0 B10R1.17 BrCC#Cc1ccccc1 Amb26032687 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.17 BrCCCc1ccccc1 Amb2721516 [0,0,0,0,0,0|1,0,3]=4 2 B10R1.17 BrCCOc1ccccc1 Amb1152333 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.17 BrCCSc1ccccc1 Amb6255409 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.17 BrCOCc1ccccc1 Amb27410470 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [0,0,0,0,0,0|1,0,1]=2 6 B10R1.17 BrC\C=C\c1ccccn1 Amb28365946 [0,0,0,0,0,0|2,0,1]=3 7 B10R1.17 BrC\C=C\c1ccncn1 Amb27246121 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 BrC\C=C\c1cnccn1 Amb35600898 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.17 BrC\C=C\c1cncnc1 Amb27214974 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [0,0,0,0,0,0|2,0,2]=4 11 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [0,0,0,0,0,0|1,0,1]=2 12 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [0,0,0,0,0,0|2,0,0]=2 14 B10R1.17 C#CC#Cc1ccccc1 Amb24585690 [0,0,0,0,0,0|1,0,3]=4 15 B10R1.17 C#CCCc1ccccc1 Amb6336492 [0,0,0,0,0,0|1,0,3]=4 16 B10R1.17 C#CCOc1ccccc1 Amb839455 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.17 C#CCSc1ccccc1 Amb3836098 [0,0,0,0,0,0|2,0,2]=4 18 B10R1.17 C#C\C=C/c1cccnc1 Amb24085625 [0,0,0,0,0,0|2,0,1]=3 19 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [0,0,0,0,0,0|1,0,1]=2 20 B10R1.17 C=C=COc1ccccc1 Amb17673264 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [0,0,0,0,0,0|1,0,2]=3 22 B10R1.17 C=CCCc1ccccc1 Amb2721241 [0,0,0,0,0,0|1,0,2]=3 23 B10R1.17 C=CCCc1ccccn1 Amb25337662 [0,0,0,0,0,0|2,0,2]=4 24 B10R1.17 C=CCCc1cccnc1 Amb24477186 [0,0,0,0,0,0|2,0,2]=4 25 B10R1.17 C=CCNc1ccccc1 Amb2720315 [0,0,0,0,0,0|2,0,1]=3 26 B10R1.17 C=CCNc1cccnc1 Amb8394248 [0,0,0,0,0,0|3,0,1]=4 27 B10R1.17 C=CCOc1ccccc1 Amb2842273 [0,0,0,0,0,0|2,0,1]=3 28 B10R1.17 C=CCOc1cccnc1 Amb26643102 [0,0,0,0,0,0|3,0,1]=4 29 B10R1.17 C=CCOc1ccncc1 Amb25234559 [0,0,0,0,0,0|3,0,1]=4 30 B10R1.17 C=CCSc1ccccc1 Amb3836099 [0,0,0,0,0,0|2,0,1]=3 31 B10R1.17 C=CC[Se]c1ccccn1 Amb24101157 [0,0,0,0,0,0|3,0,1]=4 32 B10R1.17 C=COCc1ccccc1 Amb17940722 [0,0,0,0,0,0|2,0,1]=3 33 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [0,0,0,0,0,0|1,0,0]=1 34 B10R1.17 C=C\C=C\c1cccnc1 Amb27976078 [0,0,0,0,0,0|2,0,0]=2 35 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [0,0,0,0,0,0|1,0,1]=2 36 B10R1.17 CCCCc1ccccc1 Amb6608912 [0,0,0,0,0,0|1,0,3]=4 37 B10R1.17 CCCNc1ccccc1 Amb534130 [0,0,0,0,0,0|2,0,2]=4 38 B10R1.17 CCCOc1ccccc1 Amb2842271 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.17 CCCSc1ccccc1 Amb4014460 [0,0,0,0,0,0|2,0,2]=4 40 B10R1.17 CCNCc1ccccc1 Amb3699539 [0,0,0,0,0,0|2,0,2]=4 41 B10R1.17 CCOCc1ccccc1 Amb9787555 [0,0,0,0,0,0|2,0,2]=4 42 B10R1.17 CCOSc1ccccc1 Amb28049338 [0,0,0,0,0,0|3,0,1]=4 43 B10R1.17 CCSCc1ccccc1 Amb9787636 [0,0,0,0,0,0|2,0,2]=4 44 B10R1.17 CCSSc1ccccc1 Amb28057163 [0,0,0,0,0,0|3,0,1]=4 45 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [0,0,0,0,0,0|2,0,1]=3 46 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [0,0,0,0,0,0|1,0,1]=2 47 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [0,0,0,0,0,0|2,0,1]=3 48 B10R1.17 CC\C=N/c1cccnc1 Amb28250076 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [0,0,0,0,0,0|2,0,1]=3 50 B10R1.17 CC\N=C\c1cccnc1 Amb26548619 [0,0,0,0,0,0|3,0,1]=4 51 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [0,0,0,0,0,0|2,0,1]=3 52 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [0,0,0,0,0,0|2,0,2]=4 53 B10R1.17 CNCCc1ccccc1 Amb1132990 [0,0,0,0,0,0|2,0,2]=4 54 B10R1.17 CNCCc1ccccc1 Amb33545919 [0,0,0,0,0,0|2,0,2]=4 55 B10R1.17 CNNCc1ccccc1 Amb26859422 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.17 CNNCc1ccccc1 Amb33328543 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.17 CNOCc1ccccc1 Amb22059601 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.17 CNOCc1ccccc1 Amb32412803 [0,0,0,0,0,0|3,0,1]=4 59 B10R1.17 CN\C=N\c1cccnc1 Amb24671021 [0,0,0,0,0,0|4,0,0]=4 60 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [0,0,0,0,0,0|3,0,0]=3 61 B10R1.17 CN\N=C\c1cccnc1 Amb28049739 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.17 COCCc1ccccc1 Amb4020014 [0,0,0,0,0,0|2,0,2]=4 64 B10R1.17 COCOc1ccccc1 Amb2608594 [0,0,0,0,0,0|3,0,1]=4 65 B10R1.17 CONCc1ccccc1 Amb26432339 [0,0,0,0,0,0|3,0,1]=4 66 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [0,0,0,0,0,0|2,0,0]=2 68 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.17 CO\N=C\c1ccccn1 Amb24719324 [0,0,0,0,0,0|4,0,0]=4 70 B10R1.17 CO\N=C\c1cccnc1 Amb26847062 [0,0,0,0,0,0|4,0,0]=4 71 B10R1.17 CO\N=C\c1ccncc1 Amb25173617 [0,0,0,0,0,0|4,0,0]=4 72 B10R1.17 CSCCc1ccccc1 Amb26586093 [0,0,0,0,0,0|2,0,2]=4 73 B10R1.17 CSCNc1ccccc1 Amb25992690 [0,0,0,0,0,0|3,0,1]=4 74 B10R1.17 CSCOc1ccccc1 Amb22231357 [0,0,0,0,0,0|3,0,1]=4 75 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [0,0,0,0,0,0|2,0,0]=2 76 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [0,0,0,0,0,0|2,0,1]=3 77 B10R1.17 C\C=C\CN1C=CC=CC1 Amb27427410 [0,0,0,0,0,0|2,0,2]=4 78 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [0,0,0,0,0,0|1,0,1]=2 79 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [0,0,0,0,0,0|2,0,0]=2 80 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [0,0,0,0,0,0|3,0,0]=3 81 B10R1.17 C\N=N\C=C1/C=CC=CN1 Amb27468590 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.17 ClCC#Cc1ccccc1 Amb17772264 [0,0,0,0,0,0|1,0,3]=4 83 B10R1.17 ClCCCc1ccccc1 Amb3941487 [0,0,0,0,0,0|1,0,3]=4 84 B10R1.17 ClCCNc1ccccc1 Amb17334388 [0,0,0,0,0,0|2,0,2]=4 85 B10R1.17 ClCCOc1ccccc1 Amb3940573 [0,0,0,0,0,0|2,0,2]=4 86 B10R1.17 ClCCSc1ccccc1 Amb2685910 [0,0,0,0,0,0|2,0,2]=4 87 B10R1.17 ClCOCc1ccccc1 Amb2684626 [0,0,0,0,0,0|2,0,2]=4 88 B10R1.17 ClCSCc1ccccc1 Amb16231183 [0,0,0,0,0,0|2,0,2]=4 89 B10R1.17 ClCSSc1ccccc1 Amb27865461 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [0,0,0,0,0,0|1,0,1]=2 91 B10R1.17 ClC\C=C\c1cccnc1 Amb26369517 [0,0,0,0,0,0|2,0,1]=3 92 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [0,0,0,0,0,0|2,0,1]=3 93 B10R1.17 ClC\C=C\c1cnccn1 Amb35600897 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [0,0,0,0,0,0|2,0,0]=2 95 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb2613089 [0,0,0,0,0,0|2,0,1]=3 96 B10R1.17 Cl\C=N\Oc1ccccn1 Amb27430268 [0,0,0,0,0,0|4,0,0]=4 97 B10R1.17 FCC#Cc1ccccc1 Amb24586400 [0,0,0,0,0,0|1,0,3]=4 98 B10R1.17 FCCNc1ccccc1 Amb26349791 [0,0,0,0,0,0|2,0,2]=4 99 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [0,0,0,0,0,0|1,0,1]=2 100 B10R1.17 ICC#Cc1ccccc1 Amb27262163 [0,0,0,0,0,0|1,0,3]=4 101 B10R1.17 ICCCc1ccccc1 Amb10605506 [0,0,0,0,0,0|1,0,3]=4 102 B10R1.17 ICCOc1ccccc1 Amb10608588 [0,0,0,0,0,0|2,0,2]=4 103 B10R1.17 ICCSc1ccccc1 Amb27458209 [0,0,0,0,0,0|2,0,2]=4 104 B10R1.17 ICOCc1ccccc1 Amb28348666 [0,0,0,0,0,0|2,0,2]=4 105 B10R1.17 N#CC#Cc1ccccc1 Amb17593333 [0,0,0,0,0,0|1,0,3]=4 106 B10R1.17 N#CCCc1ccccc1 Amb33551192 [0,0,0,0,0,0|1,0,3]=4 107 B10R1.17 N#CCNc1ccccc1 Amb1651088 [0,0,0,0,0,0|2,0,2]=4 108 B10R1.17 N#CCOc1ccccc1 Amb2725206 [0,0,0,0,0,0|2,0,2]=4 109 B10R1.17 N#CCSc1ccccc1 Amb2690327 [0,0,0,0,0,0|2,0,2]=4 110 B10R1.17 N#CNCc1ccccc1 Amb27257452 [0,0,0,0,0,0|2,0,2]=4 111 B10R1.17 N#CSCc1ccccc1 Amb2611897 [0,0,0,0,0,0|2,0,2]=4 112 B10R1.17 N#C\C=C/c1cccnc1 Amb27453523 [0,0,0,0,0,0|2,0,1]=3 113 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [0,0,0,0,0,0|1,0,1]=2 114 B10R1.17 N#C\C=C\c1ccccn1 Amb32658017 [0,0,0,0,0,0|2,0,1]=3 115 B10R1.17 N#C\C=C\c1cccnc1 Amb17477822 [0,0,0,0,0,0|2,0,1]=3 116 B10R1.17 N#C\C=C\c1ccncc1 Amb17477821 [0,0,0,0,0,0|2,0,1]=3 117 B10R1.17 N#C\C=C\c1cnccn1 Amb35602892 [0,0,0,0,0,0|3,0,1]=4 118 B10R1.17 N#C\C=C\c1cncnc1 Amb27779874 [0,0,0,0,0,0|3,0,1]=4 119 B10R1.17 N#C\C=C\c1ncccn1 Amb27230880 [0,0,0,0,0,0|3,0,1]=4 120 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [0,0,0,0,0,0|1,0,2]=3 121 B10R1.17 NCC#Cc1ccccc1 Amb1239477 [0,0,0,0,0,0|1,0,3]=4 122 B10R1.17 NCC#Cc1ccccc1 Amb2371766 [0,0,0,0,0,0|1,0,3]=4 123 B10R1.17 NCCCc1ccccc1 Amb844788 [0,0,0,0,0,0|1,0,3]=4 124 B10R1.17 NCCNc1ccccc1 Amb23412206 [0,0,0,0,0,0|2,0,2]=4 125 B10R1.17 NCCNc1ccccc1 Amb2720312 [0,0,0,0,0,0|2,0,2]=4 126 B10R1.17 NCCOc1ccccc1 Amb1214559 [0,0,0,0,0,0|2,0,2]=4 127 B10R1.17 NCCOc1ccccc1 Amb2099529 [0,0,0,0,0,0|2,0,2]=4 128 B10R1.17 NCCSc1ccccc1 Amb6374305 [0,0,0,0,0,0|2,0,2]=4 129 B10R1.17 NCCSc1ccccc1 Amb6827055 [0,0,0,0,0,0|2,0,2]=4 130 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [0,0,0,0,0,0|1,0,1]=2 131 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [0,0,0,0,0,0|1,0,1]=2 132 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [0,0,0,0,0,0|1,0,1]=2 133 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [0,0,0,0,0,0|1,0,1]=2 134 B10R1.17 NC\C=C\c1ccccn1 Amb18063261 [0,0,0,0,0,0|2,0,1]=3 135 B10R1.17 NC\C=C\c1cccnc1 Amb18063302 [0,0,0,0,0,0|2,0,1]=3 136 B10R1.17 NC\C=C\c1cccnc1 Amb31148908 [0,0,0,0,0,0|2,0,1]=3 137 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [0,0,0,0,0,0|2,0,1]=3 138 B10R1.17 NC\C=C\c1ccncn1 Amb27617981 [0,0,0,0,0,0|3,0,1]=4 139 B10R1.17 NC\C=C\c1cnccn1 Amb35602895 [0,0,0,0,0,0|3,0,1]=4 140 B10R1.17 NC\C=C\c1cncnc1 Amb18643006 [0,0,0,0,0,0|3,0,1]=4 141 B10R1.17 NC\C=C\c1ncccn1 Amb33270034 [0,0,0,0,0,0|3,0,1]=4 142 B10R1.17 NNCCc1ccccc1 Amb10608987 [0,0,0,0,0,0|2,0,2]=4 143 B10R1.17 NNCCc1ccccc1 Amb1117029 [0,0,0,0,0,0|2,0,2]=4 144 B10R1.17 NNCCc1ccccc1 Amb33552804 [0,0,0,0,0,0|2,0,2]=4 145 B10R1.17 NOCCc1ccccc1 Amb2899735 [0,0,0,0,0,0|2,0,2]=4 146 B10R1.17 NOCCc1ccccc1 Amb6308543 [0,0,0,0,0,0|2,0,2]=4 147 B10R1.17 N\N=C\Nc1ccccc1 Amb27770569 [0,0,0,0,0,0|3,0,0]=3 148 B10R1.17 O=C=C\C=C1/C=CC=CN1 Amb27779702 [0,0,0,0,0,0|1,0,1]=2 149 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [0,0,0,0,0,0|1,0,2]=3 150 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [0,0,0,0,0,0|2,0,2]=4 151 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [0,0,0,0,0,0|2,0,2]=4 152 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [0,0,0,0,0,0|0,0,2]=2 153 B10R1.17 O=CC#Cc1cccnc1 Amb25950612 [0,0,0,0,0,0|1,0,2]=3 154 B10R1.17 O=CCCc1ccccc1 Amb2720576 [0,0,0,0,0,0|0,0,2]=2 155 B10R1.17 O=CCCc1ccccn1 Amb17081674 [0,0,0,0,0,0|1,0,2]=3 156 B10R1.17 O=CCCc1cccnc1 Amb17081675 [0,0,0,0,0,0|1,0,2]=3 157 B10R1.17 O=CCCc1ccncc1 Amb8388451 [0,0,0,0,0,0|1,0,2]=3 158 B10R1.17 O=CCCc1ccncn1 Amb26958514 [0,0,0,0,0,0|2,0,2]=4 159 B10R1.17 O=CCCc1cnccn1 Amb25876683 [0,0,0,0,0,0|2,0,2]=4 160 B10R1.17 O=CCCc1cncnc1 Amb24657168 [0,0,0,0,0,0|2,0,2]=4 161 B10R1.17 O=CCCc1ncccn1 Amb24056162 [0,0,0,0,0,0|2,0,2]=4 162 B10R1.17 O=CCOc1ccccc1 Amb3465095 [0,0,0,0,0,0|1,0,1]=2 163 B10R1.17 O=CCOc1ccccn1 Amb27823582 [0,0,0,0,0,0|2,0,1]=3 164 B10R1.17 O=CCSc1ccccc1 Amb17082903 [0,0,0,0,0,0|1,0,1]=2 165 B10R1.17 O=CNCc1ccccc1 Amb1916036 [0,0,0,0,0,0|1,0,1]=2 166 B10R1.17 O=CNCc1ccccn1 Amb22370826 [0,0,0,0,0,0|2,0,1]=3 167 B10R1.17 O=CNCc1cccnc1 Amb2694543 [0,0,0,0,0,0|2,0,1]=3 168 B10R1.17 O=CNCc1ncccn1 Amb27638889 [0,0,0,0,0,0|3,0,1]=4 169 B10R1.17 O=CNNc1ccccc1 Amb2721099 [0,0,0,0,0,0|2,0,0]=2 170 B10R1.17 O=CNNc1ccncc1 Amb26560692 [0,0,0,0,0,0|3,0,0]=3 171 B10R1.17 O=COCc1ccccc1 Amb4605893 [0,0,0,0,0,0|1,0,1]=2 172 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [0,0,0,0,0,0|0,0,2]=2 173 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [0,0,0,0,0,0|0,0,0]=0 174 B10R1.17 O=C\C=C\C1=CCCCC1 Amb18643092 [0,0,0,0,0,0|0,0,4]=4 175 B10R1.17 O=C\C=C\C1=COCCC1 Amb33414875 [0,0,0,0,0,0|1,0,3]=4 176 B10R1.17 O=C\C=C\C1CC=CCC1 Amb25691324 [0,0,0,0,0,0|0,0,4]=4 177 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [0,0,0,0,0,0|0,0,0]=0 178 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [0,0,0,0,0,0|1,0,0]=1 179 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [0,0,0,0,0,0|1,0,0]=1 180 B10R1.17 O=C\C=C\c1cccnn1 Amb18642956 [0,0,0,0,0,0|2,0,0]=2 181 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [0,0,0,0,0,0|1,0,0]=1 182 B10R1.17 O=C\C=C\c1ccncn1 Amb18642951 [0,0,0,0,0,0|2,0,0]=2 183 B10R1.17 O=C\C=C\c1cnccn1 Amb35600870 [0,0,0,0,0,0|2,0,0]=2 184 B10R1.17 O=C\C=C\c1cncnc1 Amb25130263 [0,0,0,0,0,0|2,0,0]=2 185 B10R1.17 O=C\C=C\c1ncccn1 Amb33270347 [0,0,0,0,0,0|2,0,0]=2 186 B10R1.17 OCC#Cc1ccccc1 Amb534712 [0,0,0,0,0,0|0,0,4]=4 187 B10R1.17 OCCCc1ccccc1 Amb3939054 [0,0,0,0,0,0|0,0,4]=4 188 B10R1.17 OCCNc1ccccc1 Amb3940335 [0,0,0,0,0,0|1,0,3]=4 189 B10R1.17 OCCOc1ccccc1 Amb2209344 [0,0,0,0,0,0|1,0,3]=4 190 B10R1.17 OCOCc1ccccc1 Amb25727798 [0,0,0,0,0,0|1,0,3]=4 191 B10R1.17 OCSCc1ccccc1 Amb27839241 [0,0,0,0,0,0|1,0,3]=4 192 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [0,0,0,0,0,0|1,0,2]=3 193 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [0,0,0,0,0,0|1,0,2]=3 194 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [0,0,0,0,0,0|0,0,2]=2 195 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [0,0,0,0,0,0|1,0,2]=3 196 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [0,0,0,0,0,0|1,0,2]=3 197 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [0,0,0,0,0,0|1,0,2]=3 198 B10R1.17 OC\C=C\c1ccncn1 Amb27775610 [0,0,0,0,0,0|2,0,2]=4 199 B10R1.17 OC\C=C\c1cnccn1 Amb33429679 [0,0,0,0,0,0|2,0,2]=4 200 B10R1.17 OC\C=C\c1cncnc1 Amb27491218 [0,0,0,0,0,0|2,0,2]=4 201 B10R1.17 OC\C=C\c1ncccn1 Amb33270341 [0,0,0,0,0,0|2,0,2]=4 202 B10R1.17 ONCCc1ccccc1 Amb33544180 [0,0,0,0,0,0|1,0,3]=4 203 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [0,0,0,0,0,0|1,0,2]=3 204 B10R1.17 O\N=C\Cc1ccccn1 Amb27767920 [0,0,0,0,0,0|2,0,2]=4 205 B10R1.17 O\N=C\Cc1ccncc1 Amb28186073 [0,0,0,0,0,0|2,0,2]=4 206 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [0,0,0,0,0,0|2,0,1]=3 207 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [0,0,0,0,0,0|1,1,2]=4 208 B10R1.17 SCC#Cc1ccccc1 Amb27454293 [0,0,0,0,0,0|0,1,3]=4 209 B10R1.17 SCCCc1ccccc1 Amb6255807 [0,0,0,0,0,0|0,1,3]=4 210 B10R1.17 SCCOc1ccccc1 Amb2794986 [0,0,0,0,0,0|1,1,2]=4 211 B10R1.17 SCCSc1ccccc1 Amb13881734 [0,0,0,0,0,0|1,1,2]=4 212 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [0,0,0,0,0,0|0,1,1]=2 213 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [0,0,0,0,0,0|2,0,2]=4 214 B10R1.17 [N-]=[N+]=NCc1ccccc1 Amb2721052 [0,0,0,0,0,0|3,0,1]=4 215 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [0,0,0,0,0,0|1,0,3]=4 216 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 217 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,0]=2 218 B9R1.8 Br\C=C/c1ccccn1 Amb25200984 [1,0,0,0,0,0|2,0,0]=3 219 B9R1.8 Br\C=C/c1cccnc1 Amb24085678 [1,0,0,0,0,0|2,0,0]=3 220 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [1,0,0,0,0,0|1,0,0]=2 221 B9R1.8 Br\C=C\c1ccccn1 Amb33134753 [1,0,0,0,0,0|2,0,0]=3 222 B9R1.8 Br\C=C\c1cccnc1 Amb33134788 [1,0,0,0,0,0|2,0,0]=3 223 B9R1.8 Br\C=C\c1ccncc1 Amb27756767 [1,0,0,0,0,0|2,0,0]=3 224 B9R1.8 C#COc1ccccc1 Amb27194589 [1,0,0,0,0,0|1,0,2]=4 225 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|1,0,2]=4 226 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|1,0,2]=4 227 B9R1.8 C#NCc1ccccc1 Amb31132452 [1,0,0,0,0,0|1,0,2]=4 228 B9R1.8 C=C=Cc1cnccn1 Amb27966298 [1,0,0,0,0,0|2,0,1]=4 229 B9R1.8 C=CCN1C=CC=CC1 Amb26480044 [1,0,0,0,0,0|1,0,2]=4 230 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [1,0,0,0,0,0|1,0,1]=3 231 B9R1.8 C=CCc1ccccc1 Amb2599341 [1,0,0,0,0,0|0,0,1]=2 232 B9R1.8 C=CCc1cccnc1 Amb24477831 [1,0,0,0,0,0|1,0,1]=3 233 B9R1.8 C=CCc1cncnc1 Amb27431822 [1,0,0,0,0,0|2,0,1]=4 234 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|1,0,0]=2 235 B9R1.8 C=COc1cccnc1 Amb24085952 [1,0,0,0,0,0|2,0,0]=3 236 B9R1.8 C=CSc1ccccc1 Amb8387516 [1,0,0,0,0,0|1,0,0]=2 237 B9R1.8 C=NCc1ccccc1 Amb28256747 [1,0,0,0,0,0|1,0,1]=3 238 B9R1.8 C=NCc1ccncc1 Amb27758185 [1,0,0,0,0,0|2,0,1]=4 239 B9R1.8 CC#Cc1ccccc1 Amb8513696 [1,0,0,0,0,0|0,0,3]=4 240 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|0,0,3]=4 241 B9R1.8 CCNc1ccccc1 Amb3940127 [1,0,0,0,0,0|1,0,2]=4 242 B9R1.8 CCOc1ccccc1 Amb2842270 [1,0,0,0,0,0|1,0,2]=4 243 B9R1.8 CCSc1ccccc1 Amb2687929 [1,0,0,0,0,0|1,0,2]=4 244 B9R1.8 CNCc1ccccc1 Amb3699562 [1,0,0,0,0,0|1,0,2]=4 245 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|2,0,1]=4 246 B9R1.8 CNNc1ccccc1 Amb27969267 [1,0,0,0,0,0|2,0,1]=4 247 B9R1.8 COCc1ccccc1 Amb2782562 [1,0,0,0,0,0|1,0,2]=4 248 B9R1.8 CSSc1ccccc1 Amb4008371 [1,0,0,0,0,0|2,0,1]=4 249 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|1,0,2]=4 250 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [1,0,0,0,0,0|0,0,1]=2 251 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [1,0,0,0,0,0|0,0,1]=2 252 B9R1.8 C\C=C\c1cnccn1 Amb27492890 [1,0,0,0,0,0|2,0,1]=4 253 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [1,0,0,0,0,0|1,0,1]=3 254 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [1,0,0,0,0,0|2,0,1]=4 255 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [1,0,0,0,0,0|1,0,1]=3 256 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [1,0,0,0,0,0|2,0,1]=4 257 B9R1.8 ClCCc1ccccc1 Amb535682 [1,0,0,0,0,0|1,0,2]=4 258 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,1]=4 259 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,0]=2 260 B9R1.8 Cl\C=C\c1cccnc1 Amb27435566 [1,0,0,0,0,0|2,0,0]=3 261 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,0]=2 262 B9R1.8 F\C=C\c1ccccn1 Amb27258216 [1,0,0,0,0,0|2,0,0]=3 263 B9R1.8 IC#Cc1ccccc1 Amb26442219 [1,0,0,0,0,0|1,0,2]=4 264 B9R1.8 ICCc1ccccc1 Amb8515353 [1,0,0,0,0,0|1,0,2]=4 265 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,0]=2 266 B9R1.8 N#CCc1ccccc1 Amb3598087 [1,0,0,0,0,0|1,0,2]=4 267 B9R1.8 N#CNc1ccccc1 Amb9783273 [1,0,0,0,0,0|2,0,1]=4 268 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 269 B9R1.8 N#CSc1ccccc1 Amb6892469 [1,0,0,0,0,0|2,0,1]=4 270 B9R1.8 N#C[Se]c1ccccc1 Amb2690321 [1,0,0,0,0,0|2,0,1]=4 271 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,2]=4 272 B9R1.8 NCCc1ccccc1 Amb2792829 [1,0,0,0,0,0|1,0,2]=4 273 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,1]=4 274 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,1]=4 275 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,1]=4 276 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,1]=4 277 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,1]=4 278 B9R1.8 NNCc1ccccc1 Amb8513062 [1,0,0,0,0,0|2,0,1]=4 279 B9R1.8 NNCc1ccccc1 Amb9826089 [1,0,0,0,0,0|2,0,1]=4 280 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,1]=4 281 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,1]=4 282 B9R1.8 NOCc1ccccc1 Amb6600539 [1,0,0,0,0,0|2,0,1]=4 283 B9R1.8 N\C=C/c1ccccn1 Amb27443779 [1,0,0,0,0,0|2,0,0]=3 284 B9R1.8 N\C=C/c1cccnc1 Amb28137814 [1,0,0,0,0,0|2,0,0]=3 285 B9R1.8 N\C=C/c1ccncc1 Amb24068867 [1,0,0,0,0,0|2,0,0]=3 286 B9R1.8 N\C=C\c1cccnc1 Amb27776892 [1,0,0,0,0,0|2,0,0]=3 287 B9R1.8 N\C=C\c1ncccn1 Amb27967499 [1,0,0,0,0,0|3,0,0]=4 288 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,0]=3 289 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [1,0,0,0,0,0|2,0,0]=3 290 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [1,0,0,0,0,0|2,0,0]=3 291 B9R1.8 N\N=C\c1cccnc1 Amb8485037 [1,0,0,0,0,0|3,0,0]=4 292 B9R1.8 N\N=C\c1ccncc1 Amb27837636 [1,0,0,0,0,0|3,0,0]=4 293 B9R1.8 O=C=Cc1cccnc1 Amb27425121 [1,0,0,0,0,0|1,0,1]=3 294 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [1,0,0,0,0,0|1,0,1]=3 295 B9R1.8 O=C=Nc1ccccn1 Amb9780818 [1,0,0,0,0,0|2,0,1]=4 296 B9R1.8 O=C=Nc1cccnc1 Amb33532890 [1,0,0,0,0,0|2,0,1]=4 297 B9R1.8 O=C=Nc1ccncc1 Amb9780817 [1,0,0,0,0,0|2,0,1]=4 298 B9R1.8 O=CCc1ccccc1 Amb3939950 [1,0,0,0,0,0|0,0,1]=2 299 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,1]=3 300 B9R1.8 O=CCc1cccnc1 Amb8011002 [1,0,0,0,0,0|1,0,1]=3 301 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,1]=3 302 B9R1.8 O=CCc1cnccn1 Amb25124492 [1,0,0,0,0,0|2,0,1]=4 303 B9R1.8 O=CCc1cncnc1 Amb24634482 [1,0,0,0,0,0|2,0,1]=4 304 B9R1.8 O=CCc1ncccn1 Amb24061341 [1,0,0,0,0,0|2,0,1]=4 305 B9R1.8 O=CNc1ccccc1 Amb2613772 [1,0,0,0,0,0|1,0,0]=2 306 B9R1.8 O=CNc1ccccn1 Amb3319168 [1,0,0,0,0,0|2,0,0]=3 307 B9R1.8 O=CNc1cccnc1 Amb4019648 [1,0,0,0,0,0|2,0,0]=3 308 B9R1.8 O=CNc1cccnn1 Amb29872451 [1,0,0,0,0,0|3,0,0]=4 309 B9R1.8 O=CNc1ccnnc1 Amb27200081 [1,0,0,0,0,0|3,0,0]=4 310 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|1,0,0]=2 311 B9R1.8 O=C\C=C1/N=CC=CN1 Amb28401450 [1,0,0,0,0,0|2,0,0]=3 312 B9R1.8 O=C\C=C1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|1,0,0]=2 313 B9R1.8 O=C\C=C1\C=CNC=N1 Amb24068339 [1,0,0,0,0,0|2,0,0]=3 314 B9R1.8 O=N\C=C1\C=CNN=C1 Amb27870945 [1,0,0,0,0,0|3,0,0]=4 315 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [1,0,0,0,0,0|2,0,0]=3 316 B9R1.8 OCCc1ccccc1 Amb2793058 [1,0,0,0,0,0|0,0,3]=4 317 B9R1.8 OCSc1ccccc1 Amb27776457 [1,0,0,0,0,0|1,0,2]=4 318 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,2]=4 319 B9R1.8 ONCc1ccccc1 Amb9825936 [1,0,0,0,0,0|1,0,2]=4 320 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [1,0,0,0,0,0|1,0,1]=3 321 B9R1.8 O\N=C/c1ccncc1 Amb9821776 [1,0,0,0,0,0|2,0,1]=4 322 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,1]=3 323 B9R1.8 O\N=C\c1ccccn1 Amb719680 [1,0,0,0,0,0|2,0,1]=4 324 B9R1.8 O\N=C\c1cccnc1 Amb3427823 [1,0,0,0,0,0|2,0,1]=4 325 B9R1.8 O\N=C\c1ccncc1 Amb1793802 [1,0,0,0,0,0|2,0,1]=4 326 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 327 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,0]=3 328 B9R1.8 S=CNc1cccnc1 Amb27492962 [1,0,0,0,0,0|2,1,0]=4 329 B9R1.8 SCCc1ccccc1 Amb6255605 [1,0,0,0,0,0|0,1,2]=4 330 B9R1.8 SSCc1ccccc1 Amb27646980 [1,0,0,0,0,0|1,1,1]=4 331 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|1,0,2]=4 