,0,0,0|1,0,0]=3 5379 B12R1.308 C=CC[C@@H](O)c1ccccc1S Amb28066020 [0,2,0,0,0,0|1,0,0]=3 5380 B12R1.308 C=CC[C@H](N)c1ccccc1Br Amb27642507 [0,2,0,0,0,0|1,0,0]=3 5381 B12R1.308 C=CC[C@H](N)c1ccccc1C Amb27850932 [0,2,0,0,0,0|1,0,0]=3 5382 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb28364530 [0,2,0,0,0,0|1,0,0]=3 5383 B12R1.308 C=CC[C@H](N)c1ccccc1F Amb27951102 [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.308 C=CC[C@H](N)c1cccnc1C Amb28043071 [0,2,0,0,0,0|2,0,0]=4 5385 B12R1.308 C=CC[C@H](N)c1cccnc1N Amb27468624 [0,2,0,0,0,0|2,0,0]=4 5386 B12R1.308 C=CC[C@H](N)c1cccnc1O Amb27389227 [0,2,0,0,0,0|2,0,0]=4 5387 B12R1.308 C=CC[C@H](N)c1cccnc1S Amb27784863 [0,2,0,0,0,0|2,0,0]=4 5388 B12R1.308 C=CC[C@H](N)c1ccncc1C Amb27596623 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.308 C=CC[C@H](N)c1ccncc1Cl Amb28364301 [0,2,0,0,0,0|2,0,0]=4 5390 B12R1.308 C=CC[C@H](N)c1cnccc1Br Amb27394129 [0,2,0,0,0,0|2,0,0]=4 5391 B12R1.308 C=CC[C@H](N)c1cnccc1N Amb27595621 [0,2,0,0,0,0|2,0,0]=4 5392 B12R1.308 C=CC[C@H](N)c1ncccc1N Amb27389226 [0,2,0,0,0,0|2,0,0]=4 5393 B12R1.308 C=CC[C@H](O)c1ccccc1C Amb27981945 [0,2,0,0,0,0|1,0,0]=3 5394 B12R1.308 C=CC[C@H](O)c1ccccc1F Amb27219078 [0,2,0,0,0,0|1,0,0]=3 5395 B12R1.308 C=COC(=O)c1ccccc1O Amb4020572 [0,2,0,0,0,0|2,0,0]=4 5396 B12R1.308 CCCN(C)c1ccccc1N Amb8898676 [0,2,0,0,0,0|0,0,2]=4 5397 B12R1.308 CN(CC#N)c1ccccc1Br Amb17343206 [0,2,0,0,0,0|1,0,1]=4 5398 B12R1.308 CN(CC#N)c1ccccc1Cl Amb17335463 [0,2,0,0,0,0|1,0,1]=4 5399 B12R1.308 CN(CC#N)c1ccccc1F Amb17334602 [0,2,0,0,0,0|1,0,1]=4 5400 B12R1.308 CN(CC#N)c1ccccc1O Amb28070395 [0,2,0,0,0,0|1,0,1]=4 5401 B12R1.308 CN(CCCl)c1ccccc1Br Amb17351919 [0,2,0,0,0,0|1,0,1]=4 5402 B12R1.308 CN(CCCl)c1ccccc1Cl Amb17338055 [0,2,0,0,0,0|1,0,1]=4 5403 B12R1.308 CN(CCCl)c1ccccc1F Amb17335951 [0,2,0,0,0,0|1,0,1]=4 5404 B12R1.308 CN(CCCl)c1ccccc1N Amb27863533 [0,2,0,0,0,0|1,0,1]=4 5405 B12R1.308 CN(CCF)c1ccccc1O Amb27853039 [0,2,0,0,0,0|1,0,1]=4 5406 B12R1.308 CN(CCI)c1ccccc1O Amb28078731 [0,2,0,0,0,0|1,0,1]=4 5407 B12R1.308 CN(CCN)c1ccccc1Br Amb17059772 [0,2,0,0,0,0|1,0,1]=4 5408 B12R1.308 CN(CCN)c1ccccc1Cl Amb17059645 [0,2,0,0,0,0|1,0,1]=4 5409 B12R1.308 CN(CCN)c1ccccc1F Amb17059642 [0,2,0,0,0,0|1,0,1]=4 5410 B12R1.308 CN(CCO)c1ccccc1Br Amb17344451 [0,2,0,0,0,0|1,0,1]=4 5411 B12R1.308 CN(CCO)c1ccccc1Cl Amb17335810 [0,2,0,0,0,0|1,0,1]=4 5412 B12R1.308 CN(CCO)c1ccccc1F Amb17334763 [0,2,0,0,0,0|1,0,1]=4 5413 B12R1.308 CN(CCO)c1ccccc1N Amb8997333 [0,2,0,0,0,0|1,0,1]=4 5414 B12R1.308 CN(CCO)c1ccccc1O Amb27256043 [0,2,0,0,0,0|1,0,1]=4 5415 B12R1.308 C\C=C\N(C)c1ccccc1O Amb28351392 [0,2,0,0,0,0|0,0,2]=4 5416 B12R1.308 Cc1ccccc1C(=O)CC=O Amb7766349 [0,2,0,0,0,0|2,0,0]=4 5417 B12R1.308 Cc1ccccc1N(C)CC#N Amb17334501 [0,2,0,0,0,0|1,0,1]=4 5418 B12R1.308 Cc1ccccc1N(C)CCCl Amb17335670 [0,2,0,0,0,0|1,0,1]=4 5419 B12R1.308 Cc1ccccc1N(C)CCN Amb17059640 [0,2,0,0,0,0|1,0,1]=4 5420 B12R1.308 Cc1ccccc1N(C)CCO Amb17334643 [0,2,0,0,0,0|1,0,1]=4 5421 B12R1.308 O=CCC(=O)c1ccccc1Br Amb9204919 [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.308 O=CCC(=O)c1ccccc1Cl Amb7766339 [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.308 O=CCC(=O)c1ccccc1F Amb9204907 [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.308 O=CCC(=O)c1ccccc1O Amb18645953 [0,2,0,0,0,0|2,0,0]=4 5425 B12R1.308 O=CCC(O)c1ccccc1F Amb27947440 [0,2,0,0,0,0|2,0,0]=4 5426 B12R1.308 O=CCS(=O)c1ccccc1Br Amb27861640 [0,2,0,0,0,0|2,0,0]=4 5427 B12R1.308 O=CCS(=O)c1ccccc1Cl Amb27763167 [0,2,0,0,0,0|2,0,0]=4 5428 B12R1.25 C#CCNc1cccc(Br)c1C Amb27187642 [0,2,0,0,0,0|0,0,2]=4 5429 B12R1.25 C#CCNc1cccc(Br)c1F Amb35642856 [0,2,0,0,0,0|0,0,2]=4 5430 B12R1.25 C#CCNc1cccc(C)c1C Amb18800151 [0,2,0,0,0,0|0,0,2]=4 5431 B12R1.25 C#CCNc1cccc(Cl)c1Br Amb27869361 [0,2,0,0,0,0|0,0,2]=4 5432 B12R1.25 C#CCNc1cccc(F)c1C Amb18792477 [0,2,0,0,0,0|0,0,2]=4 5433 B12R1.25 C#CCNc1cccc(F)c1I Amb28127919 [0,2,0,0,0,0|0,0,2]=4 5434 B12R1.25 C#CCNc1cccc(I)c1C Amb28127918 [0,2,0,0,0,0|0,0,2]=4 5435 B12R1.25 C=CCCN1C=CC=C(N)C1=O Amb32705440 [0,2,0,0,0,0|2,0,0]=4 5436 B12R1.25 C=CCCc1cccc(Br)c1F Amb35715387 [0,2,0,0,0,0|1,0,0]=3 5437 B12R1.25 C=CCCc1cccc(C)c1C Amb30012802 [0,2,0,0,0,0|1,0,0]=3 5438 B12R1.25 C=CCCc1cccc(C)c1F Amb27461509 [0,2,0,0,0,0|1,0,0]=3 5439 B12R1.25 C=CCNC1=C(Cl)C(=O)NC=N1 Amb27187822 [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.25 C=CCNC1=C(Cl)C(=O)NN=C1 Amb27227626 [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.25 C=CCNc1cccc(Br)c1F Amb35649405 [0,2,0,0,0,0|0,0,0]=2 5442 B12R1.25 C=CCNc1cccc(Cl)c1Cl Amb27848515 [0,2,0,0,0,0|0,0,0]=2 5443 B12R1.25 C=CCNc1cccc(Cl)c1F Amb19058325 [0,2,0,0,0,0|0,0,0]=2 5444 B12R1.25 C=CCNc1cccc(F)c1Cl Amb28319489 [0,2,0,0,0,0|0,0,0]=2 5445 B12R1.25 C=CCNc1ccnc(Cl)c1N Amb27666991 [0,2,0,0,0,0|1,0,0]=3 5446 B12R1.25 C=CCNc1ccnc(O)c1N Amb35669762 [0,2,0,0,0,0|1,0,0]=3 5447 B12R1.25 C=CCNc1cncc(Cl)c1C Amb35706638 [0,2,0,0,0,0|1,0,0]=3 5448 B12R1.25 C=CCNc1nccc(C)c1N Amb17213637 [0,2,0,0,0,0|1,0,0]=3 5449 B12R1.25 C=CCNc1nccc(N)c1N Amb27402734 [0,2,0,0,0,0|1,0,0]=3 5450 B12R1.25 C=CCNc1ncnc(Cl)c1C Amb27961046 [0,2,0,0,0,0|2,0,0]=4 5451 B12R1.25 C=CCNc1ncnc(F)c1Br Amb35712613 [0,2,0,0,0,0|2,0,0]=4 5452 B12R1.25 C=CCNc1ncnc(F)c1C Amb35675496 [0,2,0,0,0,0|2,0,0]=4 5453 B12R1.25 C=CCNc1ncnc(F)c1N Amb35656698 [0,2,0,0,0,0|2,0,0]=4 5454 B12R1.25 C=CCOc1cccc(C)c1F Amb28240665 [0,2,0,0,0,0|1,0,0]=3 5455 B12R1.25 C=CCOc1cccc(C)c1O Amb28243897 [0,2,0,0,0,0|1,0,0]=3 5456 B12R1.25 C=CCOc1cccc(Cl)c1Cl Amb28139646 [0,2,0,0,0,0|1,0,0]=3 5457 B12R1.25 C=CCOc1cccc(Cl)c1F Amb27205602 [0,2,0,0,0,0|1,0,0]=3 5458 B12R1.25 C=CCOc1cccc(F)c1F Amb27977696 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.25 C=CCOc1cccc(N)c1N Amb27814322 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.25 C=CCOc1nccc(C)c1N Amb28410642 [0,2,0,0,0,0|2,0,0]=4 5461 B12R1.25 C=CCOc1nccc(Cl)c1Cl Amb27786040 [0,2,0,0,0,0|2,0,0]=4 5462 B12R1.25 C=CCSC1=C(N)C(=O)NC=C1 Amb35675783 [0,2,0,0,0,0|2,0,0]=4 5463 B12R1.25 C=CCSc1cccc(C)c1C Amb27389292 [0,2,0,0,0,0|1,0,0]=3 5464 B12R1.25 C=CCSc1cccc(Cl)c1C Amb25684672 [0,2,0,0,0,0|1,0,0]=3 5465 B12R1.25 C=CCSc1cccc(F)c1C Amb27231625 [0,2,0,0,0,0|1,0,0]=3 5466 B12R1.25 C=CCSc1nccc(C)c1Br Amb27394963 [0,2,0,0,0,0|2,0,0]=4 5467 B12R1.25 CCCNc1cccc(Br)c1Cl Amb29865088 [0,2,0,0,0,0|0,0,2]=4 5468 B12R1.25 CCCNc1cccc(Br)c1F Amb35642859 [0,2,0,0,0,0|0,0,2]=4 5469 B12R1.25 CCCNc1cccc(C)c1C Amb6700736 [0,2,0,0,0,0|0,0,2]=4 5470 B12R1.25 CCCNc1cccc(C)c1O Amb27751740 [0,2,0,0,0,0|0,0,2]=4 5471 B12R1.25 CCCNc1cccc(Cl)c1C Amb4313518 [0,2,0,0,0,0|0,0,2]=4 5472 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb33329381 [0,2,0,0,0,0|0,0,2]=4 5473 B12R1.25 CCCNc1cccc(Cl)c1Cl Amb6631952 [0,2,0,0,0,0|0,0,2]=4 5474 B12R1.25 CCCNc1cccc(F)c1Cl Amb29864394 [0,2,0,0,0,0|0,0,2]=4 5475 B12R1.25 CCCNc1cccc(F)c1I Amb27591891 [0,2,0,0,0,0|0,0,2]=4 5476 B12R1.25 CCCNc1cccc(F)c1N Amb18968033 [0,2,0,0,0,0|0,0,2]=4 5477 B12R1.25 CCCNc1cccc(I)c1C Amb27760819 [0,2,0,0,0,0|0,0,2]=4 5478 B12R1.25 Cc1c(Br)cccc1CCC=O Amb26607997 [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.25 Cc1c(Br)cccc1NCC#N Amb28366649 [0,2,0,0,0,0|1,0,1]=4 5480 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.25 Cc1c(Cl)cccc1NCC#N Amb6709007 [0,2,0,0,0,0|1,0,1]=4 5482 B12R1.25 Cc1c(Cl)cccc1NCCCl Amb17338051 [0,2,0,0,0,0|1,0,1]=4 5483 B12R1.25 Cc1c(Cl)cccc1NCCN Amb17091057 [0,2,0,0,0,0|1,0,1]=4 5484 B12R1.25 Cc1c(Cl)cccc1NCCO Amb6709042 [0,2,0,0,0,0|1,0,1]=4 5485 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,2,0,0,0,0|2,0,0]=4 5486 B12R1.25 Cc1c(F)cccc1NCC#N Amb18955814 [0,2,0,0,0,0|1,0,1]=4 5487 B12R1.25 Cc1c(F)cccc1NCCN Amb18251978 [0,2,0,0,0,0|1,0,1]=4 5488 B12R1.25 Cc1c(F)cccc1NCCO Amb18980394 [0,2,0,0,0,0|1,0,1]=4 5489 B12R1.25 Cc1c(N)cccc1CCC=O Amb27624875 [0,2,0,0,0,0|2,0,0]=4 5490 B12R1.25 Cc1c(O)cccc1CCC=O Amb27199497 [0,2,0,0,0,0|2,0,0]=4 5491 B12R1.25 Cc1c(S)cccc1CCC=O Amb27623403 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.25 Cc1cccc(CCC=O)c1Cl Amb26880111 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.25 Cc1cccc(CCC=O)c1I Amb28251276 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.25 Cc1cccc(CCC=O)c1N Amb27847134 [0,2,0,0,0,0|2,0,0]=4 5498 B12R1.25 Cc1cccc(NCC#N)c1C Amb6714006 [0,2,0,0,0,0|1,0,1]=4 5499 B12R1.25 Cc1cccc(NCCCl)c1C Amb17335666 [0,2,0,0,0,0|1,0,1]=4 5500 B12R1.25 Cc1cccc(NCCF)c1C Amb27263424 [0,2,0,0,0,0|1,0,1]=4 5501 B12R1.25 Cc1cccc(NCCN)c1C Amb17091054 [0,2,0,0,0,0|1,0,1]=4 5502 B12R1.25 Cc1cccc(NCCN)c1N Amb27258743 [0,2,0,0,0,0|1,0,1]=4 5503 B12R1.25 Cc1cccc(NCCO)c1Br Amb25046066 [0,2,0,0,0,0|1,0,1]=4 5504 B12R1.25 Cc1cccc(NCCO)c1C Amb6714046 [0,2,0,0,0,0|1,0,1]=4 5505 B12R1.25 Cc1cccc(OCC=O)c1C Amb5731827 [0,2,0,0,0,0|2,0,0]=4 5506 B12R1.25 Cc1cccc(OCC=O)c1F Amb27765287 [0,2,0,0,0,0|2,0,0]=4 5507 B12R1.25 ClCCNc1cccc(Cl)c1Cl Amb17343166 [0,2,0,0,0,0|1,0,1]=4 5508 B12R1.25 FCCNc1cccc(Br)c1Cl Amb35707465 [0,2,0,0,0,0|1,0,1]=4 5509 B12R1.25 FCCNc1cccc(Br)c1F Amb35649407 [0,2,0,0,0,0|1,0,1]=4 5510 B12R1.25 FCCNc1cccc(F)c1Cl Amb30016016 [0,2,0,0,0,0|1,0,1]=4 5511 B12R1.25 N#CCNc1cccc(Br)c1Cl Amb35707464 [0,2,0,0,0,0|1,0,1]=4 5512 B12R1.25 N#CCNc1cccc(Br)c1F Amb35649404 [0,2,0,0,0,0|1,0,1]=4 5513 B12R1.25 N#CCNc1cccc(Cl)c1Cl Amb6742655 [0,2,0,0,0,0|1,0,1]=4 5514 B12R1.25 N#CCNc1cccc(F)c1Cl Amb30016015 [0,2,0,0,0,0|1,0,1]=4 5515 B12R1.25 N#CCNc1cccc(F)c1F Amb18951258 [0,2,0,0,0,0|1,0,1]=4 5516 B12R1.25 NCCNc1cccc(Br)c1Cl Amb29865108 [0,2,0,0,0,0|1,0,1]=4 5517 B12R1.25 NCCNc1cccc(Br)c1F Amb27869212 [0,2,0,0,0,0|1,0,1]=4 5518 B12R1.25 NCCNc1cccc(Cl)c1Cl Amb17091084 [0,2,0,0,0,0|1,0,1]=4 5519 B12R1.25 NCCNc1cccc(F)c1Cl Amb29864395 [0,2,0,0,0,0|1,0,1]=4 5520 B12R1.25 NCCNc1cccc(F)c1N Amb18991513 [0,2,0,0,0,0|1,0,1]=4 5521 B12R1.25 Nc1c(Cl)cccc1NCCO Amb27642520 [0,2,0,0,0,0|1,0,1]=4 5522 B12R1.25 Nc1c(F)cccc1NCCF Amb28422165 [0,2,0,0,0,0|1,0,1]=4 5523 B12R1.25 Nc1c(F)cccc1NCCO Amb18968044 [0,2,0,0,0,0|1,0,1]=4 5524 B12R1.25 Nc1cccc(CCC=O)c1N Amb27246821 [0,2,0,0,0,0|2,0,0]=4 5525 B12R1.25 Nc1cccc(CCC=O)c1O Amb27215519 [0,2,0,0,0,0|2,0,0]=4 5526 B12R1.25 O=CCCc1cccc(Br)c1Br Amb26844644 [0,2,0,0,0,0|2,0,0]=4 5527 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,2,0,0,0,0|2,0,0]=4 5529 B12R1.25 O=CCCc1cccc(Br)c1I Amb26880680 [0,2,0,0,0,0|2,0,0]=4 5530 B12R1.25 O=CCCc1cccc(Br)c1O Amb24728306 [0,2,0,0,0,0|2,0,0]=4 5531 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,2,0,0,0,0|2,0,0]=4 5532 B12R1.25 O=CCCc1cccc(Cl)c1F Amb26315353 [0,2,0,0,0,0|2,0,0]=4 5533 B12R1.25 O=CCCc1cccc(Cl)c1I Amb26935759 [0,2,0,0,0,0|2,0,0]=4 5534 B12R1.25 O=CCCc1cccc(Cl)c1O Amb26898533 [0,2,0,0,0,0|2,0,0]=4 5535 B12R1.25 O=CCCc1cccc(F)c1Br Amb27876559 [0,2,0,0,0,0|2,0,0]=4 5536 B12R1.25 O=CCCc1cccc(F)c1Cl Amb27798762 [0,2,0,0,0,0|2,0,0]=4 5537 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,2,0,0,0,0|2,0,0]=4 5538 B12R1.25 O=CCCc1cccc(F)c1I Amb26880769 [0,2,0,0,0,0|2,0,0]=4 5539 B12R1.25 O=CCCc1cccc(F)c1O Amb26339327 [0,2,0,0,0,0|2,0,0]=4 5540 B12R1.25 O=CCCc1cccc(I)c1Br Amb25890570 [0,2,0,0,0,0|2,0,0]=4 5541 B12R1.25 O=CCCc1cccc(I)c1Cl Amb28119151 [0,2,0,0,0,0|2,0,0]=4 5542 B12R1.25 O=CCCc1cccc(I)c1I Amb27633745 [0,2,0,0,0,0|2,0,0]=4 5543 B12R1.25 O=CCCc1cccc(I)c1O Amb27800783 [0,2,0,0,0,0|2,0,0]=4 5544 B12R1.25 O=CCCc1cccc(O)c1Br Amb28123651 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.25 O=CCCc1cccc(O)c1Cl Amb27632383 [0,2,0,0,0,0|2,0,0]=4 5546 B12R1.25 O=CCCc1cccc(O)c1F Amb25831101 [0,2,0,0,0,0|2,0,0]=4 5547 B12R1.25 O=CCCc1cccc(O)c1I Amb26645175 [0,2,0,0,0,0|2,0,0]=4 5548 B12R1.25 O=CCCc1cccc(O)c1O Amb27192383 [0,2,0,0,0,0|2,0,0]=4 5549 B12R1.25 O=CCCc1cccc(O)c1S Amb27423590 [0,2,0,0,0,0|2,0,0]=4 5550 B12R1.25 O=CCCc1cccc(S)c1Br Amb27964574 [0,2,0,0,0,0|2,0,0]=4 5551 B12R1.25 O=CCCc1cccc(S)c1Cl Amb28196073 [0,2,0,0,0,0|2,0,0]=4 5552 B12R1.25 O=CCCc1cccc(S)c1O Amb27965652 [0,2,0,0,0,0|2,0,0]=4 5553 B12R1.25 O=CCCc1cccc(S)c1S Amb28196024 [0,2,0,0,0,0|2,0,0]=4 5554 B12R1.25 O=CCOc1cccc(Cl)c1Cl Amb5731859 [0,2,0,0,0,0|2,0,0]=4 5555 B12R1.25 OCCNc1cccc(Br)c1F Amb35649406 [0,2,0,0,0,0|1,0,1]=4 5556 B12R1.25 OCCNc1cccc(Cl)c1Br Amb24271233 [0,2,0,0,0,0|1,0,1]=4 5557 B12R1.25 OCCNc1cccc(Cl)c1Cl Amb6742674 [0,2,0,0,0,0|1,0,1]=4 5558 B12R1.121 C#CCNc1ccccc1OC Amb18985949 [0,2,0,0,0,0|0,0,2]=4 5559 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.121 C=CCCc1ccccc1CO Amb24069012 [0,2,0,0,0,0|1,0,0]=3 5561 B12R1.121 C=CCCc1ccccc1OC Amb6299112 [0,2,0,0,0,0|1,0,0]=3 5562 B12R1.121 C=CCNc1ccccc1CN Amb27412335 [0,2,0,0,0,0|0,0,0]=2 5563 B12R1.121 C=CCNc1ccccc1CO Amb27230201 [0,2,0,0,0,0|0,0,0]=2 5564 B12R1.121 C=CCNc1ccccc1OC Amb8394242 [0,2,0,0,0,0|0,0,0]=2 5565 B12R1.121 C=CCNc1ccccc1SC Amb28383467 [0,2,0,0,0,0|0,0,0]=2 5566 B12R1.121 C=CCNc1ccncc1C#N Amb28065507 [0,2,0,0,0,0|1,0,0]=3 5567 B12R1.121 C=CCNc1cnccc1C#N Amb25952342 [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.121 C=CCNc1ncccc1C#N Amb6273740 [0,2,0,0,0,0|1,0,0]=3 5569 B12R1.121 C=CCNc1ncccc1CN Amb17232430 [0,2,0,0,0,0|1,0,0]=3 5570 B12R1.121 C=CCNc1ncccc1CO Amb17232477 [0,2,0,0,0,0|1,0,0]=3 5571 B12R1.121 C=CCNc1nccnc1CC Amb35668530 [0,2,0,0,0,0|2,0,0]=4 5572 B12R1.121 C=CCNc1ncncc1OC Amb27644247 [0,2,0,0,0,0|2,0,0]=4 5573 B12R1.121 C=CCNc1nnccc1C#N Amb27795469 [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.121 C=CCOc1ccccc1C=O Amb1211891 [0,2,0,0,0,0|1,0,0]=3 5575 B12R1.121 C=CCOc1ccccc1CBr Amb30640043 [0,2,0,0,0,0|1,0,0]=3 5576 B12R1.121 C=CCOc1ccccc1CN Amb9620829 [0,2,0,0,0,0|1,0,0]=3 5577 B12R1.121 C=CCOc1ccccc1CO Amb33526645 [0,2,0,0,0,0|1,0,0]=3 5578 B12R1.121 C=CCOc1ccccc1CS Amb32788363 [0,2,0,0,0,0|1,0,0]=3 5579 B12R1.121 C=CCOc1ncccc1C#N Amb9208748 [0,2,0,0,0,0|2,0,0]=4 5580 B12R1.121 C=CCSc1ccncc1C#N Amb28347197 [0,2,0,0,0,0|2,0,0]=4 5581 B12R1.121 CCCNc1ccccc1C#N Amb6716331 [0,2,0,0,0,0|0,0,2]=4 5582 B12R1.121 CCCNc1ccccc1CC Amb6698992 [0,2,0,0,0,0|0,0,2]=4 5583 B12R1.121 CCCNc1ccccc1CN Amb18800850 [0,2,0,0,0,0|0,0,2]=4 5584 B12R1.121 CCCNc1ccccc1OC Amb6688440 [0,2,0,0,0,0|0,0,2]=4 5585 B12R1.121 CCc1ccccc1CCC=O Amb33448757 [0,2,0,0,0,0|2,0,0]=4 5586 B12R1.121 CCc1ccccc1NCCCl Amb17335667 [0,2,0,0,0,0|1,0,1]=4 5587 B12R1.121 CCc1ccccc1NCCF Amb27619590 [0,2,0,0,0,0|1,0,1]=4 5588 B12R1.121 CCc1ccccc1NCCO Amb4016393 [0,2,0,0,0,0|1,0,1]=4 5589 B12R1.121 CCc1ccccc1OCC=O Amb5731829 [0,2,0,0,0,0|2,0,0]=4 5590 B12R1.121 COCNc1ccccc1OC Amb27238667 [0,2,0,0,0,0|1,0,1]=4 5591 B12R1.121 COc1ccccc1CCC=O Amb17081677 [0,2,0,0,0,0|2,0,0]=4 5592 B12R1.121 COc1ccccc1NCC#N Amb6708229 [0,2,0,0,0,0|1,0,1]=4 5593 B12R1.121 COc1ccccc1NCCCl Amb17335806 [0,2,0,0,0,0|1,0,1]=4 5594 B12R1.121 COc1ccccc1NCCN Amb17057753 [0,2,0,0,0,0|1,0,1]=4 5595 B12R1.121 COc1ccccc1NCCO Amb6708268 [0,2,0,0,0,0|1,0,1]=4 5596 B12R1.121 COc1ccccc1OCC=O Amb5731832 [0,2,0,0,0,0|2,0,0]=4 5597 B12R1.121 COc1ccccc1SCC=O Amb18809763 [0,2,0,0,0,0|2,0,0]=4 5598 B12R1.121 CSc1ccccc1CCC=O Amb33473857 [0,2,0,0,0,0|2,0,0]=4 5599 B12R1.121 CSc1ccccc1NCCN Amb27597535 [0,2,0,0,0,0|1,0,1]=4 5600 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.121 N#Cc1ccccc1NCCCl Amb17335460 [0,2,0,0,0,0|1,0,1]=4 5602 B12R1.121 N#Cc1ccccc1NCCO Amb6712054 [0,2,0,0,0,0|1,0,1]=4 5603 B12R1.121 NCc1ccccc1NCCO Amb5786775 [0,2,0,0,0,0|1,0,1]=4 5604 B12R1.125 C=C(Br)CNc1ccccc1Br Amb27863101 [0,2,0,0,0,0|0,0,0]=2 5605 B12R1.125 C=C(Br)CNc1ccccc1I Amb27242931 [0,2,0,0,0,0|0,0,0]=2 5606 B12R1.125 C=C(Br)CNc1cccnc1N Amb27483849 [0,2,0,0,0,0|1,0,0]=3 5607 B12R1.125 C=C(Br)CNc1ccncc1C Amb27494522 [0,2,0,0,0,0|1,0,0]=3 5608 B12R1.125 C=C(Br)CNc1ccncc1F Amb30036706 [0,2,0,0,0,0|1,0,0]=3 5609 B12R1.125 C=C(Br)CNc1ncccc1Br Amb27461697 [0,2,0,0,0,0|1,0,0]=3 5610 B12R1.125 C=C(Br)CNc1ncccc1F Amb27645976 [0,2,0,0,0,0|1,0,0]=3 5611 B12R1.125 C=C(Br)CNc1ncccc1N Amb27243430 [0,2,0,0,0,0|1,0,0]=3 5612 B12R1.125 C=C(Br)CNc1nccnc1F Amb29866304 [0,2,0,0,0,0|2,0,0]=4 5613 B12R1.125 C=C(Br)COc1ccccc1Cl Amb27175753 [0,2,0,0,0,0|1,0,0]=3 5614 B12R1.125 C=C(Br)COc1ccccc1I Amb28321049 [0,2,0,0,0,0|1,0,0]=3 5615 B12R1.125 C=C(Br)COc1cccnc1Br Amb27960244 [0,2,0,0,0,0|2,0,0]=4 5616 B12R1.125 C=C(Br)COc1cccnc1F Amb28067580 [0,2,0,0,0,0|2,0,0]=4 5617 B12R1.125 C=C(Br)CSc1ccccc1C Amb27828288 [0,2,0,0,0,0|1,0,0]=3 5618 B12R1.125 C=C(Br)CSc1ccncc1C Amb27648029 [0,2,0,0,0,0|2,0,0]=4 5619 B12R1.125 C=C(Br)CSc1ncccc1C Amb27982762 [0,2,0,0,0,0|2,0,0]=4 5620 B12R1.125 C=C(Br)CSc1ncccc1N Amb18969575 [0,2,0,0,0,0|2,0,0]=4 5621 B12R1.125 C=C(C)CCN1C=CC=CC1=O Amb28369040 [0,2,0,0,0,0|2,0,0]=4 5622 B12R1.125 C=C(C)CNC1=NC=CNC1=O Amb27453211 [0,2,0,0,0,0|2,0,0]=4 5623 B12R1.125 C=C(C)CNc1ccncc1F Amb30036537 [0,2,0,0,0,0|1,0,0]=3 5624 B12R1.125 C=C(C)CNc1ncccc1Cl Amb27840718 [0,2,0,0,0,0|1,0,0]=3 5625 B12R1.125 C=C(C)CNc1nccnc1C Amb28282890 [0,2,0,0,0,0|2,0,0]=4 5626 B12R1.125 C=C(C)CNc1nccnc1F Amb30018934 [0,2,0,0,0,0|2,0,0]=4 5627 B12R1.125 C=C(C)CNc1nccnc1N Amb27231245 [0,2,0,0,0,0|2,0,0]=4 5628 B12R1.125 C=C(C)CNc1ncncc1Br Amb28245667 [0,2,0,0,0,0|2,0,0]=4 5629 B12R1.125 C=C(C)CNc1ncncc1Cl Amb27394988 [0,2,0,0,0,0|2,0,0]=4 5630 B12R1.125 C=C(C)COC1=CC=CNC1=O Amb18034656 [0,2,0,0,0,0|2,0,0]=4 5631 B12R1.125 C=C(C)COc1ccccc1Br Amb6273934 [0,2,0,0,0,0|1,0,0]=3 5632 B12R1.125 C=C(C)COc1ccccc1Cl Amb25831212 [0,2,0,0,0,0|1,0,0]=3 5633 B12R1.125 C=C(C)COc1ccccc1N Amb2081551 [0,2,0,0,0,0|1,0,0]=3 5634 B12R1.125 C=C(C)COc1ccccc1N Amb6740593 [0,2,0,0,0,0|1,0,0]=3 5635 B12R1.125 C=C(C)COc1ccccc1O Amb8837378 [0,2,0,0,0,0|1,0,0]=3 5636 B12R1.125 C=C(C)COc1cccnc1N Amb17206808 [0,2,0,0,0,0|2,0,0]=4 5637 B12R1.125 C=C(C)CSc1ccccc1C Amb4016676 [0,2,0,0,0,0|1,0,0]=3 5638 B12R1.125 C=C(C)CSc1ccccc1Cl Amb27589388 [0,2,0,0,0,0|1,0,0]=3 5639 B12R1.125 C=C(C)CSc1ncccc1C Amb27452297 [0,2,0,0,0,0|2,0,0]=4 5640 B12R1.125 C=C(C)\C=C\c1ccccc1N Amb27627468 [0,2,0,0,0,0|1,0,1]=4 5641 B12R1.125 C=C(C)\C=C\c1ccccc1O Amb25915366 [0,2,0,0,0,0|1,0,1]=4 5642 B12R1.125 C=C(Cl)CCc1ccccc1Cl Amb6298966 [0,2,0,0,0,0|1,0,0]=3 5643 B12R1.125 C=C(Cl)CNc1ccccc1Cl Amb28121549 [0,2,0,0,0,0|0,0,0]=2 5644 B12R1.125 C=C(Cl)CNc1ccncc1F Amb30036548 [0,2,0,0,0,0|1,0,0]=3 5645 B12R1.125 C=C(Cl)CNc1ncccc1C Amb27748525 [0,2,0,0,0,0|1,0,0]=3 5646 B12R1.125 C=C(Cl)CNc1ncccc1N Amb27251428 [0,2,0,0,0,0|1,0,0]=3 5647 B12R1.125 C=C(Cl)CNc1nccnc1C Amb27450346 [0,2,0,0,0,0|2,0,0]=4 5648 B12R1.125 C=C(Cl)CNc1nccnc1Cl Amb27615339 [0,2,0,0,0,0|2,0,0]=4 5649 B12R1.125 C=C(Cl)CNc1nccnc1F Amb29866303 [0,2,0,0,0,0|2,0,0]=4 5650 B12R1.125 C=C(Cl)CNc1ncncc1Br Amb27776649 [0,2,0,0,0,0|2,0,0]=4 5651 B12R1.125 C=C(Cl)CNc1ncncc1N Amb27788236 [0,2,0,0,0,0|2,0,0]=4 5652 B12R1.125 C=C(Cl)COc1cccc[n+]1[O-] Amb28204740 [0,2,0,0,0,0|2,0,0]=4 5653 B12R1.125 C=C(Cl)CSc1cccc[n+]1[O-] Amb11211101 [0,2,0,0,0,0|2,0,0]=4 5654 B12R1.125 C=C(Cl)CSc1ccccc1Br Amb27160007 [0,2,0,0,0,0|1,0,0]=3 5655 B12R1.125 C=C(F)COc1ccccc1Br Amb23570547 [0,2,0,0,0,0|1,0,0]=3 5656 B12R1.125 CC(=O)CCc1ccccc1Br Amb9031563 [0,2,0,0,0,0|1,0,1]=4 5657 B12R1.125 CC(=O)CCc1ccccc1C Amb9031558 [0,2,0,0,0,0|1,0,1]=4 5658 B12R1.125 CC(=O)CCc1ccccc1Cl Amb9031570 [0,2,0,0,0,0|1,0,1]=4 5659 B12R1.125 CC(=O)CCc1ccccc1F Amb9031573 [0,2,0,0,0,0|1,0,1]=4 5660 B12R1.125 CC(=O)CCc1ccccc1N Amb27246247 [0,2,0,0,0,0|1,0,1]=4 5661 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,2,0,0,0,0|1,0,1]=4 5662 B12R1.125 CC(=O)CNc1ccccc1C Amb25062983 [0,2,0,0,0,0|0,0,1]=3 5663 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,2,0,0,0,0|1,0,1]=4 5664 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [0,2,0,0,0,0|1,0,1]=4 5665 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,2,0,0,0,0|1,0,1]=4 5666 B12R1.125 CC(=O)CSc1ccccc1Br Amb9229574 [0,2,0,0,0,0|1,0,1]=4 5667 B12R1.125 CC(=O)CSc1ccccc1C Amb18796318 [0,2,0,0,0,0|1,0,1]=4 5668 B12R1.125 CC(=O)CSc1ccccc1Cl Amb4744662 [0,2,0,0,0,0|1,0,1]=4 5669 B12R1.125 CC(=O)CSc1ccccc1F Amb9268572 [0,2,0,0,0,0|1,0,1]=4 5670 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,2,0,0,0,0|1,0,1]=4 5671 B12R1.125 CC(=O)NNc1ccccc1C Amb4362488 [0,2,0,0,0,0|1,0,1]=4 5672 B12R1.125 CC(=O)NNc1ccccc1F Amb27414447 [0,2,0,0,0,0|1,0,1]=4 5673 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [0,2,0,0,0,0|1,0,1]=4 5674 B12R1.125 CC(C)CNc1ccccc1Br Amb6696377 [0,2,0,0,0,0|0,0,2]=4 5675 B12R1.125 CC(C)CNc1ccccc1Cl Amb6696853 [0,2,0,0,0,0|0,0,2]=4 5676 B12R1.125 CC(C)CNc1ccccc1F Amb6697273 [0,2,0,0,0,0|0,0,2]=4 5677 B12R1.125 CC(C)CNc1ccccc1I Amb7785761 [0,2,0,0,0,0|0,0,2]=4 5678 B12R1.125 CC(C)CNc1ccccc1N Amb7767494 [0,2,0,0,0,0|0,0,2]=4 5679 B12R1.125 CC(N)CNc1ccccc1Br Amb27399526 [0,2,0,0,0,0|0,0,2]=4 5680 B12R1.125 CC(N)CNc1ccccc1Cl Amb26923176 [0,2,0,0,0,0|0,0,2]=4 5681 B12R1.125 CC(N)CNc1ccccc1F Amb27756404 [0,2,0,0,0,0|0,0,2]=4 5682 B12R1.125 CC(O)CNc1ccccc1Br Amb17142610 [0,2,0,0,0,0|0,0,2]=4 5683 B12R1.125 CC(O)CNc1ccccc1Cl Amb17139125 [0,2,0,0,0,0|0,0,2]=4 5684 B12R1.125 CC(O)CNc1ccccc1F Amb17138650 [0,2,0,0,0,0|0,0,2]=4 5685 B12R1.125 CC(O)CNc1ccccc1I Amb28410519 [0,2,0,0,0,0|0,0,2]=4 5686 B12R1.125 CC(O)CNc1ccccc1N Amb9359006 [0,2,0,0,0,0|0,0,2]=4 5687 B12R1.125 C[C@@H](O)CNc1ccccc1Cl Amb27848418 [0,2,0,0,0,0|0,0,2]=4 5688 B12R1.125 C[C@H](O)CNc1ccccc1Br Amb27213619 [0,2,0,0,0,0|0,0,2]=4 5689 B12R1.125 C[C@H](O)CNc1ccccc1Cl Amb28244269 [0,2,0,0,0,0|0,0,2]=4 5690 B12R1.125 C\C(N)=N\Nc1ccccc1Cl Amb27214150 [0,2,0,0,0,0|1,0,1]=4 5691 B12R1.125 Cc1ccccc1CCC(=N)N Amb18065464 [0,2,0,0,0,0|2,0,0]=4 5692 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,2,0,0,0,0|2,0,0]=4 5693 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [0,2,0,0,0,0|2,0,0]=4 5694 B12R1.125 Cc1ccccc1CCC(N)=O Amb17400134 [0,2,0,0,0,0|2,0,0]=4 5695 B12R1.125 Cc1ccccc1NCC(=O)Cl Amb27400550 [0,2,0,0,0,0|1,0,0]=3 5696 B12R1.125 Cc1ccccc1NCC(=O)O Amb1258286 [0,2,0,0,0,0|1,0,0]=3 5697 B12R1.125 Cc1ccccc1NCC(C)C Amb6701131 [0,2,0,0,0,0|0,0,2]=4 5698 B12R1.125 Cc1ccccc1NCC(C)N Amb25913696 [0,2,0,0,0,0|0,0,2]=4 5699 B12R1.125 Cc1ccccc1NCC(C)O Amb17138592 [0,2,0,0,0,0|0,0,2]=4 5700 B12R1.125 Cc1ccccc1NCC(C)S Amb27658986 [0,2,0,0,0,0|0,0,2]=4 5701 B12R1.125 Cc1ccccc1NCC(N)=O Amb845279 [0,2,0,0,0,0|1,0,0]=3 5702 B12R1.125 Cc1ccccc1NCS(=O)[O-] Amb27238580 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.125 Cc1ccccc1NNC(N)=O Amb3378061 [0,2,0,0,0,0|2,0,0]=4 5704 B12R1.125 Cc1ccccc1NNC(N)=S Amb6384741 [0,2,0,0,0,0|2,0,0]=4 5705 B12R1.125 Cc1ccccc1OCC(=N)N Amb10610301 [0,2,0,0,0,0|2,0,0]=4 5706 B12R1.125 Cc1ccccc1OCC(=N)N Amb6274243 [0,2,0,0,0,0|2,0,0]=4 5707 B12R1.125 Cc1ccccc1OCC(=O)Cl Amb10880009 [0,2,0,0,0,0|2,0,0]=4 5708 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.125 Cc1ccccc1OCC(N)=O Amb6334508 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.125 Cc1ccccc1OCC(N)=S Amb2589370 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.125 Cc1ccccc1SCC(=O)O Amb1205492 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.125 Cc1cnccc1NCC(=O)O Amb27393345 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.125 FC(F)CNc1ccccc1Cl Amb18320405 [0,2,0,0,0,0|1,0,1]=4 5714 B12R1.125 Fc1ccccc1NCC(F)F Amb18795536 [0,2,0,0,0,0|1,0,1]=4 5715 B12R1.125 N=C(N)CCc1ccccc1Br Amb18070244 [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.125 N=C(N)CCc1ccccc1Cl Amb10844871 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.125 N=C(N)CCc1ccccc1F Amb18563718 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.125 N=C(N)COc1ccccc1Cl Amb2726041 [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.125 N=C(N)COc1ccccc1Cl Amb6280413 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.125 NC(=O)CCc1ccccc1F Amb8341221 [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.125 NC(=O)CCc1ccccc1N Amb8941622 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.125 NC(=O)CCc1ccccc1O Amb2695332 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.125 NC(=O)CNc1ccccc1Br Amb6712122 [0,2,0,0,0,0|1,0,0]=3 5726 B12R1.125 NC(=O)CNc1ccccc1Cl Amb500616 [0,2,0,0,0,0|1,0,0]=3 5727 B12R1.125 NC(=O)CNc1ccccc1F Amb6712534 [0,2,0,0,0,0|1,0,0]=3 5728 B12R1.125 NC(=O)CNc1ccccc1O Amb28323151 [0,2,0,0,0,0|1,0,0]=3 5729 B12R1.125 NC(=O)CNc1ccncc1Br Amb27864994 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.125 NC(=O)CNc1ccncc1Cl Amb28119624 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.125 NC(=O)CNc1ccncc1F Amb30036542 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.125 NC(=O)CNc1ncccc1F Amb18300629 [0,2,0,0,0,0|2,0,0]=4 5733 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.125 NC(=O)COc1ccccc1Cl Amb3738387 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.125 NC(=O)COc1ccccc1F Amb8335270 [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.125 NC(=O)COc1ccccc1N Amb6662641 [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.125 NC(=O)COc1ccccc1O Amb8505284 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.125 NC(=O)CSc1ccccc1Cl Amb4534168 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.125 NC(=O)NNc1ccccc1F Amb26495079 [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.125 NC(=S)COc1ccccc1Br Amb6278086 [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.125 NC(=S)COc1ccccc1Cl Amb2725937 [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.125 NC(=S)COc1ccccc1F Amb6278328 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.125 NC(=S)CSc1ccccc1Br Amb28342723 [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.125 NC(=S)NNc1ccccc1Br Amb18071689 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.125 NC(=S)NNc1ccccc1Cl Amb3427743 [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.125 NC(=S)NNc1ccccc1F Amb3427742 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.125 Nc1ccccc1CCC(=O)[O-] Amb34189651 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.125 Nc1ccccc1NCS(=O)O Amb27986124 [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.125 Nc1ccccc1OCC(=O)O Amb4065760 [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.125 Nc1ccccc1OCC(=O)[O-] Amb21972214 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.125 Nc1ccccc1SCC(=O)Cl Amb28073003 [0,2,0,0,0,0|2,0,0]=4 5757 B12R1.125 Nc1ccccc1SCC(=O)O Amb6267584 [0,2,0,0,0,0|2,0,0]=4 5758 B12R1.125 Nc1cccnc1NCC(=O)O Amb18989766 [0,2,0,0,0,0|2,0,0]=4 5759 B12R1.125 Nc1cnccc1NCC(=O)O Amb18987716 [0,2,0,0,0,0|2,0,0]=4 5760 B12R1.125 O=C(Br)COc1ccccc1Cl Amb27481125 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,2,0,0,0,0|2,0,0]=4 5762 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,2,0,0,0,0|2,0,0]=4 5763 B12R1.125 O=C(Cl)CCc1ccccc1F Amb10838958 [0,2,0,0,0,0|2,0,0]=4 5764 B12R1.125 O=C(Cl)CNc1ccccc1Cl Amb28239488 [0,2,0,0,0,0|1,0,0]=3 5765 B12R1.125 O=C(Cl)COc1ccccc1Br Amb16230053 [0,2,0,0,0,0|2,0,0]=4 5766 B12R1.125 O=C(Cl)COc1ccccc1Cl Amb16230049 [0,2,0,0,0,0|2,0,0]=4 5767 B12R1.125 O=C(Cl)COc1ccccc1F Amb10880012 [0,2,0,0,0,0|2,0,0]=4 5768 B12R1.125 O=C(Cl)CSc1ccccc1Cl Amb17143819 [0,2,0,0,0,0|2,0,0]=4 5769 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [0,2,0,0,0,0|2,0,0]=4 5770 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [0,2,0,0,0,0|1,0,0]=3 5776 B12R1.125 O=C(O)CNc1ccccc1Cl Amb33528017 [0,2,0,0,0,0|1,0,0]=3 5777 B12R1.125 O=C(O)CNc1ccccc1F Amb840521 [0,2,0,0,0,0|1,0,0]=3 5778 B12R1.125 O=C(O)CNc1ccccc1O Amb842591 [0,2,0,0,0,0|1,0,0]=3 5779 B12R1.125 O=C(O)CNc1cccnc1Cl Amb27770209 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.125 O=C(O)CNc1ccncc1Br Amb27826042 [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.125 O=C(O)CNc1ccncc1F Amb30036425 [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.125 O=C(O)CNc1cnccc1Cl Amb22495942 [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.125 O=C(O)CNc1ncccc1Cl Amb2372425 [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.125 O=C(O)CNc1ncccc1O Amb25891362 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [0,2,0,0,0,0|2,0,0]=4 5786 B12R1.125 O=C(O)COc1ccccc1Cl Amb6336452 [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.125 O=C(O)COc1ccccc1F Amb6335614 [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.125 O=C(O)COc1ccccc1I Amb9339538 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.125 O=C(O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|2,0,0]=4 5792 B12R1.125 O=C(O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|2,0,0]=4 5793 B12R1.125 O=C(O)CSc1ccccc1O Amb18294823 [0,2,0,0,0,0|2,0,0]=4 5794 B12R1.125 O=C([O-])CCc1ccccc1F Amb15692476 [0,2,0,0,0,0|2,0,0]=4 5795 B12R1.267 C#CCCNc1ccccc1Br Amb28133302 [0,2,0,0,0,0|0,0,2]=4 5796 B12R1.267 C#CCCNc1ccccc1I Amb27401663 [0,2,0,0,0,0|0,0,2]=4 5797 B12R1.267 C#CCNCc1ccccc1C Amb21979502 [0,2,0,0,0,0|0,0,2]=4 5798 B12R1.267 C#CCNCc1ccccc1C Amb6683555 [0,2,0,0,0,0|0,0,2]=4 5799 B12R1.267 C#CCNCc1ccccc1Cl Amb1925447 [0,2,0,0,0,0|0,0,2]=4 5800 B12R1.267 C#CCNCc1ccccc1Cl Amb6868432 [0,2,0,0,0,0|0,0,2]=4 5801 B12R1.267 C#CCNCc1ccccc1F Amb21979501 [0,2,0,0,0,0|0,0,2]=4 5802 B12R1.267 C#CCNCc1ccccc1F Amb6683727 [0,2,0,0,0,0|0,0,2]=4 5803 B12R1.267 C#CCNCc1ccccc1I Amb28317561 [0,2,0,0,0,0|0,0,2]=4 5804 B12R1.267 C#CCNCc1ccccc1O Amb6683601 [0,2,0,0,0,0|0,0,2]=4 5805 B12R1.267 C=CCCCc1ccccc1Br Amb32654215 [0,2,0,0,0,0|1,0,0]=3 5806 B12R1.267 C=CCCNC1=NC=CNC1=O Amb27226291 [0,2,0,0,0,0|2,0,0]=4 5807 B12R1.267 C=CCCNc1ccncc1F Amb30036533 [0,2,0,0,0,0|1,0,0]=3 5808 B12R1.267 C=CCCNc1ncccc1Br Amb28046026 [0,2,0,0,0,0|1,0,0]=3 5809 B12R1.267 C=CCCNc1ncccc1N Amb27476788 [0,2,0,0,0,0|1,0,0]=3 5810 B12R1.267 C=CCCNc1nccnc1C Amb28077589 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.267 C=CCCNc1nccnc1F Amb30018945 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.267 C=CCCNc1ncncc1Br Amb27615309 [0,2,0,0,0,0|2,0,0]=4 5813 B12R1.267 C=CCCOc1ccccc1Br Amb22232193 [0,2,0,0,0,0|1,0,0]=3 5814 B12R1.267 C=CCCOc1cccnc1Br Amb20241441 [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.267 C=CCNCc1ccccc1Br Amb20673595 [0,2,0,0,0,0|0,0,0]=2 5816 B12R1.267 C=CCNCc1ccccc1Br Amb6683971 [0,2,0,0,0,0|0,0,0]=2 5817 B12R1.267 C=CCNCc1ccccc1C Amb6683786 [0,2,0,0,0,0|0,0,0]=2 5818 B12R1.267 C=CCNCc1ccccc1C Amb6865276 [0,2,0,0,0,0|0,0,0]=2 5819 B12R1.267 C=CCNCc1ccccc1Cl Amb6683768 [0,2,0,0,0,0|0,0,0]=2 5820 B12R1.267 C=CCNCc1ccccc1Cl Amb6865275 [0,2,0,0,0,0|0,0,0]=2 5821 B12R1.267 C=CCNCc1ccccc1F Amb10609764 [0,2,0,0,0,0|0,0,0]=2 5822 B12R1.267 C=CCNCc1ccccc1F Amb2721870 [0,2,0,0,0,0|0,0,0]=2 5823 B12R1.267 C=CCNCc1ccccc1O Amb19890804 [0,2,0,0,0,0|0,0,0]=2 5824 B12R1.267 C=CCNCc1ccccc1O Amb6683831 [0,2,0,0,0,0|0,0,0]=2 5825 B12R1.267 C=CCOCc1ccccc1F Amb22227646 [0,2,0,0,0,0|1,0,0]=3 5826 B12R1.267 CC#CCNc1ccccc1Br Amb27948329 [0,2,0,0,0,0|0,0,2]=4 5827 B12R1.267 CC#CCNc1ccccc1C Amb18797550 [0,2,0,0,0,0|0,0,2]=4 5828 B12R1.267 CC#CCNc1ccccc1F Amb18182603 [0,2,0,0,0,0|0,0,2]=4 5829 B12R1.267 CC#CCNc1ccccc1I Amb27453194 [0,2,0,0,0,0|0,0,2]=4 5830 B12R1.267 CCCCNc1ccccc1Br Amb6696452 [0,2,0,0,0,0|0,0,2]=4 5831 B12R1.267 CCCCNc1ccccc1C Amb4016420 [0,2,0,0,0,0|0,0,2]=4 5832 B12R1.267 CCCCNc1ccccc1Cl Amb4313689 [0,2,0,0,0,0|0,0,2]=4 5833 B12R1.267 CCCCNc1ccccc1F Amb6697370 [0,2,0,0,0,0|0,0,2]=4 5834 B12R1.267 CCCCNc1ccccc1N Amb7767737 [0,2,0,0,0,0|0,0,2]=4 5835 B12R1.267 CCCCNc1ccccc1O Amb18646353 [0,2,0,0,0,0|0,0,2]=4 5836 B12R1.267 CCCNCc1ccccc1Br Amb19892805 [0,2,0,0,0,0|0,0,2]=4 5837 B12R1.267 CCCNCc1ccccc1Br Amb6272793 [0,2,0,0,0,0|0,0,2]=4 5838 B12R1.267 CCCNCc1ccccc1C Amb6276128 [0,2,0,0,0,0|0,0,2]=4 5839 B12R1.267 CCCNCc1ccccc1C Amb6865254 [0,2,0,0,0,0|0,0,2]=4 5840 B12R1.267 CCCNCc1ccccc1Cl Amb6271434 [0,2,0,0,0,0|0,0,2]=4 5841 B12R1.267 CCCNCc1ccccc1Cl Amb6542582 [0,2,0,0,0,0|0,0,2]=4 5842 B12R1.267 CCCNCc1ccccc1F Amb6258177 [0,2,0,0,0,0|0,0,2]=4 5843 B12R1.267 CCCNCc1ccccc1F Amb6865253 [0,2,0,0,0,0|0,0,2]=4 5844 B12R1.267 CCCNCc1ccccc1O Amb20673481 [0,2,0,0,0,0|0,0,2]=4 5845 B12R1.267 CCCNCc1ccccc1O Amb6281040 [0,2,0,0,0,0|0,0,2]=4 5846 B12R1.267 CNCCNc1ccccc1C Amb15772130 [0,2,0,0,0,0|0,0,2]=4 5847 B12R1.267 COCCNc1ccccc1Br Amb6712141 [0,2,0,0,0,0|0,0,2]=4 5848 B12R1.267 COCCNc1ccccc1C Amb595420 [0,2,0,0,0,0|0,0,2]=4 5849 B12R1.267 COCCNc1ccccc1Cl Amb6712363 [0,2,0,0,0,0|0,0,2]=4 5850 B12R1.267 COCCNc1ccccc1F Amb6712555 [0,2,0,0,0,0|0,0,2]=4 5851 B12R1.267 COCCNc1ccccc1I Amb7785821 [0,2,0,0,0,0|0,0,2]=4 5852 B12R1.267 COCCNc1ccccc1N Amb7767474 [0,2,0,0,0,0|0,0,2]=4 5853 B12R1.267 CSCCNc1ccccc1Br Amb27875069 [0,2,0,0,0,0|0,0,2]=4 5854 B12R1.267 CSCCNc1ccccc1I Amb28044651 [0,2,0,0,0,0|0,0,2]=4 5855 B12R1.267 CSCCNc1ccccc1N Amb27863236 [0,2,0,0,0,0|0,0,2]=4 5856 B12R1.267 C\C=C/C=C\c1ccccc1O Amb28122369 [0,2,0,0,0,0|1,0,1]=4 5857 B12R1.267 C\C=C\CCc1ccccc1C Amb27267945 [0,2,0,0,0,0|1,0,0]=3 5858 B12R1.267 C\C=C\CNc1ccccc1C Amb27606301 [0,2,0,0,0,0|0,0,0]=2 5859 B12R1.267 C\C=C\CNc1cccnc1N Amb28201938 [0,2,0,0,0,0|1,0,0]=3 5860 B12R1.267 C\C=C\CNc1ccncc1C Amb27432862 [0,2,0,0,0,0|1,0,0]=3 5861 B12R1.267 C\C=C\CNc1ccncc1F Amb35655043 [0,2,0,0,0,0|1,0,0]=3 5862 B12R1.267 C\C=C\CNc1ccncc1N Amb27422870 [0,2,0,0,0,0|1,0,0]=3 5863 B12R1.267 C\C=C\CNc1cnccc1N Amb27422872 [0,2,0,0,0,0|1,0,0]=3 5864 B12R1.267 C\C=C\CNc1nccnc1F Amb29866306 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.267 C\C=C\CNc1nccnc1N Amb28144785 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.267 C\C=C\CNc1ncncc1Cl Amb27648305 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.267 C\C=C\CNc1ncncc1I Amb28144762 [0,2,0,0,0,0|2,0,0]=4 5868 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|1,0,0]=3 5869 B12R1.267 C\C=C\COc1ccncc1I Amb24444269 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.267 C\C=C\COc1ccncc1N Amb28141493 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.267 C\C=C\COc1ncccc1I Amb26581973 [0,2,0,0,0,0|2,0,0]=4 5872 B12R1.267 C\C=C\CSc1cccc[n+]1[O-] Amb28398755 [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.267 C\C=C\CSc1ccccc1Br Amb28398756 [0,2,0,0,0,0|1,0,0]=3 5874 B12R1.267 C\C=C\CSc1ccccc1C Amb4020367 [0,2,0,0,0,0|1,0,0]=3 5875 B12R1.267 C\C=C\CSc1ncccc1Br Amb27187835 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.267 C\C=C\CSc1ncccc1Cl Amb27752845 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.267 Cc1ccccc1CCCC=O Amb18645710 [0,2,0,0,0,0|1,0,1]=4 5878 B12R1.267 Cc1ccccc1CNCC#N Amb17400074 [0,2,0,0,0,0|1,0,1]=4 5879 B12R1.267 Cc1ccccc1CNCCN Amb9174055 [0,2,0,0,0,0|1,0,1]=4 5880 B12R1.267 Cc1ccccc1CNCCO Amb6865192 [0,2,0,0,0,0|1,0,1]=4 5881 B12R1.267 Cc1ccccc1CNCCO Amb7757032 [0,2,0,0,0,0|1,0,1]=4 5882 B12R1.267 Cc1ccccc1CSCC=O Amb18184909 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.267 Cc1ccccc1NCCC#N Amb2794093 [0,2,0,0,0,0|0,0,2]=4 5884 B12R1.267 Cc1ccccc1NCCCF Amb27757671 [0,2,0,0,0,0|0,0,2]=4 5885 B12R1.267 Cc1ccccc1NCCCN Amb17057721 [0,2,0,0,0,0|0,0,2]=4 5886 B12R1.267 Cc1ccccc1NCCCO Amb17306598 [0,2,0,0,0,0|0,0,2]=4 5887 B12R1.267 Cc1ccccc1NC\C=C/Cl Amb27407084 [0,2,0,0,0,0|0,0,0]=2 5888 B12R1.267 Cc1ccccc1NC\C=C\Cl Amb28045972 [0,2,0,0,0,0|0,0,0]=2 5889 B12R1.267 Cc1ccccc1OCCC=O Amb5731759 [0,2,0,0,0,0|1,0,1]=4 5890 B12R1.267 Cc1ccccc1OC\C=C/Cl Amb27658979 [0,2,0,0,0,0|1,0,0]=3 5891 B12R1.267 Cc1ccccc1OC\C=C\Cl Amb27215119 [0,2,0,0,0,0|1,0,0]=3 5892 B12R1.267 Cc1ccccc1SCCC=O Amb18178931 [0,2,0,0,0,0|1,0,1]=4 5893 B12R1.267 Cc1cccnc1N\C=C\C=O Amb27256404 [0,2,0,0,0,0|1,0,1]=4 5894 B12R1.267 Cl\C=C\CNc1ccccc1I Amb28207679 [0,2,0,0,0,0|0,0,0]=2 5895 B12R1.267 Cl\C=C\COc1cccnc1Cl Amb27952198 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.267 Cl\C=C\CSc1ncccc1Br Amb27599242 [0,2,0,0,0,0|2,0,0]=4 5897 B12R1.267 Fc1ccccc1SC\C=C\Cl Amb27609566 [0,2,0,0,0,0|1,0,0]=3 5898 B12R1.267 N#CCCNc1ccccc1Br Amb7094593 [0,2,0,0,0,0|0,0,2]=4 5899 B12R1.267 N#CCCNc1ccccc1Cl Amb2794094 [0,2,0,0,0,0|0,0,2]=4 5900 B12R1.267 N#CCCNc1ccccc1F Amb1103848 [0,2,0,0,0,0|0,0,2]=4 5901 B12R1.267 N#CCCNc1ccccc1I Amb9202488 [0,2,0,0,0,0|0,0,2]=4 5902 B12R1.267 N#CCCNc1ccccc1O Amb4401572 [0,2,0,0,0,0|0,0,2]=4 5903 B12R1.267 N#CCNCc1ccccc1Cl Amb6709999 [0,2,0,0,0,0|1,0,1]=4 5904 B12R1.267 N#CCNCc1ccccc1F Amb6712731 [0,2,0,0,0,0|1,0,1]=4 5905 B12R1.267 NCCCNc1ccccc1Br Amb27226464 [0,2,0,0,0,0|0,0,2]=4 5906 B12R1.267 NCCCNc1ccccc1Cl Amb17057727 [0,2,0,0,0,0|0,0,2]=4 5907 B12R1.267 NCCCNc1ccccc1F Amb17057724 [0,2,0,0,0,0|0,0,2]=4 5908 B12R1.267 NCCCNc1ccccc1F Amb32718812 [0,2,0,0,0,0|0,0,2]=4 5909 B12R1.267 NCCNCc1ccccc1Br Amb18306264 [0,2,0,0,0,0|1,0,1]=4 5910 B12R1.267 NCCNCc1ccccc1Cl Amb10075510 [0,2,0,0,0,0|1,0,1]=4 5911 B12R1.267 NCCNCc1ccccc1Cl Amb29844472 [0,2,0,0,0,0|1,0,1]=4 5912 B12R1.267 NCCNCc1ccccc1F Amb10075506 [0,2,0,0,0,0|1,0,1]=4 5913 B12R1.267 NCCNCc1ccccc1F Amb29844475 [0,2,0,0,0,0|1,0,1]=4 5914 B12R1.267 NCCNCc1ccccc1O Amb19005483 [0,2,0,0,0,0|1,0,1]=4 5915 B12R1.267 Nc1ccccc1NCCCF Amb27656342 [0,2,0,0,0,0|0,0,2]=4 5916 B12R1.267 Nc1ccccc1NCCCO Amb8997320 [0,2,0,0,0,0|0,0,2]=4 5917 B12R1.267 Nc1ccccc1N\C=C/C=O Amb27876581 [0,2,0,0,0,0|0,0,1]=3 5918 B12R1.267 Nc1ccccc1N\C=C\CO Amb27866483 [0,2,0,0,0,0|0,0,2]=4 5919 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|1,0,0]=3 5920 B12R1.267 O=CCCCc1ccccc1Br Amb33451106 [0,2,0,0,0,0|1,0,1]=4 5921 B12R1.267 O=CCCCc1ccccc1Cl Amb32750392 [0,2,0,0,0,0|1,0,1]=4 5922 B12R1.267 O=CCCCc1ccccc1F Amb33474216 [0,2,0,0,0,0|1,0,1]=4 5923 B12R1.267 O=CCCCc1ccccc1O Amb18646065 [0,2,0,0,0,0|1,0,1]=4 5924 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|1,0,1]=4 5925 B12R1.267 O=CCCOc1ccccc1Cl Amb5731775 [0,2,0,0,0,0|1,0,1]=4 5926 B12R1.267 O=CCCSc1ccccc1Br Amb32682705 [0,2,0,0,0,0|1,0,1]=4 5927 B12R1.267 O=CCCSc1ccccc1Cl Amb18317016 [0,2,0,0,0,0|1,0,1]=4 5928 B12R1.267 O=CCCSc1ccccc1F Amb19045412 [0,2,0,0,0,0|1,0,1]=4 5929 B12R1.267 O=CCSCc1ccccc1Cl Amb32683106 [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.267 O=CNCCc1ccccc1Br Amb28410820 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.267 OCCCNc1ccccc1Br Amb17306220 [0,2,0,0,0,0|0,0,2]=4 5932 B12R1.267 OCCCNc1ccccc1Cl Amb17306039 [0,2,0,0,0,0|0,0,2]=4 5933 B12R1.267 OCCCNc1ccccc1F Amb17306155 [0,2,0,0,0,0|0,0,2]=4 5934 B12R1.267 OCCCNc1ccccc1I Amb27395286 [0,2,0,0,0,0|0,0,2]=4 5935 B12R1.267 OCCNCc1ccccc1Br Amb9203175 [0,2,0,0,0,0|1,0,1]=4 5936 B12R1.267 OCCNCc1ccccc1Cl Amb13949019 [0,2,0,0,0,0|1,0,1]=4 5937 B12R1.267 OCCNCc1ccccc1Cl Amb2721952 [0,2,0,0,0,0|1,0,1]=4 5938 B12R1.267 OCCNCc1ccccc1F Amb2592100 [0,2,0,0,0,0|1,0,1]=4 5939 B12R1.267 OCCNCc1ccccc1F Amb6865191 [0,2,0,0,0,0|1,0,1]=4 5940 B12R1.267 OCCNCc1ccccc1I Amb21861540 [0,2,0,0,0,0|1,0,1]=4 5941 B12R1.267 SCCCNc1ccccc1S Amb27667794 [0,2,0,0,0,0|0,0,2]=4 5942 B12R1.267 [O-][n+]1ccccc1OC\C=C\Cl Amb28283558 [0,2,0,0,0,0|2,0,0]=4 5943 B12R1.371 C#CC(C)Nc1ccccc1Cl Amb27232949 [0,2,0,0,0,0|0,0,2]=4 5944 B12R1.371 C#CC(C)Nc1ccccc1I Amb28388458 [0,2,0,0,0,0|0,0,2]=4 5945 B12R1.371 C=CC(=O)Cc1ccccc1Br Amb28143882 [0,2,0,0,0,0|1,0,1]=4 5946 B12R1.371 C=CC(=O)Cc1ccccc1F Amb2699672 [0,2,0,0,0,0|1,0,1]=4 5947 B12R1.371 C=CC(=O)Nc1ccccc1C Amb6843670 [0,2,0,0,0,0|0,0,1]=3 5948 B12R1.371 C=CC(=O)Nc1ccccc1Cl Amb6843675 [0,2,0,0,0,0|0,0,1]=3 5949 B12R1.371 C=CC(=O)Nc1ccccc1F Amb6843680 [0,2,0,0,0,0|0,0,1]=3 5950 B12R1.371 C=CC(=O)Nc1ccccc1I Amb9261228 [0,2,0,0,0,0|0,0,1]=3 5951 B12R1.371 C=CC(=O)Nc1cccnc1F Amb30018346 [0,2,0,0,0,0|1,0,1]=4 5952 B12R1.371 C=CC(=O)Nc1ccncc1F Amb27803592 [0,2,0,0,0,0|1,0,1]=4 5953 B12R1.371 C=CC(=O)Oc1ccccc1C Amb28204165 [0,2,0,0,0,0|1,0,1]=4 5954 B12R1.371 C=CC(=O)Oc1ccccc1Cl Amb28364728 [0,2,0,0,0,0|1,0,1]=4 5955 B12R1.371 C=CC(C)Nc1cccnc1N Amb28315384 [0,2,0,0,0,0|1,0,0]=3 5956 B12R1.371 C=CC(C)Nc1ccncc1Br Amb28076495 [0,2,0,0,0,0|1,0,0]=3 5957 B12R1.371 C=CC(C)Nc1ccncc1F Amb30036531 [0,2,0,0,0,0|1,0,0]=3 5958 B12R1.371 C=CC(C)Nc1ncccc1C Amb28461578 [0,2,0,0,0,0|1,0,0]=3 5959 B12R1.371 C=CC(C)Nc1ncccc1Cl Amb27234261 [0,2,0,0,0,0|1,0,0]=3 5960 B12R1.371 C=CC(C)Nc1ncccc1F Amb27669730 [0,2,0,0,0,0|1,0,0]=3 5961 B12R1.371 C=CC(C)Nc1ncccc1I Amb28185743 [0,2,0,0,0,0|1,0,0]=3 5962 B12R1.371 C=CC(C)Nc1nccnc1Cl Amb25156898 [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.371 C=CC(C)Nc1nccnc1F Amb30018937 [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.371 C=CC(C)Nc1ncncc1Cl Amb27594989 [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.371 C=CC(C)Oc1ccccc1Cl Amb27949950 [0,2,0,0,0,0|1,0,0]=3 5966 B12R1.371 C=CC(C)Oc1ccccc1F Amb26015971 [0,2,0,0,0,0|1,0,0]=3 5967 B12R1.371 C=CC(C)Oc1ccccc1I Amb27793487 [0,2,0,0,0,0|1,0,0]=3 5968 B12R1.371 C=CC(C)Oc1ccccc1N Amb24100513 [0,2,0,0,0,0|1,0,0]=3 5969 B12R1.371 C=CC(C)Sc1ccccc1Br Amb28400670 [0,2,0,0,0,0|1,0,0]=3 5970 B12R1.371 C=CC(C)Sc1ccccc1O Amb18805139 [0,2,0,0,0,0|1,0,0]=3 5971 B12R1.371 C=CC(C)Sc1ccncc1N Amb18990256 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.371 C=CC(C)Sc1ncccc1Br Amb27187829 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.371 C=CC(N)Cc1ccccc1Br Amb27389711 [0,2,0,0,0,0|1,0,0]=3 5974 B12R1.371 C=CC(N)Cc1ccccc1C Amb27162019 [0,2,0,0,0,0|1,0,0]=3 5975 B12R1.371 C=CC(N)Cc1ccccc1Cl Amb28367910 [0,2,0,0,0,0|1,0,0]=3 5976 B12R1.371 C=CC(O)Cc1ccccc1C Amb28401244 [0,2,0,0,0,0|1,0,0]=3 5977 B12R1.371 C=CC(O)Cc1ccccc1Cl Amb27211337 [0,2,0,0,0,0|1,0,0]=3 5978 B12R1.371 C=CC(O)Cc1ccccc1F Amb27431183 [0,2,0,0,0,0|1,0,0]=3 5979 B12R1.371 CC(C#N)Nc1ccccc1Br Amb17406668 [0,2,0,0,0,0|1,0,1]=4 5980 B12R1.371 CC(C#N)Nc1ccccc1Cl Amb17400851 [0,2,0,0,0,0|1,0,1]=4 5981 B12R1.371 CC(C#N)Nc1ccccc1F Amb17400147 [0,2,0,0,0,0|1,0,1]=4 5982 B12R1.371 CC(C#N)Nc1ccccc1I Amb27955536 [0,2,0,0,0,0|1,0,1]=4 5983 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [0,2,0,0,0,0|2,0,0]=4 5984 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [0,2,0,0,0,0|2,0,0]=4 5985 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [0,2,0,0,0,0|2,0,0]=4 5986 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [0,2,0,0,0,0|2,0,0]=4 5987 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [0,2,0,0,0,0|2,0,0]=4 5988 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [0,2,0,0,0,0|2,0,0]=4 5989 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [0,2,0,0,0,0|2,0,0]=4 5990 B12R1.371 CC(C=O)Oc1ccccc1F Amb35737124 [0,2,0,0,0,0|2,0,0]=4 5991 B12R1.371 CC(C=O)Oc1ccccc1I Amb30020615 [0,2,0,0,0,0|2,0,0]=4 5992 B12R1.371 CC(C=O)Sc1ccccc1Br Amb30020876 [0,2,0,0,0,0|2,0,0]=4 5993 B12R1.371 CC(C=O)Sc1ccccc1Cl Amb30020873 [0,2,0,0,0,0|2,0,0]=4 5994 B12R1.371 CC(C=O)Sc1ccccc1F Amb30020863 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.371 CC(CN)Nc1ccccc1Br Amb28118354 [0,2,0,0,0,0|1,0,1]=4 5996 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,2,0,0,0,0|1,0,1]=4 5997 B12R1.371 CC(CO)Nc1ccccc1I Amb28369198 [0,2,0,0,0,0|1,0,1]=4 5998 B12R1.371 CCC(C)Nc1ccccc1Br Amb6696460 [0,2,0,0,0,0|0,0,2]=4 5999 B12R1.371 CCC(C)Nc1ccccc1C Amb6701228 [0,2,0,0,0,0|0,0,2]=4 6000 B12R1.371 CCC(C)Nc1ccccc1Cl Amb6696915 [0,2,0,0,0,0|0,0,2]=4 6001 B12R1.371 CCC(C)Nc1ccccc1F Amb6697377 [0,2,0,0,0,0|0,0,2]=4 6002 B12R1.371 CCC(C)Nc1ccccc1I Amb7785642 [0,2,0,0,0,0|0,0,2]=4 6003 B12R1.371 CCC(C)Nc1ccccc1O Amb27760304 [0,2,0,0,0,0|0,0,2]=4 6004 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.371 Cc1ccccc1CC(Cl)C=O Amb17204326 [0,2,0,0,0,0|2,0,0]=4 6006 B12R1.371 Cc1ccccc1CC(F)C=O Amb27251880 [0,2,0,0,0,0|2,0,0]=4 6007 B12R1.371 Cc1ccccc1NC(C)C#N Amb17400076 [0,2,0,0,0,0|1,0,1]=4 6008 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,2,0,0,0,0|1,0,1]=4 6009 B12R1.371 Cc1ccccc1OC(C)C=O Amb27841630 [0,2,0,0,0,0|2,0,0]=4 6010 B12R1.371 Cc1ccccc1SC(C)C=O Amb30020858 [0,2,0,0,0,0|2,0,0]=4 6011 B12R1.371 O=CC(Cl)Cc1ccccc1Br Amb17204707 [0,2,0,0,0,0|2,0,0]=4 6012 B12R1.371 O=CC(Cl)Cc1ccccc1Cl Amb17204401 [0,2,0,0,0,0|2,0,0]=4 6013 B12R1.371 O=CC(Cl)Cc1ccccc1F Amb17204341 [0,2,0,0,0,0|2,0,0]=4 6014 B12R1.374 C#CCNc1cc(Br)ccc1F Amb27666454 [0,2,0,0,0,0|0,0,2]=4 6015 B12R1.374 C#CCNc1cc(C)ccc1Cl Amb27187643 [0,2,0,0,0,0|0,0,2]=4 6016 B12R1.374 C#CCNc1cc(C)ccc1F Amb18792476 [0,2,0,0,0,0|0,0,2]=4 6017 B12R1.374 C#CCNc1cc(Cl)ccc1C Amb18809275 [0,2,0,0,0,0|0,0,2]=4 6018 B12R1.374 C#CCNc1cc(Cl)ccc1Cl Amb4148887 [0,2,0,0,0,0|0,0,2]=4 6019 B12R1.374 C#CCNc1cc(Cl)ccc1I Amb30015871 [0,2,0,0,0,0|0,0,2]=4 6020 B12R1.374 C#CCNc1cc(F)ccc1F Amb17307292 [0,2,0,0,0,0|0,0,2]=4 6021 B12R1.374 C#CCNc1cc(I)ccc1Br Amb27765021 [0,2,0,0,0,0|0,0,2]=4 6022 B12R1.374 C=CCCN1C=C(F)C=CC1=O Amb28317653 [0,2,0,0,0,0|2,0,0]=4 6023 B12R1.374 C=CCCN1C=C(N)C=CC1=O Amb32705442 [0,2,0,0,0,0|2,0,0]=4 6024 B12R1.374 C=CCCc1cc(C)ccc1Cl Amb29867188 [0,2,0,0,0,0|1,0,0]=3 6025 B12R1.374 C=CCCc1cc(C)ccc1F Amb30012313 [0,2,0,0,0,0|1,0,0]=3 6026 B12R1.374 C=CCCc1cc(Cl)ccc1Br Amb28460915 [0,2,0,0,0,0|1,0,0]=3 6027 B12R1.374 C=CCCc1cc(Cl)ccc1F Amb28314187 [0,2,0,0,0,0|1,0,0]=3 6028 B12R1.374 C=CCCc1cc(Cl)ccc1I Amb35706094 [0,2,0,0,0,0|1,0,0]=3 6029 B12R1.374 C=CCCc1cc(F)ccc1Br Amb27631371 [0,2,0,0,0,0|1,0,0]=3 6030 B12R1.374 C=CCCc1cc(F)ccc1Cl Amb27784280 [0,2,0,0,0,0|1,0,0]=3 6031 B12R1.374 C=CCNc1cc(Br)ccc1C Amb28137664 [0,2,0,0,0,0|0,0,0]=2 6032 B12R1.374 C=CCNc1cc(Br)ccc1Cl Amb27454272 [0,2,0,0,0,0|0,0,0]=2 6033 B12R1.374 C=CCNc1cc(C)ccc1Cl Amb27231766 [0,2,0,0,0,0|0,0,0]=2 6034 B12R1.374 C=CCNc1cc(Cl)ccc1Cl Amb17306516 [0,2,0,0,0,0|0,0,0]=2 6035 B12R1.374 C=CCNc1cc(Cl)ccc1I Amb35706565 [0,2,0,0,0,0|0,0,0]=2 6036 B12R1.374 C=CCNc1cc(Cl)ccc1O Amb27750774 [0,2,0,0,0,0|0,0,0]=2 6037 B12R1.374 C=CCNc1cc(F)ccc1C Amb18792653 [0,2,0,0,0,0|0,0,0]=2 6038 B12R1.374 C=CCNc1cc(F)ccc1Cl Amb27606063 [0,2,0,0,0,0|0,0,0]=2 6039 B12R1.374 C=CCNc1cc(I)ccc1Br Amb27983424 [0,2,0,0,0,0|0,0,0]=2 6040 B12R1.374 C=CCNc1cc(I)ccc1C Amb27758292 [0,2,0,0,0,0|0,0,0]=2 6041 B12R1.374 C=CCNc1nc(C)ccc1N Amb17209147 [0,2,0,0,0,0|1,0,0]=3 6042 B12R1.374 C=CCNc1nc(C)cnc1C Amb27845374 [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.374 C=CCNc1nc(Cl)ccc1N Amb26066875 [0,2,0,0,0,0|1,0,0]=3 6044 B12R1.374 C=CCNc1nc(Cl)ncc1Br Amb24455112 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.374 C=CCNc1nc(Cl)ncc1Cl Amb27873514 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.374 C=CCNc1nc(Cl)ncc1F Amb1149324 [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.374 C=CCNc1nc(F)ncc1Br Amb35670526 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.374 C=CCNc1nc(F)ncc1C Amb35650550 [0,2,0,0,0,0|2,0,0]=4 6049 B12R1.374 C=CCNc1nc(F)ncc1Cl Amb35611502 [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.374 C=CCNc1nc(F)ncc1N Amb35626603 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.374 C=CCOC1=CC(=O)C=CC1=O Amb25373844 [0,2,0,0,0,0|1,0,0]=3 6052 B12R1.374 C=CCOc1cc(Br)ccc1F Amb26412966 [0,2,0,0,0,0|1,0,0]=3 6053 B12R1.374 C=CCOc1cc(Br)ccc1O Amb27630363 [0,2,0,0,0,0|1,0,0]=3 6054 B12R1.374 C=CCOc1cc(Br)ncc1C Amb27981613 [0,2,0,0,0,0|2,0,0]=4 6055 B12R1.374 C=CCOc1cc(C)ccc1Br Amb35663089 [0,2,0,0,0,0|1,0,0]=3 6056 B12R1.374 C=CCOc1cc(C)ccc1C Amb25882157 [0,2,0,0,0,0|1,0,0]=3 6057 B12R1.374 C=CCOc1cc(C)ccc1Cl Amb25871596 [0,2,0,0,0,0|1,0,0]=3 6058 B12R1.374 C=CCOc1cc(C)ccc1N Amb17138557 [0,2,0,0,0,0|1,0,0]=3 6059 B12R1.374 C=CCOc1cc(Cl)ccc1Cl Amb4422145 [0,2,0,0,0,0|1,0,0]=3 6060 B12R1.374 C=CCOc1cc(Cl)ncc1C Amb28044737 [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.374 C=CCOc1cc(F)ccc1Br Amb24605603 [0,2,0,0,0,0|1,0,0]=3 6062 B12R1.374 C=CCOc1cc(N)ccc1C Amb17138558 [0,2,0,0,0,0|1,0,0]=3 6063 B12R1.374 C=CCOc1cc(N)ccc1Cl Amb23454613 [0,2,0,0,0,0|1,0,0]=3 6064 B12R1.374 C=CCOc1cc(N)ccc1N Amb27208923 [0,2,0,0,0,0|1,0,0]=3 6065 B12R1.374 C=CCOc1cc(O)ccc1Cl Amb18649015 [0,2,0,0,0,0|1,0,0]=3 6066 B12R1.374 C=CCSc1cc(C)ccc1C Amb28291439 [0,2,0,0,0,0|1,0,0]=3 6067 B12R1.374 C=CCSc1cc(Cl)ccc1C Amb26564282 [0,2,0,0,0,0|1,0,0]=3 6068 B12R1.374 C=CCSc1cc(Cl)ccc1Cl Amb24688252 [0,2,0,0,0,0|1,0,0]=3 6069 B12R1.374 C=CCSc1cc(Cl)ccc1N Amb27227913 [0,2,0,0,0,0|1,0,0]=3 6070 B12R1.374 C=CCSc1cc(F)ccc1C Amb26944778 [0,2,0,0,0,0|1,0,0]=3 6071 B12R1.374 C=CCSc1cc(O)ccc1C Amb28324316 [0,2,0,0,0,0|1,0,0]=3 6072 B12R1.374 C=CCSc1nc(Cl)ccc1N Amb27390307 [0,2,0,0,0,0|2,0,0]=4 6073 B12R1.374 C=C\C=C/c1cc(Cl)ccc1O Amb28243957 [0,2,0,0,0,0|1,0,1]=4 6074 B12R1.374 CCCNc1cc(Br)ccc1N Amb25738246 [0,2,0,0,0,0|0,0,2]=4 6075 B12R1.374 CCCNc1cc(C)ccc1C Amb4313517 [0,2,0,0,0,0|0,0,2]=4 6076 B12R1.374 CCCNc1cc(C)ccc1N Amb23114177 [0,2,0,0,0,0|0,0,2]=4 6077 B12R1.374 CCCNc1cc(Cl)ccc1C Amb6683517 [0,2,0,0,0,0|0,0,2]=4 6078 B12R1.374 CCCNc1cc(Cl)ccc1Cl Amb6647443 [0,2,0,0,0,0|0,0,2]=4 6079 B12R1.374 CCCNc1cc(Cl)ccc1I Amb30016029 [0,2,0,0,0,0|0,0,2]=4 6080 B12R1.374 CCCNc1cc(Cl)ccc1N Amb26025569 [0,2,0,0,0,0|0,0,2]=4 6081 B12R1.374 CCCNc1cc(Cl)ccc1O Amb27164011 [0,2,0,0,0,0|0,0,2]=4 6082 B12R1.374 CCCNc1cc(F)ccc1Cl Amb28384962 [0,2,0,0,0,0|0,0,2]=4 6083 B12R1.374 CCCNc1cc(F)ccc1F Amb6691519 [0,2,0,0,0,0|0,0,2]=4 6084 B12R1.374 CCCNc1cc(F)ccc1N Amb18989853 [0,2,0,0,0,0|0,0,2]=4 6085 B12R1.374 CCCNc1cc(I)ccc1C Amb27760818 [0,2,0,0,0,0|0,0,2]=4 6086 B12R1.374 Cc1ccc(Br)c(CCC=O)c1 Amb28187072 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.374 Cc1ccc(Br)c(NCC#N)c1 Amb27255872 [0,2,0,0,0,0|1,0,1]=4 6088 B12R1.374 Cc1ccc(Br)c(NCCO)c1 Amb27599653 [0,2,0,0,0,0|1,0,1]=4 6089 B12R1.374 Cc1ccc(Br)c(OCC=O)c1 Amb35666597 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.374 Cc1ccc(Br)cc1CCC=O Amb27209546 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.374 Cc1ccc(Br)cc1NCCN Amb26883679 [0,2,0,0,0,0|1,0,1]=4 6092 B12R1.374 Cc1ccc(C)c(CCC=O)c1 Amb18798123 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.374 Cc1ccc(C)c(NCC#N)c1 Amb6714123 [0,2,0,0,0,0|1,0,1]=4 6094 B12R1.374 Cc1ccc(C)c(NCCCl)c1 Amb17335662 [0,2,0,0,0,0|1,0,1]=4 6095 B12R1.374 Cc1ccc(C)c(NCCN)c1 Amb17091051 [0,2,0,0,0,0|1,0,1]=4 6096 B12R1.374 Cc1ccc(C)c(NCCO)c1 Amb6714168 [0,2,0,0,0,0|1,0,1]=4 6097 B12R1.374 Cc1ccc(C)c(OCC=O)c1 Amb5731826 [0,2,0,0,0,0|2,0,0]=4 6098 B12R1.374 Cc1ccc(C)c(SCC=O)c1 Amb17082911 [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.374 Cc1ccc(Cl)c(CCC=O)c1 Amb27471041 [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.374 Cc1ccc(Cl)cc1NCC#N Amb6706371 [0,2,0,0,0,0|1,0,1]=4 6102 B12R1.374 Cc1ccc(Cl)cc1NCCCl Amb17338052 [0,2,0,0,0,0|1,0,1]=4 6103 B12R1.374 Cc1ccc(Cl)cc1NCCN Amb17091058 [0,2,0,0,0,0|1,0,1]=4 6104 B12R1.374 Cc1ccc(Cl)cc1NCCO Amb6706402 [0,2,0,0,0,0|1,0,1]=4 6105 B12R1.374 Cc1ccc(F)c(CCC=O)c1 Amb25775656 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.374 Cc1ccc(F)c(OCC=O)c1 Amb28241692 [0,2,0,0,0,0|2,0,0]=4 6107 B12R1.374 Cc1ccc(F)cc1CCC=O Amb26860965 [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.374 Cc1ccc(F)cc1NCCF Amb27799699 [0,2,0,0,0,0|1,0,1]=4 6109 B12R1.374 Cc1ccc(F)cc1OCC=O Amb28430393 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.374 Cc1ccc(I)c(CCC=O)c1 Amb27851427 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.374 Cc1ccc(N)c(NCCN)c1 Amb27167275 [0,2,0,0,0,0|1,0,1]=4 6112 B12R1.374 Cc1ccc(N)c(NCCO)c1 Amb27257675 [0,2,0,0,0,0|1,0,1]=4 6113 B12R1.374 Cc1ccc(O)c(CCC=O)c1 Amb24527959 [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.374 Cc1ccc(O)c(NCCO)c1 Amb27223975 [0,2,0,0,0,0|1,0,1]=4 6115 B12R1.374 ClCCNc1cc(Cl)ccc1Cl Amb17343164 [0,2,0,0,0,0|1,0,1]=4 6116 B12R1.374 FCCNc1cc(Br)ccc1I Amb27791394 [0,2,0,0,0,0|1,0,1]=4 6117 B12R1.374 FCCNc1cc(Cl)ccc1F Amb27477495 [0,2,0,0,0,0|1,0,1]=4 6118 B12R1.374 FCCNc1cc(Cl)ccc1I Amb35706566 [0,2,0,0,0,0|1,0,1]=4 6119 B12R1.374 FCCNc1cc(F)ccc1Br Amb27662624 [0,2,0,0,0,0|1,0,1]=4 6120 B12R1.374 FCCNc1cc(I)ccc1Br Amb28119464 [0,2,0,0,0,0|1,0,1]=4 6121 B12R1.374 FCCNc1cc(I)ccc1Cl Amb27666460 [0,2,0,0,0,0|1,0,1]=4 6122 B12R1.374 N#CCNc1cc(Br)ccc1Br Amb27198411 [0,2,0,0,0,0|1,0,1]=4 6123 B12R1.374 N#CCNc1cc(Cl)ccc1Br Amb28366677 [0,2,0,0,0,0|1,0,1]=4 6124 B12R1.374 N#CCNc1cc(Cl)ccc1Cl Amb6707789 [0,2,0,0,0,0|1,0,1]=4 