332 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,0]=3 333 B9R1.8 [N-]=[N+]=Cc1ccccn1 Amb27945596 [1,0,0,0,0,0|3,0,0]=4 334 B9R1.8 [N-]=[N+]=Nc1ccccc1 Amb6892570 [1,0,0,0,0,0|3,0,0]=4 335 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,2]=4 336 B9R1.8 [NH3+]OCc1ccccc1 Amb9786371 [1,0,0,0,0,0|2,0,1]=4 337 B9R1.8 [O-][N+]#Cc1ccccc1 Amb25951967 [1,0,0,0,0,0|1,0,2]=4 338 B11R1.1 BrC\C=C\c1ccc(Br)cc1 Amb28388511 [0,1,0,0,0,0|1,0,1]=3 339 B11R1.1 C#C\C=C\c1ccc(F)cc1 Amb33202432 [0,1,0,0,0,0|1,0,1]=3 340 B11R1.1 C=CCCc1ccc(Br)cc1 Amb6298956 [0,1,0,0,0,0|1,0,2]=4 341 B11R1.1 C=CCCc1ccc(C)cc1 Amb6299000 [0,1,0,0,0,0|1,0,2]=4 342 B11R1.1 C=CCCc1ccc(F)cc1 Amb2721507 [0,1,0,0,0,0|1,0,2]=4 343 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [0,1,0,0,0,0|1,0,2]=4 344 B11R1.1 C=CCNc1ccc(Br)cc1 Amb17306795 [0,1,0,0,0,0|2,0,1]=4 345 B11R1.1 C=CCNc1ccc(C)cc1 Amb17306868 [0,1,0,0,0,0|2,0,1]=4 346 B11R1.1 C=CCNc1ccc(F)cc1 Amb17306180 [0,1,0,0,0,0|2,0,1]=4 347 B11R1.1 C=CCNc1ccc(I)cc1 Amb17306247 [0,1,0,0,0,0|2,0,1]=4 348 B11R1.1 C=CCNc1ccc(N)cc1 Amb18991898 [0,1,0,0,0,0|2,0,1]=4 349 B11R1.1 C=CCOc1ccc(Br)cc1 Amb5722388 [0,1,0,0,0,0|2,0,1]=4 350 B11R1.1 C=CCOc1ccc(C)cc1 Amb3940652 [0,1,0,0,0,0|2,0,1]=4 351 B11R1.1 C=CCOc1ccc(Cl)cc1 Amb17933920 [0,1,0,0,0,0|2,0,1]=4 352 B11R1.1 C=CCOc1ccc(F)cc1 Amb27214032 [0,1,0,0,0,0|2,0,1]=4 353 B11R1.1 C=CCOc1ccc(I)cc1 Amb25699607 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.1 C=CCOc1ccc(N)cc1 Amb2592767 [0,1,0,0,0,0|2,0,1]=4 355 B11R1.1 C=CCOc1ccc(N)cc1 Amb6541454 [0,1,0,0,0,0|2,0,1]=4 356 B11R1.1 C=CCOc1ccc(O)cc1 Amb2612084 [0,1,0,0,0,0|2,0,1]=4 357 B11R1.1 C=CCSc1ccc(Br)cc1 Amb4013518 [0,1,0,0,0,0|2,0,1]=4 358 B11R1.1 C=CCSc1ccc(C)cc1 Amb3836102 [0,1,0,0,0,0|2,0,1]=4 359 B11R1.1 C=CCSc1ccc(Cl)cc1 Amb3836125 [0,1,0,0,0,0|2,0,1]=4 360 B11R1.1 C=CCSc1ccc(F)cc1 Amb24615573 [0,1,0,0,0,0|2,0,1]=4 361 B11R1.1 C=CCSc1ccc(O)cc1 Amb8394315 [0,1,0,0,0,0|2,0,1]=4 362 B11R1.1 C=COCc1ccc(Br)cc1 Amb28046575 [0,1,0,0,0,0|2,0,1]=4 363 B11R1.1 C=COCc1ccc(Cl)cc1 Amb27976232 [0,1,0,0,0,0|2,0,1]=4 364 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [0,1,0,0,0,0|1,0,0]=2 365 B11R1.1 C=C\C=C\c1ccc(F)cc1 Amb26993814 [0,1,0,0,0,0|1,0,0]=2 366 B11R1.1 CC=C=Cc1ccc(F)cc1 Amb27246329 [0,1,0,0,0,0|1,0,1]=3 367 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [0,1,0,0,0,0|1,0,1]=3 368 B11R1.1 CC\C=C\c1ccc(Br)cc1 Amb26968483 [0,1,0,0,0,0|1,0,1]=3 369 B11R1.1 CC\C=C\c1ccc(C)nc1 Amb27952324 [0,1,0,0,0,0|2,0,1]=4 370 B11R1.1 CC\N=C\c1ccc(O)cc1 Amb3777289 [0,1,0,0,0,0|2,0,1]=4 371 B11R1.1 CN\C=N\c1ccc(C)cc1 Amb27596513 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.1 CN\N=C\c1ccc(Cl)cc1 Amb27484285 [0,1,0,0,0,0|3,0,0]=4 373 B11R1.1 CN\N=C\c1ccc(F)cc1 Amb17805862 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.1 CN\N=C\c1ccc(O)cc1 Amb17696985 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.1 CO\C=C\c1ccc(Br)nc1 Amb27977887 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.1 CO\C=C\c1ccc(C)nc1 Amb25201672 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.1 CO\C=N\c1ccc(C)cc1 Amb21936895 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.1 CO\C=N\c1ccc(Cl)cc1 Amb21936899 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.1 CO\C=N\c1ccc(F)cc1 Amb34912872 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.1 CO\N=C\c1ccc(Br)cc1 Amb28282446 [0,1,0,0,0,0|3,0,0]=4 381 B11R1.1 CO\N=C\c1ccc(C)cc1 Amb27652457 [0,1,0,0,0,0|3,0,0]=4 382 B11R1.1 CO\N=C\c1ccc(N)cc1 Amb27439385 [0,1,0,0,0,0|3,0,0]=4 383 B11R1.1 C\C=C\CN1C=CC(=O)C=C1 Amb27252849 [0,1,0,0,0,0|2,0,1]=4 384 B11R1.1 C\C=C\Cc1ccc(C)nc1 Amb25981807 [0,1,0,0,0,0|2,0,1]=4 385 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [0,1,0,0,0,0|1,0,1]=3 386 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [0,1,0,0,0,0|1,0,1]=3 387 B11R1.1 C\C=C\Oc1ccc(N)cc1 Amb27859329 [0,1,0,0,0,0|2,0,0]=3 388 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [0,1,0,0,0,0|0,0,2]=3 389 B11R1.1 Cc1ccc(CCC=O)cn1 Amb28124472 [0,1,0,0,0,0|1,0,2]=4 390 B11R1.1 Cc1ccc(CN=C=O)cc1 Amb3939296 [0,1,0,0,0,0|1,0,2]=4 391 B11R1.1 Cc1ccc(CNC=O)cc1 Amb1916037 [0,1,0,0,0,0|1,0,1]=3 392 B11R1.1 Cc1ccc(NNC=O)cc1 Amb2721110 [0,1,0,0,0,0|2,0,0]=3 393 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [0,1,0,0,0,0|1,0,1]=3 394 B11R1.1 Cc1ccc(O\C=C/Cl)cc1 Amb27400345 [0,1,0,0,0,0|2,0,0]=3 395 B11R1.1 Cc1ccc(SCC=O)cc1 Amb17082904 [0,1,0,0,0,0|1,0,1]=3 396 B11R1.1 Cc1ccc(\C=C/C=O)cc1 Amb27268490 [0,1,0,0,0,0|0,0,0]=1 397 B11R1.1 Cc1ccc(\C=C\C#N)cc1 Amb17231964 [0,1,0,0,0,0|1,0,1]=3 398 B11R1.1 Cc1ccc(\C=C\C#N)cn1 Amb28341277 [0,1,0,0,0,0|2,0,1]=4 399 B11R1.1 Cc1ccc(\C=C\C#N)nc1 Amb27805885 [0,1,0,0,0,0|2,0,1]=4 400 B11R1.1 Cc1ccc(\C=C\C=O)cc1 Amb17232009 [0,1,0,0,0,0|0,0,0]=1 401 B11R1.1 Cc1ccc(\C=C\C=O)cn1 Amb27845226 [0,1,0,0,0,0|1,0,0]=2 402 B11R1.1 Cc1ccc(\C=C\C=O)nc1 Amb33448753 [0,1,0,0,0,0|1,0,0]=2 403 B11R1.1 Cc1ccc(\C=C\CCl)cc1 Amb26620547 [0,1,0,0,0,0|1,0,1]=3 404 B11R1.1 Cc1ccc(\C=C\CCl)cn1 Amb27246941 [0,1,0,0,0,0|2,0,1]=4 405 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [0,1,0,0,0,0|1,0,1]=3 406 B11R1.1 Cc1ccc(\C=C\CN)cn1 Amb33429954 [0,1,0,0,0,0|2,0,1]=4 407 B11R1.1 Cc1ccc(\C=C\CN)nc1 Amb28206327 [0,1,0,0,0,0|2,0,1]=4 408 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [0,1,0,0,0,0|0,0,2]=3 409 B11R1.1 Cc1ccc(\C=C\CO)cn1 Amb33359222 [0,1,0,0,0,0|1,0,2]=4 410 B11R1.1 Cc1ccc(\C=C\CO)nc1 Amb33359294 [0,1,0,0,0,0|1,0,2]=4 411 B11R1.1 Cc1ccc(\C=N\CO)cc1 Amb27598320 [0,1,0,0,0,0|1,0,2]=4 412 B11R1.1 Cc1cnc(\C=C\C=O)cn1 Amb33374304 [0,1,0,0,0,0|2,0,0]=3 413 B11R1.1 Cc1ncc(\C=C/C=O)cn1 Amb27268009 [0,1,0,0,0,0|2,0,0]=3 414 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [0,1,0,0,0,0|1,0,1]=3 415 B11R1.1 Cl\C=C\Oc1ccc(Cl)cc1 Amb27878895 [0,1,0,0,0,0|2,0,0]=3 416 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [0,1,0,0,0,0|1,0,1]=3 417 B11R1.1 Clc1ccc(\C=C\CBr)cn1 Amb2696456 [0,1,0,0,0,0|2,0,1]=4 418 B11R1.1 Fc1ccc(\C=C\CBr)cc1 Amb25923286 [0,1,0,0,0,0|1,0,1]=3 419 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [0,1,0,0,0,0|1,0,1]=3 420 B11R1.1 Fc1ccc(\C=C\CS)cc1 Amb33201386 [0,1,0,0,0,0|0,1,1]=3 421 B11R1.1 N#C\C=C\c1ccc(Br)cc1 Amb2708676 [0,1,0,0,0,0|1,0,1]=3 422 B11R1.1 N#C\C=C\c1ccc(Cl)cc1 Amb1158219 [0,1,0,0,0,0|1,0,1]=3 423 B11R1.1 N#C\C=C\c1ccc(Cl)cn1 Amb28043407 [0,1,0,0,0,0|2,0,1]=4 424 B11R1.1 N#C\C=C\c1ccc(F)cc1 Amb2688082 [0,1,0,0,0,0|1,0,1]=3 425 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [0,1,0,0,0,0|1,0,1]=3 426 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb30584648 [0,1,0,0,0,0|1,0,1]=3 427 B11R1.1 NC\C=C\c1ccc(Br)cn1 Amb33450883 [0,1,0,0,0,0|2,0,1]=4 428 B11R1.1 NC\C=C\c1ccc(Br)nc1 Amb33388372 [0,1,0,0,0,0|2,0,1]=4 429 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [0,1,0,0,0,0|1,0,1]=3 430 B11R1.1 NC\C=C\c1ccc(Cl)cn1 Amb33223969 [0,1,0,0,0,0|2,0,1]=4 431 B11R1.1 NC\C=C\c1ccc(Cl)nc1 Amb33261581 [0,1,0,0,0,0|2,0,1]=4 432 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [0,1,0,0,0,0|1,0,1]=3 433 B11R1.1 NC\C=C\c1ccc(F)cn1 Amb33317376 [0,1,0,0,0,0|2,0,1]=4 434 B11R1.1 NC\C=C\c1ccc(F)nc1 Amb33425818 [0,1,0,0,0,0|2,0,1]=4 435 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb33361954 [0,1,0,0,0,0|1,0,1]=3 436 B11R1.1 N\C=N\Nc1ccc(N)cc1 Amb24637265 [0,1,0,0,0,0|3,0,0]=4 437 B11R1.1 N\N=C\Cc1ccc(F)cc1 Amb27968899 [0,1,0,0,0,0|2,0,1]=4 438 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [0,1,0,0,0,0|0,0,2]=3 439 B11R1.1 Nc1ccc(CN=C=O)cc1 Amb28346898 [0,1,0,0,0,0|1,0,2]=4 440 B11R1.1 Nc1ccc(C\C=C\Br)cc1 Amb27217330 [0,1,0,0,0,0|1,0,1]=3 441 B11R1.1 Nc1ccc(NCC=O)cc1 Amb27607100 [0,1,0,0,0,0|1,0,1]=3 442 B11R1.1 Nc1ccc(SCC=O)cc1 Amb30012112 [0,1,0,0,0,0|1,0,1]=3 443 B11R1.1 O=C1C=CN(C\C=C\Cl)C=C1 Amb27593698 [0,1,0,0,0,0|2,0,1]=4 444 B11R1.1 O=C=NCc1ccc(Br)cc1 Amb3939390 [0,1,0,0,0,0|1,0,2]=4 445 B11R1.1 O=C=NCc1ccc(Cl)cc1 Amb5750718 [0,1,0,0,0,0|1,0,2]=4 446 B11R1.1 O=C=NCc1ccc(F)cc1 Amb3939292 [0,1,0,0,0,0|1,0,2]=4 447 B11R1.1 O=CC#Cc1ccc(Br)cc1 Amb18115173 [0,1,0,0,0,0|0,0,2]=3 448 B11R1.1 O=CC#Cc1ccc(F)cc1 Amb18117287 [0,1,0,0,0,0|0,0,2]=3 449 B11R1.1 O=CC#Cc1ccc(O)cc1 Amb18117760 [0,1,0,0,0,0|0,0,2]=3 450 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [0,1,0,0,0,0|0,0,2]=3 451 B11R1.1 O=CCCc1ccc(Br)cn1 Amb24704728 [0,1,0,0,0,0|1,0,2]=4 452 B11R1.1 O=CCCc1ccc(Br)nc1 Amb33388882 [0,1,0,0,0,0|1,0,2]=4 453 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [0,1,0,0,0,0|0,0,2]=3 454 B11R1.1 O=CCCc1ccc(Cl)cn1 Amb26462754 [0,1,0,0,0,0|1,0,2]=4 455 B11R1.1 O=CCCc1ccc(Cl)nc1 Amb33220658 [0,1,0,0,0,0|1,0,2]=4 456 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [0,1,0,0,0,0|0,0,2]=3 457 B11R1.1 O=CCCc1ccc(F)nc1 Amb33225081 [0,1,0,0,0,0|1,0,2]=4 458 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [0,1,0,0,0,0|0,0,2]=3 459 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [0,1,0,0,0,0|0,0,2]=3 460 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [0,1,0,0,0,0|0,0,2]=3 461 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [0,1,0,0,0,0|1,0,1]=3 462 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [0,1,0,0,0,0|1,0,1]=3 463 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [0,1,0,0,0,0|1,0,1]=3 464 B11R1.1 O=CCSc1ccc(Br)cc1 Amb17082907 [0,1,0,0,0,0|1,0,1]=3 465 B11R1.1 O=CCSc1ccc(Cl)cc1 Amb17082906 [0,1,0,0,0,0|1,0,1]=3 466 B11R1.1 O=CCSc1ccc(F)cc1 Amb17082905 [0,1,0,0,0,0|1,0,1]=3 467 B11R1.1 O=CNCc1ccc(Br)cc1 Amb27410847 [0,1,0,0,0,0|1,0,1]=3 468 B11R1.1 O=CNCc1ccc(Br)cn1 Amb27176625 [0,1,0,0,0,0|2,0,1]=4 469 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [0,1,0,0,0,0|1,0,1]=3 470 B11R1.1 O=CNCc1ccc(Cl)nc1 Amb27468718 [0,1,0,0,0,0|2,0,1]=4 471 B11R1.1 O=CNCc1ccc(F)cn1 Amb27840373 [0,1,0,0,0,0|2,0,1]=4 472 B11R1.1 O=CNNc1ccc(Br)cc1 Amb25147924 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.1 O=COCc1ccc(Cl)nc1 Amb27451108 [0,1,0,0,0,0|2,0,1]=4 474 B11R1.1 O=C\C=C\c1ccc(Br)cc1 Amb1787168 [0,1,0,0,0,0|0,0,0]=1 475 B11R1.1 O=C\C=C\c1ccc(Br)cn1 Amb27245473 [0,1,0,0,0,0|1,0,0]=2 476 B11R1.1 O=C\C=C\c1ccc(Br)nc1 Amb27796539 [0,1,0,0,0,0|1,0,0]=2 477 B11R1.1 O=C\C=C\c1ccc(Cl)cc1 Amb34005096 [0,1,0,0,0,0|0,0,0]=1 478 B11R1.1 O=C\C=C\c1ccc(Cl)cn1 Amb33223968 [0,1,0,0,0,0|1,0,0]=2 479 B11R1.1 O=C\C=C\c1ccc(Cl)nc1 Amb33220743 [0,1,0,0,0,0|1,0,0]=2 480 B11R1.1 O=C\C=C\c1ccc(F)cc1 Amb6296447 [0,1,0,0,0,0|0,0,0]=1 481 B11R1.1 O=C\C=C\c1ccc(F)cn1 Amb33317377 [0,1,0,0,0,0|1,0,0]=2 482 B11R1.1 O=C\C=C\c1ccc(F)nc1 Amb33425820 [0,1,0,0,0,0|1,0,0]=2 483 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [0,1,0,0,0,0|0,0,0]=1 484 B11R1.1 O=C\C=C\c1ncc(Br)cn1 Amb33334786 [0,1,0,0,0,0|2,0,0]=3 485 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [0,1,0,0,0,0|1,0,0]=2 