6125 B12R1.374 N#CCNc1cc(Cl)ccc1I Amb35706564 [0,2,0,0,0,0|1,0,1]=4 6126 B12R1.374 N#CCNc1cc(F)ccc1Br Amb27794016 [0,2,0,0,0,0|1,0,1]=4 6127 B12R1.374 N#CCNc1cc(F)ccc1Cl Amb27259958 [0,2,0,0,0,0|1,0,1]=4 6128 B12R1.374 N#CCNc1cc(F)ccc1F Amb6709824 [0,2,0,0,0,0|1,0,1]=4 6129 B12R1.374 NCCNc1cc(Br)ccc1F Amb24732633 [0,2,0,0,0,0|1,0,1]=4 6130 B12R1.374 NCCNc1cc(Br)ccc1N Amb27478399 [0,2,0,0,0,0|1,0,1]=4 6131 B12R1.374 NCCNc1cc(Cl)ccc1Cl Amb17091082 [0,2,0,0,0,0|1,0,1]=4 6132 B12R1.374 NCCNc1cc(Cl)ccc1F Amb18243910 [0,2,0,0,0,0|1,0,1]=4 6133 B12R1.374 NCCNc1cc(Cl)ccc1I Amb30016030 [0,2,0,0,0,0|1,0,1]=4 6134 B12R1.374 NCCNc1cc(F)ccc1F Amb18997936 [0,2,0,0,0,0|1,0,1]=4 6135 B12R1.374 Nc1ccc(Br)cc1NCCO Amb26880088 [0,2,0,0,0,0|1,0,1]=4 6136 B12R1.374 Nc1ccc(F)c(CCC=O)c1 Amb27614027 [0,2,0,0,0,0|2,0,0]=4 6137 B12R1.374 Nc1ccc(F)cc1CCC=O Amb27614026 [0,2,0,0,0,0|2,0,0]=4 6138 B12R1.374 Nc1ccc(F)cc1NCCF Amb27426829 [0,2,0,0,0,0|1,0,1]=4 6139 B12R1.374 Nc1ccc(O)c(CCC=O)c1 Amb28129930 [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.374 Nc1ccc(S)c(CCC=O)c1 Amb27777371 [0,2,0,0,0,0|2,0,0]=4 6141 B12R1.374 O=C1C=CC(=O)C(NCCO)=C1 Amb27230328 [0,2,0,0,0,0|1,0,1]=4 6142 B12R1.374 O=CCCc1cc(Br)ccc1Br Amb26904631 [0,2,0,0,0,0|2,0,0]=4 6143 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.374 O=CCCc1cc(Br)ccc1F Amb27460881 [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.374 O=CCCc1cc(Br)ccc1O Amb26009876 [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.374 O=CCCc1cc(Cl)ccc1Cl Amb10606178 [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.374 O=CCCc1cc(Cl)ccc1I Amb25941284 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.374 O=CCCc1cc(Cl)ccc1O Amb27148868 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.374 O=CCCc1cc(F)ccc1Cl Amb25968941 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.374 O=CCCc1cc(F)ccc1O Amb24432683 [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.374 O=CCCc1cc(F)ccc1S Amb27423576 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.374 O=CCCc1cc(I)ccc1Cl Amb27876661 [0,2,0,0,0,0|2,0,0]=4 6158 B12R1.374 O=CCCc1cc(I)ccc1F Amb27978680 [0,2,0,0,0,0|2,0,0]=4 6159 B12R1.374 O=CCCc1cc(I)ccc1O Amb27638722 [0,2,0,0,0,0|2,0,0]=4 6160 B12R1.374 O=CCCc1cc(I)ccc1S Amb27423735 [0,2,0,0,0,0|2,0,0]=4 6161 B12R1.374 O=CCCc1cc(O)ccc1Br Amb25311997 [0,2,0,0,0,0|2,0,0]=4 6162 B12R1.374 O=CCCc1cc(O)ccc1Cl Amb26846620 [0,2,0,0,0,0|2,0,0]=4 6163 B12R1.374 O=CCCc1cc(O)ccc1F Amb26879965 [0,2,0,0,0,0|2,0,0]=4 6164 B12R1.374 O=CCCc1cc(O)ccc1I Amb27604868 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.374 O=CCCc1cc(O)ccc1O Amb27962672 [0,2,0,0,0,0|2,0,0]=4 6166 B12R1.374 O=CCCc1cc(S)ccc1Cl Amb27428155 [0,2,0,0,0,0|2,0,0]=4 6167 B12R1.374 O=CCCc1cc(S)ccc1O Amb27423589 [0,2,0,0,0,0|2,0,0]=4 6168 B12R1.374 O=CCOc1cc(Cl)ccc1Cl Amb5731858 [0,2,0,0,0,0|2,0,0]=4 6169 B12R1.374 O=CCOc1cc(F)ccc1Br Amb27776004 [0,2,0,0,0,0|2,0,0]=4 6170 B12R1.374 O=CCOc1cc(F)ccc1Cl Amb27257466 [0,2,0,0,0,0|2,0,0]=4 6171 B12R1.374 O=CCOc1cc(F)ccc1F Amb28455954 [0,2,0,0,0,0|2,0,0]=4 6172 B12R1.374 O=CCSc1cc(Cl)ccc1Cl Amb25751305 [0,2,0,0,0,0|2,0,0]=4 6173 B12R1.374 O=CCSc1cc(F)ccc1F Amb19077118 [0,2,0,0,0,0|2,0,0]=4 6174 B12R1.374 OCCNc1cc(Cl)ccc1Cl Amb6707812 [0,2,0,0,0,0|1,0,1]=4 6175 B12R1.374 OCCNc1cc(Cl)ccc1I Amb35706945 [0,2,0,0,0,0|1,0,1]=4 6176 B12R1.374 OCCNc1cc(F)ccc1Br Amb27175199 [0,2,0,0,0,0|1,0,1]=4 6177 B12R1.374 OCCNc1cc(F)ccc1F Amb6709873 [0,2,0,0,0,0|1,0,1]=4 6178 B12R1.1631 C#CCNc1c(C)cccc1Br Amb35721341 [0,2,0,0,0,0|0,0,2]=4 6179 B12R1.1631 C#CCNc1c(C)cccc1C Amb18797551 [0,2,0,0,0,0|0,0,2]=4 6180 B12R1.1631 C=CCCN1C(=O)C=CC=C1Br Amb27484358 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.1631 C=CCCc1c(C)cccc1C Amb27596124 [0,2,0,0,0,0|1,0,0]=3 6182 B12R1.1631 C=CCCc1c(Cl)cccc1Br Amb35715389 [0,2,0,0,0,0|1,0,0]=3 6183 B12R1.1631 C=CCCc1c(F)cncc1F Amb35630168 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.1631 C=CCNc1c(C)cccc1Br Amb35706681 [0,2,0,0,0,0|0,0,0]=2 6185 B12R1.1631 C=CCNc1c(C)cccc1C Amb17306408 [0,2,0,0,0,0|0,0,0]=2 6186 B12R1.1631 C=CCNc1c(C)cccc1F Amb27203262 [0,2,0,0,0,0|0,0,0]=2 6187 B12R1.1631 C=CCNc1c(Cl)cccc1Cl Amb17306282 [0,2,0,0,0,0|0,0,0]=2 6188 B12R1.1631 C=CCNc1c(Cl)ncnc1Cl Amb21959552 [0,2,0,0,0,0|2,0,0]=4 6189 B12R1.1631 C=CCNc1c(F)cccc1F Amb18295623 [0,2,0,0,0,0|0,0,0]=2 6190 B12R1.1631 C=CCNc1c(N)cccc1Br Amb35638508 [0,2,0,0,0,0|0,0,0]=2 6191 B12R1.1631 C=CCNc1c(N)cncc1Cl Amb27187894 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.1631 C=CCOc1c(Br)cccc1Br Amb27946036 [0,2,0,0,0,0|1,0,0]=3 6193 B12R1.1631 C=CCOc1c(C)cccc1Cl Amb28044119 [0,2,0,0,0,0|1,0,0]=3 6194 B12R1.1631 C=CCOc1c(C)cccc1N Amb27407078 [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.1631 C=CCOc1c(Cl)cccc1Cl Amb25075776 [0,2,0,0,0,0|1,0,0]=3 6196 B12R1.1631 C=CCOc1c(F)cccc1F Amb22641482 [0,2,0,0,0,0|1,0,0]=3 6197 B12R1.1631 C=CCOc1c(N)cccc1F Amb28287242 [0,2,0,0,0,0|1,0,0]=3 6198 B12R1.1631 C=CCOc1c(O)ccnc1C Amb17219243 [0,2,0,0,0,0|2,0,0]=4 6199 B12R1.1631 C=CCSc1c(N)cccc1Br Amb35591418 [0,2,0,0,0,0|1,0,0]=3 6200 B12R1.1631 CCCNc1c(C)cccc1Br Amb35721344 [0,2,0,0,0,0|0,0,2]=4 6201 B12R1.1631 CCCNc1c(C)cccc1C Amb9174039 [0,2,0,0,0,0|0,0,2]=4 6202 B12R1.1631 CCCNc1c(C)cccc1Cl Amb27784256 [0,2,0,0,0,0|0,0,2]=4 6203 B12R1.1631 CCCNc1c(C)cccc1F Amb28423309 [0,2,0,0,0,0|0,0,2]=4 6204 B12R1.1631 CCCNc1c(C)cccc1N Amb24678901 [0,2,0,0,0,0|0,0,2]=4 6205 B12R1.1631 CCCNc1c(F)cccc1Br Amb27840814 [0,2,0,0,0,0|0,0,2]=4 6206 B12R1.1631 CCCNc1c(F)cccc1F Amb7784430 [0,2,0,0,0,0|0,0,2]=4 6207 B12R1.1631 CCCNc1c(N)cccc1Br Amb32708759 [0,2,0,0,0,0|0,0,2]=4 6208 B12R1.1631 CCCNc1c(N)cccc1F Amb22289420 [0,2,0,0,0,0|0,0,2]=4 6209 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,2,0,0,0,0|2,0,0]=4 6210 B12R1.1631 Cc1cccc(Br)c1NCC#N Amb35706680 [0,2,0,0,0,0|1,0,1]=4 6211 B12R1.1631 Cc1cccc(Br)c1NCCF Amb35706683 [0,2,0,0,0,0|1,0,1]=4 6212 B12R1.1631 Cc1cccc(Br)c1NCCN Amb35721345 [0,2,0,0,0,0|1,0,1]=4 6213 B12R1.1631 Cc1cccc(Br)c1NCCO Amb35706949 [0,2,0,0,0,0|1,0,1]=4 6214 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,2,0,0,0,0|2,0,0]=4 6215 B12R1.1631 Cc1cccc(C)c1NCC#N Amb17400079 [0,2,0,0,0,0|1,0,1]=4 6216 B12R1.1631 Cc1cccc(C)c1NCCCl Amb17335665 [0,2,0,0,0,0|1,0,1]=4 6217 B12R1.1631 Cc1cccc(C)c1NCCN Amb17091053 [0,2,0,0,0,0|1,0,1]=4 6218 B12R1.1631 Cc1cccc(C)c1NCCO Amb17306428 [0,2,0,0,0,0|1,0,1]=4 6219 B12R1.1631 Cc1cccc(C)c1OCC=O Amb5731825 [0,2,0,0,0,0|2,0,0]=4 6220 B12R1.1631 Cc1cccc(Cl)c1CCC=O Amb27211329 [0,2,0,0,0,0|2,0,0]=4 6221 B12R1.1631 Cc1cccc(Cl)c1NCCF Amb27648002 [0,2,0,0,0,0|1,0,1]=4 6222 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,2,0,0,0,0|2,0,0]=4 6223 B12R1.1631 Cc1cccc(F)c1NCCN Amb27164797 [0,2,0,0,0,0|1,0,1]=4 6224 B12R1.1631 Cc1cccc(F)c1NCCO Amb27595906 [0,2,0,0,0,0|1,0,1]=4 6225 B12R1.1631 Cc1cccc(I)c1CCC=O Amb27962889 [0,2,0,0,0,0|2,0,0]=4 6226 B12R1.1631 Cc1cccc(N)c1NCCO Amb28244081 [0,2,0,0,0,0|1,0,1]=4 6227 B12R1.1631 Cc1cccc(S)c1CCC=O Amb27624765 [0,2,0,0,0,0|2,0,0]=4 6228 B12R1.1631 N#CCNc1c(Cl)cccc1Cl Amb27806995 [0,2,0,0,0,0|1,0,1]=4 6229 B12R1.1631 N#CCNc1c(F)cccc1F Amb7784597 [0,2,0,0,0,0|1,0,1]=4 6230 B12R1.1631 NCCNc1c(F)cccc1F Amb17091087 [0,2,0,0,0,0|1,0,1]=4 6231 B12R1.1631 NCCNc1c(N)cccc1Br Amb35638510 [0,2,0,0,0,0|1,0,1]=4 6232 B12R1.1631 NCCNc1c(N)cccc1Cl Amb18991499 [0,2,0,0,0,0|1,0,1]=4 6233 B12R1.1631 Nc1cccc(Br)c1NCCF Amb35638514 [0,2,0,0,0,0|1,0,1]=4 6234 B12R1.1631 Nc1cccc(Br)c1NCCO Amb35638513 [0,2,0,0,0,0|1,0,1]=4 6235 B12R1.1631 Nc1cccc(S)c1CCC=O Amb28384695 [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.1631 O=CCCc1c(Cl)cccc1Br Amb26494572 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,2,0,0,0,0|2,0,0]=4 6238 B12R1.1631 O=CCCc1c(Cl)cccc1I Amb27759488 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,2,0,0,0,0|2,0,0]=4 6242 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,2,0,0,0,0|2,0,0]=4 6243 B12R1.1631 O=CCCc1c(F)cccc1S Amb27798716 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.1631 O=CCCc1c(O)cccc1Br Amb28046347 [0,2,0,0,0,0|2,0,0]=4 6245 B12R1.1631 O=CCCc1c(O)cccc1Cl Amb26845539 [0,2,0,0,0,0|2,0,0]=4 6246 B12R1.1631 O=CCCc1c(O)cccc1I Amb25784762 [0,2,0,0,0,0|2,0,0]=4 6247 B12R1.1631 O=CCCc1c(O)cccc1S Amb27259768 [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.1631 O=CCCc1c(S)cccc1Br Amb28435487 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.1631 O=CCCc1c(S)cccc1Cl Amb27623464 [0,2,0,0,0,0|2,0,0]=4 6250 B12R1.1631 O=CCCc1c(S)cccc1S Amb28133073 [0,2,0,0,0,0|2,0,0]=4 6251 B12R1.1631 O=CCOc1c(Cl)cccc1Cl Amb5731860 [0,2,0,0,0,0|2,0,0]=4 6252 B12R1.1631 OCCNc1c(F)cccc1Cl Amb28346199 [0,2,0,0,0,0|1,0,1]=4 6253 B12R1.28 C#CCCNc1cccc(Cl)c1 Amb27816959 [0,2,0,0,0,0|0,0,2]=4 6254 B12R1.28 C#CCCNc1cccc(I)c1 Amb27591883 [0,2,0,0,0,0|0,0,2]=4 6255 B12R1.28 C#CCNCc1cccc(Br)c1 Amb21979461 [0,2,0,0,0,0|0,0,2]=4 6256 B12R1.28 C#CCNCc1cccc(Br)c1 Amb6683537 [0,2,0,0,0,0|0,0,2]=4 6257 B12R1.28 C#CCNCc1cccc(C)c1 Amb21979538 [0,2,0,0,0,0|0,0,2]=4 6258 B12R1.28 C#CCNCc1cccc(C)c1 Amb6683558 [0,2,0,0,0,0|0,0,2]=4 6259 B12R1.28 C#CCNCc1cccc(Cl)c1 Amb21979462 [0,2,0,0,0,0|0,0,2]=4 6260 B12R1.28 C#CCNCc1cccc(Cl)c1 Amb6683718 [0,2,0,0,0,0|0,0,2]=4 6261 B12R1.28 C#CCNCc1cccc(I)c1 Amb27410312 [0,2,0,0,0,0|0,0,2]=4 6262 B12R1.28 C=CCCNc1cc(Br)ncn1 Amb28458180 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.28 C=CCCNc1cc(C)cnn1 Amb27872109 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.28 C=CCCNc1cc(N)ccn1 Amb28143385 [0,2,0,0,0,0|1,0,0]=3 6265 B12R1.28 C=CCCNc1cc(N)ncn1 Amb28283455 [0,2,0,0,0,0|2,0,0]=4 6266 B12R1.28 C=CCCNc1cccc(Br)c1 Amb27589967 [0,2,0,0,0,0|0,0,0]=2 6267 B12R1.28 C=CCCNc1cccc(C)c1 Amb27789522 [0,2,0,0,0,0|0,0,0]=2 6268 B12R1.28 C=CCCNc1cccc(Cl)c1 Amb27470578 [0,2,0,0,0,0|0,0,0]=2 6269 B12R1.28 C=CCCNc1cccc(F)n1 Amb27863115 [0,2,0,0,0,0|1,0,0]=3 6270 B12R1.28 C=CCCNc1cccc(I)c1 Amb27250272 [0,2,0,0,0,0|0,0,0]=2 6271 B12R1.28 C=CCCNc1ccnc(F)c1 Amb27760906 [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.28 C=CCCNc1ccnc(F)n1 Amb29855140 [0,2,0,0,0,0|2,0,0]=4 6273 B12R1.28 C=CCCNc1cncc(Br)c1 Amb27235692 [0,2,0,0,0,0|1,0,0]=3 6274 B12R1.28 C=CCCNc1cncc(Cl)c1 Amb35706913 [0,2,0,0,0,0|1,0,0]=3 6275 B12R1.28 C=CCCNc1cncc(F)n1 Amb29861551 [0,2,0,0,0,0|2,0,0]=4 6276 B12R1.28 C=CCCOc1cccc(F)c1 Amb33474289 [0,2,0,0,0,0|1,0,0]=3 6277 B12R1.28 C=CCCOc1cccc(N)c1 Amb33545664 [0,2,0,0,0,0|1,0,0]=3 6278 B12R1.28 C=CCNCc1cccc(Br)c1 Amb1923351 [0,2,0,0,0,0|0,0,0]=2 6279 B12R1.28 C=CCNCc1cccc(Br)c1 Amb6864776 [0,2,0,0,0,0|0,0,0]=2 6280 B12R1.28 C=CCNCc1cccc(C)c1 Amb19890661 [0,2,0,0,0,0|0,0,0]=2 6281 B12R1.28 C=CCNCc1cccc(C)c1 Amb6683789 [0,2,0,0,0,0|0,0,0]=2 6282 B12R1.28 C=CCNCc1cccc(Cl)c1 Amb19890325 [0,2,0,0,0,0|0,0,0]=2 6283 B12R1.28 C=CCNCc1cccc(Cl)c1 Amb4304022 [0,2,0,0,0,0|0,0,0]=2 6284 B12R1.28 C=CCNCc1cccc(F)c1 Amb20673583 [0,2,0,0,0,0|0,0,0]=2 6285 B12R1.28 C=CCNCc1cccc(F)c1 Amb6683782 [0,2,0,0,0,0|0,0,0]=2 6286 B12R1.28 C=CCNCc1cccc(O)c1 Amb19890781 [0,2,0,0,0,0|0,0,0]=2 6287 B12R1.28 C=CCNCc1cccc(O)c1 Amb6683948 [0,2,0,0,0,0|0,0,0]=2 6288 B12R1.28 C=CCOCc1cccc(Br)c1 Amb30590522 [0,2,0,0,0,0|1,0,0]=3 6289 B12R1.28 CCCCNc1cccc(Br)c1 Amb6696673 [0,2,0,0,0,0|0,0,2]=4 6290 B12R1.28 CCCCNc1cccc(C)c1 Amb6684517 [0,2,0,0,0,0|0,0,2]=4 6291 B12R1.28 CCCCNc1cccc(Cl)c1 Amb6695729 [0,2,0,0,0,0|0,0,2]=4 6292 B12R1.28 CCCCNc1cccc(F)c1 Amb6695886 [0,2,0,0,0,0|0,0,2]=4 6293 B12R1.28 CCCCNc1cccc(I)c1 Amb19232035 [0,2,0,0,0,0|0,0,2]=4 6294 B12R1.28 CCCCNc1cccc(I)c1 Amb7760185 [0,2,0,0,0,0|0,0,2]=4 6295 B12R1.28 CCCNCc1cccc(Br)c1 Amb1922696 [0,2,0,0,0,0|0,0,2]=4 6296 B12R1.28 CCCNCc1cccc(Br)c1 Amb6864727 [0,2,0,0,0,0|0,0,2]=4 6297 B12R1.28 CCCNCc1cccc(C)c1 Amb20673492 [0,2,0,0,0,0|0,0,2]=4 6298 B12R1.28 CCCNCc1cccc(C)c1 Amb6268946 [0,2,0,0,0,0|0,0,2]=4 6299 B12R1.28 CCCNCc1cccc(Cl)c1 Amb1923473 [0,2,0,0,0,0|0,0,2]=4 6300 B12R1.28 CCCNCc1cccc(Cl)c1 Amb6865252 [0,2,0,0,0,0|0,0,2]=4 6301 B12R1.28 CCCNCc1cccc(F)c1 Amb20673497 [0,2,0,0,0,0|0,0,2]=4 6302 B12R1.28 CCCNCc1cccc(F)c1 Amb6267755 [0,2,0,0,0,0|0,0,2]=4 6303 B12R1.28 CCCNCc1cccc(O)c1 Amb20673478 [0,2,0,0,0,0|0,0,2]=4 6304 B12R1.28 CCCNCc1cccc(O)c1 Amb6263095 [0,2,0,0,0,0|0,0,2]=4 6305 B12R1.28 CNCCNc1cccc(Cl)c1 Amb19025283 [0,2,0,0,0,0|0,0,2]=4 6306 B12R1.28 CNCCNc1cccc(F)c1 Amb19025285 [0,2,0,0,0,0|0,0,2]=4 6307 B12R1.28 COCCNc1cccc(Br)c1 Amb6712246 [0,2,0,0,0,0|0,0,2]=4 6308 B12R1.28 COCCNc1cccc(C)c1 Amb6706720 [0,2,0,0,0,0|0,0,2]=4 6309 B12R1.28 COCCNc1cccc(Cl)c1 Amb6711841 [0,2,0,0,0,0|0,0,2]=4 6310 B12R1.28 COCCNc1cccc(F)c1 Amb6711904 [0,2,0,0,0,0|0,0,2]=4 6311 B12R1.28 COCCNc1cccc(I)c1 Amb7763650 [0,2,0,0,0,0|0,0,2]=4 6312 B12R1.28 CSCCNc1cccc(Cl)c1 Amb27799357 [0,2,0,0,0,0|0,0,2]=4 6313 B12R1.28 CSCCNc1cccc(N)c1 Amb27975120 [0,2,0,0,0,0|0,0,2]=4 6314 B12R1.28 C\C=C/COc1cccc(O)c1 Amb27409570 [0,2,0,0,0,0|1,0,0]=3 6315 B12R1.28 C\C=C\CNc1cccc(Br)c1 Amb27232571 [0,2,0,0,0,0|0,0,0]=2 6316 B12R1.28 C\C=C\CNc1cccc(Cl)c1 Amb27866490 [0,2,0,0,0,0|0,0,0]=2 6317 B12R1.28 C\C=C\CNc1cccc(F)n1 Amb27211589 [0,2,0,0,0,0|1,0,0]=3 6318 B12R1.28 C\C=C\CNc1ccnc(F)n1 Amb35670779 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.28 C\C=C\CNc1ccnc(N)c1 Amb28200614 [0,2,0,0,0,0|1,0,0]=3 6320 B12R1.28 C\C=C\CNc1cncc(Cl)c1 Amb35706915 [0,2,0,0,0,0|1,0,0]=3 6321 B12R1.28 C\C=C\CNc1cncc(Cl)n1 Amb27858564 [0,2,0,0,0,0|2,0,0]=4 6322 B12R1.28 C\C=C\CNc1cncc(F)n1 Amb29861667 [0,2,0,0,0,0|2,0,0]=4 6323 B12R1.28 C\C=C\CNc1cncc(N)n1 Amb27226569 [0,2,0,0,0,0|2,0,0]=4 6324 B12R1.28 C\C=C\COc1cccc(C)c1 Amb27596496 [0,2,0,0,0,0|1,0,0]=3 6325 B12R1.28 C\C=C\COc1cccc(F)c1 Amb27794079 [0,2,0,0,0,0|1,0,0]=3 6326 B12R1.28 C\C=C\COc1cccc(F)n1 Amb28046956 [0,2,0,0,0,0|2,0,0]=4 6327 B12R1.28 C\C=C\COc1cccc(I)c1 Amb28460870 [0,2,0,0,0,0|1,0,0]=3 6328 B12R1.28 C\C=C\COc1cccc(N)n1 Amb27258525 [0,2,0,0,0,0|2,0,0]=4 6329 B12R1.28 C\C=C\CSc1cccc(O)c1 Amb27748496 [0,2,0,0,0,0|1,0,0]=3 6330 B12R1.28 Cc1cccc(C#C\C=C\Cl)c1 Amb27645392 [0,2,0,0,0,0|1,0,1]=4 6331 B12R1.28 Cc1cccc(CCCC=O)c1 Amb33474174 [0,2,0,0,0,0|1,0,1]=4 6332 B12R1.28 Cc1cccc(CNCC#N)c1 Amb17400075 [0,2,0,0,0,0|1,0,1]=4 6333 B12R1.28 Cc1cccc(CNCCN)c1 Amb10075511 [0,2,0,0,0,0|1,0,1]=4 6334 B12R1.28 Cc1cccc(CNCCO)c1 Amb28872365 [0,2,0,0,0,0|1,0,1]=4 6335 B12R1.28 Cc1cccc(CNCCO)c1 Amb7757042 [0,2,0,0,0,0|1,0,1]=4 6336 B12R1.28 Cc1cccc(CSCC=O)c1 Amb18184910 [0,2,0,0,0,0|2,0,0]=4 6337 B12R1.28 Cc1cccc(NCCC#N)c1 Amb1647378 [0,2,0,0,0,0|0,0,2]=4 6338 B12R1.28 Cc1cccc(NCCCN)c1 Amb17057722 [0,2,0,0,0,0|0,0,2]=4 6339 B12R1.28 Cc1cccc(OCCC=O)c1 Amb5731760 [0,2,0,0,0,0|1,0,1]=4 6340 B12R1.28 Cc1cccc(OC\C=C\Cl)c1 Amb28314535 [0,2,0,0,0,0|1,0,0]=3 6341 B12R1.28 Cc1cccc(SCCC=O)c1 Amb17082972 [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.28 Cc1ccnc(N\C=C\C=O)c1 Amb27794447 [0,2,0,0,0,0|1,0,1]=4 6343 B12R1.28 ClCCCNc1cccc(Cl)c1 Amb27759269 [0,2,0,0,0,0|0,0,2]=4 6344 B12R1.28 Cl\C=C\CNc1cccc(Cl)c1 Amb27233264 [0,2,0,0,0,0|0,0,0]=2 6345 B12R1.28 Cl\C=C\CNc1cncc(Cl)c1 Amb35706929 [0,2,0,0,0,0|1,0,0]=3 6346 B12R1.28 FCCCNc1cccc(I)c1 Amb28206460 [0,2,0,0,0,0|0,0,2]=4 6347 B12R1.28 Fc1cccc(SC\C=C\Cl)c1 Amb27836541 [0,2,0,0,0,0|1,0,0]=3 6348 B12R1.28 N#CCCNc1cccc(Br)c1 Amb7094568 [0,2,0,0,0,0|0,0,2]=4 6349 B12R1.28 N#CCCNc1cccc(Cl)c1 Amb1647289 [0,2,0,0,0,0|0,0,2]=4 6350 B12R1.28 N#CCCNc1cccc(F)c1 Amb8827880 [0,2,0,0,0,0|0,0,2]=4 6351 B12R1.28 N#CCCNc1cccc(O)c1 Amb17142902 [0,2,0,0,0,0|0,0,2]=4 6352 B12R1.28 N#CCNCc1cccc(Cl)c1 Amb2416269 [0,2,0,0,0,0|1,0,1]=4 6353 B12R1.28 N#CCNCc1cccc(O)c1 Amb27422125 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.28 N#C\C=N\Nc1cccc(Cl)c1 Amb27835118 [0,2,0,0,0,0|1,0,1]=4 6355 B12R1.28 NCCCNc1cccc(Br)c1 Amb26015621 [0,2,0,0,0,0|0,0,2]=4 6356 B12R1.28 NCCCNc1cccc(Cl)c1 Amb17057728 [0,2,0,0,0,0|0,0,2]=4 6357 B12R1.28 NCCCNc1cccc(F)c1 Amb17057725 [0,2,0,0,0,0|0,0,2]=4 6358 B12R1.28 NCCCNc1cccc(F)c1 Amb33535186 [0,2,0,0,0,0|0,0,2]=4 6359 B12R1.28 NCCNCc1cccc(Br)c1 Amb19005476 [0,2,0,0,0,0|1,0,1]=4 6360 B12R1.28 NCCNCc1cccc(Cl)c1 Amb10075509 [0,2,0,0,0,0|1,0,1]=4 6361 B12R1.28 NCCNCc1cccc(Cl)c1 Amb29844473 [0,2,0,0,0,0|1,0,1]=4 6362 B12R1.28 NCCNCc1cccc(F)c1 Amb10075489 [0,2,0,0,0,0|1,0,1]=4 6363 B12R1.28 NCCNCc1cccc(F)c1 Amb29844479 [0,2,0,0,0,0|1,0,1]=4 6364 B12R1.28 NCCNCc1cccc(O)c1 Amb19005503 [0,2,0,0,0,0|1,0,1]=4 6365 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|1,0,1]=4 6366 B12R1.28 O=CCCCc1cccc(Cl)c1 Amb33406790 [0,2,0,0,0,0|1,0,1]=4 6367 B12R1.28 O=CCCCc1cccc(F)c1 Amb33449550 [0,2,0,0,0,0|1,0,1]=4 6368 B12R1.28 O=CCCCc1cccc(O)c1 Amb33358761 [0,2,0,0,0,0|1,0,1]=4 6369 B12R1.28 O=CCCOc1cccc(I)c1 Amb33307154 [0,2,0,0,0,0|1,0,1]=4 6370 B12R1.28 O=CCCSc1cccc(Br)c1 Amb32682701 [0,2,0,0,0,0|1,0,1]=4 6371 B12R1.28 O=CCCSc1cccc(Cl)c1 Amb17082982 [0,2,0,0,0,0|1,0,1]=4 6372 B12R1.28 O=CCCSc1cccc(F)c1 Amb32682707 [0,2,0,0,0,0|1,0,1]=4 6373 B12R1.28 OCCCNc1cccc(Cl)c1 Amb17307144 [0,2,0,0,0,0|0,0,2]=4 6374 B12R1.28 OCCCNc1cccc(F)c1 Amb17306246 [0,2,0,0,0,0|0,0,2]=4 6375 B12R1.28 OCCNCc1cccc(Br)c1 Amb6857164 [0,2,0,0,0,0|1,0,1]=4 6376 B12R1.28 OCCNCc1cccc(Br)c1 Amb8604245 [0,2,0,0,0,0|1,0,1]=4 6377 B12R1.28 OCCNCc1cccc(Cl)c1 Amb22284257 [0,2,0,0,0,0|1,0,1]=4 6378 B12R1.28 OCCNCc1cccc(Cl)c1 Amb4303946 [0,2,0,0,0,0|1,0,1]=4 6379 B12R1.28 OCCNCc1cccc(F)c1 Amb24271193 [0,2,0,0,0,0|1,0,1]=4 6380 B12R1.28 OCCNCc1cccc(F)c1 Amb2592101 [0,2,0,0,0,0|1,0,1]=4 6381 B12R1.28 OCCNCc1cccc(O)c1 Amb7757039 [0,2,0,0,0,0|1,0,1]=4 6382 B12R1.50 C#CC(C)Nc1cccc(C)c1 Amb27758695 [0,2,0,0,0,0|0,0,2]=4 6383 B12R1.50 C#CC(C)Nc1cccc(Cl)c1 Amb27232581 [0,2,0,0,0,0|0,0,2]=4 6384 B12R1.50 C#CC(C)Nc1cccc(F)c1 Amb27834235 [0,2,0,0,0,0|0,0,2]=4 6385 B12R1.50 C=CC(=O)Cc1cccc(F)c1 Amb2699673 [0,2,0,0,0,0|1,0,1]=4 6386 B12R1.50 C=CC(=O)Nc1cccc(Br)c1 Amb33534001 [0,2,0,0,0,0|0,0,1]=3 6387 B12R1.50 C=CC(=O)Nc1cccc(C)c1 Amb6843664 [0,2,0,0,0,0|0,0,1]=3 6388 B12R1.50 C=CC(=O)Nc1cccc(Cl)c1 Amb6843674 [0,2,0,0,0,0|0,0,1]=3 6389 B12R1.50 C=CC(=O)Nc1cccc(Cl)n1 Amb27176213 [0,2,0,0,0,0|1,0,1]=4 6390 B12R1.50 C=CC(=O)Nc1cccc(F)c1 Amb6843681 [0,2,0,0,0,0|0,0,1]=3 6391 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,2,0,0,0,0|0,0,1]=3 6392 B12R1.50 C=CC(=O)Nc1cccc(N)n1 Amb28252453 [0,2,0,0,0,0|1,0,1]=4 6393 B12R1.50 C=CC(=O)Nc1cccc(O)c1 Amb6738692 [0,2,0,0,0,0|0,0,1]=3 6394 B12R1.50 C=CC(=O)Nc1ccnc(C)c1 Amb27597153 [0,2,0,0,0,0|1,0,1]=4 6395 B12R1.50 C=CC(=O)Nc1ccnc(N)c1 Amb35713240 [0,2,0,0,0,0|1,0,1]=4 6396 B12R1.50 C=CC(=O)Nc1cncc(Br)c1 Amb28244162 [0,2,0,0,0,0|1,0,1]=4 6397 B12R1.50 C=CC(=O)Nc1cncc(Cl)c1 Amb35717647 [0,2,0,0,0,0|1,0,1]=4 6398 B12R1.50 C=CC(=O)Oc1cccc(Br)c1 Amb27247979 [0,2,0,0,0,0|1,0,1]=4 6399 B12R1.50 C=CC(C)Nc1cc(F)ncn1 Amb27970291 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.50 C=CC(C)Nc1cc(N)ccn1 Amb27410790 [0,2,0,0,0,0|1,0,0]=3 6401 B12R1.50 C=CC(C)Nc1cccc(Br)n1 Amb27762983 [0,2,0,0,0,0|1,0,0]=3 6402 B12R1.50 C=CC(C)Nc1cccc(Cl)c1 Amb27751102 [0,2,0,0,0,0|0,0,0]=2 6403 B12R1.50 C=CC(C)Nc1cccc(F)c1 Amb27180321 [0,2,0,0,0,0|0,0,0]=2 6404 B12R1.50 C=CC(C)Nc1cccc(F)n1 Amb27162638 [0,2,0,0,0,0|1,0,0]=3 6405 B12R1.50 C=CC(C)Nc1cccc(N)n1 Amb28118320 [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.50 C=CC(C)Nc1ccnc(Cl)c1 Amb28041937 [0,2,0,0,0,0|1,0,0]=3 6407 B12R1.50 C=CC(C)Nc1ccnc(Cl)n1 Amb27223495 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.50 C=CC(C)Nc1ccnc(F)n1 Amb35677725 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.50 C=CC(C)Nc1cncc(Cl)c1 Amb35706914 [0,2,0,0,0,0|1,0,0]=3 6410 B12R1.50 C=CC(C)Nc1cncc(Cl)n1 Amb27770877 [0,2,0,0,0,0|2,0,0]=4 6411 B12R1.50 C=CC(C)Nc1cncc(F)n1 Amb29861545 [0,2,0,0,0,0|2,0,0]=4 6412 B12R1.50 C=CC(C)Nc1cncc(N)n1 Amb28041238 [0,2,0,0,0,0|2,0,0]=4 6413 B12R1.50 C=CC(C)Oc1cccc(Cl)c1 Amb28430371 [0,2,0,0,0,0|1,0,0]=3 6414 B12R1.50 C=CC(C)Oc1cccc(N)c1 Amb18990275 [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.50 C=CC(C)Sc1cccc(Br)c1 Amb28400602 [0,2,0,0,0,0|1,0,0]=3 6416 B12R1.50 C=CC(C)Sc1cccc(Cl)c1 Amb27598315 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.50 C=CC(C)Sc1cccc(F)c1 Amb27456212 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.50 C=CC(C)Sc1cccc(N)c1 Amb27475964 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.50 C=CC(N)Cc1cccc(Br)c1 Amb28286567 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.50 C=CC(N)Cc1cccc(C)c1 Amb27494449 [0,2,0,0,0,0|1,0,0]=3 6421 B12R1.50 C=CC(O)Cc1cccc(Br)c1 Amb27840834 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.50 C=CC(O)Cc1cccc(F)c1 Amb27840833 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.50 C=CC(O)Cc1cccc(N)c1 Amb35620632 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.50 CC(C#N)Nc1cccc(Br)c1 Amb17406669 [0,2,0,0,0,0|1,0,1]=4 6425 B12R1.50 CC(C#N)Nc1cccc(Cl)c1 Amb17400852 [0,2,0,0,0,0|1,0,1]=4 6426 B12R1.50 CC(C#N)Nc1cccc(F)c1 Amb17400149 [0,2,0,0,0,0|1,0,1]=4 6427 B12R1.50 CC(C=O)Cc1cccc(Br)c1 Amb26348210 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.50 CC(C=O)Cc1cccc(F)c1 Amb25885683 [0,2,0,0,0,0|2,0,0]=4 6429 B12R1.50 CC(C=O)Cc1cccc(I)c1 Amb25850018 [0,2,0,0,0,0|2,0,0]=4 6430 B12R1.50 CC(C=O)Cc1cccc(N)c1 Amb25251154 [0,2,0,0,0,0|2,0,0]=4 6431 B12R1.50 CC(C=O)Cc1cccc(O)c1 Amb27601007 [0,2,0,0,0,0|2,0,0]=4 6432 B12R1.50 CC(C=O)Oc1cccc(Br)c1 Amb30020611 [0,2,0,0,0,0|2,0,0]=4 6433 B12R1.50 CC(C=O)Oc1cccc(F)c1 Amb30020587 [0,2,0,0,0,0|2,0,0]=4 6434 B12R1.50 CC(C=O)Oc1cccc(I)c1 Amb30020616 [0,2,0,0,0,0|2,0,0]=4 6435 B12R1.50 CC(C=O)Sc1cccc(Br)c1 Amb30020878 [0,2,0,0,0,0|2,0,0]=4 6436 B12R1.50 CC(C=O)Sc1cccc(Cl)c1 Amb30020871 [0,2,0,0,0,0|2,0,0]=4 6437 B12R1.50 CC(C=O)Sc1cccc(F)c1 Amb30020861 [0,2,0,0,0,0|2,0,0]=4 6438 B12R1.50 CC(CN)Nc1cccc(Br)c1 Amb27860926 [0,2,0,0,0,0|1,0,1]=4 6439 B12R1.50 CC(CN)Nc1cccc(I)c1 Amb27861768 [0,2,0,0,0,0|1,0,1]=4 6440 B12R1.50 CC(CN)Nc1cccc(O)c1 Amb27212647 [0,2,0,0,0,0|1,0,1]=4 6441 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,2,0,0,0,0|1,0,1]=4 6442 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,2,0,0,0,0|1,0,1]=4 6443 B12R1.50 CCC(C)Nc1cccc(Br)c1 Amb6696680 [0,2,0,0,0,0|0,0,2]=4 6444 B12R1.50 CCC(C)Nc1cccc(C)c1 Amb6684523 [0,2,0,0,0,0|0,0,2]=4 6445 B12R1.50 CCC(C)Nc1cccc(Cl)c1 Amb6695735 [0,2,0,0,0,0|0,0,2]=4 6446 B12R1.50 CCC(C)Nc1cccc(F)c1 Amb6695894 [0,2,0,0,0,0|0,0,2]=4 6447 B12R1.50 CCC(C)Nc1cccc(I)c1 Amb7785286 [0,2,0,0,0,0|0,0,2]=4 6448 B12R1.50 CCC(C)Nc1cccc(N)c1 Amb8825433 [0,2,0,0,0,0|0,0,2]=4 6449 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|2,0,0]=4 6450 B12R1.50 Cc1cccc(CC(Cl)C=O)c1 Amb17204327 [0,2,0,0,0,0|2,0,0]=4 6451 B12R1.50 Cc1cccc(CC(F)C=O)c1 Amb28423095 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.50 Cc1cccc(NC(C)C#N)c1 Amb17400077 [0,2,0,0,0,0|1,0,1]=4 6453 B12R1.50 Cc1cccc(NC(C)CO)c1 Amb18971818 [0,2,0,0,0,0|1,0,1]=4 6454 B12R1.50 Cc1cccc(SC(C)C=O)c1 Amb30020857 [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.50 NNC(S)Nc1cccc(Cl)c1 Amb27173801 [0,2,0,0,0,0|2,0,0]=4 6456 B12R1.50 O=CC(Cl)Cc1cccc(Br)c1 Amb17204708 [0,2,0,0,0,0|2,0,0]=4 6457 B12R1.50 O=CC(Cl)Cc1cccc(Cl)c1 Amb17204402 [0,2,0,0,0,0|2,0,0]=4 6458 B12R1.50 O=CC(Cl)Cc1cccc(F)c1 Amb17204343 [0,2,0,0,0,0|2,0,0]=4 6459 B12R1.50 O=CC(F)Cc1cccc(F)c1 Amb27595749 [0,2,0,0,0,0|2,0,0]=4 6460 B12R1.100 C#CCNc1cc(Br)cc(Br)c1 Amb35721397 [0,2,0,0,0,0|0,0,2]=4 6461 B12R1.100 C#CCNc1cc(C)cc(Br)c1 Amb28366220 [0,2,0,0,0,0|0,0,2]=4 6462 B12R1.100 C#CCNc1cc(C)cc(F)c1 Amb27827708 [0,2,0,0,0,0|0,0,2]=4 6463 B12R1.100 C#CCNc1cc(F)cc(Br)c1 Amb28047953 [0,2,0,0,0,0|0,0,2]=4 6464 B12R1.100 C#CCNc1cc(F)cc(F)c1 Amb18798744 [0,2,0,0,0,0|0,0,2]=4 6465 B12R1.100 C#CCNc1cc(I)cc(I)c1 Amb35721000 [0,2,0,0,0,0|0,0,2]=4 6466 B12R1.100 C=CCCc1cc(C)cc(F)c1 Amb30012332 [0,2,0,0,0,0|1,0,0]=3 6467 B12R1.100 C=CCCc1cc(C)nc(C)c1 Amb10573775 [0,2,0,0,0,0|2,0,0]=4 6468 B12R1.100 C=CCCc1cc(F)cc(Br)c1 Amb27225439 [0,2,0,0,0,0|1,0,0]=3 6469 B12R1.100 C=CCCc1cc(F)cc(F)c1 Amb6299391 [0,2,0,0,0,0|1,0,0]=3 6470 B12R1.100 C=CCNc1cc(Br)cc(Br)c1 Amb35725567 [0,2,0,0,0,0|0,0,0]=2 6471 B12R1.100 C=CCNc1cc(Br)nc(N)n1 Amb28140656 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.100 C=CCNc1cc(C)cc(C)c1 Amb17306768 [0,2,0,0,0,0|0,0,0]=2 6473 B12R1.100 C=CCNc1cc(C)cc(N)c1 Amb27598846 [0,2,0,0,0,0|0,0,0]=2 6474 B12R1.100 C=CCNc1cc(C)nc(F)n1 Amb35671585 [0,2,0,0,0,0|2,0,0]=4 6475 B12R1.100 C=CCNc1cc(Cl)cc(Cl)c1 Amb17306158 [0,2,0,0,0,0|0,0,0]=2 6476 B12R1.100 C=CCNc1cc(F)nc(F)n1 Amb29865213 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.100 C=CCNc1cc(I)cc(Cl)n1 Amb28318143 [0,2,0,0,0,0|1,0,0]=3 6478 B12R1.100 C=CCNc1cc(I)cc(I)c1 Amb35725584 [0,2,0,0,0,0|0,0,0]=2 6479 B12R1.100 C=CCNc1cc(O)nc(C)n1 Amb27840819 [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.100 C=CCNc1nc(C)cc(C)n1 Amb5716222 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.100 C=CCNc1nc(C)cc(N)n1 Amb25953985 [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.100 C=CCOc1cc(Cl)cc(Br)c1 Amb35638815 [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.100 C=CCOc1cc(Cl)cc(Cl)c1 Amb25762862 [0,2,0,0,0,0|1,0,0]=3 6484 B12R1.100 C=CCOc1cc(F)cc(Br)c1 Amb27456956 [0,2,0,0,0,0|1,0,0]=3 6485 B12R1.100 C=CCSc1cc(F)cc(Cl)c1 Amb26880749 [0,2,0,0,0,0|1,0,0]=3 6486 B12R1.100 CCCNc1cc(Br)cc(Br)c1 Amb35721402 [0,2,0,0,0,0|0,0,2]=4 6487 B12R1.100 CCCNc1cc(C)cc(C)c1 Amb4313516 [0,2,0,0,0,0|0,0,2]=4 6488 B12R1.100 CCCNc1cc(C)cc(F)c1 Amb28349512 [0,2,0,0,0,0|0,0,2]=4 6489 B12R1.100 CCCNc1cc(C)cc(I)c1 Amb35691308 [0,2,0,0,0,0|0,0,2]=4 6490 B12R1.100 CCCNc1cc(C)cc(N)c1 Amb27753298 [0,2,0,0,0,0|0,0,2]=4 6491 B12R1.100 CCCNc1cc(Cl)cc(Cl)c1 Amb4313515 [0,2,0,0,0,0|0,0,2]=4 6492 B12R1.100 CCCNc1cc(I)cc(I)c1 Amb35721004 [0,2,0,0,0,0|0,0,2]=4 6493 B12R1.100 CCCNc1cc(N)cc(F)c1 Amb18289354 [0,2,0,0,0,0|0,0,2]=4 6494 B12R1.100 Cc1cc(Br)cc(CCC=O)c1 Amb25141592 [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.100 Cc1cc(C)cc(CCC=O)c1 Amb18798122 [0,2,0,0,0,0|2,0,0]=4 6496 B12R1.100 Cc1cc(C)cc(NCC#N)c1 Amb6712923 [0,2,0,0,0,0|1,0,1]=4 6497 B12R1.100 Cc1cc(C)cc(NCCCl)c1 Amb17335664 [0,2,0,0,0,0|1,0,1]=4 6498 B12R1.100 Cc1cc(C)cc(NCCN)c1 Amb17057763 [0,2,0,0,0,0|1,0,1]=4 6499 B12R1.100 Cc1cc(C)cc(NCCO)c1 Amb6712967 [0,2,0,0,0,0|1,0,1]=4 6500 B12R1.100 Cc1cc(C)cc(OCC=O)c1 Amb5731824 [0,2,0,0,0,0|2,0,0]=4 6501 B12R1.100 Cc1cc(Cl)cc(CCC=O)c1 Amb26511468 [0,2,0,0,0,0|2,0,0]=4 6502 B12R1.100 Cc1cc(F)cc(CCC=O)c1 Amb25839793 [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.100 Cc1cc(F)cc(NCCO)c1 Amb27616825 [0,2,0,0,0,0|1,0,1]=4 6504 B12R1.100 Cc1cc(I)cc(CCC=O)c1 Amb27614585 [0,2,0,0,0,0|2,0,0]=4 6505 B12R1.100 Cc1cc(I)cc(NCC#N)c1 Amb35691126 [0,2,0,0,0,0|1,0,1]=4 6506 B12R1.100 Cc1cc(I)cc(NCCF)c1 Amb35691127 [0,2,0,0,0,0|1,0,1]=4 6507 B12R1.100 Cc1cc(I)cc(NCCN)c1 Amb35691309 [0,2,0,0,0,0|1,0,1]=4 6508 B12R1.100 Cc1cc(N)cc(CCC=O)c1 Amb27616079 [0,2,0,0,0,0|2,0,0]=4 6509 B12R1.100 ClCCNc1cc(Cl)cc(Cl)c1 Amb17343165 [0,2,0,0,0,0|1,0,1]=4 6510 B12R1.100 FCCNc1cc(Br)cc(Br)c1 Amb35725569 [0,2,0,0,0,0|1,0,1]=4 6511 B12R1.100 FCCNc1cc(F)cc(Br)c1 Amb27483275 [0,2,0,0,0,0|1,0,1]=4 6512 B12R1.100 FCCNc1cc(I)cc(I)c1 Amb35725585 [0,2,0,0,0,0|1,0,1]=4 6513 B12R1.100 N#CCNc1cc(Br)cc(Br)c1 Amb35725566 [0,2,0,0,0,0|1,0,1]=4 6514 B12R1.100 N#CCNc1cc(Cl)cc(Br)c1 Amb27862768 [0,2,0,0,0,0|1,0,1]=4 6515 B12R1.100 N#CCNc1cc(Cl)cc(Cl)c1 Amb6710413 [0,2,0,0,0,0|1,0,1]=4 6516 B12R1.100 N#CCNc1cc(F)cc(Br)c1 Amb27249981 [0,2,0,0,0,0|1,0,1]=4 6517 B12R1.100 N#CCNc1cc(I)cc(I)c1 Amb35725583 [0,2,0,0,0,0|1,0,1]=4 6518 B12R1.100 NCCNc1cc(Br)cc(Br)c1 Amb35721403 [0,2,0,0,0,0|1,0,1]=4 6519 B12R1.100 NCCNc1cc(Cl)cc(Cl)c1 Amb17091083 [0,2,0,0,0,0|1,0,1]=4 6520 B12R1.100 NCCNc1cc(I)cc(I)c1 Amb35721005 [0,2,0,0,0,0|1,0,1]=4 6521 B12R1.100 NCCNc1cc(N)cc(F)c1 Amb18991515 [0,2,0,0,0,0|1,0,1]=4 6522 B12R1.100 Nc1cc(F)cc(CCC=O)c1 Amb27798933 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.100 Nc1cc(N)cc(CCC=O)c1 Amb27665955 [0,2,0,0,0,0|2,0,0]=4 6524 B12R1.100 O=CCCc1cc(Br)cc(Br)c1 Amb26349656 [0,2,0,0,0,0|2,0,0]=4 6525 B12R1.100 O=CCCc1cc(Br)cc(I)c1 Amb27836304 [0,2,0,0,0,0|2,0,0]=4 6526 B12R1.100 O=CCCc1cc(Cl)cc(Br)c1 Amb26880746 [0,2,0,0,0,0|2,0,0]=4 6527 B12R1.100 O=CCCc1cc(Cl)cc(Cl)c1 Amb18066575 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.100 O=CCCc1cc(F)cc(Br)c1 Amb26850424 [0,2,0,0,0,0|2,0,0]=4 6529 B12R1.100 O=CCCc1cc(F)cc(Cl)c1 Amb6306224 [0,2,0,0,0,0|2,0,0]=4 6530 B12R1.100 O=CCCc1cc(F)cc(F)c1 Amb25149927 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.100 O=CCCc1cc(F)cc(I)c1 Amb25104319 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.100 O=CCCc1cc(I)cc(I)c1 Amb28199256 [0,2,0,0,0,0|2,0,0]=4 6533 B12R1.100 O=CCCc1cc(O)cc(Cl)c1 Amb27222112 [0,2,0,0,0,0|2,0,0]=4 6534 B12R1.100 O=CCCc1cc(O)cc(F)c1 Amb28057761 [0,2,0,0,0,0|2,0,0]=4 6535 B12R1.100 O=CCCc1cc(O)cc(I)c1 Amb27841377 [0,2,0,0,0,0|2,0,0]=4 6536 B12R1.100 O=CCCc1cc(O)cc(S)c1 Amb27423591 [0,2,0,0,0,0|2,0,0]=4 6537 B12R1.100 O=CCCc1cc(S)cc(Cl)c1 Amb27428156 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.100 O=CCOc1cc(Cl)cc(Br)c1 Amb35635452 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.100 O=CCOc1cc(Cl)cc(Cl)c1 Amb5731862 [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.100 O=CCOc1cc(F)cc(Br)c1 Amb25827273 [0,2,0,0,0,0|2,0,0]=4 6541 B12R1.100 O=CCOc1cc(F)cc(F)c1 Amb18802837 [0,2,0,0,0,0|2,0,0]=4 6542 B12R1.100 O=CCSc1cc(Cl)cc(Cl)c1 Amb25817384 [0,2,0,0,0,0|2,0,0]=4 6543 B12R1.100 OCCNc1cc(Br)cc(Br)c1 Amb35725568 [0,2,0,0,0,0|1,0,1]=4 6544 B12R1.100 OCCNc1cc(Cl)cc(Br)c1 Amb27829336 [0,2,0,0,0,0|1,0,1]=4 6545 B12R1.100 OCCNc1cc(Cl)cc(Cl)c1 Amb6710435 [0,2,0,0,0,0|1,0,1]=4 6546 B12R1.100 OCCNc1cc(F)cc(Br)c1 Amb27467107 [0,2,0,0,0,0|1,0,1]=4 6547 B12R1.226 C=C(Br)CNC1=CC(=O)NC=N1 Amb28041297 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.226 C=C(Br)CNc1cc(Br)ncn1 Amb27865290 [0,2,0,0,0,0|2,0,0]=4 6549 B12R1.226 C=C(Br)CNc1cccc(F)c1 Amb27477553 [0,2,0,0,0,0|0,0,0]=2 6550 B12R1.226 C=C(Br)CNc1cccc(N)c1 Amb28322473 [0,2,0,0,0,0|0,0,0]=2 6551 B12R1.226 C=C(Br)CNc1cccc(N)n1 Amb27664301 [0,2,0,0,0,0|1,0,0]=3 6552 B12R1.226 C=C(Br)CNc1ccnc(Cl)c1 Amb27754252 [0,2,0,0,0,0|1,0,0]=3 6553 B12R1.226 C=C(Br)CNc1ccnc(Cl)n1 Amb27806788 [0,2,0,0,0,0|2,0,0]=4 6554 B12R1.226 C=C(Br)CNc1ccnc(F)c1 Amb28342906 [0,2,0,0,0,0|1,0,0]=3 6555 B12R1.226 C=C(Br)CNc1ccnc(F)n1 Amb29855165 [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.226 C=C(Br)CNc1ccnc(N)c1 Amb27466647 [0,2,0,0,0,0|1,0,0]=3 6557 B12R1.226 C=C(Br)CNc1cncc(Cl)c1 Amb35706776 [0,2,0,0,0,0|1,0,0]=3 6558 B12R1.226 C=C(Br)CNc1cncc(F)n1 Amb29861573 [0,2,0,0,0,0|2,0,0]=4 6559 B12R1.226 C=C(Br)COc1cccc(Br)c1 Amb27666515 [0,2,0,0,0,0|1,0,0]=3 6560 B12R1.226 C=C(Br)COc1cccc(Cl)c1 Amb27238299 [0,2,0,0,0,0|1,0,0]=3 6561 B12R1.226 C=C(Br)COc1cccc(F)c1 Amb27469477 [0,2,0,0,0,0|1,0,0]=3 6562 B12R1.226 C=C(Br)COc1cncc(Br)c1 Amb27220393 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.226 C=C(C)CCc1cccc(O)c1 Amb8388640 [0,2,0,0,0,0|1,0,0]=3 6564 B12R1.226 C=C(C)CCc1ccnc(N)c1 Amb27407496 [0,2,0,0,0,0|2,0,0]=4 6565 B12R1.226 C=C(C)CNC1=CC(=O)NC=N1 Amb28383569 [0,2,0,0,0,0|2,0,0]=4 6566 B12R1.226 C=C(C)CNc1cc(Br)ncn1 Amb27669529 [0,2,0,0,0,0|2,0,0]=4 6567 B12R1.226 C=C(C)CNc1cc(N)ccn1 Amb27791727 [0,2,0,0,0,0|1,0,0]=3 6568 B12R1.226 C=C(C)CNc1cccc(F)c1 Amb17306245 [0,2,0,0,0,0|0,0,0]=2 6569 B12R1.226 C=C(C)CNc1cccc(F)n1 Amb28045966 [0,2,0,0,0,0|1,0,0]=3 6570 B12R1.226 C=C(C)CNc1cccc(I)c1 Amb28255098 [0,2,0,0,0,0|0,0,0]=2 6571 B12R1.226 C=C(C)CNc1ccnc(Cl)n1 Amb27865291 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.226 C=C(C)CNc1ccnc(F)n1 Amb35677722 [0,2,0,0,0,0|2,0,0]=4 6573 B12R1.226 C=C(C)CNc1ccnc(N)n1 Amb28146691 [0,2,0,0,0,0|2,0,0]=4 6574 B12R1.226 C=C(C)CNc1cncc(Br)c1 Amb27409801 [0,2,0,0,0,0|1,0,0]=3 6575 B12R1.226 C=C(C)CNc1cncc(Cl)c1 Amb35706911 [0,2,0,0,0,0|1,0,0]=3 6576 B12R1.226 C=C(C)CNc1cncc(F)n1 Amb29861542 [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.226 C=C(C)CNc1cncc(N)n1 Amb27392927 [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.226 C=C(C)CNc1nccc(C)n1 Amb28194756 [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.226 C=C(C)COc1cccc(Br)c1 Amb6264391 [0,2,0,0,0,0|1,0,0]=3 6580 B12R1.226 C=C(C)COc1cccc(N)c1 Amb2081546 [0,2,0,0,0,0|1,0,0]=3 6581 B12R1.226 C=C(C)COc1cccc(N)c1 Amb9172211 [0,2,0,0,0,0|1,0,0]=3 6582 B12R1.226 C=C(C)COc1cccc(O)c1 Amb8837493 [0,2,0,0,0,0|1,0,0]=3 6583 B12R1.226 C=C(C)COc1cncc(Br)c1 Amb27469541 [0,2,0,0,0,0|2,0,0]=4 6584 B12R1.226 C=C(C)CSc1cccc(Br)c1 Amb28291774 [0,2,0,0,0,0|1,0,0]=3 6585 B12R1.226 C=C(C)CSc1cccc(N)c1 Amb27770253 [0,2,0,0,0,0|1,0,0]=3 6586 B12R1.226 C=C(Cl)CNc1cc(Br)ncn1 Amb28350532 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.226 C=C(Cl)CNc1cc(C)cnn1 Amb27615546 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.226 C=C(Cl)CNc1cccc(C)c1 Amb18809685 [0,2,0,0,0,0|0,0,0]=2 6589 B12R1.226 C=C(Cl)CNc1cccc(Cl)c1 Amb27955110 [0,2,0,0,0,0|0,0,0]=2 6590 B12R1.226 C=C(Cl)CNc1cccc(F)c1 Amb18969176 [0,2,0,0,0,0|0,0,0]=2 6591 B12R1.226 C=C(Cl)CNc1cccc(N)n1 Amb27812662 [0,2,0,0,0,0|1,0,0]=3 6592 B12R1.226 C=C(Cl)CNc1ccnc(Cl)c1 Amb28458179 [0,2,0,0,0,0|1,0,0]=3 6593 B12R1.226 C=C(Cl)CNc1ccnc(F)n1 Amb29855052 [0,2,0,0,0,0|2,0,0]=4 6594 B12R1.226 C=C(Cl)CNc1cncc(Cl)c1 Amb35706930 [0,2,0,0,0,0|1,0,0]=3 6595 B12R1.226 C=C(Cl)CNc1cncc(F)n1 Amb29861572 [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.226 C=C(Cl)CNc1cncc(N)n1 Amb28456744 [0,2,0,0,0,0|2,0,0]=4 6597 B12R1.226 C=C(Cl)CNc1nccc(C)n1 Amb27645075 [0,2,0,0,0,0|2,0,0]=4 6598 B12R1.226 C=C(Cl)COc1cccc(N)c1 Amb18290028 [0,2,0,0,0,0|1,0,0]=3 6599 B12R1.226 CC(=O)CCc1cccc(Br)c1 Amb9031557 [0,2,0,0,0,0|1,0,1]=4 6600 B12R1.226 CC(=O)CCc1cccc(C)c1 Amb8869632 [0,2,0,0,0,0|1,0,1]=4 6601 B12R1.226 CC(=O)CCc1cccc(Cl)c1 Amb9031572 [0,2,0,0,0,0|1,0,1]=4 6602 B12R1.226 CC(=O)CCc1cccc(F)c1 Amb9031555 [0,2,0,0,0,0|1,0,1]=4 6603 B12R1.226 CC(=O)CCc1cccc(N)c1 Amb26452029 [0,2,0,0,0,0|1,0,1]=4 6604 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,2,0,0,0,0|1,0,1]=4 6605 B12R1.226 CC(=O)COc1cccc(Br)c1 Amb17226706 [0,2,0,0,0,0|1,0,1]=4 6606 B12R1.226 CC(=O)COc1cccc(I)c1 Amb27829069 [0,2,0,0,0,0|1,0,1]=4 6607 B12R1.226 CC(=O)COc1cccc(N)c1 Amb17110084 [0,2,0,0,0,0|1,0,1]=4 6608 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [0,2,0,0,0,0|1,0,1]=4 6609 B12R1.226 CC(=O)CSc1cccc(C)c1 Amb18791171 [0,2,0,0,0,0|1,0,1]=4 6610 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [0,2,0,0,0,0|1,0,1]=4 6611 B12R1.226 CC(=O)CSc1cccc(F)c1 Amb28386048 [0,2,0,0,0,0|1,0,1]=4 6612 B12R1.226 CC(=O)NNc1cccc(Br)c1 Amb27414445 [0,2,0,0,0,0|1,0,1]=4 6613 B12R1.226 CC(=O)NNc1cccc(Cl)c1 Amb4362483 [0,2,0,0,0,0|1,0,1]=4 6614 B12R1.226 CC(C)=NNc1cccc(C)c1 Amb2613348 [0,2,0,0,0,0|1,0,1]=4 6615 B12R1.226 CC(C)CNc1cccc(Br)c1 Amb6696597 [0,2,0,0,0,0|0,0,2]=4 6616 B12R1.226 CC(C)CNc1cccc(Cl)c1 Amb28555675 [0,2,0,0,0,0|0,0,2]=4 6617 B12R1.226 CC(C)CNc1cccc(Cl)c1 Amb6695671 [0,2,0,0,0,0|0,0,2]=4 6618 B12R1.226 CC(C)CNc1cccc(F)c1 Amb6695788 [0,2,0,0,0,0|0,0,2]=4 6619 B12R1.226 CC(C)CNc1cccc(I)c1 Amb7785404 [0,2,0,0,0,0|0,0,2]=4 6620 B12R1.226 CC(C)CNc1cccc(O)c1 Amb6734803 [0,2,0,0,0,0|0,0,2]=4 6621 B12R1.226 CC(Cl)CNc1cccc(Cl)c1 Amb28366509 [0,2,0,0,0,0|0,0,2]=4 6622 B12R1.226 CC(N)CNc1cccc(Br)c1 Amb25674799 [0,2,0,0,0,0|0,0,2]=4 6623 B12R1.226 CC(N)CNc1cccc(Cl)c1 Amb26422155 [0,2,0,0,0,0|0,0,2]=4 6624 B12R1.226 CC(N)CNc1cccc(F)c1 Amb26017767 [0,2,0,0,0,0|0,0,2]=4 6625 B12R1.226 CC(O)CNc1cccc(Br)c1 Amb17142611 [0,2,0,0,0,0|0,0,2]=4 6626 B12R1.226 CC(O)CNc1cccc(Cl)c1 Amb17139126 [0,2,0,0,0,0|0,0,2]=4 6627 B12R1.226 CC(O)CNc1cccc(F)c1 Amb17138652 [0,2,0,0,0,0|0,0,2]=4 6628 B12R1.226 C[C@@H](O)CNc1cccc(Br)c1 Amb28244268 [0,2,0,0,0,0|0,0,2]=4 6629 B12R1.226 C[C@@H](O)CNc1cccc(Cl)c1 Amb28249854 [0,2,0,0,0,0|0,0,2]=4 6630 B12R1.226 Cc1cccc(CCC(=N)N)c1 Amb18065465 [0,2,0,0,0,0|2,0,0]=4 6631 B12R1.226 Cc1cccc(CCC(=O)Cl)c1 Amb18325287 [0,2,0,0,0,0|2,0,0]=4 6632 B12R1.226 Cc1cccc(CCC(=O)O)c1 Amb1106242 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.226 Cc1cccc(CCC(N)=O)c1 Amb17400135 [0,2,0,0,0,0|2,0,0]=4 6634 B12R1.226 Cc1cccc(NCC(=O)O)c1 Amb840514 [0,2,0,0,0,0|1,0,0]=3 6635 B12R1.226 Cc1cccc(NCC(C)C)c1 Amb6684427 [0,2,0,0,0,0|0,0,2]=4 6636 B12R1.226 Cc1cccc(NCC(C)N)c1 Amb27828202 [0,2,0,0,0,0|0,0,2]=4 6637 B12R1.226 Cc1cccc(NCC(C)O)c1 Amb17138593 [0,2,0,0,0,0|0,0,2]=4 6638 B12R1.226 Cc1cccc(NCC(N)=O)c1 Amb6706700 [0,2,0,0,0,0|1,0,0]=3 6639 B12R1.226 Cc1cccc(NNC(N)=O)c1 Amb25061369 [0,2,0,0,0,0|2,0,0]=4 6640 B12R1.226 Cc1cccc(NNC(N)=S)c1 Amb6384750 [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.226 Cc1cccc(OCC(=O)Cl)c1 Amb10880010 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.226 Cc1cccc(OCC(=O)O)c1 Amb6336446 [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.226 Cc1cccc(OCC(N)=O)c1 Amb6346003 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.226 Cc1cccc(OCC(N)=S)c1 Amb5542138 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.226 Cc1cccc(SCC(=O)Cl)c1 Amb17143249 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.226 Cc1cccc(SCC(=O)O)c1 Amb5768509 [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.226 Cc1cccc(SCC(N)=O)c1 Amb17142988 [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.226 Cc1ccnc(NCC(=O)O)c1 Amb10597602 [0,2,0,0,0,0|2,0,0]=4 6649 B12R1.226 FC(F)CNc1cccc(Cl)c1 Amb18320416 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.226 Fc1cccc(NCC(F)F)c1 Amb18795534 [0,2,0,0,0,0|1,0,1]=4 6651 B12R1.226 N=C(N)CCc1cccc(Br)c1 Amb18571443 [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.226 N=C(N)CCc1cccc(Cl)c1 Amb18564230 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.226 N=C(N)CCc1cccc(F)c1 Amb18563720 [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.226 N=C(N)COc1cccc(Cl)c1 Amb6266509 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.226 N=C(N)COc1cccc(Cl)c1 Amb8626375 [0,2,0,0,0,0|2,0,0]=4 6656 B12R1.226 N=C(N)COc1cccc(F)c1 Amb6272872 [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.226 N=C(N)COc1cccc(F)c1 Amb8627400 [0,2,0,0,0,0|2,0,0]=4 6658 B12R1.226 N=C(N)COc1cccc(N)c1 Amb27667472 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.226 NC(=O)CCc1cccc(Br)c1 Amb8997695 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.226 NC(=O)CCc1cccc(Cl)c1 Amb17400995 [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.226 NC(=O)CNc1cccc(Br)c1 Amb143565 [0,2,0,0,0,0|1,0,0]=3 6662 B12R1.226 NC(=O)CNc1cccc(Cl)c1 Amb6711826 [0,2,0,0,0,0|1,0,0]=3 6663 B12R1.226 NC(=O)CNc1cccc(F)c1 Amb6711883 [0,2,0,0,0,0|1,0,0]=3 6664 B12R1.226 NC(=O)CNc1cccc(I)c1 Amb7758310 [0,2,0,0,0,0|1,0,0]=3 6665 B12R1.226 NC(=O)CNc1cccc(N)n1 Amb28410237 [0,2,0,0,0,0|2,0,0]=4 6666 B12R1.226 NC(=O)CNc1cccc(O)c1 Amb26868898 [0,2,0,0,0,0|1,0,0]=3 6667 B12R1.226 NC(=O)CNc1ccnc(Cl)c1 Amb27813886 [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.226 NC(=O)CNc1cncc(Cl)c1 Amb35706918 [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.226 NC(=O)COc1cccc(Br)c1 Amb192032 [0,2,0,0,0,0|2,0,0]=4 6670 B12R1.226 NC(=O)COc1cccc(Cl)c1 Amb2726046 [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.226 NC(=O)COc1cccc(I)c1 Amb181273 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.226 NC(=O)COc1cccc(N)c1 Amb1112358 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.226 NC(=O)COc1cccc(O)c1 Amb9210998 [0,2,0,0,0,0|2,0,0]=4 6674 B12R1.226 NC(=O)CSc1cccc(Cl)c1 Amb17143258 [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.226 NC(=O)CSc1cccc(N)c1 Amb27770252 [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.226 NC(=O)NNc1cccc(Br)c1 Amb27980089 [0,2,0,0,0,0|2,0,0]=4 6677 B12R1.226 NC(=O)NNc1cccc(Cl)c1 Amb27858802 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.226 NC(=O)NNc1cccc(F)c1 Amb6298511 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.226 NC(=S)CCc1cccc(Br)c1 Amb17256979 [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.226 NC(=S)NNc1cccc(Br)c1 Amb2439188 [0,2,0,0,0,0|2,0,0]=4 6681 B12R1.226 NC(=S)NNc1cccc(Cl)c1 Amb6384751 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.226 NC(=S)NNc1cccc(F)c1 Amb2407870 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.226 Nc1cccc(CCC(=O)Cl)c1 Amb27453550 [0,2,0,0,0,0|2,0,0]=4 6684 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2684507 [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2692058 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22408735 [0,2,0,0,0,0|2,0,0]=4 6687 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22757721 [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.226 Nc1cccc(OCC(=O)O)c1 Amb839769 [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,2,0,0,0,0|2,0,0]=4 6690 B12R1.226 O=C(Cl)COc1cccc(Br)c1 Amb16230149 [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.226 O=C(Cl)COc1cccc(F)c1 Amb27406717 [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.226 O=C(Cl)CSc1cccc(Cl)c1 Amb17143820 [0,2,0,0,0,0|2,0,0]=4 6693 B12R1.226 O=C(O)CCc1cccc(Br)c1 Amb1209216 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.226 O=C(O)CCc1cccc(Cl)c1 Amb1672952 [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.226 O=C(O)CCc1cccc(F)c1 Amb1091868 [0,2,0,0,0,0|2,0,0]=4 6696 B12R1.226 O=C(O)CCc1cccc(I)c1 Amb16232982 [0,2,0,0,0,0|2,0,0]=4 6697 B12R1.226 O=C(O)CCc1cccc(O)c1 Amb2688781 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.226 O=C(O)CNc1cccc(Br)c1 Amb840527 [0,2,0,0,0,0|1,0,0]=3 6699 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb10609174 [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb840525 [0,2,0,0,0,0|1,0,0]=3 6701 B12R1.226 O=C(O)CNc1cccc(Cl)n1 Amb25736170 [0,2,0,0,0,0|2,0,0]=4 6702 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,0]=3 6703 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb840522 [0,2,0,0,0,0|1,0,0]=3 6704 B12R1.226 O=C(O)CNc1cccc(F)n1 Amb27471101 [0,2,0,0,0,0|2,0,0]=4 6705 B12R1.226 O=C(O)CNc1ccnc(Cl)c1 Amb27598005 [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.226 O=C(O)CNc1cncc(Cl)c1 Amb35706919 [0,2,0,0,0,0|2,0,0]=4 6707 B12R1.226 O=C(O)CNc1cncc(F)c1 Amb28251708 [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.226 O=C(O)COc1cccc(Br)c1 Amb6336684 [0,2,0,0,0,0|2,0,0]=4 6709 B12R1.226 O=C(O)COc1cccc(Cl)c1 Amb1211231 [0,2,0,0,0,0|2,0,0]=4 6710 B12R1.226 O=C(O)COc1cccc(F)c1 Amb1102803 [0,2,0,0,0,0|2,0,0]=4 6711 B12R1.226 O=C(O)COc1cccc(I)c1 Amb4574102 [0,2,0,0,0,0|2,0,0]=4 6712 B12R1.226 O=C(O)COc1cccc(O)c1 Amb6360813 [0,2,0,0,0,0|2,0,0]=4 6713 B12R1.226 O=C(O)CSc1cccc(Br)c1 Amb2372547 [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.226 O=C(O)CSc1cccc(Cl)c1 Amb2794096 [0,2,0,0,0,0|2,0,0]=4 6715 B12R1.226 O=C(O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|2,0,0]=4 6716 B12R1.226 O=C(O)CSc1cccc(O)c1 Amb28385688 [0,2,0,0,0,0|2,0,0]=4 6717 B12R1.382 C#Cc1cccc(CCC=O)c1 Amb33272129 [0,2,0,0,0,0|2,0,0]=4 6718 B12R1.382 C#Cc1cccc(NCCF)c1 Amb27171747 [0,2,0,0,0,0|1,0,1]=4 6719 B12R1.382 C=CCCc1cccc(C=O)c1 Amb24085224 [0,2,0,0,0,0|1,0,0]=3 6720 B12R1.382 C=CCCc1cccc(OC)c1 Amb6299119 [0,2,0,0,0,0|1,0,0]=3 6721 B12R1.382 C=CCNc1cc(OC)ncn1 Amb18854298 [0,2,0,0,0,0|2,0,0]=4 6722 B12R1.382 C=CCNc1cccc(C=O)c1 Amb27251573 [0,2,0,0,0,0|0,0,0]=2 6723 B12R1.382 C=CCNc1cccc(CC)c1 Amb18792395 [0,2,0,0,0,0|0,0,0]=2 6724 B12R1.382 C=CCNc1cccc(CO)c1 Amb27166912 [0,2,0,0,0,0|0,0,0]=2 6725 B12R1.382 C=CCNc1cccc(SC)c1 Amb17307263 [0,2,0,0,0,0|0,0,0]=2 6726 B12R1.382 C=CCNc1ccnc(C#N)c1 Amb19000119 [0,2,0,0,0,0|1,0,0]=3 6727 B12R1.382 C=CCNc1ccnc(OC)c1 Amb27466783 [0,2,0,0,0,0|1,0,0]=3 6728 B12R1.382 C=CCNc1ccnc(SC)n1 Amb27978097 [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.382 C=CCNc1cncc(C#N)n1 Amb30011522 [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.382 C=CCNc1nccc(SC)n1 Amb27261507 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.382 C=CCOc1cc(C#N)ccn1 Amb9208750 [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.382 C=CCOc1cccc(C#N)c1 Amb6279827 [0,2,0,0,0,0|1,0,0]=3 6733 B12R1.382 C=CCOc1cccc(C=O)c1 Amb1227717 [0,2,0,0,0,0|1,0,0]=3 6734 B12R1.382 C=CCOc1cccc(CO)c1 Amb33527963 [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.382 C=CCOc1cccc(NC)c1 Amb23539741 [0,2,0,0,0,0|1,0,0]=3 6736 B12R1.382 C=CCOc1cccc(NC)n1 Amb27770620 [0,2,0,0,0,0|2,0,0]=4 6737 B12R1.382 C=CCOc1cncc(NC)c1 Amb27416634 [0,2,0,0,0,0|2,0,0]=4 6738 B12R1.382 C=CCSc1cccc(C#N)c1 Amb27175068 [0,2,0,0,0,0|1,0,0]=3 6739 B12R1.382 C=CCSc1cccc(NC)n1 Amb28366723 [0,2,0,0,0,0|2,0,0]=4 6740 B12R1.382 C=CCSc1ccnc(NC)c1 Amb27766815 [0,2,0,0,0,0|2,0,0]=4 6741 B12R1.382 C=C\C=C/c1cccc(C=O)c1 Amb24085624 [0,2,0,0,0,0|1,0,1]=4 6742 B12R1.382 CCCNc1cccc(CN)c1 Amb27241497 [0,2,0,0,0,0|0,0,2]=4 6743 B12R1.382 CCCNc1cccc(NN)c1 Amb27645860 [0,2,0,0,0,0|0,0,2]=4 6744 B12R1.382 CCCNc1cccc(OC)c1 Amb4313520 [0,2,0,0,0,0|0,0,2]=4 6745 B12R1.382 CCCNc1cccc(SC)c1 Amb6687792 [0,2,0,0,0,0|0,0,2]=4 6746 B12R1.382 CCc1cccc(CCC=O)c1 Amb33474379 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.382 CCc1cccc(NCCF)c1 Amb27389206 [0,2,0,0,0,0|1,0,1]=4 6748 B12R1.382 CCc1cccc(OCC=O)c1 Amb5731830 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.382 COc1cccc(CCC=O)c1 Amb6306214 [0,2,0,0,0,0|2,0,0]=4 6750 B12R1.382 COc1cccc(NCC#N)c1 Amb6713943 [0,2,0,0,0,0|1,0,1]=4 6751 B12R1.382 COc1cccc(NCCCl)c1 Amb17335807 [0,2,0,0,0,0|1,0,1]=4 6752 B12R1.382 COc1cccc(NCCN)c1 Amb17057754 [0,2,0,0,0,0|1,0,1]=4 6753 B12R1.382 COc1cccc(NCCO)c1 Amb6713990 [0,2,0,0,0,0|1,0,1]=4 6754 B12R1.382 COc1cccc(OCC=O)c1 Amb5731833 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.382 COc1cccc(SCC=O)c1 Amb18809762 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.382 CSc1cccc(CCC=O)c1 Amb33079612 [0,2,0,0,0,0|2,0,0]=4 6757 B12R1.382 CSc1cccc(NCCF)c1 Amb27241786 [0,2,0,0,0,0|1,0,1]=4 6758 B12R1.382 N#CCNc1cccc(CO)c1 Amb28288752 [0,2,0,0,0,0|1,0,1]=4 6759 B12R1.382 N#Cc1cccc(CCC=O)c1 Amb18645176 [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.382 N#Cc1cccc(NCCCl)c1 Amb17335461 [0,2,0,0,0,0|1,0,1]=4 6761 B12R1.382 N#Cc1cccc(NCCO)c1 Amb6712113 [0,2,0,0,0,0|1,0,1]=4 6762 B12R1.382 N#Cc1cccc(OCC=O)c1 Amb18800496 [0,2,0,0,0,0|2,0,0]=4 6763 B12R1.382 NCc1cccc(NCCF)c1 Amb28208771 [0,2,0,0,0,0|1,0,1]=4 6764 B12R1.382 OCCNc1cccc(CO)c1 Amb27178607 [0,2,0,0,0,0|1,0,1]=4 6765 B12R1.8 BrC\C=C\C=C\c1ccccc1 Amb8394285 [0,2,0,0,0,0|1,0,1]=4 6766 B12R1.8 C#CCCCNc1ccccc1 Amb28186421 [0,2,0,0,0,0|0,0,2]=4 6767 B12R1.8 C#CCCNCc1ccccc1 Amb26644765 [0,2,0,0,0,0|0,0,2]=4 6768 B12R1.8 C#CCNCCc1ccccc1 Amb5262796 [0,2,0,0,0,0|0,0,2]=4 6769 B12R1.8 C#CCNOCc1ccccc1 Amb25282219 [0,2,0,0,0,0|0,0,2]=4 6770 B12R1.8 C=CCCC#Cc1ccccc1 Amb29867189 [0,2,0,0,0,0|1,0,0]=3 6771 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [0,2,0,0,0,0|1,0,0]=3 6772 B12R1.8 C=CCCNCc1ccccc1 Amb6384625 [0,2,0,0,0,0|0,0,0]=2 6773 B12R1.8 C=CCCOCc1ccccc1 Amb26862285 [0,2,0,0,0,0|1,0,0]=3 6774 B12R1.8 C=CCNCCc1ccccc1 Amb2119614 [0,2,0,0,0,0|0,0,0]=2 6775 B12R1.8 C=CCNCCc1ccccc1 Amb6683808 [0,2,0,0,0,0|0,0,0]=2 6776 B12R1.8 C=CCNOCc1ccccc1 Amb27234127 [0,2,0,0,0,0|0,0,0]=2 6777 B12R1.8 C=CCONCc1ccccc1 Amb24725564 [0,2,0,0,0,0|0,0,0]=2 6778 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [0,2,0,0,0,0|0,0,2]=4 6779 B12R1.8 CC#CCNCc1ccccc1 Amb4084953 [0,2,0,0,0,0|0,0,2]=4 6780 B12R1.8 CCCCNCc1ccccc1 Amb2684625 [0,2,0,0,0,0|0,0,2]=4 6781 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [0,2,0,0,0,0|0,0,2]=4 6782 B12R1.8 CCCNCCc1ccccc1 Amb4358610 [0,2,0,0,0,0|0,0,2]=4 6783 B12R1.8 CCCNOCc1ccccc1 Amb26553937 [0,2,0,0,0,0|0,0,2]=4 6784 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [0,2,0,0,0,0|0,0,2]=4 6785 B12R1.8 CC\C=C\CNc1ccncc1 Amb27618440 [0,2,0,0,0,0|1,0,0]=3 6786 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [0,2,0,0,0,0|0,0,2]=4 6787 B12R1.8 CNCCNCc1ccccc1 Amb9200691 [0,2,0,0,0,0|0,0,2]=4 6788 B12R1.8 COCCCNc1ccccc1 Amb17232551 [0,2,0,0,0,0|0,0,2]=4 6789 B12R1.8 COCCNCc1ccccc1 Amb33387674 [0,2,0,0,0,0|0,0,2]=4 6790 B12R1.8 COCCNCc1ccccc1 Amb6410960 [0,2,0,0,0,0|0,0,2]=4 6791 B12R1.8 C\C=C\CCNc1ccccc1 Amb28119164 [0,2,0,0,0,0|0,0,0]=2 6792 B12R1.8 C\C=C\CCNc1ccncc1 Amb27831175 [0,2,0,0,0,0|1,0,0]=3 6793 B12R1.8 C\C=C\CCNc1cnccn1 Amb27414079 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.8 ClCCCNCc1ccccc1 Amb10766327 [0,2,0,0,0,0|0,0,2]=4 6795 B12R1.8 ClCCCNCc1ccccc1 Amb27857637 [0,2,0,0,0,0|0,0,2]=4 6796 B12R1.8 ClCCNOCc1ccccc1 Amb27659332 [0,2,0,0,0,0|1,0,1]=4 6797 B12R1.8 ClC\C=C\C#Cc1ccccc1 Amb27859690 [0,2,0,0,0,0|1,0,1]=4 6798 B12R1.8 ClC\C=C\CNc1ccccc1 Amb27806651 [0,2,0,0,0,0|0,0,0]=2 6799 B12R1.8 FCCCNCc1ccccc1 Amb27172983 [0,2,0,0,0,0|0,0,2]=4 6800 B12R1.8 FCCN\C=N\c1ccccc1 Amb26869476 [0,2,0,0,0,0|1,0,1]=4 6801 B12R1.8 N#CCCNCc1ccccc1 Amb4244013 [0,2,0,0,0,0|0,0,2]=4 6802 B12R1.8 N#CCCNCc1ccccc1 Amb575385 [0,2,0,0,0,0|0,0,2]=4 6803 B12R1.8 N#CCCNNc1ccccc1 Amb17594020 [0,2,0,0,0,0|0,0,2]=4 6804 B12R1.8 N#CCNCCc1ccccc1 Amb6711714 [0,2,0,0,0,0|1,0,1]=4 6805 B12R1.8 N#C\C=C\CSc1ccccn1 Amb28189138 [0,2,0,0,0,0|2,0,0]=4 6806 B12R1.8 NCCCNCc1ccccc1 Amb17720405 [0,2,0,0,0,0|0,0,2]=4 6807 B12R1.8 NCCCNCc1ccccc1 Amb6774034 [0,2,0,0,0,0|0,0,2]=4 6808 B12R1.8 NCCNCCc1ccccc1 Amb1086596 [0,2,0,0,0,0|1,0,1]=4 6809 B12R1.8 NCCNOCc1ccccc1 Amb26336084 [0,2,0,0,0,0|1,0,1]=4 6810 B12R1.8 NCCNOCc1ccccc1 Amb32645664 [0,2,0,0,0,0|1,0,1]=4 6811 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [0,2,0,0,0,0|1,0,1]=4 6812 B12R1.8 NC\C=C\CCc1ccccc1 Amb32951855 [0,2,0,0,0,0|1,0,0]=3 6813 B12R1.8 NC\C=C\COc1ccccc1 Amb32428654 [0,2,0,0,0,0|1,0,0]=3 6814 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|1,0,1]=4 6815 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|1,0,1]=4 6816 B12R1.8 O=CCCOCc1ccccc1 Amb8394259 [0,2,0,0,0,0|1,0,1]=4 6817 B12R1.8 O=CCCSCc1ccccc1 Amb18791178 [0,2,0,0,0,0|1,0,1]=4 6818 B12R1.8 O=CCC\C=C\c1ccccc1 Amb18645368 [0,2,0,0,0,0|1,0,1]=4 6819 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [0,2,0,0,0,0|2,0,0]=4 6820 B12R1.8 O=C\C=C/NCc1ccccc1 Amb28054344 [0,2,0,0,0,0|0,0,1]=3 6821 B12R1.8 O=C\C=C\C=C\c1ccccc1 Amb17593956 [0,2,0,0,0,0|1,0,1]=4 6822 B12R1.8 O=C\C=C\CCc1ccccc1 Amb32954855 [0,2,0,0,0,0|1,0,0]=3 6823 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [0,2,0,0,0,0|0,0,1]=3 6824 B12R1.8 OCCCNCc1ccccc1 Amb2221510 [0,2,0,0,0,0|0,0,2]=4 6825 B12R1.8 OCCCNCc1ccccc1 Amb4017628 [0,2,0,0,0,0|0,0,2]=4 6826 B12R1.8 OCCNCCc1ccccc1 Amb6711760 [0,2,0,0,0,0|1,0,1]=4 6827 B12R1.8 OCCNOCc1ccccc1 Amb27658441 [0,2,0,0,0,0|1,0,1]=4 6828 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|1,0,1]=4 6829 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|1,0,1]=4 6830 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [0,2,0,0,0,0|1,0,1]=4 6831 B12R1.8 OC\C=C\CCc1ccccc1 Amb33082995 [0,2,0,0,0,0|1,0,0]=3 6832 B12R1.8 O\C=C/NCCc1ccccc1 Amb27975397 [0,2,0,0,0,0|1,0,0]=3 6833 B12R1.8 S=CNC\C=C\c1ccccc1 Amb27232732 [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|1,0,1]=4 6835 B12R1.27 C#CC(=O)CSc1ccccc1 Amb27961049 [0,2,0,0,0,0|1,0,1]=4 6836 B12R1.27 C#CC(=O)NNc1ccccc1 Amb28317629 [0,2,0,0,0,0|1,0,1]=4 6837 B12R1.27 C#CC(C)NCc1ccccc1 Amb27866300 [0,2,0,0,0,0|0,0,2]=4 6838 B12R1.27 C#CC(O)CNc1ccccc1 Amb29875227 [0,2,0,0,0,0|0,0,2]=4 6839 B12R1.27 C#C[C@H](C)NCc1ccccc1 Amb28461424 [0,2,0,0,0,0|0,0,2]=4 6840 B12R1.27 C=C(C#N)CNc1ccccc1 Amb18645075 [0,2,0,0,0,0|0,0,0]=2 6841 B12R1.27 C=C(C#N)CSc1ccccc1 Amb27859469 [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.27 C=C(C#N)CSc1ccccn1 Amb28282609 [0,2,0,0,0,0|2,0,0]=4 6843 B12R1.27 C=C(CBr)CCc1ccccc1 Amb32951881 [0,2,0,0,0,0|1,0,0]=3 