486 B11R1.1 OC\C=C\c1ccc(Br)cc1 Amb5559245 [0,1,0,0,0,0|0,0,2]=3 487 B11R1.1 OC\C=C\c1ccc(Br)nc1 Amb33388370 [0,1,0,0,0,0|1,0,2]=4 488 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [0,1,0,0,0,0|0,0,2]=3 489 B11R1.1 OC\C=C\c1ccc(Cl)nc1 Amb27980589 [0,1,0,0,0,0|1,0,2]=4 490 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [0,1,0,0,0,0|0,0,2]=3 491 B11R1.1 OC\C=C\c1ccc(F)cn1 Amb33317353 [0,1,0,0,0,0|1,0,2]=4 492 B11R1.1 OC\C=C\c1ccc(F)nc1 Amb33425603 [0,1,0,0,0,0|1,0,2]=4 493 B11R1.1 OC\C=C\c1ccc(O)cc1 Amb2445151 [0,1,0,0,0,0|0,0,2]=3 494 B11R1.1 O\N=C/Cc1ccc(O)cc1 Amb27833768 [0,1,0,0,0,0|1,0,2]=4 495 B11R1.1 O\N=C\Cc1ccc(O)cc1 Amb25705671 [0,1,0,0,0,0|1,0,2]=4 496 B11R1.1 O\N=C\Nc1ccc(Cl)cc1 Amb27606304 [0,1,0,0,0,0|2,0,1]=4 497 B11R1.16 C#CCC(=O)c1ccccc1 Amb27794052 [0,1,0,0,0,0|1,0,2]=4 498 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,1,0,0,0,0|2,0,1]=4 499 B11R1.16 C=C(CCBr)c1ccccc1 Amb27646402 [0,1,0,0,0,0|1,0,2]=4 500 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,1,0,0,0,0|1,0,2]=4 501 B11R1.16 C=C(CCCl)c1ccccc1 Amb28120007 [0,1,0,0,0,0|1,0,2]=4 502 B11R1.16 C=C(CCN)c1ccccc1 Amb32953172 [0,1,0,0,0,0|1,0,2]=4 503 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.16 C=C(N=[N+]=[N-])c1ccccc1 Amb27863728 [0,1,0,0,0,0|3,0,0]=4 506 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [0,1,0,0,0,0|1,0,0]=2 507 B11R1.16 C=C=C[C@@H](N)c1ccccc1 Amb28241475 [0,1,0,0,0,0|1,0,2]=4 508 B11R1.16 C=C=C[C@H](O)c1ccccc1 Amb27207074 [0,1,0,0,0,0|1,0,2]=4 509 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|1,0,1]=3 510 B11R1.16 C=CCC(=O)c1ccccn1 Amb17334265 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.16 C=CCC(=O)c1cccnc1 Amb17334267 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.16 C=CCC(=O)c1ccncc1 Amb17334269 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [0,1,0,0,0,0|1,0,2]=4 514 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [0,1,0,0,0,0|1,0,2]=4 515 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [0,1,0,0,0,0|1,0,2]=4 516 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|1,0,2]=4 518 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|1,0,2]=4 519 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|1,0,2]=4 520 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [0,1,0,0,0,0|1,0,2]=4 521 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [0,1,0,0,0,0|1,0,2]=4 522 B11R1.16 C=CNC(=O)c1ccncc1 Amb27170598 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.16 C=CNC(C)c1ccccc1 Amb27455084 [0,1,0,0,0,0|2,0,1]=4 524 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,0,0,0,0|2,0,0]=3 525 B11R1.16 C=COC(C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|2,0,1]=4 526 B11R1.16 C=C\C=C(\N)c1ccccc1 Amb26578846 [0,1,0,0,0,0|1,0,0]=2 527 B11R1.16 C=C\C=C(\N)c1ccccn1 Amb24579514 [0,1,0,0,0,0|2,0,0]=3 528 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,1,0,0,0,0|1,0,2]=4 529 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [0,1,0,0,0,0|0,0,2]=3 530 B11R1.16 CC(CC=O)c1ccccn1 Amb27965829 [0,1,0,0,0,0|1,0,2]=4 531 B11R1.16 CC(N=C=O)c1ccccc1 Amb2092860 [0,1,0,0,0,0|1,0,2]=4 532 B11R1.16 CC(NC=O)c1ccccc1 Amb4020107 [0,1,0,0,0,0|1,0,1]=3 533 B11R1.16 CC(NC=O)c1ccccn1 Amb10070157 [0,1,0,0,0,0|2,0,1]=4 534 B11R1.16 CC(NC=O)c1cccnc1 Amb10070156 [0,1,0,0,0,0|2,0,1]=4 535 B11R1.16 CC(NC=O)c1ccncc1 Amb10070155 [0,1,0,0,0,0|2,0,1]=4 536 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,1,0,0,0,0|2,0,1]=4 537 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|1,0,1]=3 538 B11R1.16 CC(\C=C\Br)c1ccccc1 Amb33134868 [0,1,0,0,0,0|1,0,1]=3 539 B11R1.16 CC(\C=N\O)c1ccccc1 Amb4018201 [0,1,0,0,0,0|1,0,2]=4 540 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,1,0,0,0,0|1,0,2]=4 541 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,1,0,0,0,0|2,0,1]=4 542 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,1,0,0,0,0|2,0,1]=4 543 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,1,0,0,0,0|2,0,1]=4 544 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,1,0,0,0,0|2,0,1]=4 545 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,1,0,0,0,0|2,0,1]=4 546 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,1,0,0,0,0|2,0,1]=4 547 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,1,0,0,0,0|2,0,1]=4 548 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,1,0,0,0,0|1,0,1]=3 549 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,1,0,0,0,0|1,0,1]=3 550 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,1,0,0,0,0|2,0,1]=4 551 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,1,0,0,0,0|2,0,0]=3 552 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,1,0,0,0,0|2,0,1]=4 553 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,1,0,0,0,0|3,0,0]=4 554 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [0,1,0,0,0,0|2,0,0]=3 555 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [0,1,0,0,0,0|3,0,0]=4 556 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,1,0,0,0,0|2,0,1]=4 557 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.16 CO\N=C(/N)c1ccccc1 Amb18224270 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.16 CP(CC=O)c1ccccc1 Amb28241337 [0,1,0,0,0,0|1,0,1]=3 560 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,1,0,0,0,0|2,0,1]=4 561 B11R1.16 CS\N=C(\N)c1ccccc1 Amb28365468 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [0,1,0,0,0,0|0,0,2]=3 563 B11R1.16 C[C@@H](N=C=O)c1ccccc1 Amb3939766 [0,1,0,0,0,0|1,0,2]=4 564 B11R1.16 C[C@@H](NC=S)c1ccccc1 Amb27229087 [0,1,0,0,0,0|1,1,1]=4 565 B11R1.16 C[C@@H](NN=O)c1ccccc1 Amb27249670 [0,1,0,0,0,0|2,0,1]=4 566 B11R1.16 C[C@H](N=C=O)c1ccccc1 Amb2689348 [0,1,0,0,0,0|1,0,2]=4 567 B11R1.16 C[C@H](NC=S)c1ccccc1 Amb28071285 [0,1,0,0,0,0|1,1,1]=4 568 B11R1.16 C\C(=C/C#N)c1ccccc1 Amb32941900 [0,1,0,0,0,0|1,0,1]=3 569 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [0,1,0,0,0,0|0,0,0]=1 570 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [0,1,0,0,0,0|1,0,1]=3 571 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [0,1,0,0,0,0|1,0,1]=3 572 B11R1.16 C\C(=C/CN)c1ccccn1 Amb31099542 [0,1,0,0,0,0|2,0,1]=4 573 B11R1.16 C\C(=C/CN)c1cccnc1 Amb31099543 [0,1,0,0,0,0|2,0,1]=4 574 B11R1.16 C\C(=C/CN)c1ccncc1 Amb31099544 [0,1,0,0,0,0|2,0,1]=4 575 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [0,1,0,0,0,0|0,0,2]=3 576 B11R1.16 C\C(=C/CO)c1ccccn1 Amb24373086 [0,1,0,0,0,0|1,0,2]=4 577 B11R1.16 C\C(=C\C=O)c1ccccn1 Amb27848247 [0,1,0,0,0,0|1,0,0]=2 578 B11R1.16 C\C(=C\C=O)c1cccnc1 Amb28056958 [0,1,0,0,0,0|1,0,0]=2 579 B11R1.16 C\C(=C\C=O)c1ccncc1 Amb27855013 [0,1,0,0,0,0|1,0,0]=2 580 B11R1.16 C\C(=C\CN)c1cccnc1 Amb27765028 [0,1,0,0,0,0|2,0,1]=4 581 B11R1.16 C\C(=C\CO)c1cccnc1 Amb27191760 [0,1,0,0,0,0|1,0,2]=4 582 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|1,0,0]=2 583 B11R1.16 C\C=C\C(=O)c1cccnc1 Amb25712944 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.16 C\C=C\C(=O)c1cncnc1 Amb27406203 [0,1,0,0,0,0|3,0,0]=4 585 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [0,1,0,0,0,0|1,0,1]=3 586 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [0,1,0,0,0,0|1,0,1]=3 587 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,1,0,0,0,0|1,0,2]=4 588 B11R1.16 N#CNC(=N)c1ccccc1 Amb20527583 [0,1,0,0,0,0|2,0,1]=4 589 B11R1.16 N#CNC(=O)c1ccccc1 Amb4007087 [0,1,0,0,0,0|2,0,1]=4 590 B11R1.16 N#C\C=C(/Br)c1ccccc1 Amb17595559 [0,1,0,0,0,0|1,0,1]=3 591 B11R1.16 N#C\C=C(/Cl)c1ccccc1 Amb1107219 [0,1,0,0,0,0|1,0,1]=3 592 B11R1.16 N#C\C=C(/N)c1ccccc1 Amb2609675 [0,1,0,0,0,0|1,0,1]=3 593 B11R1.16 N#C\C=C(/N)c1ccccn1 Amb33869506 [0,1,0,0,0,0|2,0,1]=4 594 B11R1.16 N#C\C=C(/[O-])c1ccncc1 Amb21837603 [0,1,0,0,0,0|2,0,1]=4 595 B11R1.16 N#C\C=C(\Br)c1ccccc1 Amb27492883 [0,1,0,0,0,0|1,0,1]=3 596 B11R1.16 N#C\C=C(\Cl)c1ccccc1 Amb27601178 [0,1,0,0,0,0|1,0,1]=3 597 B11R1.16 N#C\C=C(\Cl)c1ccncc1 Amb27882192 [0,1,0,0,0,0|2,0,1]=4 598 B11R1.16 N#C\C=C(\N)c1ccccc1 Amb25891462 [0,1,0,0,0,0|1,0,1]=3 599 B11R1.16 N#C\C=C(\N)c1cccnc1 Amb26880191 [0,1,0,0,0,0|2,0,1]=4 600 B11R1.16 N#C\C=C(\N)c1ccncc1 Amb28429809 [0,1,0,0,0,0|2,0,1]=4 601 B11R1.16 N#C\N=C(/N)c1ccccc1 Amb1146072 [0,1,0,0,0,0|2,0,1]=4 602 B11R1.16 N#C\N=C(\N)c1ccccc1 Amb4437466 [0,1,0,0,0,0|2,0,1]=4 603 B11R1.16 N=C=NC(=O)c1ccccc1 Amb28127436 [0,1,0,0,0,0|2,0,1]=4 604 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [0,1,0,0,0,0|2,0,0]=3 605 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [0,1,0,0,0,0|0,0,2]=3 606 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,1,0,0,0,0|1,0,2]=4 607 B11R1.16 NOCC(=O)c1ccccc1 Amb29848094 [0,1,0,0,0,0|2,0,1]=4 608 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [0,1,0,0,0,0|2,0,0]=3 609 B11R1.16 O=C(C=C=S)c1ccccc1 Amb27227059 [0,1,0,0,0,0|0,1,1]=3 610 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,1,0,0,0,0|1,0,2]=4 611 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,1,0,0,0,0|1,0,2]=4 612 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,1,0,0,0,0|0,0,3]=4 613 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,1,0,0,0,0|0,1,2]=4 614 B11R1.16 O=C(N=C=S)c1ccccc1 Amb2092776 [0,1,0,0,0,0|1,1,1]=4 615 B11R1.16 O=C(NC#P)c1ccccc1 Amb28245816 [0,1,0,0,0,0|2,0,1]=4 616 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,1,0,0,0,0|2,0,1]=4 617 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,1,0,0,0,0|1,0,2]=4 618 B11R1.16 O=C(NO[K])c1ccccc1 Amb33457787 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,1,0,0,0,0|2,0,1]=4 620 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,1,0,0,0,0|2,0,1]=4 621 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,1,0,0,0,0|2,0,1]=4 622 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,1,0,0,0,0|1,0,2]=4 623 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,1,0,0,0,0|2,0,1]=4 624 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [0,1,0,0,0,0|0,0,1]=2 625 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [0,1,0,0,0,0|0,0,1]=2 626 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [0,1,0,0,0,0|1,0,0]=2 627 B11R1.16 O=C(\C=C\Cl)c1ccccn1 Amb35645311 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.16 O=C(\C=C\Cl)c1cccnc1 Amb35645317 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.16 O=C(\C=C\Cl)c1ccncc1 Amb35645314 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.16 O=C(\C=C\Cl)c1ccncn1 Amb35628814 [0,1,0,0,0,0|3,0,0]=4 631 B11R1.16 O=C(\C=C\Cl)c1ccnnc1 Amb35628607 [0,1,0,0,0,0|3,0,0]=4 632 B11R1.16 O=C(\C=C\Cl)c1cnccn1 Amb35609471 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.16 O=C(\C=C\Cl)c1cncnc1 Amb35628608 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [0,1,0,0,0,0|0,0,1]=2 635 B11R1.16 O=C(\C=C\[O-])c1cnccn1 Amb35789121 [0,1,0,0,0,0|2,0,1]=4 636 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [0,1,0,0,0,0|1,0,1]=3 637 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,0,0,0,0|1,1,0]=3 638 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [0,1,0,0,0,0|1,0,1]=3 639 B11R1.16 O=C=NC(=O)c1ccccn1 Amb26647466 [0,1,0,0,0,0|2,0,1]=4 640 B11R1.16 O=C=NC(=O)c1cccnc1 Amb17232035 [0,1,0,0,0,0|2,0,1]=4 641 B11R1.16 O=C=NC(=O)c1ccncc1 Amb27473383 [0,1,0,0,0,0|2,0,1]=4 642 B11R1.16 O=C=NC(F)c1ccccc1 Amb27437162 [0,1,0,0,0,0|1,0,2]=4 643 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [0,1,0,0,0,0|0,0,1]=2 644 B11R1.16 O=CCC(=O)c1ccccn1 Amb9204927 [0,1,0,0,0,0|1,0,1]=3 645 B11R1.16 O=CCC(=O)c1cccnc1 Amb9204929 [0,1,0,0,0,0|1,0,1]=3 646 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [0,1,0,0,0,0|1,0,1]=3 647 B11R1.16 O=CCC(=O)c1ccncn1 Amb26967626 [0,1,0,0,0,0|2,0,1]=4 648 B11R1.16 O=CCC(=O)c1cnccn1 Amb24763812 [0,1,0,0,0,0|2,0,1]=4 649 B11R1.16 O=CCC(=O)c1cncnc1 Amb28285337 [0,1,0,0,0,0|2,0,1]=4 650 B11R1.16 O=CCC(=O)c1ncccn1 Amb27413849 [0,1,0,0,0,0|2,0,1]=4 651 B11R1.16 O=CCC(O)c1ccccn1 Amb26844000 [0,1,0,0,0,0|1,0,2]=4 652 B11R1.16 O=CCC(O)c1ccncc1 Amb24434533 [0,1,0,0,0,0|1,0,2]=4 653 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [0,1,0,0,0,0|2,0,0]=3 654 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,1,0,0,0,0|1,0,0]=2 655 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [0,1,0,0,0,0|0,0,1]=2 656 B11R1.16 O=C[CH-]C(=O)c1cccnc1 Amb27816419 [0,1,0,0,0,0|1,0,1]=3 657 B11R1.16 O=C\C=C(/Cl)c1ccccc1 Amb17232626 [0,1,0,0,0,0|0,0,0]=1 658 B11R1.16 O=C\C=C(/Cl)c1cccnc1 Amb24378408 [0,1,0,0,0,0|1,0,0]=2 659 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [0,1,0,0,0,0|0,0,2]=3 660 B11R1.16 [N-]=[N+]=CC(=O)c1ccccc1 Amb16233231 [0,1,0,0,0,0|2,0,0]=3 661 B11R1.16 [N-]=[N+]=CC(=O)c1ccccn1 Amb24618462 [0,1,0,0,0,0|3,0,0]=4 662 B11R1.16 [N-]=[N+]=CC(=O)c1cccnc1 Amb26961792 [0,1,0,0,0,0|3,0,0]=4 663 B11R1.16 [N-]=[N+]=CC(=O)c1ccncc1 Amb25922938 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.16 [N-]=[N+]=NC(=O)c1ccccc1 Amb8938214 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.17 C#C\C=C\c1cccc[n+]1[O-] Amb28400762 [0,1,0,0,0,0|2,0,1]=4 666 B11R1.17 C=CC#Cc1ccccc1F Amb25349463 [0,1,0,0,0,0|1,0,2]=4 667 B11R1.17 C=CCCc1ccccc1N Amb18124836 [0,1,0,0,0,0|1,0,2]=4 668 B11R1.17 C=CCNc1ccccc1Br Amb17306217 [0,1,0,0,0,0|2,0,1]=4 669 B11R1.17 C=CCNc1ccccc1C Amb4035723 [0,1,0,0,0,0|2,0,1]=4 670 B11R1.17 C=CCNc1ccccc1F Amb17306139 [0,1,0,0,0,0|2,0,1]=4 671 B11R1.17 C=CCNc1ccccc1I Amb28285324 [0,1,0,0,0,0|2,0,1]=4 672 B11R1.17 C=CCNc1ccccc1S Amb27870731 [0,1,0,0,0,0|2,0,1]=4 673 B11R1.17 C=CCOc1ccccc1Br Amb4422143 [0,1,0,0,0,0|2,0,1]=4 674 B11R1.17 C=CCOc1ccccc1C Amb2721161 [0,1,0,0,0,0|2,0,1]=4 675 B11R1.17 C=CCOc1ccccc1Cl Amb3940570 [0,1,0,0,0,0|2,0,1]=4 676 B11R1.17 C=CCOc1ccccc1F Amb2688315 [0,1,0,0,0,0|2,0,1]=4 677 B11R1.17 C=CCOc1ccccc1I Amb24384940 [0,1,0,0,0,0|2,0,1]=4 678 B11R1.17 C=CCOc1ccccc1N Amb2081548 [0,1,0,0,0,0|2,0,1]=4 679 B11R1.17 C=CCOc1ccccc1N Amb2721826 [0,1,0,0,0,0|2,0,1]=4 680 B11R1.17 C=CCOc1ccccc1O Amb8837354 [0,1,0,0,0,0|2,0,1]=4 681 B11R1.17 C=CCSc1ccccc1Br Amb25188543 [0,1,0,0,0,0|2,0,1]=4 682 B11R1.17 C=CCSc1ccccc1C Amb25231651 [0,1,0,0,0,0|2,0,1]=4 683 B11R1.17 C=CCSc1ccccc1Cl Amb27218500 [0,1,0,0,0,0|2,0,1]=4 684 B11R1.17 C=CCSc1ccccc1F Amb28319358 [0,1,0,0,0,0|2,0,1]=4 685 B11R1.17 C=CCSc1ccccc1N Amb433020 [0,1,0,0,0,0|2,0,1]=4 686 B11R1.17 C=CCSc1ccccc1O Amb18788504 [0,1,0,0,0,0|2,0,1]=4 687 B11R1.17 C=C\C=C\c1ccccc1C Amb26953331 [0,1,0,0,0,0|1,0,0]=2 688 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [0,1,0,0,0,0|1,0,1]=3 689 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [0,1,0,0,0,0|1,0,1]=3 690 B11R1.17 CC\N=C\c1ccccc1N Amb25991917 [0,1,0,0,0,0|2,0,1]=4 691 B11R1.17 CN\N=C\c1ccccc1F Amb17704011 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [0,1,0,0,0,0|2,0,0]=3 693 B11R1.17 CO\C=C\c1ccccc1C Amb27804452 [0,1,0,0,0,0|2,0,0]=3 694 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [0,1,0,0,0,0|2,0,0]=3 695 B11R1.17 CO\N=C\c1ccccc1Br Amb28400546 [0,1,0,0,0,0|3,0,0]=4 696 B11R1.17 CO\N=C\c1ccccc1I Amb27853303 [0,1,0,0,0,0|3,0,0]=4 697 B11R1.17 CO\N=C\c1ccccc1N Amb24605335 [0,1,0,0,0,0|3,0,0]=4 698 B11R1.17 CO\N=C\c1ccccc1O Amb25740232 [0,1,0,0,0,0|3,0,0]=4 699 B11R1.17 CS\C=C/c1ccccc1O Amb28351599 [0,1,0,0,0,0|2,0,0]=3 700 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [0,1,0,0,0,0|2,0,0]=3 701 B11R1.17 C\C=C\CN1C=CC=CC1=O Amb27882210 [0,1,0,0,0,0|2,0,1]=4 702 B11R1.17 C\C=C\C[n+]1ccccc1Br Amb27980024 [0,1,0,0,0,0|2,0,1]=4 703 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [0,1,0,0,0,0|1,0,1]=3 704 B11R1.17 C\C=C\Sc1ccccc1N Amb27234697 [0,1,0,0,0,0|2,0,0]=3 705 B11R1.17 C\C=N\Nc1ccccc1N Amb27167739 [0,1,0,0,0,0|3,0,0]=4 706 B11R1.17 Cc1cccc[n+]1C\C=C\Cl Amb27979999 [0,1,0,0,0,0|2,0,1]=4 707 B11R1.17 Cc1ccccc1C#CC=O Amb18635840 [0,1,0,0,0,0|0,0,2]=3 708 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [0,1,0,0,0,0|0,0,2]=3 709 B11R1.17 Cc1ccccc1CN=C=O Amb3941010 [0,1,0,0,0,0|1,0,2]=4 710 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [0,1,0,0,0,0|1,0,1]=3 711 B11R1.17 Cc1ccccc1COC=O Amb17778964 [0,1,0,0,0,0|1,0,1]=3 712 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [0,1,0,0,0,0|1,0,1]=3 713 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [0,1,0,0,0,0|1,0,1]=3 714 B11R1.17 Cc1ccccc1S\C=C\Cl Amb26481359 [0,1,0,0,0,0|2,0,0]=3 715 B11R1.17 Cc1ccccc1\C=C\C#N Amb17231962 [0,1,0,0,0,0|1,0,1]=3 716 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [0,1,0,0,0,0|0,0,0]=1 717 B11R1.17 Cc1ccccc1\C=C\CCl Amb27831983 [0,1,0,0,0,0|1,0,1]=3 718 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [0,1,0,0,0,0|1,0,1]=3 719 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [0,1,0,0,0,0|0,0,2]=3 720 B11R1.17 Cc1cccnc1SCC=O Amb29879878 [0,1,0,0,0,0|2,0,1]=4 721 B11R1.17 Cc1cccnc1\C=C\C=O Amb33428727 [0,1,0,0,0,0|1,0,0]=2 722 B11R1.17 Cc1cccnc1\C=C\CN Amb33428735 [0,1,0,0,0,0|2,0,1]=4 723 B11R1.17 Cc1cccnc1\C=C\CO Amb33428736 [0,1,0,0,0,0|1,0,2]=4 724 B11R1.17 Cc1ccncc1CCC=O Amb27971665 [0,1,0,0,0,0|1,0,2]=4 725 B11R1.17 Cc1ccncc1CNC=O Amb28044503 [0,1,0,0,0,0|2,0,1]=4 726 B11R1.17 Cc1ccncc1\C=C\C=O Amb32953945 [0,1,0,0,0,0|1,0,0]=2 727 B11R1.17 Cc1ccncc1\C=C\CN Amb33079113 [0,1,0,0,0,0|2,0,1]=4 728 B11R1.17 Cc1ccncc1\C=C\CO Amb33226224 [0,1,0,0,0,0|1,0,2]=4 729 B11R1.17 Cc1cnccc1CCC=O Amb33426427 [0,1,0,0,0,0|1,0,2]=4 730 B11R1.17 Cc1cnccc1CNC=O Amb27639891 [0,1,0,0,0,0|2,0,1]=4 731 B11R1.17 Cc1cnccc1\C=C\C=O Amb33414326 [0,1,0,0,0,0|1,0,0]=2 732 B11R1.17 Cc1cnccc1\C=C\CCl Amb27648327 [0,1,0,0,0,0|2,0,1]=4 733 B11R1.17 Cc1cnccc1\C=C\CN Amb28062283 [0,1,0,0,0,0|2,0,1]=4 734 B11R1.17 Cc1cnccc1\C=C\CO Amb33414325 [0,1,0,0,0,0|1,0,2]=4 735 B11R1.17 Cc1ncccc1CCC=O Amb32879664 [0,1,0,0,0,0|1,0,2]=4 736 B11R1.17 Cc1ncccc1\C=C\C=O Amb32878968 [0,1,0,0,0,0|1,0,0]=2 737 B11R1.17 Cc1ncccc1\C=C\CN Amb32878965 [0,1,0,0,0,0|2,0,1]=4 738 B11R1.17 Cc1ncccc1\C=C\CO Amb32878967 [0,1,0,0,0,0|1,0,2]=4 739 B11R1.17 Cc1nccnc1\C=C\C=O Amb35600874 [0,1,0,0,0,0|2,0,0]=3 740 B11R1.17 Cc1ncncc1\C=C\C=O Amb33149152 [0,1,0,0,0,0|2,0,0]=3 741 B11R1.17 ClC\C=C\c1ccccc1Cl Amb27592206 [0,1,0,0,0,0|1,0,1]=3 742 B11R1.17 Cl\C=C\C[n+]1ccccc1Cl Amb27396539 [0,1,0,0,0,0|2,0,1]=4 743 B11R1.17 Clc1ccccc1\C=C\CBr Amb8392445 [0,1,0,0,0,0|1,0,1]=3 744 B11R1.17 Fc1ccccc1\C=C\CCl Amb26495610 [0,1,0,0,0,0|1,0,1]=3 745 B11R1.17 N#C\C=C/c1ccccc1F Amb28141899 [0,1,0,0,0,0|1,0,1]=3 746 B11R1.17 N#C\C=C/c1ccccc1O Amb26450429 [0,1,0,0,0,0|1,0,1]=3 747 B11R1.17 N#C\C=C\c1ccccc1Br Amb17239681 [0,1,0,0,0,0|1,0,1]=3 748 B11R1.17 N#C\C=C\c1ccccc1Cl Amb17232457 [0,1,0,0,0,0|1,0,1]=3 749 B11R1.17 N#C\C=C\c1ccccc1F Amb17232025 [0,1,0,0,0,0|1,0,1]=3 750 B11R1.17 N#C\C=C\c1ccccc1I Amb4015088 [0,1,0,0,0,0|1,0,1]=3 751 B11R1.17 N#C\C=C\c1cccnc1Br Amb22584112 [0,1,0,0,0,0|2,0,1]=4 752 B11R1.17 N=C\C=C\c1ccccc1O Amb27226996 [0,1,0,0,0,0|1,0,0]=2 753 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [0,1,0,0,0,0|1,0,1]=3 754 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [0,1,0,0,0,0|1,0,1]=3 755 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [0,1,0,0,0,0|1,0,1]=3 756 B11R1.17 NC\C=C\c1ccccc1O Amb27442155 [0,1,0,0,0,0|1,0,1]=3 757 B11R1.17 NC\C=C\c1cccnc1Br Amb33387815 [0,1,0,0,0,0|2,0,1]=4 758 B11R1.17 NC\C=C\c1cccnc1Cl Amb33257368 [0,1,0,0,0,0|2,0,1]=4 759 B11R1.17 NC\C=C\c1cccnc1F Amb33377192 [0,1,0,0,0,0|2,0,1]=4 760 B11R1.17 NC\C=C\c1ccncc1Br Amb33388608 [0,1,0,0,0,0|2,0,1]=4 761 B11R1.17 NC\C=C\c1ccncc1Cl Amb33413776 [0,1,0,0,0,0|2,0,1]=4 762 B11R1.17 NC\C=C\c1ccncc1F Amb33317170 [0,1,0,0,0,0|2,0,1]=4 763 B11R1.17 NC\C=C\c1ncccc1Br Amb33336102 [0,1,0,0,0,0|2,0,1]=4 764 B11R1.17 NC\C=C\c1ncccc1F Amb33419616 [0,1,0,0,0,0|2,0,1]=4 765 B11R1.17 N\N=C\Cc1ccccc1F Amb28248964 [0,1,0,0,0,0|2,0,1]=4 766 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [0,1,0,0,0,0|0,0,0]=1 767 B11R1.17 Nc1ccccc1\C=C\CO Amb34916231 [0,1,0,0,0,0|0,0,2]=3 768 B11R1.17 Nc1ccncc1\N=C\C=O Amb26637985 [0,1,0,0,0,0|2,0,0]=3 769 B11R1.17 Nc1cnccc1\N=C\C=O Amb25255524 [0,1,0,0,0,0|2,0,0]=3 770 B11R1.17 Nc1ncccc1NNC=O Amb18125378 [0,1,0,0,0,0|3,0,0]=4 771 B11R1.17 O=C1C=CC=C\C1=C\C#CCl Amb28253829 [0,1,0,0,0,0|1,0,2]=4 772 B11R1.17 O=C=NCc1ccccc1Br Amb25251434 [0,1,0,0,0,0|1,0,2]=4 773 B11R1.17 O=C=NCc1ccccc1Cl Amb2720550 [0,1,0,0,0,0|1,0,2]=4 774 B11R1.17 O=C=NCc1ccccc1F Amb3939408 [0,1,0,0,0,0|1,0,2]=4 775 B11R1.17 O=CC#Cc1ccccc1F Amb18117458 [0,1,0,0,0,0|0,0,2]=3 776 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [0,1,0,0,0,0|0,0,2]=3 777 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [0,1,0,0,0,0|0,0,2]=3 778 B11R1.17 O=CCCc1ccccc1F Amb10602147 [0,1,0,0,0,0|0,0,2]=3 779 B11R1.17 O=CCCc1ccccc1O Amb22228954 [0,1,0,0,0,0|0,0,2]=3 780 B11R1.17 O=CCCc1cccnc1Br Amb33388081 [0,1,0,0,0,0|1,0,2]=4 781 B11R1.17 O=CCCc1cccnc1Cl Amb33052730 [0,1,0,0,0,0|1,0,2]=4 782 B11R1.17 O=CCCc1cccnc1F Amb33377143 [0,1,0,0,0,0|1,0,2]=4 783 B11R1.17 O=CCCc1ccncc1Br Amb33243315 [0,1,0,0,0,0|1,0,2]=4 784 B11R1.17 O=CCCc1ccncc1Cl Amb27617324 [0,1,0,0,0,0|1,0,2]=4 785 B11R1.17 O=CCCc1ccncc1F Amb25677089 [0,1,0,0,0,0|1,0,2]=4 786 B11R1.17 O=CCCc1ncccc1Br Amb27153362 [0,1,0,0,0,0|1,0,2]=4 787 B11R1.17 O=CCCc1ncccc1F Amb27878559 [0,1,0,0,0,0|1,0,2]=4 788 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [0,1,0,0,0,0|1,0,1]=3 789 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [0,1,0,0,0,0|1,0,1]=3 790 B11R1.17 O=CCOc1ccccc1F Amb18182892 [0,1,0,0,0,0|1,0,1]=3 791 B11R1.17 O=CCOc1ccccc1I Amb27871520 [0,1,0,0,0,0|1,0,1]=3 792 B11R1.17 O=CCOc1ccccc1O Amb27176428 [0,1,0,0,0,0|1,0,1]=3 793 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [0,1,0,0,0,0|1,0,1]=3 794 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [0,1,0,0,0,0|1,0,1]=3 