6844 B12R1.27 C=C(CC)CNc1ccncc1 Amb27408055 [0,2,0,0,0,0|1,0,0]=3 6845 B12R1.27 C=C(CC)CNc1cnccn1 Amb27829339 [0,2,0,0,0,0|2,0,0]=4 6846 B12R1.27 C=C(CCl)CCc1ccccc1 Amb32951884 [0,2,0,0,0,0|1,0,0]=3 6847 B12R1.27 C=C(CCl)CNc1ccccc1 Amb28245221 [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.27 C=C(CN)CCc1ccccc1 Amb32954092 [0,2,0,0,0,0|1,0,0]=3 6849 B12R1.27 C=C(CNc1ccccc1)SC Amb27394285 [0,2,0,0,0,0|0,0,0]=2 6850 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [0,2,0,0,0,0|1,0,1]=4 6851 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [0,2,0,0,0,0|1,0,1]=4 6852 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [0,2,0,0,0,0|1,0,1]=4 6853 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|1,0,0]=3 6854 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [0,2,0,0,0,0|0,0,0]=2 6855 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,2,0,0,0,0|0,0,1]=3 6856 B12R1.27 C=CC(=O)NCc1ccccn1 Amb9480451 [0,2,0,0,0,0|1,0,1]=4 6857 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,2,0,0,0,0|1,0,1]=4 6858 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [0,2,0,0,0,0|1,0,1]=4 6859 B12R1.27 C=CC(O)CCc1ccccc1 Amb33082669 [0,2,0,0,0,0|1,0,0]=3 6860 B12R1.27 C=CC(O)\C=C\c1ccccc1 Amb27478521 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.27 C=C[C@@H](C)NCc1ccccc1 Amb27616678 [0,2,0,0,0,0|0,0,0]=2 6862 B12R1.27 C=C[C@H](O)C#Cc1ccccc1 Amb27660912 [0,2,0,0,0,0|1,0,0]=3 6863 B12R1.27 CC(C#N)CNc1ccccc1 Amb8867341 [0,2,0,0,0,0|0,0,2]=4 6864 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [0,2,0,0,0,0|1,0,1]=4 6865 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [0,2,0,0,0,0|1,0,1]=4 6866 B12R1.27 CC(C=O)CSc1ccccc1 Amb17594629 [0,2,0,0,0,0|1,0,1]=4 6867 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|2,0,0]=4 6868 B12R1.27 CC(C=O)SCc1ccccc1 Amb18648419 [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb33081219 [0,2,0,0,0,0|2,0,0]=4 6870 B12R1.27 CC(CBr)NCc1ccccc1 Amb28318958 [0,2,0,0,0,0|1,0,1]=4 6871 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,2,0,0,0,0|0,0,2]=4 6872 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,2,0,0,0,0|1,0,1]=4 6873 B12R1.27 CC(CO)NCc1ccccc1 Amb2697658 [0,2,0,0,0,0|1,0,1]=4 6874 B12R1.27 CC(CS)NCc1ccccc1 Amb27606358 [0,2,0,0,0,0|1,0,1]=4 6875 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [0,2,0,0,0,0|1,0,1]=4 6876 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [0,2,0,0,0,0|0,0,1]=3 6877 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [0,2,0,0,0,0|1,0,1]=4 6878 B12R1.27 CCC(=O)NNc1ccccc1 Amb2720825 [0,2,0,0,0,0|1,0,1]=4 6879 B12R1.27 CCC(C)NCc1ccccc1 Amb5729099 [0,2,0,0,0,0|0,0,2]=4 6880 B12R1.27 CCC(C)NCc1ccccc1 Amb837601 [0,2,0,0,0,0|0,0,2]=4 6881 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [0,2,0,0,0,0|0,0,2]=4 6882 B12R1.27 CCC(O)CNc1ccccc1 Amb13952005 [0,2,0,0,0,0|0,0,2]=4 6883 B12R1.27 CC[C@@H](C)NCc1ccccc1 Amb28283155 [0,2,0,0,0,0|0,0,2]=4 6884 B12R1.27 CC[C@@H](O)CNc1ccccc1 Amb27793988 [0,2,0,0,0,0|0,0,2]=4 6885 B12R1.27 CC[C@H](N)CNc1ccccc1 Amb27965358 [0,2,0,0,0,0|0,0,2]=4 6886 B12R1.27 CC[C@H](O)CNc1ccccc1 Amb28071833 [0,2,0,0,0,0|0,0,2]=4 6887 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [0,2,0,0,0,0|1,0,1]=4 6888 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [0,2,0,0,0,0|1,0,1]=4 6889 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,2,0,0,0,0|1,0,1]=4 6890 B12R1.27 CNC(=S)CCc1ccccc1 Amb4430624 [0,2,0,0,0,0|1,0,1]=4 6891 B12R1.27 CNC(=S)NNc1ccccc1 Amb4005752 [0,2,0,0,0,0|1,0,1]=4 6892 B12R1.27 CN[C@H](C)CNc1ccccc1 Amb28076762 [0,2,0,0,0,0|0,0,2]=4 6893 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [0,2,0,0,0,0|1,0,1]=4 6894 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [0,2,0,0,0,0|1,0,1]=4 6895 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [0,2,0,0,0,0|0,0,1]=3 6896 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [0,2,0,0,0,0|0,0,1]=3 6897 B12R1.27 COC(=O)CNc1ccccn1 Amb6649089 [0,2,0,0,0,0|1,0,1]=4 6898 B12R1.27 COC(=O)CNc1cccnc1 Amb18270093 [0,2,0,0,0,0|1,0,1]=4 6899 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [0,2,0,0,0,0|1,0,1]=4 6900 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [0,2,0,0,0,0|1,0,1]=4 6901 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [0,2,0,0,0,0|1,0,1]=4 6902 B12R1.27 CSC(=S)NNc1ccccc1 Amb27852793 [0,2,0,0,0,0|1,0,1]=4 6903 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,2,0,0,0,0|0,0,2]=4 6904 B12R1.27 C[C@@H](C=O)OCc1ccccc1 Amb17609288 [0,2,0,0,0,0|2,0,0]=4 6905 B12R1.27 C[C@@H](CF)NCc1ccccc1 Amb28145925 [0,2,0,0,0,0|1,0,1]=4 6906 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,2,0,0,0,0|1,0,1]=4 6907 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,2,0,0,0,0|1,0,1]=4 6908 B12R1.27 C[C@H](C=O)ONc1ccccc1 Amb28239490 [0,2,0,0,0,0|1,0,0]=3 6909 B12R1.27 C[C@H](CF)NCc1ccccc1 Amb28066677 [0,2,0,0,0,0|1,0,1]=4 6910 B12R1.27 C[C@H](CN)NCc1ccccc1 Amb25861224 [0,2,0,0,0,0|1,0,1]=4 6911 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,2,0,0,0,0|1,0,1]=4 6912 B12R1.27 C\C(=C\Cl)CCc1ccccc1 Amb27658993 [0,2,0,0,0,0|1,0,0]=3 6913 B12R1.27 C\C(=C\Cl)CSc1ccccc1 Amb27760378 [0,2,0,0,0,0|1,0,0]=3 6914 B12R1.27 C\C(C#N)=C\Nc1ccccc1 Amb27420007 [0,2,0,0,0,0|0,0,2]=4 6915 B12R1.27 C\C(C=O)=C/Nc1ccccc1 Amb18645511 [0,2,0,0,0,0|0,0,1]=3 6916 B12R1.27 C\C(COc1ccccc1)=N\N Amb35672409 [0,2,0,0,0,0|1,0,1]=4 6917 B12R1.27 C\C(COc1ccccc1)=N\O Amb35672643 [0,2,0,0,0,0|1,0,1]=4 6918 B12R1.27 C\C=C(\C)C#Cc1ccccc1 Amb30621736 [0,2,0,0,0,0|1,0,1]=4 6919 B12R1.27 C\C=C(\C)CNc1cccnc1 Amb27598355 [0,2,0,0,0,0|1,0,0]=3 6920 B12R1.27 Cl\C=C(\Cl)COc1ccccc1 Amb27228628 [0,2,0,0,0,0|1,0,0]=3 6921 B12R1.27 N=C(CN)NNc1ccccc1 Amb27250373 [0,2,0,0,0,0|1,0,1]=4 6922 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|1,0,1]=4 6923 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,2,0,0,0,0|1,0,1]=4 6924 B12R1.27 NCC(=O)CNc1cccnc1 Amb27463455 [0,2,0,0,0,0|1,0,1]=4 6925 B12R1.27 NCC(O)CNc1ccccc1 Amb17138613 [0,2,0,0,0,0|0,0,2]=4 6926 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,2,0,0,0,0|1,0,0]=3 6928 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [0,2,0,0,0,0|1,0,0]=3 6929 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [0,2,0,0,0,0|2,0,0]=4 6931 B12R1.27 NNC(=O)NNc1ccccc1 Amb28045865 [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.27 NNC(=S)CCc1ccccc1 Amb27492786 [0,2,0,0,0,0|2,0,0]=4 6933 B12R1.27 NNC(=S)NNc1ccccc1 Amb24502103 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.27 N[C@@H](CO)CNc1ccccc1 Amb27233028 [0,2,0,0,0,0|0,0,2]=4 6935 B12R1.27 N\C(CCc1ccccc1)=N/O Amb1115853 [0,2,0,0,0,0|2,0,0]=4 6936 B12R1.27 N\C(CCc1ccccc1)=N\O Amb22053006 [0,2,0,0,0,0|2,0,0]=4 6937 B12R1.27 N\C(COc1ccccc1)=N/O Amb6666310 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.27 N\C(CSc1ccccc1)=N/O Amb6677887 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.27 N\N=C(\N)CSc1ccccc1 Amb27602971 [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|1,0,1]=4 6941 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,1]=4 6942 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,2,0,0,0,0|2,0,0]=4 6943 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|1,0,1]=4 6944 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,1]=4 6945 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [0,2,0,0,0,0|1,0,1]=4 6946 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,2,0,0,0,0|1,0,1]=4 6947 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|1,0,1]=4 6948 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|1,0,1]=4 6949 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [0,2,0,0,0,0|1,0,1]=4 6950 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.27 O=C(CS)NNc1ccccc1 Amb8459004 [0,2,0,0,0,0|1,0,1]=4 6952 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.27 O=C(NO)NNc1ccccc1 Amb3427817 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [0,2,0,0,0,0|2,0,0]=4 6955 B12R1.27 O=C\C(Cl)=C\Nc1ccccc1 Amb25797781 [0,2,0,0,0,0|0,0,1]=3 6956 B12R1.27 O=C\C(Cl)=N\Nc1ccccc1 Amb27797293 [0,2,0,0,0,0|1,0,0]=3 6957 B12R1.27 O=C\C(F)=C\Cc1ccccc1 Amb27166149 [0,2,0,0,0,0|1,0,1]=4 6958 B12R1.27 O=C\C(O)=C/Nc1ccccc1 Amb27476557 [0,2,0,0,0,0|0,0,1]=3 6959 B12R1.27 OC(CCl)CNc1ccccc1 Amb10565986 [0,2,0,0,0,0|0,0,2]=4 6960 B12R1.27 OC(CF)CNc1ccccc1 Amb26517065 [0,2,0,0,0,0|0,0,2]=4 6961 B12R1.27 OC[C@H](O)CNc1ccccc1 Amb27238799 [0,2,0,0,0,0|0,0,2]=4 6962 B12R1.27 O\N=C(/Cl)CCc1ccccc1 Amb32661748 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.27 [C-]#[N+]\C(C)=C/Nc1ccccc1 Amb28398147 [0,2,0,0,0,0|0,0,2]=4 6964 B12R1.32 C#CCC(=O)Nc1ccccc1 Amb27234818 [0,2,0,0,0,0|0,0,2]=4 6965 B12R1.32 C#CCN(C)Cc1ccccc1 Amb3940470 [0,2,0,0,0,0|0,0,2]=4 6966 B12R1.32 C#CCN(C)Cc1ccccc1 Amb8390240 [0,2,0,0,0,0|0,0,2]=4 6967 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,2,0,0,0,0|0,0,0]=2 6968 B12R1.32 C=CCC(C)Nc1ccccc1 Amb27794468 [0,2,0,0,0,0|0,0,0]=2 6969 B12R1.32 C=CCC(C)Nc1ccccn1 Amb10554010 [0,2,0,0,0,0|1,0,0]=3 6970 B12R1.32 C=CCC(C)Nc1cnccn1 Amb27807081 [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.32 C=CCC(N)Cc1ccccc1 Amb32663713 [0,2,0,0,0,0|1,0,0]=3 6972 B12R1.32 C=CCC(N)Cc1ccccc1 Amb33538411 [0,2,0,0,0,0|1,0,0]=3 6973 B12R1.32 C=CCC(O)Cc1ccccc1 Amb18177786 [0,2,0,0,0,0|1,0,0]=3 6974 B12R1.32 C=CCN(C)Cc1ccccc1 Amb6360694 [0,2,0,0,0,0|0,0,0]=2 6975 B12R1.32 C=CCN(N)Cc1ccccc1 Amb26501723 [0,2,0,0,0,0|0,0,0]=2 6976 B12R1.32 C=CNC(=O)Cc1ccccc1 Amb27455089 [0,2,0,0,0,0|1,0,1]=4 6977 B12R1.32 C=CNC(=S)Cc1ccccc1 Amb27239916 [0,2,0,0,0,0|1,0,1]=4 6978 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,2,0,0,0,0|1,0,1]=4 6979 B12R1.32 C=COC(=S)Nc1ccccc1 Amb27969249 [0,2,0,0,0,0|0,0,1]=3 6980 B12R1.32 CC(=C\c1ccccc1)\C=C\N Amb27788151 [0,2,0,0,0,0|1,0,1]=4 6981 B12R1.32 CC(CC#N)Nc1ccccc1 Amb17138511 [0,2,0,0,0,0|0,0,2]=4 6982 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [0,2,0,0,0,0|2,0,0]=4 6983 B12R1.32 CCCC(=O)Nc1ccccc1 Amb5794989 [0,2,0,0,0,0|0,0,2]=4 6984 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [0,2,0,0,0,0|0,0,2]=4 6985 B12R1.32 CN(CC#N)Cc1ccccc1 Amb5781387 [0,2,0,0,0,0|1,0,1]=4 6986 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|1,0,0]=3 6987 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,2,0,0,0,0|1,0,1]=4 6988 B12R1.32 CN(CCBr)Cc1ccccc1 Amb32882453 [0,2,0,0,0,0|1,0,1]=4 6989 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,2,0,0,0,0|1,0,1]=4 6990 B12R1.32 CN(CCCl)Cc1ccccc1 Amb3940690 [0,2,0,0,0,0|1,0,1]=4 6991 B12R1.32 CN(CCN)Cc1ccccc1 Amb5357836 [0,2,0,0,0,0|1,0,1]=4 6992 B12R1.32 CN(CCO)Cc1ccccc1 Amb3938987 [0,2,0,0,0,0|1,0,1]=4 6993 B12R1.32 CN(CCS)Cc1ccccc1 Amb13881720 [0,2,0,0,0,0|1,0,1]=4 6994 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6246115 [0,2,0,0,0,0|1,0,1]=4 6995 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6893116 [0,2,0,0,0,0|1,0,1]=4 6996 B12R1.32 CNCC(C)Nc1ccccc1 Amb27955315 [0,2,0,0,0,0|0,0,2]=4 6997 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [0,2,0,0,0,0|1,0,1]=4 6998 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,2,0,0,0,0|0,0,2]=4 6999 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,2,0,0,0,0|1,0,1]=4 7000 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [0,2,0,0,0,0|2,0,0]=4 7001 B12R1.32 C\C(=C/c1ccccc1)CC=O Amb32952974 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.32 C\C(=C\C=O)Cc1ccccc1 Amb27435409 [0,2,0,0,0,0|1,0,1]=4 7003 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [0,2,0,0,0,0|0,0,1]=3 7004 B12R1.32 C\C=C\C(=O)Nc1cccnc1 Amb27766723 [0,2,0,0,0,0|1,0,1]=4 7005 B12R1.32 C\C=C\C(=O)Nc1ccncc1 Amb27858099 [0,2,0,0,0,0|1,0,1]=4 7006 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [0,2,0,0,0,0|1,0,1]=4 7007 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [0,2,0,0,0,0|0,0,1]=3 7008 B12R1.32 C\C=C\C(C)Nc1ccccc1 Amb28245278 [0,2,0,0,0,0|0,0,0]=2 7009 B12R1.32 C\C=C\C(O)Cc1ccccc1 Amb27641998 [0,2,0,0,0,0|1,0,0]=3 7010 B12R1.32 N#CCC(=O)Nc1ccccc1 Amb1634628 [0,2,0,0,0,0|1,0,1]=4 7011 B12R1.32 N#CCC(=S)Nc1ccccc1 Amb1980796 [0,2,0,0,0,0|1,0,1]=4 7012 B12R1.32 N#C\C=C(\N)Nc1ccccc1 Amb27607188 [0,2,0,0,0,0|0,0,2]=4 7013 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,2,0,0,0,0|1,0,1]=4 7014 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,2,0,0,0,0|1,0,1]=4 7015 B12R1.32 NCCC(=S)Nc1ccccc1 Amb27491751 [0,2,0,0,0,0|1,0,1]=4 7016 B12R1.32 NNCC(=O)Nc1ccccc1 Amb26632802 [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.32 N\C=N\C(=S)Nc1ccccc1 Amb27441755 [0,2,0,0,0,0|1,0,1]=4 7018 B12R1.32 O=C(CCBr)Nc1ccccc1 Amb16191990 [0,2,0,0,0,0|1,0,1]=4 7019 B12R1.32 O=C(CCCl)Nc1ccccc1 Amb6458951 [0,2,0,0,0,0|1,0,1]=4 7020 B12R1.32 O=C(CCO)Nc1ccccc1 Amb9421562 [0,2,0,0,0,0|1,0,1]=4 7021 B12R1.32 O=C(CCS)Nc1ccccc1 Amb17305724 [0,2,0,0,0,0|1,0,1]=4 7022 B12R1.32 O=C(\C=C\Cl)Nc1ccccc1 Amb28342211 [0,2,0,0,0,0|0,0,1]=3 7023 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,2,0,0,0,0|0,0,1]=3 7024 B12R1.32 O=C(\C=N\O)Nc1ccccc1 Amb1205570 [0,2,0,0,0,0|1,0,1]=4 7025 B12R1.32 O=CCC(=S)Nc1ccccc1 Amb28073090 [0,2,0,0,0,0|1,0,0]=3 7026 B12R1.32 O=S(CCCl)Nc1ccccc1 Amb27607773 [0,2,0,0,0,0|1,0,1]=4 7027 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [0,2,0,0,0,0|1,0,0]=3 7028 B12R1.252 C=C(C)CCNc1cccnn1 Amb27613311 [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.252 C=C(C)CCNc1ccncc1 Amb28322222 [0,2,0,0,0,0|1,0,0]=3 7030 B12R1.252 C=C(C)CCNc1ccncn1 Amb27858434 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.252 C=C(C)CNCc1ccccc1 Amb10608684 [0,2,0,0,0,0|0,0,0]=2 7032 B12R1.252 C=C(C)CNCc1ccccc1 Amb17622487 [0,2,0,0,0,0|0,0,0]=2 7033 B12R1.252 C=C(C)CNCc1ccccn1 Amb17308945 [0,2,0,0,0,0|1,0,0]=3 7034 B12R1.252 C=C(C)CNCc1cccnc1 Amb18800663 [0,2,0,0,0,0|1,0,0]=3 7035 B12R1.252 C=C(C)CNCc1ccncc1 Amb17308927 [0,2,0,0,0,0|1,0,0]=3 7036 B12R1.252 C=C(C)COCc1ccccc1 Amb28062621 [0,2,0,0,0,0|1,0,0]=3 7037 B12R1.252 CC(=O)CC#Cc1ccccc1 Amb28122481 [0,2,0,0,0,0|1,0,1]=4 7038 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [0,2,0,0,0,0|1,0,1]=4 7039 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [0,2,0,0,0,0|0,0,1]=3 7040 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [0,2,0,0,0,0|1,0,1]=4 7041 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [0,2,0,0,0,0|1,0,1]=4 7042 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [0,2,0,0,0,0|1,0,1]=4 7043 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [0,2,0,0,0,0|0,0,1]=3 7044 B12R1.252 CC(=O)CSCc1ccccc1 Amb4018341 [0,2,0,0,0,0|1,0,1]=4 7045 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,2,0,0,0,0|1,0,1]=4 7046 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,2,0,0,0,0|0,0,2]=4 7047 B12R1.252 CC(=O)NCCc1ccccc1 Amb2781514 [0,2,0,0,0,0|1,0,1]=4 7048 B12R1.252 CC(=O)NCSc1ccccc1 Amb27797274 [0,2,0,0,0,0|1,0,1]=4 7049 B12R1.252 CC(=O)OCCc1ccccc1 Amb6357159 [0,2,0,0,0,0|1,0,1]=4 7050 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [0,2,0,0,0,0|0,0,1]=3 7051 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [0,2,0,0,0,0|1,0,1]=4 7052 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,2,0,0,0,0|0,0,1]=3 7053 B12R1.252 CC(=O)\C=C\Nc1ccccn1 Amb22490408 [0,2,0,0,0,0|1,0,1]=4 7054 B12R1.252 CC(=O)\C=C\Oc1ccccc1 Amb26528572 [0,2,0,0,0,0|1,0,1]=4 7055 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb35789855 [0,2,0,0,0,0|1,0,1]=4 7056 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,2,0,0,0,0|1,0,0]=3 7057 B12R1.252 CC(=S)NCCc1ccccc1 Amb27412033 [0,2,0,0,0,0|1,0,1]=4 7058 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|1,0,0]=3 7059 B12R1.252 CC(C)=CCCc1cccnc1 Amb35582905 [0,2,0,0,0,0|2,0,0]=4 7060 B12R1.252 CC(C)=CCNc1ccccc1 Amb27638094 [0,2,0,0,0,0|0,0,0]=2 7061 B12R1.252 CC(C)=CCNc1ccncc1 Amb27601157 [0,2,0,0,0,0|1,0,0]=3 7062 B12R1.252 CC(C)=CCNc1ncccn1 Amb27389822 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.252 CC(C)=CCSc1ccccc1 Amb8394723 [0,2,0,0,0,0|1,0,0]=3 7064 B12R1.252 CC(C)=CCSc1ccccn1 Amb27595302 [0,2,0,0,0,0|2,0,0]=4 7065 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb28143072 [0,2,0,0,0,0|1,0,1]=4 7066 B12R1.252 CC(C)CCNc1ccccc1 Amb4016589 [0,2,0,0,0,0|0,0,2]=4 7067 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [0,2,0,0,0,0|0,0,2]=4 7068 B12R1.252 CC(C)CNCc1ccccc1 Amb6687359 [0,2,0,0,0,0|0,0,2]=4 7069 B12R1.252 CC(Cl)CNCc1ccccc1 Amb27656927 [0,2,0,0,0,0|0,0,2]=4 7070 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [0,2,0,0,0,0|0,0,2]=4 7071 B12R1.252 CC(O)CNCc1ccccc1 Amb837676 [0,2,0,0,0,0|0,0,2]=4 7072 B12R1.252 CN(C)CCNc1ccccc1 Amb6477740 [0,2,0,0,0,0|0,0,2]=4 7073 B12R1.252 CN(C)\C=N\Nc1ccccc1 Amb26911036 [0,2,0,0,0,0|1,0,1]=4 7074 B12R1.252 C[C@H](O)CNCc1ccccc1 Amb27862492 [0,2,0,0,0,0|0,0,2]=4 7075 B12R1.252 C\C(Cl)=C\CNc1ccccc1 Amb4303986 [0,2,0,0,0,0|0,0,0]=2 7076 B12R1.252 ClC(Cl)=CCCc1ccccc1 Amb27443084 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.252 ClC(Cl)=CCNc1ccccn1 Amb29859506 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.252 ClC(Cl)=CCNc1cccnn1 Amb29857059 [0,2,0,0,0,0|2,0,0]=4 7079 B12R1.252 ClC(Cl)=CCNc1ccncc1 Amb29857412 [0,2,0,0,0,0|1,0,0]=3 7080 B12R1.252 ClC(Cl)=CCNc1ccncn1 Amb29857058 [0,2,0,0,0,0|2,0,0]=4 7081 B12R1.252 ClC(Cl)=CCNc1cnccn1 Amb29859464 [0,2,0,0,0,0|2,0,0]=4 7082 B12R1.252 ClC(Cl)=CCNc1ncccn1 Amb29859471 [0,2,0,0,0,0|2,0,0]=4 7083 B12R1.252 ClC(Cl)=CCOc1ccccc1 Amb29866947 [0,2,0,0,0,0|1,0,0]=3 7084 B12R1.252 ClC(Cl)=CCOc1cccnc1 Amb29866948 [0,2,0,0,0,0|2,0,0]=4 7085 B12R1.252 ClC(Cl)=CNCc1ccccc1 Amb2793552 [0,2,0,0,0,0|1,0,1]=4 7086 B12R1.252 FC(Cl)CNCc1ccccc1 Amb27407058 [0,2,0,0,0,0|1,0,1]=4 7087 B12R1.252 FC(F)CNCc1ccccc1 Amb16229911 [0,2,0,0,0,0|1,0,1]=4 7088 B12R1.252 N=C(N)CCCc1ccccc1 Amb6276737 [0,2,0,0,0,0|1,0,1]=4 7089 B12R1.252 N=C(N)CCOc1ccccc1 Amb6279642 [0,2,0,0,0,0|1,0,1]=4 7090 B12R1.252 N=C(N)COCc1ccccc1 Amb6266963 [0,2,0,0,0,0|2,0,0]=4 7091 B12R1.252 N=C(N)COCc1ccccc1 Amb8630424 [0,2,0,0,0,0|2,0,0]=4 7092 B12R1.252 N=C(N)CSCc1ccccc1 Amb28555674 [0,2,0,0,0,0|2,0,0]=4 7093 B12R1.252 N=C(N)CSCc1ccccc1 Amb6678181 [0,2,0,0,0,0|2,0,0]=4 7094 B12R1.252 N=C(N)C\C=C\c1ccccc1 Amb27652946 [0,2,0,0,0,0|2,0,0]=4 7095 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736089 [0,2,0,0,0,0|2,0,0]=4 7096 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736599 [0,2,0,0,0,0|2,0,0]=4 7097 B12R1.252 N=C(N)NCCc1ccccc1 Amb28974714 [0,2,0,0,0,0|2,0,0]=4 7098 B12R1.252 N=C(N)NCCc1ccccc1 Amb6761287 [0,2,0,0,0,0|2,0,0]=4 7099 B12R1.252 N=C(N)NCCc1ccccc1 Amb838720 [0,2,0,0,0,0|2,0,0]=4 7100 B12R1.252 N=C(N)NNCc1ccccc1 Amb18563641 [0,2,0,0,0,0|2,0,0]=4 7101 B12R1.252 N=C(N)SCCc1ccccc1 Amb20675983 [0,2,0,0,0,0|2,0,0]=4 7102 B12R1.252 NC(=O)CC#Cc1ccccc1 Amb28256571 [0,2,0,0,0,0|2,0,0]=4 7103 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [0,2,0,0,0,0|1,0,1]=4 7104 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [0,2,0,0,0,0|0,0,1]=3 7105 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [0,2,0,0,0,0|1,0,1]=4 7106 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [0,2,0,0,0,0|1,0,1]=4 7107 B12R1.252 NC(=O)CNCc1ccccc1 Amb2696395 [0,2,0,0,0,0|1,0,0]=3 7108 B12R1.252 NC(=O)CNCc1ccccn1 Amb6661065 [0,2,0,0,0,0|2,0,0]=4 7109 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [0,2,0,0,0,0|2,0,0]=4 7110 B12R1.252 NC(=O)CNCc1cccnc1 Amb33545533 [0,2,0,0,0,0|2,0,0]=4 7111 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [0,2,0,0,0,0|2,0,0]=4 7112 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [0,2,0,0,0,0|2,0,0]=4 7113 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,2,0,0,0,0|2,0,0]=4 7114 B12R1.252 NC(=O)NCSc1ccccc1 Amb28200898 [0,2,0,0,0,0|2,0,0]=4 7115 B12R1.252 NC(=S)CCCc1ccccc1 Amb6244938 [0,2,0,0,0,0|1,0,1]=4 7116 B12R1.252 NC(=S)CCOc1ccccc1 Amb5542247 [0,2,0,0,0,0|1,0,1]=4 7117 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [0,2,0,0,0,0|1,0,1]=4 7118 B12R1.252 NC(=S)COCc1ccccc1 Amb6276568 [0,2,0,0,0,0|2,0,0]=4 7119 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,2,0,0,0,0|2,0,0]=4 7120 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [0,2,0,0,0,0|2,0,0]=4 7121 B12R1.252 NC(=S)NCNc1ccccc1 Amb28325645 [0,2,0,0,0,0|1,0,0]=3 7122 B12R1.252 NC(=S)NNCc1ccccc1 Amb2439185 [0,2,0,0,0,0|2,0,0]=4 7123 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [0,2,0,0,0,0|1,0,1]=4 7124 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [0,2,0,0,0,0|1,0,1]=4 7125 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|1,0,1]=4 7126 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [0,2,0,0,0,0|2,0,0]=4 7127 B12R1.252 O=C(Cl)CSCc1ccccc1 Amb10880013 [0,2,0,0,0,0|2,0,0]=4 7128 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,2,0,0,0,0|2,0,0]=4 7129 B12R1.252 O=C(Cl)OCCc1ccccc1 Amb32661047 [0,2,0,0,0,0|2,0,0]=4 7130 B12R1.252 O=C(O)C=C=Cc1ccccc1 Amb25102534 [0,2,0,0,0,0|1,0,1]=4 7131 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|2,0,0]=4 7132 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|1,0,1]=4 7133 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|0,0,1]=3 7134 B12R1.252 O=C(O)CCNc1ccccn1 Amb10609119 [0,2,0,0,0,0|1,0,1]=4 7135 B12R1.252 O=C(O)CCNc1ccccn1 Amb6258091 [0,2,0,0,0,0|1,0,1]=4 7136 B12R1.252 O=C(O)CCNc1cccnc1 Amb18269696 [0,2,0,0,0,0|1,0,1]=4 7137 B12R1.252 O=C(O)CCNc1ccncc1 Amb33456130 [0,2,0,0,0,0|1,0,1]=4 7138 B12R1.252 O=C(O)CCNc1ccncc1 Amb6280380 [0,2,0,0,0,0|1,0,1]=4 7139 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|1,0,1]=4 7140 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|1,0,1]=4 7141 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [0,2,0,0,0,0|1,0,0]=3 7142 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [0,2,0,0,0,0|1,0,0]=3 7143 B12R1.252 O=C(O)CNCc1ccccn1 Amb1111426 [0,2,0,0,0,0|2,0,0]=4 7144 B12R1.252 O=C(O)CNCc1ccccn1 Amb13951702 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.252 O=C(O)CNCc1cccnc1 Amb1111197 [0,2,0,0,0,0|2,0,0]=4 7146 B12R1.252 O=C(O)CNCc1cccnc1 Amb6893093 [0,2,0,0,0,0|2,0,0]=4 7147 B12R1.252 O=C(O)CNCc1ccncc1 Amb1110916 [0,2,0,0,0,0|2,0,0]=4 7148 B12R1.252 O=C(O)CNCc1ccncc1 Amb32729434 [0,2,0,0,0,0|2,0,0]=4 7149 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [0,2,0,0,0,0|2,0,0]=4 7150 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [0,2,0,0,0,0|2,0,0]=4 7151 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|1,0,1]=4 7152 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [0,2,0,0,0,0|1,0,1]=4 7153 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [0,2,0,0,0,0|2,0,0]=4 7154 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [0,2,0,0,0,0|1,0,1]=4 7155 B12R1.252 O=C(O)\C=C/Sc1ccccc1 Amb3940780 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.252 O=C(O)\C=C\Cc1ccccc1 Amb8392409 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.252 O=C(O)\C=C\Sc1ccccc1 Amb1661597 [0,2,0,0,0,0|1,0,1]=4 7158 B12R1.252 O=C(O)\C=N/Nc1ccccc1 Amb24068313 [0,2,0,0,0,0|1,0,0]=3 7159 B12R1.252 O=C(O)\C=N\Nc1ccccc1 Amb17594064 [0,2,0,0,0,0|1,0,0]=3 7160 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|1,0,1]=4 7161 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|0,0,2]=4 7162 B12R1.252 O=C([O-])\C=C\Sc1ccccc1 Amb534252 [0,2,0,0,0,0|1,0,1]=4 7163 B12R1.252 O=[PH](O)CNCc1ccccc1 Amb28383469 [0,2,0,0,0,0|2,0,0]=4 7164 B12R1.43 C=C(C)C(=O)Nc1ccccc1 Amb6384289 [0,2,0,0,0,0|0,0,1]=3 7165 B12R1.43 C=C(C)C(=O)Nc1ccncc1 Amb2613139 [0,2,0,0,0,0|1,0,1]=4 7166 B12R1.43 C=C(C)C(=O)Oc1ccccc1 Amb8394675 [0,2,0,0,0,0|1,0,1]=4 7167 B12R1.43 C=C(C)C(=S)Nc1ccccc1 Amb28243811 [0,2,0,0,0,0|0,0,1]=3 7168 B12R1.43 C=C(C)C(C)Nc1ccccc1 Amb28368457 [0,2,0,0,0,0|0,0,0]=2 7169 B12R1.43 C=C(C)C(N)Cc1ccccc1 Amb28056790 [0,2,0,0,0,0|1,0,0]=3 7170 B12R1.43 C=C(C)C(N)Cc1cccnc1 Amb27985470 [0,2,0,0,0,0|2,0,0]=4 7171 B12R1.43 C=C(C)[C@@H](N)Cc1ccccc1 Amb28250037 [0,2,0,0,0,0|1,0,0]=3 7172 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 Amb27751263 [0,2,0,0,0,0|0,0,1]=3 7173 B12R1.43 C=C(Cl)C(=O)Nc1cccnc1 Amb28197358 [0,2,0,0,0,0|1,0,1]=4 7174 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [0,2,0,0,0,0|0,0,2]=4 7175 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [0,2,0,0,0,0|1,0,1]=4 7176 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [0,2,0,0,0,0|1,0,1]=4 7177 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [0,2,0,0,0,0|0,0,1]=3 7178 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [0,2,0,0,0,0|1,0,1]=4 7179 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [0,2,0,0,0,0|1,0,1]=4 7180 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [0,2,0,0,0,0|1,0,1]=4 7181 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [0,2,0,0,0,0|1,0,1]=4 7182 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [0,2,0,0,0,0|1,0,1]=4 7183 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [0,2,0,0,0,0|1,0,1]=4 7184 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [0,2,0,0,0,0|1,0,1]=4 7185 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,2,0,0,0,0|1,0,1]=4 7186 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,2,0,0,0,0|1,0,1]=4 7187 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [0,2,0,0,0,0|1,0,1]=4 7188 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [0,2,0,0,0,0|1,0,1]=4 7189 B12R1.43 CC(C)C(C)Nc1ccccc1 Amb6685131 [0,2,0,0,0,0|0,0,2]=4 7190 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 Amb27482555 [0,2,0,0,0,0|0,0,2]=4 7191 B12R1.43 CC(Cc1ccccc1)C(=O)Cl Amb5744098 [0,2,0,0,0,0|2,0,0]=4 7192 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,2,0,0,0,0|2,0,0]=4 7193 B12R1.43 CC(Cc1ccccc1)C(N)=O Amb2701804 [0,2,0,0,0,0|2,0,0]=4 7194 B12R1.43 CC(N)C(C)Nc1ccccc1 Amb18646160 [0,2,0,0,0,0|0,0,2]=4 7195 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [0,2,0,0,0,0|1,0,0]=3 7196 B12R1.43 CC(Nc1ccccc1)C(F)F Amb27615367 [0,2,0,0,0,0|1,0,1]=4 7197 B12R1.43 CC(Nc1ccccc1)C(N)=S Amb27955863 [0,2,0,0,0,0|1,0,0]=3 7198 B12R1.43 CC(Nc1cccnc1)C(=O)O Amb18270393 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.43 CC(Nc1cccnc1)C(N)=O Amb27831365 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.43 CC(Oc1ccccc1)C(=O)Cl Amb3939464 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [0,2,0,0,0,0|2,0,0]=4 7202 B12R1.43 CC(Oc1ccccc1)C(N)=O Amb3886659 [0,2,0,0,0,0|2,0,0]=4 7203 B12R1.43 CC(Oc1ccccc1)C(N)=S Amb17233851 [0,2,0,0,0,0|2,0,0]=4 7204 B12R1.43 CC(Sc1ccccc1)C(=O)Cl Amb17143250 [0,2,0,0,0,0|2,0,0]=4 7205 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [0,2,0,0,0,0|2,0,0]=4 7206 B12R1.43 CC(Sc1ccccc1)C(N)=O Amb10665761 [0,2,0,0,0,0|2,0,0]=4 7207 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,2,0,0,0,0|2,0,0]=4 7208 B12R1.43 C[C@@H](N)[C@@H](C)Nc1ccccc1 Amb27394625 [0,2,0,0,0,0|0,0,2]=4 7209 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [0,2,0,0,0,0|1,0,0]=3 7210 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [0,2,0,0,0,0|2,0,0]=4 7211 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [0,2,0,0,0,0|2,0,0]=4 7212 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,2,0,0,0,0|2,0,0]=4 7213 B12R1.43 C[C@H](Cc1ccccc1)C(N)=O Amb28319376 [0,2,0,0,0,0|2,0,0]=4 7214 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [0,2,0,0,0,0|1,0,0]=3 7215 B12R1.43 C[C@H](Nc1ccccc1)[C@@H](C)O Amb27225799 [0,2,0,0,0,0|0,0,2]=4 7216 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [0,2,0,0,0,0|2,0,0]=4 7217 B12R1.43 C[C@H](Oc1ccccc1)C(N)=O Amb27431501 [0,2,0,0,0,0|2,0,0]=4 7218 B12R1.43 N=C(N)C(N)Cc1ccccc1 Amb27813157 [0,2,0,0,0,0|2,0,0]=4 7219 B12R1.43 N=C(N)C(O)Cc1ccccc1 Amb28137730 [0,2,0,0,0,0|2,0,0]=4 7220 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [0,2,0,0,0,0|1,0,1]=4 7221 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,2,0,0,0,0|1,0,1]=4 7222 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [0,2,0,0,0,0|1,0,1]=4 7223 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,2,0,0,0,0|2,0,0]=4 7224 B12R1.43 NC(=O)C(Cl)Cc1ccccc1 Amb17204334 [0,2,0,0,0,0|2,0,0]=4 7225 B12R1.43 NC(=O)C(F)Sc1ccccc1 Amb27865643 [0,2,0,0,0,0|2,0,0]=4 7226 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,2,0,0,0,0|2,0,0]=4 7227 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb9727200 [0,2,0,0,0,0|2,0,0]=4 7228 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|2,0,0]=4 7229 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.43 NC(=O)C(S)Cc1ccccc1 Amb27663190 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.43 NC(=O)[C@@H](Br)Cc1ccccc1 Amb27240179 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb6295777 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb9825510 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.43 NC(=O)[C@@H](O)Cc1ccccc1 Amb26371653 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.43 NC(=O)[C@H](Cl)Cc1ccccc1 Amb28385619 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb16183950 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb33800758 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.43 NC(=S)C(O)Cc1ccccc1 Amb27398697 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,2,0,0,0,0|2,0,0]=4 7241 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)Cl Amb27955901 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)S Amb27407796 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.43 O=C(Br)C(Br)Cc1ccccc1 Amb27840480 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.43 O=C(Cl)C(F)Cc1ccccc1 Amb27615534 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.43 O=C(Cl)C(O)Cc1ccccc1 Amb27632817 [0,2,0,0,0,0|2,0,0]=4 7251 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [0,2,0,0,0,0|1,0,1]=4 7252 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [0,2,0,0,0,0|1,0,1]=4 7253 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|2,0,0]=4 7255 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [0,2,0,0,0,0|2,0,0]=4 7256 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,2,0,0,0,0|2,0,0]=4 7257 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,2,0,0,0,0|2,0,0]=4 7258 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [0,2,0,0,0,0|2,0,0]=4 7259 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|2,0,0]=4 7260 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|2,0,0]=4 7261 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,2,0,0,0,0|2,0,0]=4 7262 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,2,0,0,0,0|2,0,0]=4 7263 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,2,0,0,0,0|2,0,0]=4 7264 B12R1.43 O=C([O-])C(O)Cc1ccccc1 Amb33513053 [0,2,0,0,0,0|2,0,0]=4 7265 B12R1.118 C=CC(CO)Nc1ccccc1 Amb27655109 [0,2,0,0,0,0|0,0,0]=2 7266 B12R1.118 C=CC(CO)Nc1ccccn1 Amb27979996 [0,2,0,0,0,0|1,0,0]=3 7267 B12R1.118 C=C\C(=C/c1ccccc1)CO Amb27981982 [0,2,0,0,0,0|1,0,1]=4 7268 B12R1.118 CCC(CF)Nc1ccccc1 Amb27664184 [0,2,0,0,0,0|0,0,2]=4 7269 B12R1.118 CCC(CN)Nc1ccccc1 Amb25982695 [0,2,0,0,0,0|0,0,2]=4 7270 B12R1.118 CCC(CO)Nc1ccccc1 Amb13952611 [0,2,0,0,0,0|0,0,2]=4 7271 B12R1.118 CC[C@@H](CO)Nc1ccccc1 Amb27175792 [0,2,0,0,0,0|0,0,2]=4 7272 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [0,2,0,0,0,0|2,0,0]=4 7273 B12R1.118 C\C=C(\CC)Nc1ccccc1 Amb26457549 [0,2,0,0,0,0|0,0,2]=4 7274 B12R1.118 N#CC(CO)Nc1ccccc1 Amb27784107 [0,2,0,0,0,0|1,0,1]=4 7275 B12R1.194 C#CC(C)(C)Nc1ccccc1 Amb8395195 [0,2,0,0,0,0|0,0,2]=4 7276 B12R1.194 C=CC(C)(C)Nc1ccccc1 Amb27751378 [0,2,0,0,0,0|0,0,0]=2 7277 B12R1.194 C=CC(C)(O)Cc1ccccc1 Amb27876057 [0,2,0,0,0,0|1,0,0]=3 7278 B12R1.194 C=CS(=O)(=O)Cc1ccccc1 Amb2459233 [0,2,0,0,0,0|2,0,0]=4 7279 B12R1.194 C=CS(=O)(=O)Nc1ccccc1 Amb25687468 [0,2,0,0,0,0|1,0,0]=3 7280 B12R1.194 C=CS(=O)(=O)Oc1ccccc1 Amb1153807 [0,2,0,0,0,0|2,0,0]=4 7281 B12R1.194 CC(C)(C#N)Nc1ccccc1 Amb2496330 [0,2,0,0,0,0|1,0,1]=4 7282 B12R1.194 CC(C)(C=O)Cc1ccccc1 Amb4358578 [0,2,0,0,0,0|2,0,0]=4 7283 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,2,0,0,0,0|2,0,0]=4 7284 B12R1.194 CC(C)(C=O)Sc1ccccc1 Amb2412521 [0,2,0,0,0,0|2,0,0]=4 7285 B12R1.194 CC(C)(CN)Nc1ccccc1 Amb3969109 [0,2,0,0,0,0|1,0,1]=4 7286 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,2,0,0,0,0|1,0,1]=4 7287 B12R1.194 CC(O)(C=O)Cc1ccccc1 Amb27399998 [0,2,0,0,0,0|2,0,0]=4 7288 B12R1.194 CC(O)(CCl)Nc1ccccc1 Amb27406772 [0,2,0,0,0,0|1,0,1]=4 7289 B12R1.194 C[C@@](O)(C=O)Cc1ccccc1 Amb27748618 [0,2,0,0,0,0|2,0,0]=4 7290 B12R1.194 O=CC(Cl)(Cl)Cc1ccccc1 Amb28129587 [0,2,0,0,0,0|2,0,0]=4 7291 B12R1.891 CC(C)(C)CNc1ccccc1 Amb10889788 [0,2,0,0,0,0|0,0,2]=4 7292 B12R1.891 CC(C)(C)CNc1ccccc1 Amb22394914 [0,2,0,0,0,0|0,0,2]=4 7293 B12R1.891 CC(C)(F)CNc1ccccc1 Amb27857222 [0,2,0,0,0,0|0,0,2]=4 7294 B12R1.891 CC(C)(N)CNc1ccccc1 Amb18974263 [0,2,0,0,0,0|0,0,2]=4 7295 B12R1.891 CC(C)(O)CNc1ccccc1 Amb17138596 [0,2,0,0,0,0|0,0,2]=4 7296 B12R1.891 FC(F)(F)CNc1ccccc1 Amb33868633 [0,2,0,0,0,0|1,0,1]=4 7297 B12R1.891 FC(F)(F)CNc1ccccc1 Amb6706999 [0,2,0,0,0,0|1,0,1]=4 7298 B10R1.162 O=CC1C=CC=CC(=O)N1 Amb28250820 [0,0,1,1,0,0|2,0,0]=4 7299 B10R1.187 C=CCN1C(=C)C=CC1=O Amb27463700 [0,0,1,1,0,0|1,0,0]=3 7300 B10R1.187 C=CCN1C(=O)C=CC1=O Amb2581408 [0,0,1,1,0,0|2,0,0]=4 7301 B10R1.5 C=CCn1cccc1C#N Amb22971210 [0,0,1,1,0,0|1,0,1]=4 7302 B10R1.5 C=CCn1cccc1C=O Amb8426773 [0,0,1,1,0,0|1,0,0]=3 7303 B10R1.5 C=CCn1ccnc1C=O Amb28458578 [0,0,1,1,0,0|2,0,0]=4 7304 B10R1.5 C=CCn1nccc1C=O Amb24598055 [0,0,1,1,0,0|2,0,0]=4 7305 B10R1.20 C=Cc1ccccc1C=C Amb17689476 [0,0,1,1,0,0|1,0,1]=4 7306 B10R1.172 C=Cc1cccc(C=C)c1 Amb22045893 [0,0,1,1,0,0|1,0,1]=4 7307 B10R2.6 c1ccc(C2CC2)cc1 Amb2780033 [1,0,0,1,0,0|0,0,2]=4 7308 B10R2.6 c1ccc(C2CN2)cc1 Amb4114017 [1,0,0,1,0,0|1,0,1]=4 7309 B10R2.6 c1ccc(C2CO2)cc1 Amb9702825 [1,0,0,1,0,0|1,0,1]=4 7310 B10R2.6 c1ccc([C@@H]2CN2)cc1 Amb30633901 [1,0,0,1,0,0|1,0,1]=4 7311 B10R2.6 c1ccc([C@@H]2CO2)cc1 Amb8514797 [1,0,0,1,0,0|1,0,1]=4 7312 B10R2.6 c1ccc([C@H]2CN2)cc1 Amb33871555 [1,0,0,1,0,0|1,0,1]=4 7313 B10R2.6 c1ccc([C@H]2CO2)cc1 Amb8628176 [1,0,0,1,0,0|1,0,1]=4 7314 B10R2.7 C1=CC2=CCN=C2C=N1 Amb27423395 [1,0,0,1,0,0|1,0,1]=4 7315 B10R2.7 C1=CC2=CCNC2N=C1 Amb28346190 [1,0,0,1,0,0|1,0,1]=4 7316 B10R2.7 C1=CC2=NCC=C2C=N1 Amb27423430 [1,0,0,1,0,0|1,0,1]=4 7317 B10R2.7 C1=CC2NC=CN2C=C1 Amb28314239 [1,0,0,1,0,0|1,0,1]=4 7318 B10R2.7 C1=CNC2=CCSC2=C1 Amb28318140 [1,0,0,1,0,0|2,0,0]=4 7319 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [1,0,0,1,0,0|0,0,0]=2 7320 B10R2.7 C1=Cc2cnccc2C1 Amb27945600 [1,0,0,1,0,0|1,0,0]=3 7321 B10R2.7 C1=NCc2cccnc21 Amb27250387 [1,0,0,1,0,0|2,0,0]=4 7322 B10R2.7 C1=Nc2cccnc2C1 Amb24099986 [1,0,0,1,0,0|2,0,0]=4 7323 B10R2.7 C1=Nc2ccncc2C1 Amb27950602 [1,0,0,1,0,0|2,0,0]=4 7324 B10R2.7 c1cc2c(cn1)CCN2 Amb19515489 [1,0,0,1,0,0|1,0,1]=4 7325 B10R2.7 c1cc2c(cn1)CCN2 Amb22372217 [1,0,0,1,0,0|1,0,1]=4 7326 B10R2.7 c1cc2c(cn1)NCC2 Amb19516033 [1,0,0,1,0,0|1,0,1]=4 7327 B10R2.7 c1cc2c(cn1)NCC2 Amb22495003 [1,0,0,1,0,0|1,0,1]=4 7328 B10R2.7 c1cc2c(cn1)NCC2 Amb23412122 [1,0,0,1,0,0|1,0,1]=4 7329 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [1,0,0,1,0,0|2,0,0]=4 7330 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [1,0,0,1,0,0|2,0,0]=4 7331 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [1,0,0,1,0,0|2,0,0]=4 7332 B10R2.7 c1cc2occc2cn1 Amb19895064 [1,0,0,1,0,0|2,0,0]=4 7333 B10R2.7 c1cc2sccc2cn1 Amb32664779 [1,0,0,1,0,0|2,0,0]=4 7334 B10R2.7 c1cc2sccc2cn1 Amb8383970 [1,0,0,1,0,0|2,0,0]=4 7335 B10R2.7 c1ccc2[se]ccc2c1 Amb8515166 [1,0,0,1,0,0|1,0,0]=3 7336 B10R2.7 c1ccc2c(c1)CCC2 Amb6608915 [1,0,0,1,0,0|0,0,2]=4 7337 B10R2.7 c1ccc2c(c1)CCN2 Amb1869493 [1,0,0,1,0,0|0,0,1]=3 7338 B10R2.7 c1ccc2c(c1)CCO2 Amb2687295 [1,0,0,1,0,0|1,0,1]=4 7339 B10R2.7 c1ccc2c(c1)CNC2 Amb33527370 [1,0,0,1,0,0|1,0,1]=4 7340 B10R2.7 c1ccc2c(c1)CNC2 Amb33544332 [1,0,0,1,0,0|1,0,1]=4 7341 B10R2.7 c1ccc2c(c1)CNN2 Amb8386538 [1,0,0,1,0,0|1,0,1]=4 7342 B10R2.7 c1ccc2c(c1)COC2 Amb2780010 [1,0,0,1,0,0|1,0,1]=4 7343 B10R2.7 c1ccc2c(c1)CPC2 Amb27217940 [1,0,0,1,0,0|1,0,1]=4 7344 B10R2.7 c1ccc2c(c1)CSC2 Amb21962922 [1,0,0,1,0,0|1,0,1]=4 7345 B10R2.7 c1ccc2c(c1)NCO2 Amb28050014 [1,0,0,1,0,0|1,0,0]=3 7346 B10R2.7 c1ccc2c(c1)OCO2 Amb2684576 [1,0,0,1,0,0|2,0,0]=4 7347 B10R2.7 c1ccc2c(c1)SCS2 Amb26548649 [1,0,0,1,0,0|2,0,0]=4 7348 B10R2.7 c1ccc2cscc2c1 Amb24066379 [1,0,0,1,0,0|1,0,1]=4 7349 B10R2.7 c1ccc2nscc2c1 Amb25336989 [1,0,0,1,0,0|1,0,1]=4 7350 B10R2.7 c1ccc2occc2c1 Amb2725466 [1,0,0,1,0,0|1,0,0]=3 7351 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [1,0,0,1,0,0|1,0,1]=4 7352 B10R2.7 c1ccc2oncc2c1 Amb1233398 [1,0,0,1,0,0|2,0,0]=4 7353 B10R2.7 c1ccc2sccc2c1 Amb2782006 [1,0,0,1,0,0|1,0,0]=3 7354 B10R2.7 c1ccc2scnc2c1 Amb2609954 [1,0,0,1,0,0|1,0,1]=4 7355 B10R2.7 c1ccn2cccc2c1 Amb10605601 [1,0,0,1,0,0|1,0,1]=4 7356 B10R2.7 c1ccn2ccnc2c1 Amb2235938 [1,0,0,1,0,0|1,0,1]=4 7357 B10R2.7 c1ccn2ccnc2c1 Amb8629968 [1,0,0,1,0,0|1,0,1]=4 7358 B10R2.7 c1ccn2nccc2c1 Amb10604230 [1,0,0,1,0,0|1,0,1]=4 7359 B10R2.7 c1cnc2c(c1)CCN2 Amb32406061 [1,0,0,1,0,0|1,0,1]=4 7360 B10R2.7 c1cnc2c(c1)CCN2 Amb6751887 [1,0,0,1,0,0|1,0,1]=4 7361 B10R2.7 c1cnc2c(c1)NCC2 Amb18833005 [1,0,0,1,0,0|1,0,1]=4 7362 B10R2.7 c1cnc2c(c1)NCC2 Amb33069019 [1,0,0,1,0,0|1,0,1]=4 7363 B10R2.7 c1cnc2cc[se]c2c1 Amb2611539 [1,0,0,1,0,0|2,0,0]=4 7364 B10R2.7 c1cnc2ccoc2c1 Amb16185654 [1,0,0,1,0,0|2,0,0]=4 7365 B10R2.7 c1cnc2ccoc2c1 Amb30585174 [1,0,0,1,0,0|2,0,0]=4 7366 B10R2.7 c1cnc2ccsc2c1 Amb10070404 [1,0,0,1,0,0|2,0,0]=4 7367 B10R2.7 c1cnc2occc2c1 Amb21963452 [1,0,0,1,0,0|2,0,0]=4 7368 B10R2.7 c1cnc2sccc2c1 Amb10070403 [1,0,0,1,0,0|2,0,0]=4 7369 B10R2.320 BrC1Cc2ccccc21 Amb8395938 [1,0,0,1,0,0|1,0,1]=4 7370 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [1,0,0,1,0,0|0,0,2]=4 7371 B10R2.320 CC1Cc2ccccc21 Amb17778870 [1,0,0,1,0,0|0,0,2]=4 7372 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,1]=4 7373 B10R2.320 ClC1Cc2ccccc21 Amb17778800 [1,0,0,1,0,0|1,0,1]=4 7374 B10R2.320 FC1=Cc2ccccc21 Amb28053263 [1,0,0,1,0,0|1,0,1]=4 7375 B10R2.320 FC1Cc2ccccc21 Amb26861975 [1,0,0,1,0,0|1,0,1]=4 7376 B10R2.320 IC1=Cc2ccccc21 Amb28041016 [1,0,0,1,0,0|1,0,1]=4 7377 B10R2.320 IC1Cc2ccccc21 Amb27465878 [1,0,0,1,0,0|1,0,1]=4 7378 B10R2.320 NC1=Cc2ccccc21 Amb26390616 [1,0,0,1,0,0|1,0,1]=4 7379 B10R2.320 NC1Cc2ccccc21 Amb26866193 [1,0,0,1,0,0|1,0,1]=4 7380 B10R2.320 NC1Cc2ccccc21 Amb33552087 [1,0,0,1,0,0|1,0,1]=4 7381 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [1,0,0,1,0,0|1,0,0]=3 7382 B10R2.320 O=C1Nc2ccccc21 Amb28436763 [1,0,0,1,0,0|1,0,0]=3 7383 B10R2.320 OC1Cc2ccccc21 Amb17778676 [1,0,0,1,0,0|1,0,1]=4 7384 B10R2.320 [NH3+]C1Cc2ccccc21 Amb17778877 [1,0,0,1,0,0|1,0,1]=4 7385 B10R2.408 c1cc2cc(c1)CNC2 Amb28197239 [1,0,0,1,0,0|1,0,1]=4 7386 B10R2.32 O=C1CNc2ccoc21 Amb18832975 [0,0,0,1,1,0|2,0,0]=4 7387 B10R2.32 O=C1CNc2ccsc21 Amb18202968 [0,0,0,1,1,0|2,0,0]=4 7388 B10R2.32 O=C1CNc2cocc21 Amb18832972 [0,0,0,1,1,0|2,0,0]=4 7389 B10R2.32 O=C1CNc2cscc21 Amb18202966 [0,0,0,1,1,0|2,0,0]=4 7390 B10R2.32 O=C1CNc2occc21 Amb18832976 [0,0,0,1,1,0|2,0,0]=4 7391 B10R2.32 O=C1CNc2sccc21 Amb18202969 [0,0,0,1,1,0|2,0,0]=4 7392 B12R2.41 C1=CC2=CN=CNC2=CC=N1 Amb25087784 [0,0,0,1,0,1|1,0,1]=4 7393 B12R2.41 C1=CC2=CN=CNC2=CN=C1 Amb27470310 [0,0,0,1,0,1|1,0,1]=4 7394 B12R2.41 C1=CC=C2C=CNC=C2C=C1 Amb27633372 [0,0,0,1,0,1|2,0,0]=4 7395 B12R2.41 C1=CC=C2NC=CC=C2C=C1 Amb27488707 [0,0,0,1,0,1|0,0,1]=3 7396 B12R2.41 C1=CC=C2NC=NC=C2C=C1 Amb27486276 [0,0,0,1,0,1|1,0,1]=4 7397 B12R2.41 C1=CC=C2NC=NC=C2N=C1 Amb25736260 [0,0,0,1,0,1|1,0,1]=4 7398 B12R2.41 C1=CC=C2NCCCN2C=C1 Amb27881573 [0,0,0,1,0,1|0,0,2]=4 7399 B12R2.41 C1=CC=C2NCCN=C2C=C1 Amb27250935 [0,0,0,1,0,1|1,0,1]=4 7400 B12R2.41 C1=CCc2ccccc2C=C1 Amb28288749 [0,0,0,1,0,1|1,0,1]=4 7401 B12R2.41 C1=CN=C2NC=NC=C2C=C1 Amb26846990 [0,0,0,1,0,1|1,0,1]=4 7402 B12R2.41 C1=CN=CC2=CN=CNC2=C1 Amb27617259 [0,0,0,1,0,1|1,0,1]=4 7403 B12R2.41 C1=CNc2ccccc2C=C1 Amb25340361 [0,0,0,1,0,1|1,0,1]=4 7404 B12R2.41 C1=COc2ccncc2C=C1 Amb25148311 [0,0,0,1,0,1|2,0,0]=4 7405 B12R2.41 C1=COc2cnccc2C=C1 Amb27212583 [0,0,0,1,0,1|2,0,0]=4 7406 B12R2.41 C1=COc2ncccc2C=C1 Amb27160763 [0,0,0,1,0,1|0,0,2]=4 7407 B12R2.41 C1=Cc2ccccc2C=CN1 Amb27267215 [0,0,0,1,0,1|1,0,1]=4 7408 B12R2.586 O=C1CCC2=C1CC=CC=C2 Amb27599449 [0,0,0,1,0,1|2,0,0]=4 7409 B12R2.586 O=C1CCC2=CC=CCC=C12 Amb28074670 [0,0,0,1,0,1|2,0,0]=4 7410 B12R2.586 O=C1CCC2=CCC=CC=C12 Amb28386613 [0,0,0,1,0,1|2,0,0]=4 7411 B12R2.2017 C1=CC=C2C=CC=CC(=C1)C2 Amb17778329 [0,0,0,1,0,1|1,0,1]=4 7412 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,1,0,1,0,0|1,0,0]=3 7413 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,1,0,1,0,0|1,0,0]=3 7414 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [0,1,0,1,0,0|2,0,0]=4 7415 B12R2.24 Brc1ccc2c(c1)C=CCC2 Amb2383772 [0,1,0,1,0,0|1,0,0]=3 7416 B12R2.24 Brc1ccc2c(c1)C=CCO2 Amb22231978 [0,1,0,1,0,0|1,0,0]=3 7417 B12R2.24 Brc1ccc2c(c1)C=NCC2 Amb22490212 [0,1,0,1,0,0|2,0,0]=4 7418 B12R2.24 Brc1ccc2c(c1)C=NCC2 Amb27830359 [0,1,0,1,0,0|2,0,0]=4 7419 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb1090469 [0,1,0,1,0,0|0,0,2]=4 7420 B12R2.24 Brc1ccc2c(c1)CCCN2 Amb6825616 [0,1,0,1,0,0|0,0,2]=4 7421 B12R2.24 Brc1ccc2c(c1)CNC=C2 Amb27632763 [0,1,0,1,0,0|2,0,0]=4 7422 B12R2.24 Brc1ccc2c(c1)NCC=C2 Amb27635282 [0,1,0,1,0,0|0,0,0]=2 7423 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb10576260 [0,1,0,1,0,0|0,0,2]=4 7424 B12R2.24 Brc1ccc2c(c1)NCCC2 Amb2383341 [0,1,0,1,0,0|0,0,2]=4 7425 B12R2.24 Brc1ccc2c(c1)NCCN2 Amb33549267 [0,1,0,1,0,0|1,0,1]=4 7426 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb21964574 [0,1,0,1,0,0|1,0,1]=4 7427 B12R2.24 Brc1ccc2c(c1)NCCO2 Amb2383447 [0,1,0,1,0,0|1,0,1]=4 7428 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb10603903 [0,1,0,1,0,0|1,0,1]=4 7429 B12R2.24 Brc1ccc2c(c1)OCCN2 Amb19958005 [0,1,0,1,0,0|1,0,1]=4 7430 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [0,1,0,1,0,0|1,0,1]=4 7431 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [0,1,0,1,0,0|0,0,2]=4 7432 B12R2.24 Brc1ccc2cccnc2c1 Amb8397712 [0,1,0,1,0,0|0,0,2]=4 7433 B12R2.24 Brc1ccc2ccncc2c1 Amb22276934 [0,1,0,1,0,0|2,0,0]=4 7434 B12R2.24 Brc1ccc2ccncc2c1 Amb7101503 [0,1,0,1,0,0|2,0,0]=4 7435 B12R2.24 Brc1ccc2ccnnc2c1 Amb22276042 [0,1,0,1,0,0|1,0,1]=4 7436 B12R2.24 Brc1ccc2cnccc2c1 Amb33140904 [0,1,0,1,0,0|2,0,0]=4 7437 B12R2.24 Brc1ccc2cnccc2c1 Amb7101488 [0,1,0,1,0,0|2,0,0]=4 7438 B12R2.24 Brc1ccc2ncccc2c1 Amb1033034 [0,1,0,1,0,0|0,0,2]=4 7439 B12R2.24 Brc1ccc2ncccc2c1 Amb19516224 [0,1,0,1,0,0|0,0,2]=4 7440 B12R2.24 Brc1ccc2nnccc2c1 Amb20241324 [0,1,0,1,0,0|1,0,1]=4 7441 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [0,1,0,1,0,0|0,0,2]=4 7442 B12R2.24 C=C1CCc2ccccc2O1 Amb27210216 [0,1,0,1,0,0|1,0,0]=3 7443 B12R2.24 C=C1CCc2ncccc2C1 Amb35702581 [0,1,0,1,0,0|2,0,0]=4 7444 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,1,0,1,0,0|1,0,0]=3 7445 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,1,0,1,0,0|2,0,0]=4 7446 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,1,0,1,0,0|0,0,0]=2 7447 B12R2.24 CC1=Nc2ccccc2NC1 Amb27244163 [0,1,0,1,0,0|0,0,1]=3 7448 B12R2.24 CC1=Nc2ccccc2SC1 Amb10976510 [0,1,0,1,0,0|1,0,1]=4 7449 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [0,1,0,1,0,0|0,0,0]=2 7450 B12R2.24 CC1C=Cc2ncccc2O1 Amb25700391 [0,1,0,1,0,0|2,0,0]=4 7451 B12R2.24 CC1CCc2ccccc2N1 Amb2792500 [0,1,0,1,0,0|0,0,2]=4 7452 B12R2.24 CC1CCc2ccccc2N1 Amb6773975 [0,1,0,1,0,0|0,0,2]=4 7453 B12R2.24 CC1CNc2ccccc2C1 Amb5745971 [0,1,0,1,0,0|0,0,2]=4 7454 B12R2.24 CC1CNc2ccccc2N1 Amb4138615 [0,1,0,1,0,0|0,0,2]=4 7455 B12R2.24 CC1CNc2ccccc2O1 Amb17097653 [0,1,0,1,0,0|0,0,2]=4 7456 B12R2.24 CC1CNc2ccccc2O1 Amb5716804 [0,1,0,1,0,0|0,0,2]=4 7457 B12R2.24 CC1CNc2ccccc2S1 Amb9173896 [0,1,0,1,0,0|0,0,2]=4 7458 B12R2.24 CC1COc2ccccc2N1 Amb3427952 [0,1,0,1,0,0|1,0,1]=4 7459 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,1,0,1,0,0|1,0,1]=4 7460 B12R2.24 CC1Cc2ccccc2C=N1 Amb27481551 [0,1,0,1,0,0|2,0,0]=4 7461 B12R2.24 CN1CNc2ccccc2C1 Amb27858302 [0,1,0,1,0,0|1,0,1]=4 7462 B12R2.24 C[C@@H]1CNc2ccccc2C1 Amb27975495 [0,1,0,1,0,0|0,0,2]=4 7463 B12R2.24 C[C@@H]1CNc2ccccc2N1 Amb25992852 [0,1,0,1,0,0|0,0,2]=4 7464 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb8388240 [0,1,0,1,0,0|2,0,0]=4 7465 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,1,0,1,0,0|0,0,2]=4 7466 B12R2.24 C[C@H]1COc2ccccc2N1 Amb28340950 [0,1,0,1,0,0|1,0,1]=4 7467 B12R2.24 C[n+]1ccc2ccccc2c1 Amb1147460 [0,1,0,1,0,0|2,0,0]=4 7468 B12R2.24 C[n+]1ccc2ccccc2c1 Amb2609709 [0,1,0,1,0,0|2,0,0]=4 7469 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [0,1,0,1,0,0|2,0,0]=4 7470 B12R2.24 Cc1ccc2c(c1)C=CCN2 Amb18062199 [0,1,0,1,0,0|0,0,0]=2 7471 B12R2.24 Cc1ccc2c(c1)C=CCO2 Amb23441455 [0,1,0,1,0,0|1,0,0]=3 7472 B12R2.24 Cc1ccc2c(c1)C=NCC2 Amb22500760 [0,1,0,1,0,0|2,0,0]=4 7473 B12R2.24 Cc1ccc2c(c1)CCCN2 Amb22499776 [0,1,0,1,0,0|0,0,2]=4 7474 B12R2.24 Cc1ccc2c(c1)CCCN2 Amb3940149 [0,1,0,1,0,0|0,0,2]=4 7475 B12R2.24 Cc1ccc2c(c1)CCN=C2 Amb27257371 [0,1,0,1,0,0|2,0,0]=4 7476 B12R2.24 Cc1ccc2c(c1)NCC=C2 Amb18062194 [0,1,0,1,0,0|0,0,0]=2 7477 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb1089737 [0,1,0,1,0,0|0,0,2]=4 7478 B12R2.24 Cc1ccc2c(c1)NCCC2 Amb22000879 [0,1,0,1,0,0|0,0,2]=4 7479 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb22234866 [0,1,0,1,0,0|1,0,1]=4 7480 B12R2.24 Cc1ccc2c(c1)NCCO2 Amb2383451 [0,1,0,1,0,0|1,0,1]=4 7481 B12R2.24 Cc1ccc2c(c1)OCCN2 Amb17496858 [0,1,0,1,0,0|1,0,1]=4 7482 B12R2.24 Cc1ccc2c(c1)SCCN2 Amb22498966 [0,1,0,1,0,0|1,0,1]=4 7483 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [0,1,0,1,0,0|1,0,1]=4 7484 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [0,1,0,1,0,0|0,0,2]=4 7485 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [0,1,0,1,0,0|0,0,2]=4 7486 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [0,1,0,1,0,0|0,0,2]=4 7487 B12R2.24 Cc1ccc2ccncc2c1 Amb33544176 [0,1,0,1,0,0|2,0,0]=4 7488 B12R2.24 Cc1ccc2cnccc2c1 Amb10071945 [0,1,0,1,0,0|2,0,0]=4 7489 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [0,1,0,1,0,0|0,0,2]=4 7490 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [0,1,0,1,0,0|0,0,2]=4 7491 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [0,1,0,1,0,0|0,0,2]=4 7492 B12R2.24 ClC1=Nc2ccccc2SC1 Amb6761149 [0,1,0,1,0,0|2,0,0]=4 7493 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [0,1,0,1,0,0|2,0,0]=4 7494 B12R2.24 Clc1ccc2c(c1)C=CCC2 Amb2383770 [0,1,0,1,0,0|1,0,0]=3 7495 B12R2.24 Clc1ccc2c(c1)C=CCN2 Amb18062201 [0,1,0,1,0,0|0,0,0]=2 7496 B12R2.24 Clc1ccc2c(c1)C=CCO2 Amb22586260 [0,1,0,1,0,0|1,0,0]=3 7497 B12R2.24 Clc1ccc2c(c1)C=NCC2 Amb27423947 [0,1,0,1,0,0|2,0,0]=4 7498 B12R2.24 Clc1ccc2c(c1)CCC=C2 Amb28044105 [0,1,0,1,0,0|1,0,0]=3 7499 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb1133229 [0,1,0,1,0,0|0,0,2]=4 7500 B12R2.24 Clc1ccc2c(c1)CCCN2 Amb31291284 [0,1,0,1,0,0|0,0,2]=4 7501 B12R2.24 Clc1ccc2c(c1)NCC=C2 Amb18062146 [0,1,0,1,0,0|0,0,0]=2 7502 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb10576261 [0,1,0,1,0,0|0,0,2]=4 7503 B12R2.24 Clc1ccc2c(c1)NCCC2 Amb2383339 [0,1,0,1,0,0|0,0,2]=4 7504 B12R2.24 Clc1ccc2c(c1)NCCN2 Amb10605577 [0,1,0,1,0,0|1,0,1]=4 7505 B12R2.24 Clc1ccc2c(c1)NCCO2 Amb2383445 [0,1,0,1,0,0|1,0,1]=4 7506 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb2371893 [0,1,0,1,0,0|1,0,1]=4 7507 B12R2.24 Clc1ccc2c(c1)NCCS2 Amb6892829 [0,1,0,1,0,0|1,0,1]=4 7508 B12R2.24 Clc1ccc2c(c1)OCCN2 Amb2792652 [0,1,0,1,0,0|1,0,1]=4 7509 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [0,1,0,1,0,0|1,0,1]=4 7510 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [0,1,0,1,0,0|0,0,2]=4 7511 B12R2.24 Clc1ccc2cccnc2c1 Amb10069239 [0,1,0,1,0,0|0,0,2]=4 7512 B12R2.24 Clc1ccc2ccncc2c1 Amb32663641 [0,1,0,1,0,0|2,0,0]=4 7513 B12R2.24 Clc1ccc2ccncc2c1 Amb4007488 [0,1,0,1,0,0|2,0,0]=4 7514 B12R2.24 Clc1ccc2ccnnc2c1 Amb22752658 [0,1,0,1,0,0|1,0,1]=4 7515 B12R2.24 Clc1ccc2cnccc2c1 Amb10603859 [0,1,0,1,0,0|2,0,0]=4 7516 B12R2.24 Clc1ccc2ncccc2c1 Amb749944 [0,1,0,1,0,0|0,0,2]=4 7517 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [0,1,0,1,0,0|0,0,2]=4 7518 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,1,0,1,0,0|1,0,0]=3 7519 B12R2.24 Fc1ccc2c(c1)C=CCC2 Amb2383771 [0,1,0,1,0,0|1,0,0]=3 7520 B12R2.24 Fc1ccc2c(c1)C=CCN2 Amb18062200 [0,1,0,1,0,0|0,0,0]=2 7521 B12R2.24 Fc1ccc2c(c1)C=CCO2 Amb25770785 [0,1,0,1,0,0|1,0,0]=3 7522 B12R2.24 Fc1ccc2c(c1)CCCN2 Amb33526449 [0,1,0,1,0,0|0,0,2]=4 7523 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb22586301 [0,1,0,1,0,0|0,0,2]=4 7524 B12R2.24 Fc1ccc2c(c1)NCCC2 Amb2383340 [0,1,0,1,0,0|0,0,2]=4 7525 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb10603189 [0,1,0,1,0,0|1,0,1]=4 7526 B12R2.24 Fc1ccc2c(c1)NCCO2 Amb2383446 [0,1,0,1,0,0|1,0,1]=4 7527 B12R2.24 Fc1ccc2c(c1)NCCS2 Amb25713881 [0,1,0,1,0,0|1,0,1]=4 7528 B12R2.24 Fc1ccc2c(c1)OCC=C2 Amb24485991 [0,1,0,1,0,0|1,0,0]=3 7529 B12R2.24 Fc1ccc2c(c1)OCCN2 Amb10974785 [0,1,0,1,0,0|1,0,1]=4 7530 B12R2.24 Fc1ccc2c(c1)SCCN2 Amb28043545 [0,1,0,1,0,0|1,0,1]=4 7531 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [0,1,0,1,0,0|1,0,1]=4 7532 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [0,1,0,1,0,0|0,0,2]=4 7533 B12R2.24 Fc1ccc2cccnc2c1 Amb2622129 [0,1,0,1,0,0|0,0,2]=4 7534 B12R2.24 Fc1ccc2ccncc2c1 Amb19100617 [0,1,0,1,0,0|2,0,0]=4 7535 B12R2.24 Fc1ccc2cnccc2c1 Amb19958275 [0,1,0,1,0,0|2,0,0]=4 7536 B12R2.24 Fc1ccc2ncccc2c1 Amb22831215 [0,1,0,1,0,0|0,0,2]=4 7537 B12R2.24 Fc1ccc2ncccc2c1 Amb6892892 [0,1,0,1,0,0|0,0,2]=4 7538 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [0,1,0,1,0,0|0,0,2]=4 7539 B12R2.24 IC1CNc2ccccc2C1 Amb27642673 [0,1,0,1,0,0|0,0,2]=4 7540 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [0,1,0,1,0,0|2,0,0]=4 7541 B12R2.24 Ic1ccc2c(c1)C=NCC2 Amb28350451 [0,1,0,1,0,0|2,0,0]=4 7542 B12R2.24 Ic1ccc2c(c1)CCCN2 Amb7785094 [0,1,0,1,0,0|0,0,2]=4 7543 B12R2.24 Ic1ccc2c(c1)NCCC2 Amb2383346 [0,1,0,1,0,0|0,0,2]=4 7544 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [0,1,0,1,0,0|1,0,1]=4 7545 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [0,1,0,1,0,0|0,0,2]=4 7546 B12R2.24 Ic1ccc2cccnc2c1 Amb21858708 [0,1,0,1,0,0|0,0,2]=4 7547 B12R2.24 Ic1ccc2ccncc2c1 Amb22170101 [0,1,0,1,0,0|2,0,0]=4 7548 B12R2.24 Ic1ccc2cnccc2c1 Amb10070847 [0,1,0,1,0,0|2,0,0]=4 7549 B12R2.24 Ic1ccc2ncccc2c1 Amb10066910 [0,1,0,1,0,0|0,0,2]=4 7550 B12R2.24 Ic1ccc2nnccc2c1 Amb22751176 [0,1,0,1,0,0|1,0,1]=4 7551 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [0,1,0,1,0,0|0,0,2]=4 7552 B12R2.24 N=C1C=c2ccccc2=NC1 Amb24061571 [0,1,0,1,0,0|0,0,1]=3 7553 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [0,1,0,1,0,0|0,0,0]=2 7554 B12R2.24 NC1=Nc2ccccc2CC1 Amb2373583 [0,1,0,1,0,0|2,0,0]=4 7555 B12R2.24 NC1=Nc2ccccc2NN1 Amb27846252 [0,1,0,1,0,0|2,0,0]=4 7556 B12R2.24 NC1=Nc2ccccc2NS1 Amb27632409 [0,1,0,1,0,0|2,0,0]=4 7557 B12R2.24 NC1=Nc2ccccc2OC1 Amb18124903 [0,1,0,1,0,0|2,0,0]=4 7558 B12R2.24 NC1=Nc2ccccc2SC1 Amb19136101 [0,1,0,1,0,0|2,0,0]=4 7559 B12R2.24 NC1=Nc2ccccc2SC1 Amb1918677 [0,1,0,1,0,0|2,0,0]=4 7560 B12R2.24 NC1C=Cc2ccccc2C1 Amb17470378 [0,1,0,1,0,0|1,0,0]=3 7561 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|1,0,0]=3 7562 B12R2.24 NC1C=Nc2cccnc2N1 Amb28340934 [0,1,0,1,0,0|2,0,0]=4 7563 B12R2.24 NC1CNc2ccccc2C1 Amb2694925 [0,1,0,1,0,0|0,0,2]=4 7564 B12R2.24 N[C@H]1C=Cc2ccccc2C1 Amb27779859 [0,1,0,1,0,0|1,0,0]=3 7565 B12R2.24 N[C@H]1CNc2ccccc2C1 Amb27165152 [0,1,0,1,0,0|0,0,2]=4 7566 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [0,1,0,1,0,0|2,0,0]=4 7567 B12R2.24 Nc1cc2ccccc2nn1 Amb8438995 [0,1,0,1,0,0|1,0,1]=4 7568 B12R2.24 Nc1ccc2c(c1)C=CCO2 Amb23441460 [0,1,0,1,0,0|1,0,0]=3 7569 B12R2.24 Nc1ccc2c(c1)C=NCC2 Amb25145814 [0,1,0,1,0,0|2,0,0]=4 7570 