795 B11R1.17 O=CCSc1ccccc1F Amb18185632 [0,1,0,0,0,0|1,0,1]=3 796 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [0,1,0,0,0,0|1,0,1]=3 797 B11R1.17 O=CNCc1ncccc1Cl Amb27953157 [0,1,0,0,0,0|2,0,1]=4 798 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [0,1,0,0,0,0|0,0,0]=1 799 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [0,1,0,0,0,0|0,0,0]=1 800 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [0,1,0,0,0,0|0,0,0]=1 801 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [0,1,0,0,0,0|0,0,0]=1 802 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [0,1,0,0,0,0|0,0,0]=1 803 B11R1.17 O=C\C=C\c1cccnc1Br Amb33387808 [0,1,0,0,0,0|1,0,0]=2 804 B11R1.17 O=C\C=C\c1cccnc1Cl Amb33406391 [0,1,0,0,0,0|1,0,0]=2 805 B11R1.17 O=C\C=C\c1cccnc1F Amb33224035 [0,1,0,0,0,0|1,0,0]=2 806 B11R1.17 O=C\C=C\c1ccncc1Br Amb33478364 [0,1,0,0,0,0|1,0,0]=2 807 B11R1.17 O=C\C=C\c1ccncc1Cl Amb33413767 [0,1,0,0,0,0|1,0,0]=2 808 B11R1.17 O=C\C=C\c1ccncc1F Amb33317172 [0,1,0,0,0,0|1,0,0]=2 809 B11R1.17 O=C\C=C\c1ncccc1Br Amb33388586 [0,1,0,0,0,0|1,0,0]=2 810 B11R1.17 O=C\C=C\c1ncccc1F Amb33418874 [0,1,0,0,0,0|1,0,0]=2 811 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [0,1,0,0,0,0|1,0,0]=2 812 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [0,1,0,0,0,0|0,0,2]=3 813 B11R1.17 OC\C=C\c1ccccc1Cl Amb8392444 [0,1,0,0,0,0|0,0,2]=3 814 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [0,1,0,0,0,0|0,0,2]=3 815 B11R1.17 OC\C=C\c1ccccc1O Amb33450068 [0,1,0,0,0,0|0,0,2]=3 816 B11R1.17 OC\C=C\c1cccnc1Br Amb33387813 [0,1,0,0,0,0|1,0,2]=4 817 B11R1.17 OC\C=C\c1cccnc1Cl Amb33262127 [0,1,0,0,0,0|1,0,2]=4 818 B11R1.17 OC\C=C\c1cccnc1F Amb33377194 [0,1,0,0,0,0|1,0,2]=4 819 B11R1.17 OC\C=C\c1ccncc1Br Amb33389509 [0,1,0,0,0,0|1,0,2]=4 820 B11R1.17 OC\C=C\c1ccncc1Cl Amb33413772 [0,1,0,0,0,0|1,0,2]=4 821 B11R1.17 OC\C=C\c1ccncc1F Amb33317171 [0,1,0,0,0,0|1,0,2]=4 822 B11R1.17 OC\C=C\c1ncccc1F Amb33418873 [0,1,0,0,0,0|1,0,2]=4 823 B11R1.17 Oc1ccccc1\C=C/CBr Amb27759396 [0,1,0,0,0,0|1,0,1]=3 824 B11R1.17 Oc1ccccc1\C=C\CCl Amb27848186 [0,1,0,0,0,0|1,0,1]=3 825 B11R1.24 BrC\C=C\c1cccc(Br)c1 Amb27401347 [0,1,0,0,0,0|1,0,1]=3 826 B11R1.24 BrC\C=C\c1cncc(Br)c1 Amb27984281 [0,1,0,0,0,0|2,0,1]=4 827 B11R1.24 C=CCCc1cccc(Br)c1 Amb6298948 [0,1,0,0,0,0|1,0,2]=4 828 B11R1.24 C=CCCc1cccc(Cl)c1 Amb6298971 [0,1,0,0,0,0|1,0,2]=4 829 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [0,1,0,0,0,0|1,0,2]=4 830 B11R1.24 C=CCNc1cccc(Br)c1 Amb17306222 [0,1,0,0,0,0|2,0,1]=4 831 B11R1.24 C=CCNc1cccc(C)c1 Amb17306547 [0,1,0,0,0,0|2,0,1]=4 832 B11R1.24 C=CCNc1cccc(Cl)c1 Amb17307127 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.24 C=CCNc1cccc(F)c1 Amb17306228 [0,1,0,0,0,0|2,0,1]=4 834 B11R1.24 C=CCNc1cccc(N)c1 Amb8394241 [0,1,0,0,0,0|2,0,1]=4 835 B11R1.24 C=CCOc1cccc(Br)c1 Amb6263292 [0,1,0,0,0,0|2,0,1]=4 836 B11R1.24 C=CCOc1cccc(Cl)c1 Amb27223591 [0,1,0,0,0,0|2,0,1]=4 837 B11R1.24 C=CCOc1cccc(N)c1 Amb2094493 [0,1,0,0,0,0|2,0,1]=4 838 B11R1.24 C=CCOc1cccc(N)c1 Amb33527291 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.24 C=CCOc1cccc(O)c1 Amb8837461 [0,1,0,0,0,0|2,0,1]=4 840 B11R1.24 C=CCSc1cccc(Br)c1 Amb26071614 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.24 C=CCSc1cccc(Cl)c1 Amb26924103 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.24 C=CCSc1cccc(F)c1 Amb26648175 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.24 CC\C=C\c1cccc(O)c1 Amb16231489 [0,1,0,0,0,0|1,0,1]=3 844 B11R1.24 CN\C=N\c1cccc(C)c1 Amb27617263 [0,1,0,0,0,0|3,0,0]=4 845 B11R1.24 CN\N=C\c1cccc(Cl)c1 Amb27261064 [0,1,0,0,0,0|3,0,0]=4 846 B11R1.24 CO\C=C\c1cccc(Br)c1 Amb27642123 [0,1,0,0,0,0|2,0,0]=3 847 B11R1.24 CO\C=C\c1cccc(F)c1 Amb27840067 [0,1,0,0,0,0|2,0,0]=3 848 B11R1.24 CO\N=C\c1cccc(Br)c1 Amb27425154 [0,1,0,0,0,0|3,0,0]=4 849 B11R1.24 CO\N=C\c1cccc(C)c1 Amb27826264 [0,1,0,0,0,0|3,0,0]=4 850 B11R1.24 CO\N=C\c1cccc(I)c1 Amb28063598 [0,1,0,0,0,0|3,0,0]=4 851 B11R1.24 C\C=C\C[n+]1cccc(C)c1 Amb27977346 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.24 Cc1cc(CCC=O)ccn1 Amb27208272 [0,1,0,0,0,0|1,0,2]=4 853 B11R1.24 Cc1cc(\C=C\C=O)ccn1 Amb33340430 [0,1,0,0,0,0|1,0,0]=2 854 B11R1.24 Cc1cc(\C=C\CN)ccn1 Amb33340427 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.24 Cc1cc(\C=C\CO)ccn1 Amb32733165 [0,1,0,0,0,0|1,0,2]=4 856 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [0,1,0,0,0,0|0,0,2]=3 857 B11R1.24 Cc1cccc(CCC=O)n1 Amb27949575 [0,1,0,0,0,0|1,0,2]=4 858 B11R1.24 Cc1cccc(CN=C=O)c1 Amb3939295 [0,1,0,0,0,0|1,0,2]=4 859 B11R1.24 Cc1cccc(CNC=O)c1 Amb27752387 [0,1,0,0,0,0|1,0,1]=3 860 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [0,1,0,0,0,0|1,0,1]=3 861 B11R1.24 Cc1cccc(O\C=C\Cl)c1 Amb27471988 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.24 Cc1cccc(SCC=O)c1 Amb17082932 [0,1,0,0,0,0|1,0,1]=3 863 B11R1.24 Cc1cccc(\C=C\C#N)c1 Amb17231963 [0,1,0,0,0,0|1,0,1]=3 864 B11R1.24 Cc1cccc(\C=C\C=O)c1 Amb17232008 [0,1,0,0,0,0|0,0,0]=1 865 B11R1.24 Cc1cccc(\C=C\C=O)n1 Amb33449582 [0,1,0,0,0,0|1,0,0]=2 866 B11R1.24 Cc1cccc(\C=C\CN)c1 Amb18065182 [0,1,0,0,0,0|1,0,1]=3 867 B11R1.24 Cc1cccc(\C=C\CN)n1 Amb33201942 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.24 Cc1cccc(\C=C\CO)c1 Amb23442940 [0,1,0,0,0,0|0,0,2]=3 869 B11R1.24 Cc1cccc(\C=C\CO)n1 Amb33201938 [0,1,0,0,0,0|1,0,2]=4 870 B11R1.24 Cc1ccnc(CCC=O)c1 Amb33317814 [0,1,0,0,0,0|1,0,2]=4 871 B11R1.24 Cc1ccnc(\C=C\C=O)c1 Amb33318077 [0,1,0,0,0,0|1,0,0]=2 872 B11R1.24 Cc1ccnc(\C=C\CN)c1 Amb33318091 [0,1,0,0,0,0|2,0,1]=4 873 B11R1.24 Cc1ccnc(\C=C\CO)c1 Amb27650189 [0,1,0,0,0,0|1,0,2]=4 874 B11R1.24 Cc1cncc(CCC=O)c1 Amb33531659 [0,1,0,0,0,0|1,0,2]=4 875 B11R1.24 Cc1cncc(\C=C\C=O)c1 Amb33317993 [0,1,0,0,0,0|1,0,0]=2 876 B11R1.24 Cc1cncc(\C=C\CN)c1 Amb33317991 [0,1,0,0,0,0|2,0,1]=4 877 B11R1.24 Cc1cncc(\C=C\CO)c1 Amb33317992 [0,1,0,0,0,0|1,0,2]=4 878 B11R1.24 Clc1cc(\C=C\CBr)ccn1 Amb2696455 [0,1,0,0,0,0|2,0,1]=4 879 B11R1.24 N#C\C=C\c1cccc(Br)c1 Amb17239682 [0,1,0,0,0,0|1,0,1]=3 880 B11R1.24 N#C\C=C\c1cccc(Cl)c1 Amb17232458 [0,1,0,0,0,0|1,0,1]=3 881 B11R1.24 N#C\C=C\c1cccc(Cl)n1 Amb26372308 [0,1,0,0,0,0|2,0,1]=4 882 B11R1.24 N#C\C=C\c1cccc(F)c1 Amb32718808 [0,1,0,0,0,0|1,0,1]=3 883 B11R1.24 N#C\C=C\c1cccc(N)c1 Amb27390243 [0,1,0,0,0,0|1,0,1]=3 884 B11R1.24 N#C\C=C\c1cccc(S)c1 Amb28287829 [0,1,0,0,0,0|1,0,1]=3 885 B11R1.24 N#C\C=C\c1cncc(Br)c1 Amb27806415 [0,1,0,0,0,0|2,0,1]=4 886 B11R1.24 NC\C=C\c1cc(F)ccn1 Amb33320265 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [0,1,0,0,0,0|1,0,1]=3 888 B11R1.24 NC\C=C\c1cccc(Br)n1 Amb33433474 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [0,1,0,0,0,0|1,0,1]=3 890 B11R1.24 NC\C=C\c1cccc(Cl)n1 Amb33222405 [0,1,0,0,0,0|2,0,1]=4 891 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [0,1,0,0,0,0|1,0,1]=3 892 B11R1.24 NC\C=C\c1cccc(O)c1 Amb33474823 [0,1,0,0,0,0|1,0,1]=3 893 B11R1.24 NC\C=C\c1cncc(Br)c1 Amb33240207 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.24 NC\C=C\c1cncc(F)c1 Amb33480695 [0,1,0,0,0,0|2,0,1]=4 895 B11R1.24 N\N=C\Cc1cccc(Cl)c1 Amb27163863 [0,1,0,0,0,0|2,0,1]=4 896 B11R1.24 O=C=NCc1cccc(Br)c1 Amb17090280 [0,1,0,0,0,0|1,0,2]=4 897 B11R1.24 O=C=NCc1cccc(Cl)c1 Amb17090264 [0,1,0,0,0,0|1,0,2]=4 898 B11R1.24 O=C=NCc1cccc(F)c1 Amb3939409 [0,1,0,0,0,0|1,0,2]=4 899 B11R1.24 O=CC#Cc1cccc(Cl)c1 Amb27238485 [0,1,0,0,0,0|0,0,2]=3 900 B11R1.24 O=CC#Cc1cccc(F)c1 Amb18117776 [0,1,0,0,0,0|0,0,2]=3 901 B11R1.24 O=CCCC1=CC(=O)NC=C1 Amb27485952 [0,1,0,0,0,0|1,0,2]=4 902 B11R1.24 O=CCCc1cc(F)ccn1 Amb33325519 [0,1,0,0,0,0|1,0,2]=4 903 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [0,1,0,0,0,0|0,0,2]=3 904 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [0,1,0,0,0,0|0,0,2]=3 905 B11R1.24 O=CCCc1cccc(Cl)n1 Amb24511743 [0,1,0,0,0,0|1,0,2]=4 906 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [0,1,0,0,0,0|0,0,2]=3 907 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [0,1,0,0,0,0|0,0,2]=3 908 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [0,1,0,0,0,0|0,0,2]=3 909 B11R1.24 O=CCCc1ccnc(Cl)c1 Amb24619570 [0,1,0,0,0,0|1,0,2]=4 910 B11R1.24 O=CCCc1cncc(Br)c1 Amb28348525 [0,1,0,0,0,0|1,0,2]=4 911 B11R1.24 O=CCCc1cncc(F)c1 Amb25923216 [0,1,0,0,0,0|1,0,2]=4 912 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [0,1,0,0,0,0|1,0,1]=3 913 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [0,1,0,0,0,0|1,0,1]=3 914 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [0,1,0,0,0,0|1,0,1]=3 915 B11R1.24 O=CCOc1cncc(Cl)c1 Amb27868020 [0,1,0,0,0,0|2,0,1]=4 916 B11R1.24 O=CCSc1cccc(Br)c1 Amb25978639 [0,1,0,0,0,0|1,0,1]=3 917 B11R1.24 O=CCSc1cccc(Cl)c1 Amb17082942 [0,1,0,0,0,0|1,0,1]=3 918 B11R1.24 O=CCSc1cccc(F)c1 Amb26942694 [0,1,0,0,0,0|1,0,1]=3 919 B11R1.24 O=CNCC1=CC(=O)NC=C1 Amb28067246 [0,1,0,0,0,0|2,0,1]=4 920 B11R1.24 O=CNCc1cccc(Br)c1 Amb27780723 [0,1,0,0,0,0|1,0,1]=3 921 B11R1.24 O=CNCc1cccc(O)c1 Amb18179387 [0,1,0,0,0,0|1,0,1]=3 922 B11R1.24 O=CNCc1cncc(F)c1 Amb24528856 [0,1,0,0,0,0|2,0,1]=4 923 B11R1.24 O=CNNc1cccc(Br)n1 Amb22261494 [0,1,0,0,0,0|3,0,0]=4 924 B11R1.24 O=CNNc1cccc(Cl)n1 Amb10067842 [0,1,0,0,0,0|3,0,0]=4 925 B11R1.24 O=C\C=C\C1=CC(=O)CCC1 Amb26974514 [0,1,0,0,0,0|0,0,3]=4 926 B11R1.24 O=C\C=C\c1cc(F)ccn1 Amb33320266 [0,1,0,0,0,0|1,0,0]=2 927 B11R1.24 O=C\C=C\c1cccc(Br)c1 Amb17240826 [0,1,0,0,0,0|0,0,0]=1 928 B11R1.24 O=C\C=C\c1cccc(Br)n1 Amb28185081 [0,1,0,0,0,0|1,0,0]=2 929 B11R1.24 O=C\C=C\c1cccc(Cl)c1 Amb16193215 [0,1,0,0,0,0|0,0,0]=1 930 B11R1.24 O=C\C=C\c1cccc(Cl)n1 Amb33222389 [0,1,0,0,0,0|1,0,0]=2 931 B11R1.24 O=C\C=C\c1cccc(F)c1 Amb17232063 [0,1,0,0,0,0|0,0,0]=1 932 B11R1.24 O=C\C=C\c1cccc(O)c1 Amb17334281 [0,1,0,0,0,0|0,0,0]=1 933 B11R1.24 O=C\C=C\c1cncc(Br)c1 Amb33450900 [0,1,0,0,0,0|1,0,0]=2 934 B11R1.24 O=C\C=C\c1cncc(F)c1 Amb33227063 [0,1,0,0,0,0|1,0,0]=2 935 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [0,1,0,0,0,0|0,0,2]=3 936 B11R1.24 OC\C=C\c1cccc(Br)n1 Amb20248560 [0,1,0,0,0,0|1,0,2]=4 937 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [0,1,0,0,0,0|0,0,2]=3 938 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [0,1,0,0,0,0|0,0,2]=3 939 B11R1.24 OC\C=C\c1cccc(I)c1 Amb28322502 [0,1,0,0,0,0|0,0,2]=3 940 B11R1.24 OC\C=C\c1cccc(O)c1 Amb33136411 [0,1,0,0,0,0|0,0,2]=3 941 B11R1.24 OC\C=C\c1cncc(Br)c1 Amb31184380 [0,1,0,0,0,0|1,0,2]=4 942 B11R1.24 OC\C=C\c1cncc(F)c1 Amb33196270 [0,1,0,0,0,0|1,0,2]=4 943 B11R1.24 Oc1ccc[n+](C\C=C\Cl)c1 Amb27399443 [0,1,0,0,0,0|2,0,1]=4 944 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [0,1,0,0,0,0|1,0,1]=3 945 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [0,1,0,0,0,0|1,0,0]=2 946 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [0,1,0,0,0,0|1,0,1]=3 947 B11R1.28 C#CC\N=C\c1ccccc1 Amb17609064 [0,1,0,0,0,0|1,0,2]=4 948 B11R1.28 C=C=CCNc1ccccc1 Amb27482470 [0,1,0,0,0,0|1,0,2]=4 949 B11R1.28 C=CCC#Cc1ccccc1 Amb10571530 [0,1,0,0,0,0|1,0,2]=4 950 B11R1.28 C=CCCNc1ccccc1 Amb27495374 [0,1,0,0,0,0|1,0,2]=4 951 B11R1.28 C=CCCOc1ccccc1 Amb27271699 [0,1,0,0,0,0|1,0,2]=4 952 B11R1.28 C=CCCSc1ccccc1 Amb27270191 [0,1,0,0,0,0|1,0,2]=4 953 B11R1.28 C=CCNCc1ccccc1 Amb6683954 [0,1,0,0,0,0|1,0,2]=4 954 B11R1.28 C=CCNCc1ccccc1 Amb6864764 [0,1,0,0,0,0|1,0,2]=4 955 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [0,1,0,0,0,0|1,0,2]=4 956 B11R1.28 C=CCO[BrH]c1ccccc1 Amb27001649 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [0,1,0,0,0,0|1,0,0]=2 958 B11R1.28 C=CC\N=C/c1cccnc1 Amb27656571 [0,1,0,0,0,0|2,0,1]=4 959 B11R1.28 C=CC\N=C\c1cccnc1 Amb27667978 [0,1,0,0,0,0|2,0,1]=4 960 B11R1.28 C=CC\N=C\c1ccncc1 Amb24705579 [0,1,0,0,0,0|2,0,1]=4 961 B11R1.28 C=CNOCc1ccccc1 Amb27791078 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.28 C=C\C=C\Sc1ccccc1 Amb28284520 [0,1,0,0,0,0|1,0,0]=2 963 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [0,1,0,0,0,0|1,0,1]=3 964 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [0,1,0,0,0,0|1,0,2]=4 965 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [0,1,0,0,0,0|1,0,2]=4 966 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [0,1,0,0,0,0|1,0,1]=3 967 B11R1.28 CCO\C=C\c1ccncc1 Amb27253748 [0,1,0,0,0,0|2,0,1]=4 968 B11R1.28 CCO\C=N\c1ccccc1 Amb9786981 [0,1,0,0,0,0|2,0,1]=4 969 B11R1.28 CC\C=C\Cc1ccncc1 Amb27230808 [0,1,0,0,0,0|2,0,1]=4 970 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [0,1,0,0,0,0|2,0,1]=4 971 B11R1.28 CNC\C=C/c1cccnc1 Amb28423371 [0,1,0,0,0,0|2,0,1]=4 972 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [0,1,0,0,0,0|1,0,1]=3 973 B11R1.28 CNC\C=C\c1ccccn1 Amb26859034 [0,1,0,0,0,0|2,0,1]=4 974 B11R1.28 CNC\C=C\c1cccnc1 Amb23442752 [0,1,0,0,0,0|2,0,1]=4 975 B11R1.28 CNC\C=C\c1ccncc1 Amb26859033 [0,1,0,0,0,0|2,0,1]=4 976 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [0,1,0,0,0,0|1,0,1]=3 977 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [0,1,0,0,0,0|0,1,1]=3 978 B11R1.28 C\C=C/N=C/c1cccnc1 Amb24486027 [0,1,0,0,0,0|2,0,0]=3 979 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [0,1,0,0,0,0|1,0,0]=2 980 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [0,1,0,0,0,0|1,0,1]=3 981 B11R1.28 C\C=C\CCc1ccncc1 Amb25830692 [0,1,0,0,0,0|2,0,1]=4 982 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [0,1,0,0,0,0|1,0,1]=3 983 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [0,1,0,0,0,0|1,0,1]=3 984 B11R1.28 C\C=C\COc1cccnc1 Amb32668803 [0,1,0,0,0,0|2,0,1]=4 985 B11R1.28 C\C=C\CSc1ccccn1 Amb28125714 [0,1,0,0,0,0|2,0,1]=4 986 B11R1.28 C\C=C\N=C\c1cccnc1 Amb26566876 [0,1,0,0,0,0|2,0,0]=3 987 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [0,1,0,0,0,0|1,0,1]=3 988 B11R1.28 ClCC\C=C\c1cccnc1 Amb28367181 [0,1,0,0,0,0|2,0,1]=4 989 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [0,1,0,0,0,0|2,0,1]=4 990 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [0,1,0,0,0,0|1,0,1]=3 991 B11R1.28 ClC\C=N\Cc1ccccc1 Amb26887419 [0,1,0,0,0,0|1,0,2]=4 992 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [0,1,0,0,0,0|1,0,0]=2 993 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [0,1,0,0,0,0|1,0,1]=3 994 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [0,1,0,0,0,0|1,0,1]=3 995 B11R1.28 Cl\C=C\CSc1ccccn1 Amb28122170 [0,1,0,0,0,0|2,0,1]=4 996 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [0,1,0,0,0,0|1,0,1]=3 997 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [0,1,0,0,0,0|1,0,1]=3 998 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [0,1,0,0,0,0|1,0,1]=3 999 B11R1.28 N#CC\C=C\c1ccccn1 Amb27213013 [0,1,0,0,0,0|2,0,1]=4 1000 B11R1.28 N#CC\C=C\c1cccnc1 Amb25827677 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.28 N#CC\C=C\c1ccncc1 Amb24531355 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.28 N#C\C=C\Cc1ccccc1 Amb28255392 [0,1,0,0,0,0|1,0,1]=3 1003 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [0,1,0,0,0,0|1,0,1]=3 1004 B11R1.28 NCC\C=C/c1cccnc1 Amb27391665 [0,1,0,0,0,0|2,0,1]=4 1005 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [0,1,0,0,0,0|1,0,1]=3 1006 B11R1.28 NCC\C=C\c1ccccn1 Amb24383569 [0,1,0,0,0,0|2,0,1]=4 1007 B11R1.28 NCC\C=C\c1cccnc1 Amb25061778 [0,1,0,0,0,0|2,0,1]=4 1008 B11R1.28 NCC\C=C\c1ccncc1 Amb24678309 [0,1,0,0,0,0|2,0,1]=4 1009 B11R1.28 NCC\N=C\c1ccccc1 Amb27760044 [0,1,0,0,0,0|1,0,2]=4 1010 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [0,1,0,0,0,0|1,0,1]=3 1011 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [0,1,0,0,0,0|1,0,1]=3 1012 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [0,1,0,0,0,0|0,0,2]=3 1013 B11R1.28 N\C=C\C#Cc1ccccn1 Amb27468683 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [0,1,0,0,0,0|1,0,0]=2 1015 B11R1.28 N\C=C\C=C\c1ccccn1 Amb27961333 [0,1,0,0,0,0|2,0,0]=3 1016 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [0,1,0,0,0,0|1,0,0]=2 1017 B11R1.28 N\N=C\C=C\c1ccccn1 Amb27768304 [0,1,0,0,0,0|2,0,0]=3 1018 B11R1.28 N\N=C\CCc1ccccc1 Amb27649733 [0,1,0,0,0,0|1,0,2]=4 1019 B11R1.28 O=C=C\C=C/c1ccccn1 Amb27434448 [0,1,0,0,0,0|1,0,0]=2 1020 B11R1.28 O=C=C\C=C\c1ccccn1 Amb27622513 [0,1,0,0,0,0|1,0,0]=2 1021 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [0,1,0,0,0,0|0,0,3]=4 1022 B11R1.28 O=C=NCOc1ccccc1 Amb20668487 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.28 O=C=NCSc1ccccc1 Amb27839732 [0,1,0,0,0,0|1,0,2]=4 1024 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [0,1,0,0,0,0|0,0,2]=3 1025 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [0,1,0,0,0,0|0,0,2]=3 1026 B11R1.28 O=CCCCc1ccccn1 Amb22897023 [0,1,0,0,0,0|1,0,2]=4 1027 B11R1.28 O=CCCCc1cccnc1 Amb24099514 [0,1,0,0,0,0|1,0,2]=4 1028 B11R1.28 O=CCCCc1ccncc1 Amb24099515 [0,1,0,0,0,0|1,0,2]=4 1029 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [0,1,0,0,0,0|0,0,2]=3 1030 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [0,1,0,0,0,0|0,0,2]=3 1031 B11R1.28 O=CCCSc1ccncc1 Amb27671141 [0,1,0,0,0,0|1,0,2]=4 1032 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [0,1,0,0,0,0|0,0,2]=3 1033 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [0,1,0,0,0,0|0,0,2]=3 1034 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [0,1,0,0,0,0|0,0,2]=3 1035 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [0,1,0,0,0,0|1,0,1]=3 1036 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [0,1,0,0,0,0|1,0,0]=2 1037 B11R1.28 O=COCCc1ccccc1 Amb6357955 [0,1,0,0,0,0|0,0,2]=3 1038 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [0,1,0,0,0,0|0,0,0]=1 1039 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [0,1,0,0,0,0|0,0,0]=1 1040 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [0,1,0,0,0,0|0,0,0]=1 1041 B11R1.28 O=C\C=C\Nc1cccnc1 Amb27445449 [0,1,0,0,0,0|1,0,0]=2 1042 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [0,1,0,0,0,0|0,0,0]=1 1043 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [0,1,0,0,0,0|1,0,0]=2 1044 B11R1.28 O=S=CNCc1ccccc1 Amb27166552 [0,1,0,0,0,0|1,0,1]=3 1045 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [0,1,0,0,0,0|0,0,2]=3 1046 B11R1.28 OCC\C=N\c1ccccc1 Amb27805392 [0,1,0,0,0,0|0,0,3]=4 1047 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [0,1,0,0,0,0|0,0,2]=3 1048 B11R1.28 OC\C=C\Oc1ccccn1 Amb27823751 [0,1,0,0,0,0|1,0,2]=4 1049 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [0,1,0,0,0,0|0,0,2]=3 1050 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [0,1,0,0,0,0|0,0,2]=3 1051 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [0,1,0,0,0,0|0,0,1]=2 1052 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [0,1,0,0,0,0|0,0,1]=2 1053 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [0,1,0,0,0,0|0,0,1]=2 1054 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [0,1,0,0,0,0|0,1,1]=3 1055 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [0,1,0,0,0,0|1,0,1]=3 1056 B11R1.28 [N-]=[N+]=N\C=C\c1ccccc1 Amb26367041 [0,1,0,0,0,0|2,0,0]=3 1057 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,1,0,0,0,0|1,0,2]=4 1058 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,1,0,0,0,0|2,0,1]=4 1059 B11R1.40 C#C\C(C)=C\c1ccccc1 Amb33476742 [0,1,0,0,0,0|1,0,1]=3 1060 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [0,1,0,0,0,0|0,0,1]=2 1061 B11R1.40 C=C(CBr)Cc1ccccc1 Amb27481590 [0,1,0,0,0,0|1,0,2]=4 1062 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [0,1,0,0,0,0|2,0,1]=4 1063 B11R1.40 C=C(CCl)Cc1ccccc1 Amb25185403 [0,1,0,0,0,0|1,0,2]=4 1064 B11R1.40 C=C(CCl)Sc1ccccc1 Amb27478090 [0,1,0,0,0,0|2,0,1]=4 1065 B11R1.40 C=C(CN)Cc1ccccc1 Amb26614383 [0,1,0,0,0,0|1,0,2]=4 1066 B11R1.40 C=C(CN)Sc1ccccc1 Amb27847529 [0,1,0,0,0,0|2,0,1]=4 1067 B11R1.40 C=C(CO)Sc1ccccc1 Amb27961782 [0,1,0,0,0,0|1,0,2]=4 1068 B11R1.40 C=CC(=C)Sc1ccccc1 Amb4013516 [0,1,0,0,0,0|2,0,0]=3 1069 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,1,0,0,0,0|1,0,1]=3 1070 B11R1.40 C=CC(=O)Cc1ccccn1 Amb24425169 [0,1,0,0,0,0|2,0,1]=4 1071 B11R1.40 C=CC(=O)Cc1cccnc1 Amb28365485 [0,1,0,0,0,0|2,0,1]=4 1072 B11R1.40 C=CC(=O)Cc1ccncc1 Amb27389580 [0,1,0,0,0,0|2,0,1]=4 1073 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [0,1,0,0,0,0|2,0,0]=3 1074 B11R1.40 C=CC(=O)Nc1ccccn1 Amb33532236 [0,1,0,0,0,0|3,0,0]=4 1075 B11R1.40 C=CC(=O)Nc1cccnc1 Amb33532237 [0,1,0,0,0,0|3,0,0]=4 1076 B11R1.40 C=CC(=O)Nc1ccncc1 Amb9480418 [0,1,0,0,0,0|3,0,0]=4 1077 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [0,1,0,0,0,0|1,0,2]=4 1078 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [0,1,0,0,0,0|2,0,1]=4 1080 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [0,1,0,0,0,0|1,0,2]=4 1081 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,1,0,0,0,0|1,0,2]=4 1082 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [0,1,0,0,0,0|2,0,1]=4 1083 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [0,1,0,0,0,0|2,0,1]=4 1084 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [0,1,0,0,0,0|1,0,2]=4 1085 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [0,1,0,0,0,0|2,0,1]=4 1086 B11R1.40 C=C\C(C)=C/c1ccccc1 Amb27428211 [0,1,0,0,0,0|1,0,0]=2 1087 B11R1.40 C=C\C(C)=C\c1ccccc1 Amb27950688 [0,1,0,0,0,0|1,0,0]=2 1088 B11R1.40 C=C\C(C)=C\c1ccccn1 Amb24101881 [0,1,0,0,0,0|2,0,0]=3 1089 B11R1.40 C=C\C(C)=C\c1cccnc1 Amb24085616 [0,1,0,0,0,0|2,0,0]=3 1090 B11R1.40 C=C\C(C)=C\c1ccncc1 Amb24103157 [0,1,0,0,0,0|2,0,0]=3 1091 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [0,1,0,0,0,0|0,0,2]=3 1092 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [0,1,0,0,0,0|1,0,2]=4 1093 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [0,1,0,0,0,0|1,0,2]=4 1094 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,1,0,0,0,0|1,0,1]=3 1095 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,1,0,0,0,0|1,0,1]=3 