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb17598307 [0,1,0,1,0,0|0,0,2]=4 7571 B12R2.24 Nc1ccc2c(c1)CCCN2 Amb6296581 [0,1,0,1,0,0|0,0,2]=4 7572 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb17598306 [0,1,0,1,0,0|0,0,2]=4 7573 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb22494228 [0,1,0,1,0,0|0,0,2]=4 7574 B12R2.24 Nc1ccc2c(c1)NCCC2 Amb8387429 [0,1,0,1,0,0|0,0,2]=4 7575 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb15695267 [0,1,0,1,0,0|1,0,1]=4 7576 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb31308216 [0,1,0,1,0,0|1,0,1]=4 7577 B12R2.24 Nc1ccc2c(c1)NCCO2 Amb8388114 [0,1,0,1,0,0|1,0,1]=4 7578 B12R2.24 Nc1ccc2c(c1)NCCS2 Amb13881705 [0,1,0,1,0,0|1,0,1]=4 7579 B12R2.24 Nc1ccc2c(c1)OCCN2 Amb8388115 [0,1,0,1,0,0|1,0,1]=4 7580 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [0,1,0,1,0,0|1,0,1]=4 7581 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [0,1,0,1,0,0|1,0,1]=4 7582 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [0,1,0,1,0,0|0,0,2]=4 7583 B12R2.24 Nc1ccc2cccnc2c1 Amb24183307 [0,1,0,1,0,0|0,0,2]=4 7584 B12R2.24 Nc1ccc2cccnc2c1 Amb31217512 [0,1,0,1,0,0|0,0,2]=4 7585 B12R2.24 Nc1ccc2cccnc2c1 Amb5717605 [0,1,0,1,0,0|0,0,2]=4 7586 B12R2.24 Nc1ccc2ccncc2c1 Amb33456346 [0,1,0,1,0,0|2,0,0]=4 7587 B12R2.24 Nc1ccc2ccncc2c1 Amb8011457 [0,1,0,1,0,0|2,0,0]=4 7588 B12R2.24 Nc1ccc2cnccc2c1 Amb33527576 [0,1,0,1,0,0|2,0,0]=4 7589 B12R2.24 Nc1ccc2cnccc2c1 Amb8010910 [0,1,0,1,0,0|2,0,0]=4 7590 B12R2.24 Nc1ccc2ncccc2c1 Amb2721017 [0,1,0,1,0,0|0,0,2]=4 7591 B12R2.24 Nc1ccc2ncccc2c1 Amb33536629 [0,1,0,1,0,0|0,0,2]=4 7592 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [0,1,0,1,0,0|0,0,2]=4 7593 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,1,0,1,0,0|2,0,0]=4 7594 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,1,0,1,0,0|1,0,1]=4 7595 B12R2.24 O=C1C=C2C=CC=CN2CC1 Amb27883588 [0,1,0,1,0,0|2,0,0]=4 7596 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,1,0,1,0,0|0,0,1]=3 7597 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,1,0,1,0,0|1,0,1]=4 7598 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,1,0,1,0,0|0,0,2]=4 7599 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [0,1,0,1,0,0|0,0,2]=4 7600 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [0,1,0,1,0,0|1,0,1]=4 7601 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [0,1,0,1,0,0|1,0,1]=4 7602 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [0,1,0,1,0,0|1,0,1]=4 7603 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [0,1,0,1,0,0|1,0,1]=4 7604 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,1,0,1,0,0|1,0,1]=4 7605 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [0,1,0,1,0,0|1,0,1]=4 7606 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [0,1,0,1,0,0|2,0,0]=4 7607 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,1,0,1,0,0|2,0,0]=4 7608 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [0,1,0,1,0,0|0,0,1]=3 7609 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [0,1,0,1,0,0|1,0,0]=3 7610 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,0]=3 7611 B12R2.24 O=C1CNc2ccncc2N1 Amb18025377 [0,1,0,1,0,0|2,0,0]=4 7612 B12R2.24 O=C1CNc2cnccc2N1 Amb18202157 [0,1,0,1,0,0|2,0,0]=4 7613 B12R2.24 O=C1CNc2ncccc2N1 Amb17948510 [0,1,0,1,0,0|2,0,0]=4 7614 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [0,1,0,1,0,0|1,0,1]=4 7615 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [0,1,0,1,0,0|2,0,0]=4 7616 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [0,1,0,1,0,0|2,0,0]=4 7617 B12R2.24 O=C1CSc2ccccc2C1 Amb22231635 [0,1,0,1,0,0|1,0,1]=4 7618 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [0,1,0,1,0,0|2,0,0]=4 7619 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [0,1,0,1,0,0|1,0,1]=4 7620 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [0,1,0,1,0,0|2,0,0]=4 7621 B12R2.24 OC1=Nc2ccccc2OC1 Amb22330533 [0,1,0,1,0,0|2,0,0]=4 7622 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [0,1,0,1,0,0|1,0,0]=3 7623 B12R2.24 OC1CCc2ccccc2N1 Amb27209313 [0,1,0,1,0,0|0,0,2]=4 7624 B12R2.24 OC1CNc2ccccc2C1 Amb33313463 [0,1,0,1,0,0|0,0,2]=4 7625 B12R2.24 OC1CNc2ccccc2C1 Amb33544228 [0,1,0,1,0,0|0,0,2]=4 7626 B12R2.24 OC1CNc2ccccc2O1 Amb24485948 [0,1,0,1,0,0|1,0,1]=4 7627 B12R2.24 O[C@@H]1CNc2ccccc2C1 Amb24426871 [0,1,0,1,0,0|0,0,2]=4 7628 B12R2.24 O[C@H]1CNc2ccccc2C1 Amb27617395 [0,1,0,1,0,0|0,0,2]=4 7629 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [0,1,0,1,0,0|2,0,0]=4 7630 B12R2.24 Oc1ccc2c(c1)C=CCC2 Amb28075248 [0,1,0,1,0,0|1,0,0]=3 7631 B12R2.24 Oc1ccc2c(c1)C=CCN2 Amb25998025 [0,1,0,1,0,0|0,0,0]=2 7632 B12R2.24 Oc1ccc2c(c1)CCCN2 Amb2697247 [0,1,0,1,0,0|0,0,2]=4 7633 B12R2.24 Oc1ccc2c(c1)NCCC2 Amb8387435 [0,1,0,1,0,0|0,0,2]=4 7634 B12R2.24 Oc1ccc2c(c1)NCCO2 Amb2698246 [0,1,0,1,0,0|1,0,1]=4 7635 B12R2.24 Oc1ccc2c(c1)NCCS2 Amb27798921 [0,1,0,1,0,0|1,0,1]=4 7636 B12R2.24 Oc1ccc2c(c1)OCC=C2 Amb27804492 [0,1,0,1,0,0|1,0,0]=3 7637 B12R2.24 Oc1ccc2c(c1)OCCN2 Amb22495584 [0,1,0,1,0,0|1,0,1]=4 7638 B12R2.24 Oc1ccc2c(c1)SCCN2 Amb27617318 [0,1,0,1,0,0|1,0,1]=4 7639 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [0,1,0,1,0,0|1,0,1]=4 7640 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [0,1,0,1,0,0|0,0,2]=4 7641 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [0,1,0,1,0,0|0,0,2]=4 7642 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [0,1,0,1,0,0|2,0,0]=4 7643 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [0,1,0,1,0,0|2,0,0]=4 7644 B12R2.24 Oc1ccc2ccnnc2c1 Amb25319976 [0,1,0,1,0,0|1,0,1]=4 7645 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [0,1,0,1,0,0|2,0,0]=4 7646 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [0,1,0,1,0,0|2,0,0]=4 7647 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [0,1,0,1,0,0|0,0,2]=4 7648 B12R2.24 Oc1ccc2nnccc2c1 Amb26871668 [0,1,0,1,0,0|1,0,1]=4 7649 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [0,1,0,1,0,0|0,0,2]=4 7650 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,1,0,1,0,0|0,0,1]=3 7651 B12R2.24 S=C1C=Cc2cccnc2N1 Amb27233738 [0,1,0,1,0,0|1,0,1]=4 7652 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,1,0,1,0,0|1,0,1]=4 7653 B12R2.24 S=C1CCc2ccccc2N1 Amb25700408 [0,1,0,1,0,0|2,0,0]=4 7654 B12R2.24 S=C1COc2ccccc2N1 Amb10070958 [0,1,0,1,0,0|2,0,0]=4 7655 B12R2.24 S=C1CSc2ccccc2N1 Amb1147064 [0,1,0,1,0,0|2,0,0]=4 7656 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [0,1,0,1,0,0|1,0,1]=4 7657 B12R2.24 Sc1ccc2c(c1)NCCO2 Amb18664649 [0,1,0,1,0,0|1,0,1]=4 7658 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [0,1,0,1,0,0|1,0,1]=4 7659 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [0,1,0,1,0,0|0,0,2]=4 7660 B12R2.24 Sc1ccc2cccnc2c1 Amb25885524 [0,1,0,1,0,0|0,0,2]=4 7661 B12R2.24 Sc1ccc2ncccc2c1 Amb25076144 [0,1,0,1,0,0|0,0,2]=4 7662 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [0,1,0,1,0,0|0,0,2]=4 7663 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [0,1,0,1,0,0|1,0,1]=4 7664 B12R2.24 [O-][N+]1=Cc2ccccc2CC1 Amb27869931 [0,1,0,1,0,0|2,0,0]=4 7665 B12R2.24 [O-][n+]1ccc2ccccc2c1 Amb2609972 [0,1,0,1,0,0|2,0,0]=4 7666 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|0,0,2]=4 7667 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|0,0,2]=4 7668 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|0,0,2]=4 7669 B12R2.132 CC1CNc2ccc(N)cc21 Amb32658292 [0,1,0,1,0,0|0,0,2]=4 7670 B12R2.132 CC1CNc2ccc(O)cc21 Amb32658310 [0,1,0,1,0,0|0,0,2]=4 7671 B12R2.132 CN1CNc2ccc(Br)cc21 Amb27947007 [0,1,0,1,0,0|1,0,1]=4 7672 B12R2.132 Cc1ccc2c(c1)C(=O)CC2 Amb2781670 [0,1,0,1,0,0|2,0,0]=4 7673 B12R2.132 Cc1ccc2c(c1)C(=O)CN2 Amb18202305 [0,1,0,1,0,0|1,0,0]=3 7674 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 Amb6683471 [0,1,0,1,0,0|2,0,0]=4 7675 B12R2.132 Cc1ccc2c(c1)C(=O)CS2 Amb18199752 [0,1,0,1,0,0|2,0,0]=4 7676 B12R2.132 Cc1ccc2c(c1)C(=O)NN2 Amb19748512 [0,1,0,1,0,0|2,0,0]=4 7677 B12R2.132 Cc1ccc2c(c1)C(=O)SN2 Amb32673864 [0,1,0,1,0,0|2,0,0]=4 7678 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|0,0,2]=4 7679 B12R2.132 Cc1ccc2c(c1)N(C)CN2 Amb28077870 [0,1,0,1,0,0|1,0,1]=4 7680 B12R2.132 NC1CNc2ccc(F)cc21 Amb27209967 [0,1,0,1,0,0|1,0,1]=4 7681 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,1,0,0|2,0,0]=4 7682 B12R2.132 Nc1ccc2c(c1)C(=O)CN2 Amb27963196 [0,1,0,1,0,0|1,0,0]=3 7683 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,1,0,0|2,0,0]=4 7684 B12R2.132 Nc1ccc2c(c1)C(=O)CS2 Amb18199702 [0,1,0,1,0,0|2,0,0]=4 7685 B12R2.132 Nc1ccc2c(c1)C(=O)NN2 Amb21959377 [0,1,0,1,0,0|2,0,0]=4 7686 B12R2.132 O=C1CCc2ccc(Br)cc21 Amb2383532 [0,1,0,1,0,0|2,0,0]=4 7687 B12R2.132 O=C1CCc2ccc(Cl)cc21 Amb2383530 [0,1,0,1,0,0|2,0,0]=4 7688 B12R2.132 O=C1CCc2ccc(F)cc21 Amb2383531 [0,1,0,1,0,0|2,0,0]=4 7689 B12R2.132 O=C1CCc2ccc(I)cc21 Amb10603865 [0,1,0,1,0,0|2,0,0]=4 7690 B12R2.132 O=C1CCc2ccc(O)cc21 Amb2612891 [0,1,0,1,0,0|2,0,0]=4 7691 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,1,0,0|1,0,0]=3 7692 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,1,0,0|1,0,0]=3 7693 B12R2.132 O=C1COc2ccc(Br)cc21 Amb33534386 [0,1,0,1,0,0|2,0,0]=4 7694 B12R2.132 O=C1COc2ccc(Cl)cc21 Amb2383540 [0,1,0,1,0,0|2,0,0]=4 7695 B12R2.132 O=C1COc2ccc(F)cc21 Amb33534384 [0,1,0,1,0,0|2,0,0]=4 7696 B12R2.132 O=C1COc2ccc(O)cc21 Amb24061522 [0,1,0,1,0,0|2,0,0]=4 7697 B12R2.132 O=C1CSc2ccc(Br)cc21 Amb18159426 [0,1,0,1,0,0|2,0,0]=4 7698 B12R2.132 O=C1CSc2ccc(Cl)cc21 Amb18822608 [0,1,0,1,0,0|2,0,0]=4 7699 B12R2.132 O=C1CSc2ccc(I)cc21 Amb27246724 [0,1,0,1,0,0|2,0,0]=4 7700 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,1,0,0|2,0,0]=4 7701 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,1,0,0|2,0,0]=4 7702 B12R2.132 O=C1ONc2ccc(Br)cc21 Amb28119155 [0,1,0,1,0,0|2,0,0]=4 7703 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,1,0,0|2,0,0]=4 7704 B12R2.132 O=C1ONc2ccc(F)cc21 Amb26974015 [0,1,0,1,0,0|2,0,0]=4 7705 B12R2.132 O=C1SNc2ccc(F)cc21 Amb32673853 [0,1,0,1,0,0|2,0,0]=4 7706 B12R2.294 Brc1ccc(NC2CC2)cc1 Amb27873756 [0,1,0,1,0,0|0,0,2]=4 7707 B12R2.294 Fc1ccc(NC2CC2)cc1 Amb18267946 [0,1,0,1,0,0|0,0,2]=4 7708 B12R2.294 Nc1ccc(NC2CC2)cc1 Amb9205211 [0,1,0,1,0,0|0,0,2]=4 7709 B12R2.294 Oc1ccc(NC2CC2)cc1 Amb27207191 [0,1,0,1,0,0|0,0,2]=4 7710 B12R2.2302 Brc1ccc(N2CCC2)cc1 Amb27257916 [0,1,0,1,0,0|0,0,2]=4 7711 B12R2.2302 Nc1ccc(N2CCC2)cc1 Amb33543789 [0,1,0,1,0,0|0,0,2]=4 7712 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,1,0,1,0,0|1,0,1]=4 7713 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 7714 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,1,0,1,0,0|1,0,1]=4 7715 B12R2.2 C1=C(c2ccccc2)NCC1 Amb17938860 [0,1,0,1,0,0|0,0,1]=3 7716 B12R2.2 C1=CC(c2ccccc2)C=C1 Amb24351108 [0,1,0,1,0,0|1,0,1]=4 7717 B12R2.2 C1=CC(c2cncnc2)NC1 Amb27260581 [0,1,0,1,0,0|2,0,0]=4 7718 B12R2.2 C1=CCC(c2ccccc2)=C1 Amb27484884 [0,1,0,1,0,0|1,0,0]=3 7719 B12R2.2 C1=CCP(c2ccccc2)C1 Amb25736369 [0,1,0,1,0,0|0,1,0]=3 7720 B12R2.2 C1=CNC(c2ccccc2)N1 Amb27617406 [0,1,0,1,0,0|1,0,1]=4 7721 B12R2.2 C1=CSC(c2ccccc2)N1 Amb27462150 [0,1,0,1,0,0|1,0,1]=4 7722 B12R2.2 C1=NCCN1c2ccccc2 Amb22527125 [0,1,0,1,0,0|0,0,1]=3 7723 B12R2.2 C1=NNC(c2ccccc2)C1 Amb2797582 [0,1,0,1,0,0|1,0,1]=4 7724 B12R2.2 C1=N[C@@H](c2ccccc2)CN1 Amb27174575 [0,1,0,1,0,0|2,0,0]=4 7725 B12R2.2 c1cc(-n2ccnc2)ccn1 Amb33528359 [0,1,0,1,0,0|1,0,1]=4 7726 B12R2.2 c1cc(-n2cncn2)ccn1 Amb25365789 [0,1,0,1,0,0|2,0,0]=4 7727 B12R2.2 c1cc(-n2cncn2)ccn1 Amb33621247 [0,1,0,1,0,0|2,0,0]=4 7728 B12R2.2 c1ccc(-c2ccco2)cc1 Amb8390025 [0,1,0,1,0,0|1,0,1]=4 7729 B12R2.2 c1ccc(-c2cccs2)cc1 Amb1215646 [0,1,0,1,0,0|1,0,1]=4 7730 B12R2.2 c1ccc(-c2ccno2)cc1 Amb2191136 [0,1,0,1,0,0|2,0,0]=4 7731 B12R2.2 c1ccc(-c2ccoc2)cc1 Amb27155517 [0,1,0,1,0,0|1,0,1]=4 7732 B12R2.2 c1ccc(-c2ccsc2)cc1 Amb2611643 [0,1,0,1,0,0|1,0,1]=4 7733 B12R2.2 c1ccc(-c2ccsn2)cc1 Amb24376714 [0,1,0,1,0,0|1,0,1]=4 7734 B12R2.2 c1ccc(-c2cnco2)cc1 Amb2725800 [0,1,0,1,0,0|2,0,0]=4 7735 B12R2.2 c1ccc(-c2cncs2)cc1 Amb15691616 [0,1,0,1,0,0|2,0,0]=4 7736 B12R2.2 c1ccc(-c2cocn2)cc1 Amb17399894 [0,1,0,1,0,0|2,0,0]=4 7737 B12R2.2 c1ccc(-c2cscn2)cc1 Amb2234625 [0,1,0,1,0,0|2,0,0]=4 7738 B12R2.2 c1ccc(-c2ncco2)cc1 Amb5494173 [0,1,0,1,0,0|2,0,0]=4 7739 B12R2.2 c1ccc(-c2nccs2)cc1 Amb13884049 [0,1,0,1,0,0|2,0,0]=4 7740 B12R2.2 c1ccc(-n2cccc2)cc1 Amb1879309 [0,1,0,1,0,0|0,0,1]=3 7741 B12R2.2 c1ccc(-n2cccc2)nc1 Amb2235020 [0,1,0,1,0,0|1,0,1]=4 7742 B12R2.2 c1ccc(-n2cccn2)cc1 Amb1157548 [0,1,0,1,0,0|0,0,1]=3 7743 B12R2.2 c1ccc(-n2cccn2)nc1 Amb8394255 [0,1,0,1,0,0|1,0,1]=4 7744 B12R2.2 c1ccc(-n2ccnc2)cc1 Amb2413300 [0,1,0,1,0,0|0,0,1]=3 7745 B12R2.2 c1ccc(-n2ccnc2)nc1 Amb2503950 [0,1,0,1,0,0|1,0,1]=4 7746 B12R2.2 c1ccc(-n2ccnn2)cc1 Amb5720633 [0,1,0,1,0,0|1,0,0]=3 7747 B12R2.2 c1ccc(-n2ccnn2)nc1 Amb25149423 [0,1,0,1,0,0|2,0,0]=4 7748 B12R2.2 c1ccc(-n2cncn2)cc1 Amb2237267 [0,1,0,1,0,0|1,0,0]=3 7749 B12R2.2 c1ccc(-n2cncn2)nc1 Amb27606711 [0,1,0,1,0,0|2,0,0]=4 7750 B12R2.2 c1ccc(-n2cnnc2)cc1 Amb6373282 [0,1,0,1,0,0|1,0,1]=4 7751 B12R2.2 c1ccc(-n2cnnn2)cc1 Amb2222042 [0,1,0,1,0,0|2,0,0]=4 7752 B12R2.2 c1ccc(-n2nccn2)cc1 Amb9804907 [0,1,0,1,0,0|1,0,0]=3 7753 B12R2.2 c1ccc(-n2ncnn2)cc1 Amb25779582 [0,1,0,1,0,0|2,0,0]=4 7754 B12R2.2 c1ccc(C2=NCCN2)cc1 Amb3940399 [0,1,0,1,0,0|1,0,1]=4 7755 B12R2.2 c1ccc(C2=NOCN2)cc1 Amb28120203 [0,1,0,1,0,0|2,0,0]=4 7756 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [0,1,0,1,0,0|0,0,2]=4 7757 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [0,1,0,1,0,0|0,0,2]=4 7758 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [0,1,0,1,0,0|1,0,1]=4 7759 B12R2.2 c1ccc(C2NCCP2)cc1 Amb27606514 [0,1,0,1,0,0|1,0,1]=4 7760 B12R2.2 c1ccc(C2NCCS2)cc1 Amb3466213 [0,1,0,1,0,0|1,0,1]=4 7761 B12R2.2 c1ccc(N2CCCC2)cc1 Amb8391946 [0,1,0,1,0,0|0,0,2]=4 7762 B12R2.2 c1ccc(N2CCNC2)cc1 Amb27785561 [0,1,0,1,0,0|0,0,2]=4 7763 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [0,1,0,1,0,0|0,0,2]=4 7764 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [0,1,0,1,0,0|0,0,2]=4 7765 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [0,1,0,1,0,0|0,0,2]=4 7766 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [0,1,0,1,0,0|0,0,2]=4 7767 B12R2.2 c1ccc([C@H]2COCN2)cc1 Amb25877610 [0,1,0,1,0,0|1,0,1]=4 7768 B12R2.2 c1ccn(-c2ccncc2)c1 Amb8439681 [0,1,0,1,0,0|1,0,1]=4 7769 B12R2.2 c1cncc(-n2cccc2)c1 Amb2236511 [0,1,0,1,0,0|1,0,1]=4 7770 B12R2.2 c1cncc(-n2cccn2)c1 Amb19515135 [0,1,0,1,0,0|1,0,1]=4 7771 B12R2.2 c1cncc(-n2ccnc2)c1 Amb2540105 [0,1,0,1,0,0|1,0,1]=4 7772 B12R2.2 c1cncc(-n2ccnc2)c1 Amb28872307 [0,1,0,1,0,0|1,0,1]=4 7773 B12R2.2 c1cncc(-n2ccnn2)c1 Amb24085121 [0,1,0,1,0,0|2,0,0]=4 7774 B12R2.2 c1cnn(-c2ccncc2)c1 Amb33531805 [0,1,0,1,0,0|1,0,1]=4 7775 B12R2.22 C=C1CC(c2ccccc2)C1 Amb35681149 [0,1,0,1,0,0|1,0,0]=3 7776 B12R2.22 NC1CN(c2ccccc2)C1 Amb23598844 [0,1,0,1,0,0|0,0,2]=4 7777 B12R2.22 NC1CN(c2ccccc2)C1 Amb30869768 [0,1,0,1,0,0|0,0,2]=4 7778 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [0,1,0,1,0,0|1,0,1]=4 7779 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [0,1,0,1,0,0|2,0,0]=4 7780 B12R2.22 OC1CN(c2ccccc2)C1 Amb23598700 [0,1,0,1,0,0|0,0,2]=4 7781 B12R2.22 S=C1CC(c2ccccc2)N1 Amb28182509 [0,1,0,1,0,0|2,0,0]=4 7782 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [0,1,0,1,0,0|1,0,0]=3 7783 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|1,0,1]=4 7784 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,1,0,1,0,0|1,0,1]=4 7785 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,1,0,1,0,0|1,0,1]=4 7786 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|1,0,1]=4 7787 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,1,0,1,0,0|2,0,0]=4 7788 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,1,0,1,0,0|1,0,1]=4 7789 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,1,0,1,0,0|1,0,1]=4 7790 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,1,0,1,0,0|2,0,0]=4 7791 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,1,0,1,0,0|1,0,0]=3 7792 B12R2.1081 BrC1CCNc2ccccc21 Amb26657292 [0,1,0,1,0,0|0,0,2]=4 7793 B12R2.1081 Brc1cccc2c1CCC=C2 Amb22500941 [0,1,0,1,0,0|1,0,0]=3 7794 B12R2.1081 Brc1cccc2c1CCCN2 Amb16231479 [0,1,0,1,0,0|0,0,2]=4 7795 B12R2.1081 Brc1cccc2c1CCCN2 Amb2383331 [0,1,0,1,0,0|0,0,2]=4 7796 B12R2.1081 Brc1cccc2c1CCN=C2 Amb26071625 [0,1,0,1,0,0|2,0,0]=4 7797 B12R2.1081 Brc1cccc2c1NCCC2 Amb1134947 [0,1,0,1,0,0|0,0,2]=4 7798 B12R2.1081 Brc1cccc2c1NCCC2 Amb13951989 [0,1,0,1,0,0|0,0,2]=4 7799 B12R2.1081 Brc1cccc2c1NCCO2 Amb28075686 [0,1,0,1,0,0|1,0,1]=4 7800 B12R2.1081 Brc1cccc2c1NCCS2 Amb22491567 [0,1,0,1,0,0|1,0,1]=4 7801 B12R2.1081 Brc1cccc2c1OCCN2 Amb21964594 [0,1,0,1,0,0|1,0,1]=4 7802 B12R2.1081 Brc1cccc2c1OCCN2 Amb2383437 [0,1,0,1,0,0|1,0,1]=4 7803 B12R2.1081 Brc1cccc2c1SCCN2 Amb25715188 [0,1,0,1,0,0|1,0,1]=4 7804 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [0,1,0,1,0,0|1,0,1]=4 7805 B12R2.1081 Brc1cccc2cccnc12 Amb2234896 [0,1,0,1,0,0|0,0,2]=4 7806 B12R2.1081 Brc1cccc2ccncc12 Amb24184018 [0,1,0,1,0,0|2,0,0]=4 7807 B12R2.1081 Brc1cccc2ccncc12 Amb5638109 [0,1,0,1,0,0|2,0,0]=4 7808 B12R2.1081 Brc1cccc2cnccc12 Amb6364737 [0,1,0,1,0,0|2,0,0]=4 7809 B12R2.1081 Brc1cccc2ncccc12 Amb22276929 [0,1,0,1,0,0|0,0,2]=4 7810 B12R2.1081 Brc1cccc2ncccc12 Amb2447603 [0,1,0,1,0,0|0,0,2]=4 7811 B12R2.1081 Brc1ccnc2ccccc12 Amb2447564 [0,1,0,1,0,0|0,0,2]=4 7812 B12R2.1081 Brc1cncc2ccccc12 Amb6364997 [0,1,0,1,0,0|2,0,0]=4 7813 B12R2.1081 Brc1cnnc2ccccc12 Amb33548752 [0,1,0,1,0,0|1,0,1]=4 7814 B12R2.1081 Brc1nccc2ccccc12 Amb2609661 [0,1,0,1,0,0|2,0,0]=4 7815 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [0,1,0,1,0,0|0,0,1]=3 7816 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,1,0,1,0,0|1,0,0]=3 7817 B12R2.1081 C=C1CCCc2cccnc21 Amb33164017 [0,1,0,1,0,0|2,0,0]=4 7818 B12R2.1081 C=C1CCNc2ccccc21 Amb27596012 [0,1,0,1,0,0|0,0,0]=2 7819 B12R2.1081 C=C1CCOc2ccccc21 Amb26360090 [0,1,0,1,0,0|1,0,0]=3 7820 B12R2.1081 C=C1NC=Cc2ccccc21 Amb27186378 [0,1,0,1,0,0|1,0,1]=4 7821 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,1,0,1,0,0|1,0,0]=3 7822 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|1,0,0]=3 7823 B12R2.1081 CC1=NCCc2ccccc21 Amb17940779 [0,1,0,1,0,0|1,0,1]=4 7824 B12R2.1081 CC1=NCCc2ccccc21 Amb33446974 [0,1,0,1,0,0|1,0,1]=4 7825 B12R2.1081 CC1=NCCc2ccccc21 Amb8517423 [0,1,0,1,0,0|1,0,1]=4 7826 B12R2.1081 CC1CCNc2ccccc21 Amb7969716 [0,1,0,1,0,0|0,0,2]=4 7827 B12R2.1081 CC1CCNc2ccccc21 Amb9782720 [0,1,0,1,0,0|0,0,2]=4 7828 B12R2.1081 CC1CNCc2ccccc21 Amb17399906 [0,1,0,1,0,0|0,0,2]=4 7829 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|0,0,2]=4 7830 B12R2.1081 CC1NC=Cc2ccccc21 Amb28424328 [0,1,0,1,0,0|2,0,0]=4 7831 B12R2.1081 CC1OCNc2ccccc21 Amb28118766 [0,1,0,1,0,0|0,0,2]=4 7832 B12R2.1081 CN1CC=Cc2ccccc21 Amb26960927 [0,1,0,1,0,0|0,0,0]=2 7833 B12R2.1081 CN1CCCc2ccccc21 Amb15692645 [0,1,0,1,0,0|0,0,2]=4 7834 B12R2.1081 CN1CCNc2ccccc21 Amb19957895 [0,1,0,1,0,0|0,0,2]=4 7835 B12R2.1081 CN1CCNc2ccccc21 Amb2383679 [0,1,0,1,0,0|0,0,2]=4 7836 B12R2.1081 CN1CCOc2ccccc21 Amb10569245 [0,1,0,1,0,0|1,0,1]=4 7837 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb30594264 [0,1,0,1,0,0|0,0,2]=4 7838 B12R2.1081 C[n+]1cccc2ccccc21 Amb2602430 [0,1,0,1,0,0|0,0,2]=4 7839 B12R2.1081 Cc1cccc2c1CCCN2 Amb19957907 [0,1,0,1,0,0|0,0,2]=4 7840 B12R2.1081 Cc1cccc2c1CCCN2 Amb2383335 [0,1,0,1,0,0|0,0,2]=4 7841 B12R2.1081 Cc1cccc2c1NCC=C2 Amb18062161 [0,1,0,1,0,0|0,0,0]=2 7842 B12R2.1081 Cc1cccc2c1NCCC2 Amb1107915 [0,1,0,1,0,0|0,0,2]=4 7843 B12R2.1081 Cc1cccc2c1NCCN2 Amb26362323 [0,1,0,1,0,0|1,0,1]=4 7844 B12R2.1081 Cc1cccc2c1NCCO2 Amb26399115 [0,1,0,1,0,0|1,0,1]=4 7845 B12R2.1081 Cc1cccc2c1NCCS2 Amb27794442 [0,1,0,1,0,0|1,0,1]=4 7846 B12R2.1081 Cc1cccc2c1OCCN2 Amb2383441 [0,1,0,1,0,0|1,0,1]=4 7847 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [0,1,0,1,0,0|1,0,1]=4 7848 B12R2.1081 Cc1cccc2cccnc12 Amb1229978 [0,1,0,1,0,0|0,0,2]=4 7849 B12R2.1081 Cc1cccc2ccncc12 Amb10070397 [0,1,0,1,0,0|2,0,0]=4 7850 B12R2.1081 Cc1cccc2cnccc12 Amb2447327 [0,1,0,1,0,0|2,0,0]=4 7851 B12R2.1081 Cc1cccc2ncccc12 Amb2447286 [0,1,0,1,0,0|0,0,2]=4 7852 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [0,1,0,1,0,0|0,0,2]=4 7853 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [0,1,0,1,0,0|2,0,0]=4 7854 B12R2.1081 Cc1cnnc2ccccc12 Amb21964128 [0,1,0,1,0,0|1,0,1]=4 7855 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,1,0,1,0,0|2,0,0]=4 7856 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,1,0,1,0,0|1,0,0]=3 7857 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,1,0,1,0,0|0,0,2]=4 7858 B12R2.1081 ClN1C=CNc2ccccc21 Amb27823291 [0,1,0,1,0,0|1,0,1]=4 7859 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,1,0,1,0,0|1,0,0]=3 7860 B12R2.1081 Clc1cccc2c1CCCN2 Amb19957902 [0,1,0,1,0,0|0,0,2]=4 7861 B12R2.1081 Clc1cccc2c1CCCN2 Amb2383329 [0,1,0,1,0,0|0,0,2]=4 7862 B12R2.1081 Clc1cccc2c1NCC=C2 Amb18062185 [0,1,0,1,0,0|0,0,0]=2 7863 B12R2.1081 Clc1cccc2c1NCCC2 Amb1140461 [0,1,0,1,0,0|0,0,2]=4 7864 B12R2.1081 Clc1cccc2c1NCCC2 Amb19373263 [0,1,0,1,0,0|0,0,2]=4 7865 B12R2.1081 Clc1cccc2c1NCCO2 Amb25991021 [0,1,0,1,0,0|1,0,1]=4 7866 B12R2.1081 Clc1cccc2c1OCC=C2 Amb22586336 [0,1,0,1,0,0|1,0,0]=3 7867 B12R2.1081 Clc1cccc2c1OCCN2 Amb2383435 [0,1,0,1,0,0|1,0,1]=4 7868 B12R2.1081 Clc1cccc2cccnc12 Amb6365653 [0,1,0,1,0,0|0,0,2]=4 7869 B12R2.1081 Clc1cccc2ccncc12 Amb10067628 [0,1,0,1,0,0|2,0,0]=4 7870 B12R2.1081 Clc1cccc2ccncc12 Amb32663564 [0,1,0,1,0,0|2,0,0]=4 7871 B12R2.1081 Clc1cccc2cnccc12 Amb10067233 [0,1,0,1,0,0|2,0,0]=4 7872 B12R2.1081 Clc1cccc2cnccc12 Amb33421960 [0,1,0,1,0,0|2,0,0]=4 7873 B12R2.1081 Clc1cccc2ncccc12 Amb2369016 [0,1,0,1,0,0|0,0,2]=4 7874 B12R2.1081 Clc1ccnc2ccccc12 Amb1033000 [0,1,0,1,0,0|0,0,2]=4 7875 B12R2.1081 Clc1cncc2ccccc12 Amb8438946 [0,1,0,1,0,0|2,0,0]=4 7876 B12R2.1081 Clc1cnnc2ccccc12 Amb28990887 [0,1,0,1,0,0|1,0,1]=4 7877 B12R2.1081 Clc1cnnc2ccccc12 Amb8394534 [0,1,0,1,0,0|1,0,1]=4 7878 B12R2.1081 Clc1nccc2ccccc12 Amb2196515 [0,1,0,1,0,0|2,0,0]=4 7879 B12R2.1081 FC1=CCCc2ccccc21 Amb27482090 [0,1,0,1,0,0|1,0,0]=3 7880 B12R2.1081 FC1CCNc2ccccc21 Amb28079527 [0,1,0,1,0,0|0,0,2]=4 7881 B12R2.1081 FC1CNCc2ccccc21 Amb10841578 [0,1,0,1,0,0|1,0,1]=4 7882 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,1,0,1,0,0|1,0,0]=3 7883 B12R2.1081 Fc1cccc2c1CCCN2 Amb19958505 [0,1,0,1,0,0|0,0,2]=4 7884 B12R2.1081 Fc1cccc2c1CCCN2 Amb2383330 [0,1,0,1,0,0|0,0,2]=4 7885 B12R2.1081 Fc1cccc2c1NCC=C2 Amb18062053 [0,1,0,1,0,0|0,0,0]=2 7886 B12R2.1081 Fc1cccc2c1NCCC2 Amb1108527 [0,1,0,1,0,0|0,0,2]=4 7887 B12R2.1081 Fc1cccc2c1NCCC2 Amb13951184 [0,1,0,1,0,0|0,0,2]=4 7888 B12R2.1081 Fc1cccc2c1NCCN2 Amb27780389 [0,1,0,1,0,0|1,0,1]=4 7889 B12R2.1081 Fc1cccc2c1NCCO2 Amb18831161 [0,1,0,1,0,0|1,0,1]=4 7890 B12R2.1081 Fc1cccc2c1OCC=C2 Amb22586337 [0,1,0,1,0,0|1,0,0]=3 7891 B12R2.1081 Fc1cccc2c1OCCN2 Amb2383436 [0,1,0,1,0,0|1,0,1]=4 7892 B12R2.1081 Fc1cccc2c1SCCN2 Amb27849615 [0,1,0,1,0,0|1,0,1]=4 7893 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [0,1,0,1,0,0|1,0,1]=4 7894 B12R2.1081 Fc1cccc2cccnc12 Amb22235972 [0,1,0,1,0,0|0,0,2]=4 7895 B12R2.1081 Fc1cccc2cccnc12 Amb532235 [0,1,0,1,0,0|0,0,2]=4 7896 B12R2.1081 Fc1cccc2ccncc12 Amb10839616 [0,1,0,1,0,0|2,0,0]=4 7897 B12R2.1081 Fc1cccc2cnccc12 Amb10573349 [0,1,0,1,0,0|2,0,0]=4 7898 B12R2.1081 Fc1cccc2ncccc12 Amb5494023 [0,1,0,1,0,0|0,0,2]=4 7899 B12R2.1081 Fc1ccnc2ccccc12 Amb10067580 [0,1,0,1,0,0|0,0,2]=4 7900 B12R2.1081 Fc1cncc2ccccc12 Amb22396493 [0,1,0,1,0,0|2,0,0]=4 7901 B12R2.1081 Fc1cncc2ccccc12 Amb6296546 [0,1,0,1,0,0|2,0,0]=4 7902 B12R2.1081 Fc1nccc2ccccc12 Amb24673352 [0,1,0,1,0,0|2,0,0]=4 7903 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,1,0,1,0,0|0,0,2]=4 7904 B12R2.1081 Ic1cccc2c1OCCN2 Amb2383443 [0,1,0,1,0,0|1,0,1]=4 7905 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [0,1,0,1,0,0|1,0,1]=4 7906 B12R2.1081 Ic1cccc2cccnc12 Amb8839225 [0,1,0,1,0,0|0,0,2]=4 7907 B12R2.1081 Ic1cccc2ccncc12 Amb22495459 [0,1,0,1,0,0|2,0,0]=4 7908 B12R2.1081 Ic1cccc2cnccc12 Amb9675239 [0,1,0,1,0,0|2,0,0]=4 7909 B12R2.1081 Ic1cccc2ncccc12 Amb33528870 [0,1,0,1,0,0|0,0,2]=4 7910 B12R2.1081 Ic1ccnc2ccccc12 Amb5492738 [0,1,0,1,0,0|0,0,2]=4 7911 B12R2.1081 Ic1cncc2ccccc12 Amb2609665 [0,1,0,1,0,0|2,0,0]=4 7912 B12R2.1081 Ic1nccc2ccccc12 Amb2609664 [0,1,0,1,0,0|2,0,0]=4 7913 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,1,0,1,0,0|0,0,2]=4 7914 B12R2.1081 NC1CCNc2ccccc21 Amb2700188 [0,1,0,1,0,0|0,0,2]=4 7915 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,1,0,1,0,0|1,0,1]=4 7916 B12R2.1081 NN1CCCc2ccccc21 Amb33172813 [0,1,0,1,0,0|0,0,2]=4 7917 B12R2.1081 NN1CCCc2ccccc21 Amb836811 [0,1,0,1,0,0|0,0,2]=4 7918 B12R2.1081 NN1CCOc2ccccc21 Amb18125145 [0,1,0,1,0,0|1,0,1]=4 7919 B12R2.1081 N[C@@H]1CCNc2ccccc21 Amb26012444 [0,1,0,1,0,0|0,0,2]=4 7920 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,1,0,1,0,0|0,0,2]=4 7921 B12R2.1081 N[n+]1cccc2ccccc21 Amb2613573 [0,1,0,1,0,0|0,0,2]=4 7922 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|1,0,0]=3 7923 B12R2.1081 Nc1cccc2c1C=CNN2 Amb27212993 [0,1,0,1,0,0|1,0,0]=3 7924 B12R2.1081 Nc1cccc2c1CCCN2 Amb33543645 [0,1,0,1,0,0|0,0,2]=4 7925 B12R2.1081 Nc1cccc2c1NCC=C2 Amb28340933 [0,1,0,1,0,0|0,0,0]=2 7926 B12R2.1081 Nc1cccc2c1NCCC2 Amb2606143 [0,1,0,1,0,0|0,0,2]=4 7927 B12R2.1081 Nc1cccc2c1NCCN2 Amb27404509 [0,1,0,1,0,0|1,0,1]=4 7928 B12R2.1081 Nc1cccc2c1NCCO2 Amb16191975 [0,1,0,1,0,0|1,0,1]=4 7929 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|1,0,0]=3 7930 B12R2.1081 Nc1cccc2c1OCCN2 Amb10067597 [0,1,0,1,0,0|1,0,1]=4 7931 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [0,1,0,1,0,0|1,0,1]=4 7932 B12R2.1081 Nc1cccc2cccnc12 Amb1056132 [0,1,0,1,0,0|0,0,2]=4 7933 B12R2.1081 Nc1cccc2ccncc12 Amb8009841 [0,1,0,1,0,0|2,0,0]=4 7934 B12R2.1081 Nc1cccc2cnccc12 Amb1157144 [0,1,0,1,0,0|2,0,0]=4 7935 B12R2.1081 Nc1cccc2cnccc12 Amb6383220 [0,1,0,1,0,0|2,0,0]=4 7936 B12R2.1081 Nc1cccc2ncccc12 Amb1151787 [0,1,0,1,0,0|0,0,2]=4 7937 B12R2.1081 Nc1ccnc2ccccc12 Amb1102727 [0,1,0,1,0,0|0,0,2]=4 7938 B12R2.1081 Nc1ccnc2ccccc12 Amb7969523 [0,1,0,1,0,0|0,0,2]=4 7939 B12R2.1081 Nc1cncc2ccccc12 Amb22276925 [0,1,0,1,0,0|2,0,0]=4 7940 B12R2.1081 Nc1cncc2ccccc12 Amb2610662 [0,1,0,1,0,0|2,0,0]=4 7941 B12R2.1081 Nc1cnnc2ccccc12 Amb4408462 [0,1,0,1,0,0|1,0,1]=4 7942 B12R2.1081 Nc1nccc2ccccc12 Amb2609973 [0,1,0,1,0,0|2,0,0]=4 7943 B12R2.1081 Nc1nccc2ccccc12 Amb32663180 [0,1,0,1,0,0|2,0,0]=4 7944 B12R2.1081 O=C1C=CC=C2SC=CC=C12 Amb28253344 [0,1,0,1,0,0|1,0,1]=4 7945 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [0,1,0,1,0,0|1,0,1]=4 7946 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,1,0,1,0,0|0,0,1]=3 7947 B12R2.1081 O=C1C=CNc2cccnc21 Amb22489921 [0,1,0,1,0,0|1,0,1]=4 7948 B12R2.1081 O=C1C=CNc2ccncc21 Amb20623103 [0,1,0,1,0,0|1,0,1]=4 7949 B12R2.1081 O=C1C=CNc2cnccc21 Amb22055906 [0,1,0,1,0,0|1,0,1]=4 7950 B12R2.1081 O=C1C=CNc2ncccc21 Amb22490480 [0,1,0,1,0,0|1,0,1]=4 7951 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,1,0,1,0,0|1,0,1]=4 7952 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,1,0,1,0,0|1,0,1]=4 7953 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,1,0,1,0,0|1,0,0]=3 7954 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,1,0,1,0,0|1,0,1]=4 7955 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,1,0,1,0,0|1,0,1]=4 7956 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,1,0,1,0,0|0,0,1]=3 7957 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,1,0,1,0,0|0,0,1]=3 7958 B12R2.1081 O=C1CCNc2cccnc21 Amb27954552 [0,1,0,1,0,0|1,0,1]=4 7959 B12R2.1081 O=C1CCNc2ncccc21 Amb16233465 [0,1,0,1,0,0|1,0,1]=4 7960 B12R2.1081 O=C1CCNc2ncccc21 Amb33532494 [0,1,0,1,0,0|1,0,1]=4 7961 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,1,0,1,0,0|1,0,1]=4 7962 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,1,0,1,0,0|1,0,1]=4 7963 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|1,0,0]=3 7964 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,1,0,1,0,0|1,0,0]=3 7965 B12R2.1081 O=C1CNCc2ncccc21 Amb18202251 [0,1,0,1,0,0|2,0,0]=4 7966 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,1,0,1,0,0|1,0,0]=3 7967 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,1,0,1,0,0|1,0,0]=3 7968 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,1,0,1,0,0|2,0,0]=4 7969 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,1,0,1,0,0|2,0,0]=4 7970 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,1,0,1,0,0|2,0,0]=4 7971 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,1,0,1,0,0|2,0,0]=4 7972 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,1,0,1,0,0|2,0,0]=4 7973 B12R2.1081 O=C1NCNc2ccncc21 Amb24419756 [0,1,0,1,0,0|2,0,0]=4 7974 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,1,0,1,0,0|2,0,0]=4 7975 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,1,0,1,0,0|2,0,0]=4 7976 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,1,0,1,0,0|2,0,0]=4 7977 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,1,0,1,0,0|2,0,0]=4 7978 B12R2.1081 O=C1OCCc2ccccc21 Amb16232507 [0,1,0,1,0,0|2,0,0]=4 7979 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,1,0,1,0,0|2,0,0]=4 7980 B12R2.1081 O=S1CCNc2ccccc21 Amb1106281 [0,1,0,1,0,0|1,0,1]=4 7981 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|1,0,0]=3 7982 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,1,0,1,0,0|2,0,0]=4 7983 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [0,1,0,1,0,0|0,0,2]=4 7984 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,1,0,1,0,0|0,0,2]=4 7985 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [0,1,0,1,0,0|1,0,1]=4 7986 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,1,0,1,0,0|1,0,1]=4 7987 B12R2.1081 ON1CC=Cc2ccccc21 Amb26600953 [0,1,0,1,0,0|0,0,0]=2 7988 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [0,1,0,1,0,0|1,0,0]=3 7989 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [0,1,0,1,0,0|1,0,0]=3 7990 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,1,0,1,0,0|1,0,1]=4 7991 B12R2.1081 Oc1cccc2c1C=CCC2 Amb18644265 [0,1,0,1,0,0|1,0,0]=3 7992 B12R2.1081 Oc1cccc2c1CCCN2 Amb18124994 [0,1,0,1,0,0|0,0,2]=4 7993 B12R2.1081 Oc1cccc2c1NCCC2 Amb1057683 [0,1,0,1,0,0|0,0,2]=4 7994 B12R2.1081 Oc1cccc2c1OCC=C2 Amb27786332 [0,1,0,1,0,0|1,0,0]=3 7995 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [0,1,0,1,0,0|1,0,1]=4 7996 B12R2.1081 Oc1cccc2cccnc12 Amb10843705 [0,1,0,1,0,0|0,0,2]=4 7997 B12R2.1081 Oc1cccc2cccnc12 Amb1151957 [0,1,0,1,0,0|0,0,2]=4 7998 B12R2.1081 Oc1cccc2cccnc12 Amb22167517 [0,1,0,1,0,0|0,0,2]=4 7999 B12R2.1081 Oc1cccc2cccnc12 Amb8386462 [0,1,0,1,0,0|0,0,2]=4 8000 B12R2.1081 Oc1cccc2ccncc12 Amb8439357 [0,1,0,1,0,0|2,0,0]=4 8001 B12R2.1081 Oc1cccc2ccnnc12 Amb24601328 [0,1,0,1,0,0|1,0,1]=4 8002 B12R2.1081 Oc1cccc2cnccc12 Amb534916 [0,1,0,1,0,0|2,0,0]=4 8003 B12R2.1081 Oc1cccc2ncccc12 Amb2613004 [0,1,0,1,0,0|0,0,2]=4 8004 B12R2.1081 Oc1ccnc2ccccc12 Amb2719646 [0,1,0,1,0,0|0,0,2]=4 8005 B12R2.1081 Oc1cncc2ccccc12 Amb10553148 [0,1,0,1,0,0|2,0,0]=4 8006 B12R2.1081 Oc1cncc2ccccc12 Amb21964404 [0,1,0,1,0,0|2,0,0]=4 8007 B12R2.1081 Oc1cnnc2ccccc12 Amb2371264 [0,1,0,1,0,0|1,0,1]=4 8008 B12R2.1081 Oc1cnnc2ccccc12 Amb482495 [0,1,0,1,0,0|1,0,1]=4 8009 B12R2.1081 Oc1nccc2ccccc12 Amb2610663 [0,1,0,1,0,0|2,0,0]=4 8010 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [0,1,0,1,0,0|0,0,1]=3 8011 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,1,0,1,0,0|1,0,0]=3 8012 B12R2.1081 S=C1NCCc2ccccc21 Amb2725056 [0,1,0,1,0,0|2,0,0]=4 8013 B12R2.1081 SC1CCNc2ccccc21 Amb26423876 [0,1,0,1,0,0|0,0,2]=4 8014 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [0,1,0,1,0,0|1,0,1]=4 8015 B12R2.1081 Sc1cccc2cccnc12 Amb8629206 [0,1,0,1,0,0|0,0,2]=4 8016 B12R2.1081 Sc1cccc2cnccc12 Amb25886341 [0,1,0,1,0,0|2,0,0]=4 8017 B12R2.1081 Sc1ccnc2ccccc12 Amb10603792 [0,1,0,1,0,0|0,0,2]=4 8018 B12R2.1081 Sc1cnnc2ccccc12 Amb2371342 [0,1,0,1,0,0|1,0,1]=4 8019 B12R2.1081 Sc1nccc2ccccc12 Amb5716285 [0,1,0,1,0,0|2,0,0]=4 8020 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [0,1,0,1,0,0|1,0,1]=4 8021 B12R2.1081 [O-][n+]1cccc2ccccc21 Amb2609905 [0,1,0,1,0,0|0,0,2]=4 8022 B12R2.1081 [O-][n+]1nccc2ccccc21 Amb28312887 [0,1,0,1,0,0|1,0,1]=4 8023 B12R2.1081 [O-]c1cccc2cccnc12 Amb22052464 [0,1,0,1,0,0|0,0,2]=4 8024 B12R2.1081 [O-]c1cccc2cccnc12 Amb22057291 [0,1,0,1,0,0|0,0,2]=4 8025 B12R2.1081 [S-]c1cccc2ccc[nH+]c12 Amb4014285 [0,1,0,1,0,0|0,0,2]=4 8026 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [0,1,0,1,0,0|1,0,1]=4 8027 B12R2.1081 [S-]c1cccc2cccnc12 Amb483273 [0,1,0,1,0,0|0,0,2]=4 8028 B12R2.2028 C=C1CC(O)c2ccncc21 Amb25863928 [0,1,0,1,0,0|2,0,0]=4 8029 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,1,0,1,0,0|2,0,0]=4 8030 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,1,0,0|2,0,0]=4 8031 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,1,0,1,0,0|2,0,0]=4 8032 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [0,1,0,1,0,0|0,0,2]=4 8033 B12R2.2028 CN1CC(N)c2ccccc21 Amb26601033 [0,1,0,1,0,0|1,0,1]=4 8034 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,1,0,1,0,0|2,0,0]=4 8035 B12R2.2028 CN1NC(=S)c2ccccc21 Amb26952885 [0,1,0,1,0,0|2,0,0]=4 8036 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,1,0,1,0,0|2,0,0]=4 8037 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|2,0,0]=4 8038 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|2,0,0]=4 8039 B12R2.2028 Cc1cn(Br)c2ccccc12 Amb28286948 [0,1,0,1,0,0|0,0,2]=4 8040 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,1,0,1,0,0|0,0,2]=4 8041 B12R2.2028 Cc1nn(C)c2ccccc12 Amb22491231 [0,1,0,1,0,0|1,0,1]=4 8042 B12R2.2028 Cc1nn(N)c2ccccc12 Amb27859143 [0,1,0,1,0,0|1,0,1]=4 8043 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,1,0,1,0,0|1,0,1]=4 8044 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,1,0,1,0,0|1,0,1]=4 8045 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,1,0,1,0,0|1,0,1]=4 8046 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,1,0,1,0,0|1,0,1]=4 8047 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,1,0,1,0,0|1,0,1]=4 8048 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,1,0,1,0,0|1,0,1]=4 8049 B12R2.2028 Cn1nc(Br)c2ccccc21 Amb10604243 [0,1,0,1,0,0|2,0,0]=4 8050 B12R2.2028 Cn1nc(I)c2ccccc21 Amb10608014 [0,1,0,1,0,0|2,0,0]=4 8051 B12R2.2028 Cn1nc(N)c2ccccc21 Amb9677805 [0,1,0,1,0,0|2,0,0]=4 8052 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,1,0,0|2,0,0]=4 8053 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|2,0,0]=4 8054 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,1,0,0|2,0,0]=4 8055 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [0,1,0,1,0,0|2,0,0]=4 8056 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,1,0,1,0,0|2,0,0]=4 8057 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,1,0,1,0,0|2,0,0]=4 8058 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,1,0,1,0,0|2,0,0]=4 8059 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,1,0,1,0,0|2,0,0]=4 8060 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,1,0,1,0,0|2,0,0]=4 8061 B12R2.2075 CN(c1ccccc1)C2CC2 Amb26509274 [0,1,0,1,0,0|0,0,2]=4 8062 B12R2.2075 O=C(c1ccccc1)C2C=N2 Amb28122438 [0,1,0,1,0,0|2,0,0]=4 8063 B12R2.32 C=CC1Cc2ccccc2C1 Amb33342617 [0,1,0,1,0,0|1,0,0]=3 8064 B12R2.32 C=CC1Cc2ccccc2N1 Amb28410346 [0,1,0,1,0,0|0,0,0]=2 8065 B12R2.32 C=Cc1cc2ccccc2s1 Amb28186077 [0,1,0,1,0,0|1,0,1]=4 8066 B12R2.32 C=Cc1nc2ccccc2o1 Amb24602813 [0,1,0,1,0,0|0,0,2]=4 8067 B12R2.32 C=Cc1nc2ccccc2s1 Amb24085073 [0,1,0,1,0,0|0,0,2]=4 8068 B12R2.32 CCC1Cc2ccccc2N1 Amb27238349 [0,1,0,1,0,0|0,0,2]=4 8069 B12R2.32 CCC1Nc2ccccc2O1 Amb28046870 [0,1,0,1,0,0|0,0,2]=4 8070 B12R2.32 NC[C@@H]1Cc2ccccc2N1 Amb27606056 [0,1,0,1,0,0|1,0,1]=4 8071 B12R2.32 NNC1Cc2ccccc2N1 Amb27641029 [0,1,0,1,0,0|2,0,0]=4 8072 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [0,1,0,1,0,0|2,0,0]=4 8073 B12R2.32 O=CC1Cc2ccccc2N1 Amb27232668 [0,1,0,1,0,0|1,0,0]=3 8074 B12R2.32 O=CC1Oc2ccccc2O1 Amb27409489 [0,1,0,1,0,0|2,0,0]=4 8075 B12R2.32 OCC1Cc2ccccc2N1 Amb2724872 [0,1,0,1,0,0|1,0,1]=4 8076 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,1,0,1,0,0|1,0,1]=4 8077 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,1,0,1,0,0|1,0,1]=4 8078 B12R2.196 C=C1COc2c1ccnc2Cl Amb25983153 [0,1,0,1,0,0|2,0,0]=4 8079 B12R2.196 CC1CNc2c(Br)cccc21 Amb26371262 [0,1,0,1,0,0|0,0,2]=4 8080 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|0,0,2]=4 8081 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|0,0,2]=4 8082 B12R2.196 CC1CNc2c(N)cccc21 Amb32658300 [0,1,0,1,0,0|0,0,2]=4 8083 B12R2.196 Cc1cccc2c1CCC2=O Amb4605923 [0,1,0,1,0,0|2,0,0]=4 8084 B12R2.196 Cc1cccc2c1NCC2=O Amb18831418 [0,1,0,1,0,0|1,0,0]=3 8085 B12R2.196 Cc1cccc2c1NCC2C Amb17040659 [0,1,0,1,0,0|0,0,2]=4 8086 B12R2.196 Cc1cccc2c1NSC2=O Amb32673862 [0,1,0,1,0,0|2,0,0]=4 8087 B12R2.196 Cc1cccc2c1OCC2=O Amb33534388 [0,1,0,1,0,0|2,0,0]=4 8088 B12R2.196 Cc1cccc2c1SCC2=O Amb18199753 [0,1,0,1,0,0|2,0,0]=4 8089 B12R2.196 NC1CNc2c(Cl)cccc21 Amb27445939 [0,1,0,1,0,0|1,0,1]=4 8090 B12R2.196 Nc1cccc2c1CCC2=O Amb10067615 [0,1,0,1,0,0|2,0,0]=4 8091 B12R2.196 Nc1cccc2c1OCC2=O Amb18202194 [0,1,0,1,0,0|2,0,0]=4 8092 B12R2.196 Nc1cccc2c1SCC2=O Amb18199701 [0,1,0,1,0,0|2,0,0]=4 8093 B12R2.196 O=C1CCc2c(Br)cccc21 Amb6683468 [0,1,0,1,0,0|2,0,0]=4 8094 B12R2.196 O=C1CCc2c(Cl)cccc21 Amb2383535 [0,1,0,1,0,0|2,0,0]=4 8095 B12R2.196 O=C1CCc2c(F)cccc21 Amb2383536 [0,1,0,1,0,0|2,0,0]=4 8096 B12R2.196 O=C1CCc2c(O)cccc21 Amb1158068 [0,1,0,1,0,0|2,0,0]=4 8097 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,1,0,0|1,0,0]=3 8098 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,1,0,1,0,0|2,0,0]=4 8099 B12R2.196 O=C1COc2c(Cl)cccc21 Amb33534389 [0,1,0,1,0,0|2,0,0]=4 8100 B12R2.196 O=C1COc2c(F)cccc21 Amb2383546 [0,1,0,1,0,0|2,0,0]=4 8101 B12R2.196 O=C1COc2c(O)cccc21 Amb22490978 [0,1,0,1,0,0|2,0,0]=4 8102 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,1,0,1,0,0|2,0,0]=4 8103 B12R2.196 O=C1CSc2c(Cl)cccc21 Amb18822582 [0,1,0,1,0,0|2,0,0]=4 8104 B12R2.196 O=C1CSc2c(F)cccc21 Amb23597480 [0,1,0,1,0,0|2,0,0]=4 8105 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,1,0,0|2,0,0]=4 8106 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,1,0,0|2,0,0]=4 8107 B12R2.196 O=C1SNc2c(F)cccc21 Amb32673867 [0,1,0,1,0,0|2,0,0]=4 8108 B12R2.225 Brc1ccccc1NC2CC2 Amb25922951 [0,1,0,1,0,0|0,0,2]=4 8109 B12R2.225 Cc1ccccc1NC2CC2 Amb27593469 [0,1,0,1,0,0|0,0,2]=4 8110 B12R2.225 Nc1ccccc1NC2CC2 Amb28960308 [0,1,0,1,0,0|0,0,2]=4 8111 B12R2.225 Nc1ccccc1NC2CC2 Amb9205213 [0,1,0,1,0,0|0,0,2]=4 8112 B12R2.203 CC1CNc2cccc(Cl)c21 Amb28286836 [0,1,0,1,0,0|0,0,2]=4 8113 B12R2.203 Cc1cccc2c1C(=N)NN2 Amb24413143 [0,1,0,1,0,0|2,0,0]=4 8114 B12R2.203 Cc1cccc2c1C(=O)CC2 Amb16232631 [0,1,0,1,0,0|2,0,0]=4 8115 B12R2.203 Cc1cccc2c1C(=O)CO2 Amb18202264 [0,1,0,1,0,0|2,0,0]=4 8116 B12R2.203 Cc1cccc2c1C(=O)CS2 Amb18199755 [0,1,0,1,0,0|2,0,0]=4 8117 B12R2.203 Cc1cccc2c1C(=O)SN2 Amb32673870 [0,1,0,1,0,0|2,0,0]=4 8118 B12R2.203 Nc1cccc2c1C(=O)CC2 Amb10603890 [0,1,0,1,0,0|2,0,0]=4 8119 B12R2.203 Nc1cccc2c1C(=O)CO2 Amb27969163 [0,1,0,1,0,0|2,0,0]=4 8120 B12R2.203 O=C1CCc2cccc(Br)c21 Amb16232616 [0,1,0,1,0,0|2,0,0]=4 8121 B12R2.203 O=C1CCc2cccc(Cl)c21 Amb6296539 [0,1,0,1,0,0|2,0,0]=4 8122 B12R2.203 O=C1CCc2cccc(F)c21 Amb10603926 [0,1,0,1,0,0|2,0,0]=4 8123 B12R2.203 O=C1CCc2cccc(O)c21 Amb6296368 [0,1,0,1,0,0|2,0,0]=4 8124 B12R2.203 O=C1CCc2cccc(S)c21 Amb27949135 [0,1,0,1,0,0|2,0,0]=4 8125 B12R2.203 O=C1COc2cccc(Br)c21 Amb16233082 [0,1,0,1,0,0|2,0,0]=4 8126 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,1,0,0|2,0,0]=4 8127 B12R2.203 O=C1COc2cccc(F)c21 Amb10840768 [0,1,0,1,0,0|2,0,0]=4 8128 B12R2.203 O=C1COc2cccc(O)c21 Amb18125055 [0,1,0,1,0,0|2,0,0]=4 8129 B12R2.203 O=C1CSc2cccc(Cl)c21 Amb18822610 [0,1,0,1,0,0|2,0,0]=4 8130 B12R2.203 O=C1CSc2cccc(I)c21 Amb27239169 [0,1,0,1,0,0|2,0,0]=4 8131 B12R2.203 O=C1CSc2cccc(O)c21 Amb28436434 [0,1,0,1,0,0|2,0,0]=4 8132 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,1,0,0|2,0,0]=4 8133 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,1,0,0|2,0,0]=4 8134 B12R2.203 O=C1ONc2cccc(F)c21 Amb27840267 [0,1,0,1,0,0|2,0,0]=4 8135 B12R2.612 C=C1CCc2cc(Br)ccc21 Amb22229945 [0,1,0,1,0,0|1,0,0]=3 8136 B12R2.612 C=C1CCc2cc(Cl)ccc21 Amb24369315 [0,1,0,1,0,0|1,0,0]=3 8137 B12R2.612 C=C1CCc2cc(O)ccc21 Amb26965176 [0,1,0,1,0,0|1,0,0]=3 8138 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|0,0,2]=4 8139 B12R2.612 CC1CNc2cc(N)ccc21 Amb28397894 [0,1,0,1,0,0|0,0,2]=4 8140 B12R2.612 Cc1ccc2c(c1)CCC2=O Amb6667023 [0,1,0,1,0,0|2,0,0]=4 8141 B12R2.612 Cc1ccc2c(c1)NCC2C Amb27760208 [0,1,0,1,0,0|0,0,2]=4 8142 B12R2.612 Cc1ccc2c(c1)OCC2=O Amb18202265 [0,1,0,1,0,0|2,0,0]=4 8143 B12R2.612 Cc1ccc2c(c1)SCC2=O Amb18199754 [0,1,0,1,0,0|2,0,0]=4 8144 B12R2.612 N=C1C=CC2=C(N)NNC2=C1 Amb24392472 [0,1,0,1,0,0|2,0,0]=4 8145 B12R2.612 NC1CNc2cc(Cl)ccc21 Amb27634347 [0,1,0,1,0,0|1,0,1]=4 8146 B12R2.612 NC1CNc2cc(F)ccc21 Amb27193911 [0,1,0,1,0,0|1,0,1]=4 8147 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,1,0,0|2,0,0]=4 8148 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb21964765 [0,1,0,1,0,0|2,0,0]=4 8149 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb22008653 [0,1,0,1,0,0|2,0,0]=4 8150 B12R2.612 Nc1ccc2c(c1)NOC2=O Amb27404538 [0,1,0,1,0,0|2,0,0]=4 8151 B12R2.612 Nc1ccc2c(c1)OCC2=O Amb26332312 [0,1,0,1,0,0|2,0,0]=4 8152 B12R2.612 O=C1CCc2cc(Br)ccc21 Amb2685276 [0,1,0,1,0,0|2,0,0]=4 8153 B12R2.612 O=C1CCc2cc(Cl)ccc21 Amb2686124 [0,1,0,1,0,0|2,0,0]=4 8154 B12R2.612 O=C1CCc2cc(F)ccc21 Amb2688113 [0,1,0,1,0,0|2,0,0]=4 8155 B12R2.612 O=C1CCc2cc(I)ccc21 Amb10602519 [0,1,0,1,0,0|2,0,0]=4 8156 B12R2.612 O=C1CCc2cc(O)ccc21 Amb2610677 [0,1,0,1,0,0|2,0,0]=4 8157 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,1,0,0|2,0,0]=4 8158 B12R2.612 O=C1CNc2cc(Br)ccc21 Amb27623314 [0,1,0,1,0,0|1,0,0]=3 8159 B12R2.612 O=C1COc2cc(Br)ccc21 Amb10070946 [0,1,0,1,0,0|2,0,0]=4 8160 B12R2.612 O=C1COc2cc(Cl)ccc21 Amb10070947 [0,1,0,1,0,0|2,0,0]=4 8161 B12R2.612 O=C1COc2cc(F)ccc21 Amb10840769 [0,1,0,1,0,0|2,0,0]=4 8162 B12R2.612 O=C1COc2cc(I)ccc21 Amb16233079 [0,1,0,1,0,0|2,0,0]=4 8163 B12R2.612 O=C1COc2cc(O)ccc21 Amb1155533 [0,1,0,1,0,0|2,0,0]=4 8164 B12R2.612 O=C1CSc2cc(Br)ccc21 Amb26632914 [0,1,0,1,0,0|2,0,0]=4 8165 B12R2.612 O=C1CSc2cc(Cl)ccc21 Amb4062420 [0,1,0,1,0,0|2,0,0]=4 8166 B12R2.612 O=C1CSc2cc(I)ccc21 Amb27441580 [0,1,0,1,0,0|2,0,0]=4 8167 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,1,0,0|2,0,0]=4 8168 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,1,0,0|2,0,0]=4 8169 B12R2.612 O=C1ONc2cc(Cl)ccc21 Amb26858350 [0,1,0,1,0,0|2,0,0]=4 8170 B12R2.612 O=C1ONc2cc(F)ccc21 Amb27488717 [0,1,0,1,0,0|2,0,0]=4 8171 B12R2.612 O=C1SNc2cc(F)ccc21 Amb32673866 [0,1,0,1,0,0|2,0,0]=4 8172 B12R2.1286 Brc1cccc(NC2CC2)c1 Amb24622562 [0,1,0,1,0,0|0,0,2]=4 8173 B12R2.1286 Clc1cccc(NC2CC2)c1 Amb18930890 [0,1,0,1,0,0|0,0,2]=4 8174 B12R2.1286 Fc1cccc(NC2CC2)c1 Amb18270328 [0,1,0,1,0,0|0,0,2]=4 8175 B12R2.1286 Nc1cccc(NC2CC2)c1 Amb33533212 [0,1,0,1,0,0|0,0,2]=4 8176 B12R2.1286 Oc1cccc(NC2CC2)c1 Amb24464849 [0,1,0,1,0,0|0,0,2]=4 8177 B12R2.2313 Brc1cccc(N2CCC2)c1 Amb28068951 [0,1,0,1,0,0|0,0,2]=4 8178 B12R2.2313 Cc1cccc(N2CSC2)c1 Amb28399348 [0,1,0,1,0,0|1,0,1]=4 8179 B12R2.2313 Nc1cccc(N2CCC2)c1 Amb27402439 [0,1,0,1,0,0|0,0,2]=4 8180 B12R2.1 C=CC1C=Nc2ccccc21 Amb28368575 [0,1,0,1,0,0|0,0,1]=3 8181 B12R2.1 C=CC1CCc2ccccc21 Amb33145111 [0,1,0,1,0,0|1,0,0]=3 8182 B12R2.1 C=CC1OCc2ccccc21 Amb8392579 [0,1,0,1,0,0|1,0,0]=3 8183 B12R2.1 C=CN1CCc2ccccc21 Amb28323569 [0,1,0,1,0,0|1,0,0]=3 8184 B12R2.1 C=Cc1csc2ccccc12 Amb27409855 [0,1,0,1,0,0|1,0,1]=4 8185 B12R2.1 C=Cc1onc2ccccc12 Amb27208307 [0,1,0,1,0,0|0,0,2]=4 8186 B12R2.1 C=Cn1cnc2ccccc21 Amb1035881 [0,1,0,1,0,0|0,0,2]=4 8187 B12R2.1 C=Cn1nnc2ccccc21 Amb10559409 [0,1,0,1,0,0|1,0,1]=4 8188 B12R2.1 CCC1CNc2ccccc21 Amb32661135 [0,1,0,1,0,0|0,0,2]=4 8189 B12R2.1 CCC1CNc2ccccc21 Amb9776196 [0,1,0,1,0,0|0,0,2]=4 8190 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|0,0,2]=4 8191 B12R2.1 CCC1NCc2ccccc21 Amb30584702 [0,1,0,1,0,0|0,0,2]=4 8192 B12R2.1 CNC1CNc2ccccc21 Amb28125195 [0,1,0,1,0,0|0,0,2]=4 8193 B12R2.1 COC1CNc2ccccc21 Amb27863100 [0,1,0,1,0,0|0,0,2]=4 8194 B12R2.1 CSC1CNc2ccccc21 Amb28423543 [0,1,0,1,0,0|0,0,2]=4 8195 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [0,1,0,1,0,0|1,0,1]=4 8196 B12R2.1 C\C=C1\CNc2ccccc21 Amb27967275 [0,1,0,1,0,0|0,0,0]=2 8197 B12R2.1 FCC1NCc2ccccc21 Amb27211089 [0,1,0,1,0,0|1,0,1]=4 8198 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|0,0,2]=4 8199 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|0,0,2]=4 8200 B12R2.1 NCC1CNc2ccccc21 Amb30588549 [0,1,0,1,0,0|0,0,2]=4 8201 B12R2.1 N\N=C1/CCc2ccccc21 Amb33734274 [0,1,0,1,0,0|2,0,0]=4 8202 B12R2.1 N\N=C1/COc2ccccc21 Amb27862558 [0,1,0,1,0,0|2,0,0]=4 8203 B12R2.1 N\N=C1\CCc2ccccc21 Amb2384463 [0,1,0,1,0,0|2,0,0]=4 8204 B12R2.1 N\N=C1\CSc2ccccc21 Amb27395953 [0,1,0,1,0,0|2,0,0]=4 8205 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,1,0,1,0,0|1,0,1]=4 8206 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|1,0,1]=4 8207 B12R2.1 O=CC1CSc2ccccc21 Amb27456947 [0,1,0,1,0,0|1,0,1]=4 8208 B12R2.1 O=CC1OCc2ccccc21 Amb27225913 [0,1,0,1,0,0|2,0,0]=4 8209 B12R2.1 O=C[C@@H]1CCc2ccccc21 Amb28319720 [0,1,0,1,0,0|1,0,1]=4 8210 B12R2.1 O=C[C@H]1CCc2ccccc21 Amb27164668 [0,1,0,1,0,0|1,0,1]=4 8211 B12R2.1 O=Cc1coc2ccccc12 Amb10844786 [0,1,0,1,0,0|1,0,1]=4 8212 B12R2.1 O=Cc1csc2ccccc12 Amb1157901 [0,1,0,1,0,0|1,0,1]=4 8213 B12R2.1 O=Cc1occ2ccccc12 Amb27793276 [0,1,0,1,0,0|2,0,0]=4 8214 B12R2.1 O=Cc1onc2ccccc12 Amb18831437 [0,1,0,1,0,0|1,0,1]=4 8215 B12R2.1 O=Cc1snc2ccccc12 Amb26948515 [0,1,0,1,0,0|1,0,1]=4 8216 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|0,0,2]=4 8217 B12R2.1 OCC1CNc2ccccc21 Amb28652884 [0,1,0,1,0,0|0,0,2]=4 8218 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|1,0,1]=4 8219 B12R2.1 O\N=C1/CCc2ccccc21 Amb4016236 [0,1,0,1,0,0|2,0,0]=4 8220 B12R2.1 O\N=C1/COc2ccccc21 Amb19650724 [0,1,0,1,0,0|2,0,0]=4 8221 B12R2.1 O\N=C1\COc2ccccc21 Amb27840218 [0,1,0,1,0,0|2,0,0]=4 8222 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,1,0,1,0,0|0,0,2]=4 8223 B12R2.11 C[C@@H]1C[C@@H]1Nc2ccccc2 Amb28059383 [0,1,0,1,0,0|0,0,2]=4 8224 B12R2.23 CC1CCN1c2ccccc2 Amb28312828 [0,1,0,1,0,0|0,0,2]=4 8225 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,1,0,1,0,0|0,0,2]=4 8226 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|1,0,1]=4 8227 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|0,0,1]=3 8228 B12R2.23 O=C1CC[C@H]1c2ccccc2 Amb28253765 [0,1,0,1,0,0|1,0,1]=4 8229 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|2,0,0]=4 8230 B12R2.23 O=C1NCC1c2ccccc2 Amb614326 [0,1,0,1,0,0|2,0,0]=4 8231 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [0,1,0,1,0,0|1,0,1]=4 8232 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,1,0,1,0,0|0,0,1]=3 8233 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb19515725 [0,1,0,1,0,0|0,0,2]=4 8234 B12R2.2057 c1ccc(CNC2CC2)cc1 Amb6662862 [0,1,0,1,0,0|0,0,2]=4 8235 B12R2.2057 c1ccc(NCC2CC2)cc1 Amb2383311 [0,1,0,1,0,0|0,0,2]=4 8236 B12R2.2057 c1ccc(NCC2CO2)cc1 Amb27413107 [0,1,0,1,0,0|0,0,2]=4 8237 B12R2.2058 c1ccc(CN2CCC2)cc1 Amb27391196 [0,1,0,1,0,0|0,0,2]=4 8238 B12R2.2058 c1ccc(NC2CCC2)cc1 Amb18283820 [0,1,0,1,0,0|0,0,2]=4 8239 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb27252900 [0,1,0,1,0,0|0,0,2]=4 8240 B12R2.2058 c1ccc(NC2CNC2)cc1 Amb32686264 [0,1,0,1,0,0|0,0,2]=4 8241 B12R2.2058 c1ccc(NC2COC2)cc1 Amb33538163 [0,1,0,1,0,0|0,0,2]=4 8242 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,1,0,1,0,0|0,0,1]=3 8243 B12R2.18 C=C1c2ccccc2OC1O Amb27197539 [0,1,0,1,0,0|1,0,0]=3 8244 B12R2.18 C=C1c2ccccc2SC1O Amb27775969 [0,1,0,1,0,0|1,0,0]=3 8245 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [0,1,0,1,0,0|2,0,0]=4 8246 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [0,1,0,1,0,0|1,0,0]=3 8247 B12R2.18 CC1Nc2ccccc2C1C Amb17593676 [0,1,0,1,0,0|0,0,2]=4 8248 B12R2.18 CC1Nc2ccccc2C1O Amb28076897 [0,1,0,1,0,0|1,0,1]=4 8249 B12R2.18 CC1Nc2ccccc2[C@H]1C Amb28341472 [0,1,0,1,0,0|0,0,2]=4 8250 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,1,0,1,0,0|2,0,0]=4 8251 B12R2.18 CN1Nc2ccccc2C1=N Amb27646089 [0,1,0,1,0,0|2,0,0]=4 8252 B12R2.18 C[C@@H]1Nc2ccccc2[C@H]1C Amb27205062 [0,1,0,1,0,0|0,0,2]=4 8253 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,1,0,1,0,0|1,0,1]=4 8254 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [0,1,0,1,0,0|2,0,0]=4 8255 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [0,1,0,1,0,0|2,0,0]=4 8256 B12R2.18 N[C@H]1c2ccccc2N[C@H]1O Amb27198050 [0,1,0,1,0,0|1,0,1]=4 8257 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,1,0,1,0,0|1,0,1]=4 8258 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,1,0,1,0,0|1,0,1]=4 8259 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,1,0,1,0,0|1,0,1]=4 8260 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [0,1,0,1,0,0|2,0,0]=4 8261 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [0,1,0,1,0,0|2,0,0]=4 8262 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [0,1,0,1,0,0|2,0,0]=4 8263 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,1,0,1,0,0|2,0,0]=4 8264 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [0,1,0,1,0,0|2,0,0]=4 8265 B12R2.94 CC1(Nc2ccccc2)CC1 Amb27176430 [0,1,0,1,0,0|0,0,2]=4 8266 B12R2.2051 C=CC1(C)Cc2ccccc21 Amb17778871 [0,1,0,1,0,0|1,0,0]=3 8267 B12R2.2403 CC1(C)CNc2ccccc21 Amb17232031 [0,1,0,1,0,0|0,0,2]=4 8268 B12R2.2403 CC1(C)CNc2ccccc21 Amb20630653 [0,1,0,1,0,0|0,0,2]=4 8269 B12R2.2403 FC1(F)CNc2ccccc21 Amb26606151 [0,1,0,1,0,0|1,0,1]=4 8270 B12R2.3190 CC(=O)C1Cc2ccccc21 Amb28066759 [0,1,0,1,0,0|1,0,1]=4 8271 B12R2.3190 N=C(N)C1Cc2ccccc21 Amb28652925 [0,1,0,1,0,0|2,0,0]=4 8272 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|2,0,0]=4 8273 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|2,0,0]=4 8274 B12R2.3190 O=C(O)C1Cc2ccccc21 Amb4017188 [0,1,0,1,0,0|2,0,0]=4 8275 B12R3.12 C1=CNN2C=C3C=C3C2=C1 Amb28143444 [0,0,0,2,0,0|1,0,1]=4 8276 B12R3.12 c1cc2c(cn1)cc3cc32 Amb28246047 [0,0,0,2,0,0|2,0,0]=4 8277 B12R3.12 c1ccc2c3n(cc2c1)C3 Amb27781391 [0,0,0,2,0,0|2,0,0]=4 8278 B12R3.12 c1cnc2c(c1)cc3cc32 Amb27482098 [0,0,0,2,0,0|0,0,2]=4 8279 B12R3.12 c1cnc2cc3cc3c2c1 Amb26034642 [0,0,0,2,0,0|0,0,2]=4 8280 B8R1.8 C=CCc1ccco1 Amb26612842 [1,0,0,0,1,0|1,0,0]=3 8281 B8R1.8 C=CCc1cccs1 Amb27882648 [1,0,0,0,1,0|1,0,0]=3 8282 B8R1.8 C=CCc1ccns1 Amb27205998 [1,0,0,0,1,0|2,0,0]=4 8283 B8R1.8 C=CCc1ccsc1 Amb27799958 [1,0,0,0,1,0|1,0,0]=3 8284 B8R1.8 C=CCc1cncs1 Amb35625105 [1,0,0,0,1,0|2,0,0]=4 8285 B8R1.8 C=CCc1cnsc1 Amb35731370 [1,0,0,0,1,0|2,0,0]=4 8286 B8R1.8 C=CCn1cccc1 Amb9371428 [1,0,0,0,1,0|1,0,0]=3 8287 B8R1.8 C=CCn1cccn1 Amb4036063 [1,0,0,0,1,0|2,0,0]=4 8288 B8R1.8 C=CCn1ccnc1 Amb3940710 [1,0,0,0,1,0|2,0,0]=4 8289 B8R1.8 C=NCc1ccco1 Amb28287800 [1,0,0,0,1,0|2,0,0]=4 8290 B8R1.8 C=NCc1cccs1 Amb27964411 [1,0,0,0,1,0|2,0,0]=4 8291 B8R1.8 CCNc1ccco1 Amb27593280 [1,0,0,0,1,0|1,0,1]=4 8292 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|2,0,0]=4 8293 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|2,0,0]=4 8294 B8R1.8 O=CCc1ccoc1 Amb18641576 [1,0,0,0,1,0|2,0,0]=4 8295 B8R1.8 O=CCc1ccsc1 Amb26603755 [1,0,0,0,1,0|2,0,0]=4 8296 B8R1.8 O=CCn1cccc1 Amb18203408 [1,0,0,0,1,0|2,0,0]=4 8297 B8R1.8 O=CNc1ccco1 Amb28135036 [1,0,0,0,1,0|2,0,0]=4 8298 B8R1.8 O=CNc1cccs1 Amb28282647 [1,0,0,0,1,0|2,0,0]=4 8299 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,1,0|2,0,0]=4