1096 B11R1.40 CC(C=O)Sc1ccccn1 Amb35652165 [0,1,0,0,0,0|2,0,1]=4 1097 B11R1.40 CC(C=O)Sc1ccncc1 Amb35652166 [0,1,0,0,0,0|2,0,1]=4 1098 B11R1.40 CC(Nc1ccccc1)=S=O Amb27592896 [0,1,0,0,0,0|2,0,0]=3 1099 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,1,0,0,0,0|1,0,2]=4 1100 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,1,0,0,0,0|2,0,1]=4 1101 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,1,0,0,0,0|2,0,1]=4 1102 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,1,0,0,0,0|2,0,1]=4 1103 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [0,1,0,0,0,0|1,0,1]=3 1104 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [0,1,0,0,0,0|1,0,1]=3 1105 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [0,1,0,0,0,0|1,0,1]=3 1106 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [0,1,0,0,0,0|1,0,1]=3 1107 B11R1.40 CN(C=O)Cc1ccncc1 Amb27262023 [0,1,0,0,0,0|2,0,1]=4 1108 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,1,0,0,0,0|2,0,1]=4 1109 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [0,1,0,0,0,0|3,0,0]=4 1110 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [0,1,0,0,0,0|2,0,1]=4 1111 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [0,1,0,0,0,0|2,0,0]=3 1116 B11R1.40 CN\C(C)=C\c1ccccn1 Amb28423447 [0,1,0,0,0,0|3,0,0]=4 1117 B11R1.40 CN\C(C)=C\c1cccnc1 Amb27170157 [0,1,0,0,0,0|3,0,0]=4 1118 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,1,0,0,0,0|2,0,1]=4 1119 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [0,1,0,0,0,0|2,0,1]=4 1121 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,1,0,0,0,0|3,0,0]=4 1122 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.40 CO\C([O-])=N\c1ccccc1 Amb8488213 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.40 CSC(=S)Nc1ccccc1 Amb5716125 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,1,0,0,0,0|1,0,1]=3 1129 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [0,1,0,0,0,0|1,0,1]=3 1130 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [0,1,0,0,0,0|1,0,1]=3 1131 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [0,1,0,0,0,0|1,0,1]=3 1132 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [0,1,0,0,0,0|0,0,2]=3 1133 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [0,1,0,0,0,0|0,1,1]=3 1134 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [0,1,0,0,0,0|1,0,1]=3 1135 B11R1.40 C\C(=C\c1ccccn1)CCl Amb27622092 [0,1,0,0,0,0|2,0,1]=4 1136 B11R1.40 C\C(=C\c1cccnc1)CN Amb27480311 [0,1,0,0,0,0|2,0,1]=4 1137 B11R1.40 C\C(=C\c1ccncc1)CBr Amb28454468 [0,1,0,0,0,0|2,0,1]=4 1138 B11R1.40 C\C(=C\c1ccncc1)CN Amb27242023 [0,1,0,0,0,0|2,0,1]=4 1139 B11R1.40 C\C(=C\c1ccncc1)CO Amb27663027 [0,1,0,0,0,0|1,0,2]=4 1140 B11R1.40 C\C(=N\N)Nc1ccccc1 Amb27198359 [0,1,0,0,0,0|3,0,0]=4 1141 B11R1.40 C\C(=N\O)Nc1ccccc1 Amb2610722 [0,1,0,0,0,0|2,0,1]=4 1142 B11R1.40 C\C(C#N)=C\c1ccccc1 Amb27421076 [0,1,0,0,0,0|1,0,1]=3 1143 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,1,0,0,0,0|0,0,0]=1 1144 B11R1.40 C\C(C=O)=C/c1ccccn1 Amb1014105 [0,1,0,0,0,0|1,0,0]=2 1145 B11R1.40 C\C(C=O)=C/c1cccnc1 Amb17334266 [0,1,0,0,0,0|1,0,0]=2 1146 B11R1.40 C\C(C=O)=C/c1ccncc1 Amb17334268 [0,1,0,0,0,0|1,0,0]=2 1147 B11R1.40 C\C(C=O)=C/c1cncnc1 Amb28058466 [0,1,0,0,0,0|2,0,0]=3 1148 B11R1.40 C\C(C=O)=C\c1cccnc1 Amb28070736 [0,1,0,0,0,0|1,0,0]=2 1149 B11R1.40 C\C=C(\C)Nc1ccccc1 Amb27597055 [0,1,0,0,0,0|2,0,0]=3 1150 B11R1.40 C\N=C(\C)Oc1ccccc1 Amb27260339 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [0,1,0,0,0,0|2,0,1]=4 1152 B11R1.40 ClC\C(Cl)=N\c1ccccc1 Amb27875115 [0,1,0,0,0,0|2,0,1]=4 1153 B11R1.40 Cl\C=C(/Cl)Oc1ccccc1 Amb34048810 [0,1,0,0,0,0|2,0,0]=3 1154 B11R1.40 Cl\C=C(\Cl)Cc1ccccc1 Amb27657562 [0,1,0,0,0,0|1,0,1]=3 1155 B11R1.40 Cl\C=C(\Cl)Oc1ccccc1 Amb25968444 [0,1,0,0,0,0|2,0,0]=3 1156 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [0,1,0,0,0,0|1,0,1]=3 1157 B11R1.40 F\C(=C\Cl)Oc1ccccc1 Amb27477898 [0,1,0,0,0,0|2,0,0]=3 1158 B11R1.40 F\C(=C\Cl)Sc1ccccc1 Amb28383507 [0,1,0,0,0,0|2,0,0]=3 1159 B11R1.40 N#CC(=O)Cc1ccccc1 Amb26498532 [0,1,0,0,0,0|1,0,2]=4 1160 B11R1.40 N#CC(=O)Nc1ccccc1 Amb4006113 [0,1,0,0,0,0|2,0,1]=4 1161 B11R1.40 N#CC(=O)Oc1ccccc1 Amb27813575 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.40 N#CC(=S)Nc1ccccc1 Amb8515443 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.40 N#C\C(F)=C/c1ccccn1 Amb26559758 [0,1,0,0,0,0|2,0,1]=4 1164 B11R1.40 N#C\C(F)=C\c1ccccc1 Amb18644314 [0,1,0,0,0,0|1,0,1]=3 1165 B11R1.40 N#C\C(F)=C\c1ccccn1 Amb25696340 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.40 N=C(CCl)Cc1ccccc1 Amb27878974 [0,1,0,0,0,0|1,0,2]=4 1167 B11R1.40 N=C(CCl)Nc1ccccc1 Amb27234641 [0,1,0,0,0,0|2,0,1]=4 1168 B11R1.40 N=C(CCl)Sc1ccccc1 Amb29847983 [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.40 N=C(CF)Nc1ccccc1 Amb27863862 [0,1,0,0,0,0|2,0,1]=4 1170 B11R1.40 N=C(CO)Nc1ccccc1 Amb28062227 [0,1,0,0,0,0|1,0,2]=4 1171 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [0,1,0,0,0,0|2,0,1]=4 1172 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,1,0,0,0,0|1,0,2]=4 1173 B11R1.40 N=C(NN)Nc1ccccc1 Amb32712057 [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.40 N=C(NN)Oc1ccccc1 Amb27769041 [0,1,0,0,0,0|3,0,0]=4 1175 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,1,0,0,0,0|1,0,2]=4 1176 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,1,0,0,0,0|1,0,2]=4 1177 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,1,0,0,0,0|2,0,1]=4 1178 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,1,0,0,0,0|2,0,1]=4 1179 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,1,0,0,0,0|2,0,1]=4 1180 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [0,1,0,0,0,0|2,0,1]=4 1181 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.40 NNC(=O)Nc1ccccc1 Amb9825866 [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.40 NNC(=O)Oc1ccccc1 Amb2737176 [0,1,0,0,0,0|3,0,0]=4 1184 B11R1.40 NNC(=S)Nc1ccccc1 Amb6335759 [0,1,0,0,0,0|3,0,0]=4 1185 B11R1.40 NNC(=S)Oc1ccccc1 Amb28248761 [0,1,0,0,0,0|3,0,0]=4 1186 B11R1.40 NNC(=S)Sc1ccccc1 Amb27254132 [0,1,0,0,0,0|3,0,0]=4 1187 B11R1.40 NN\C(S)=N\c1ccccc1 Amb8468017 [0,1,0,0,0,0|3,0,0]=4 1188 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,1,0,0,0,0|3,0,0]=4 1189 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [0,1,0,0,0,0|0,0,2]=3 1190 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb18799378 [0,1,0,0,0,0|2,0,1]=4 1191 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb33743404 [0,1,0,0,0,0|2,0,1]=4 1192 B11R1.40 N\C(=N\Cl)Nc1ccccc1 Amb27244827 [0,1,0,0,0,0|3,0,0]=4 1193 B11R1.40 N\C(Cc1ccccc1)=N/O Amb1159399 [0,1,0,0,0,0|1,0,2]=4 1194 B11R1.40 N\C(Cc1ccccc1)=N\O Amb1106303 [0,1,0,0,0,0|1,0,2]=4 1195 B11R1.40 N\N=C(\N)Nc1ccccc1 Amb25046170 [0,1,0,0,0,0|3,0,0]=4 1196 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,1,0,0,0,0|1,0,2]=4 1197 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,1,0,0,0,0|2,0,1]=4 1198 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [0,1,0,0,0,0|2,0,1]=4 1199 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,1,0,0,0,0|1,0,2]=4 1200 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,1,0,0,0,0|2,0,1]=4 1203 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,1,0,0,0,0|2,0,1]=4 1204 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,1,0,0,0,0|1,0,2]=4 1205 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,1,0,0,0,0|1,1,1]=4 1206 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,1,0,0,0,0|0,0,1]=2 1209 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,1,0,0,0,0|1,0,0]=2 1210 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [0,1,0,0,0,0|0,0,2]=3 1211 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [0,1,0,0,0,0|1,0,2]=4 1212 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [0,1,0,0,0,0|0,0,2]=3 1213 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [0,1,0,0,0,0|1,0,2]=4 1214 B11R1.40 O=CN(O)Cc1ccccc1 Amb27873557 [0,1,0,0,0,0|1,0,1]=3 1215 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [0,1,0,0,0,0|0,0,2]=3 1216 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [0,1,0,0,0,0|0,0,2]=3 1217 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [0,1,0,0,0,0|0,0,2]=3 1218 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,1,0,0,0,0|0,0,0]=1 1219 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,1,0,0,0,0|0,0,0]=1 1220 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,1,0,0,0,0|0,0,0]=1 1221 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,1,0,0,0,0|0,0,0]=1 1222 B11R1.40 O=C\C(Cl)=C\c1ccccn1 Amb18126489 [0,1,0,0,0,0|1,0,0]=2 1223 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,1,0,0,0,0|0,0,0]=1 1224 B11R1.40 O=NN(O)Cc1ccccc1 Amb28131432 [0,1,0,0,0,0|2,0,1]=4 1225 B11R1.40 O=N\C(Br)=C/c1ccccc1 Amb27862869 [0,1,0,0,0,0|1,0,0]=2 1226 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [0,1,0,0,0,0|0,0,2]=3 1227 B11R1.40 ONC(=S)Nc1ccccc1 Amb9824829 [0,1,0,0,0,0|2,0,1]=4 1228 B11R1.40 O\N=C(/Cl)Cc1ccccc1 Amb33625234 [0,1,0,0,0,0|1,0,2]=4 1229 B11R1.40 O\N=C(/O)Cc1ccccc1 Amb19986986 [0,1,0,0,0,0|1,0,2]=4 1230 B11R1.91 C=C(Br)CNc1ccccc1 Amb4303983 [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [0,1,0,0,0,0|1,0,2]=4 1232 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [0,1,0,0,0,0|2,0,1]=4 1233 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [0,1,0,0,0,0|2,0,1]=4 1234 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [0,1,0,0,0,0|2,0,1]=4 1235 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [0,1,0,0,0,0|2,0,1]=4 1236 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [0,1,0,0,0,0|2,0,1]=4 1237 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [0,1,0,0,0,0|1,0,0]=2 1238 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [0,1,0,0,0,0|2,0,1]=4 1239 B11R1.91 C=C(Cl)CSc1ccccc1 Amb4013517 [0,1,0,0,0,0|2,0,1]=4 1240 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [0,1,0,0,0,0|1,0,2]=4 1241 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [0,1,0,0,0,0|2,0,1]=4 1242 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [0,1,0,0,0,0|2,0,1]=4 1243 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [0,1,0,0,0,0|0,0,2]=3 1244 B11R1.91 CC(=O)C#Cc1ccccn1 Amb27267519 [0,1,0,0,0,0|1,0,2]=4 1245 B11R1.91 CC(=O)C#Cc1cccnc1 Amb26455637 [0,1,0,0,0,0|1,0,2]=4 1246 B11R1.91 CC(=O)C#Cc1ccncc1 Amb27249499 [0,1,0,0,0,0|1,0,2]=4 1247 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [0,1,0,0,0,0|0,0,2]=3 1248 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [0,1,0,0,0,0|1,0,2]=4 1249 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [0,1,0,0,0,0|1,0,2]=4 1250 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [0,1,0,0,0,0|1,0,2]=4 1251 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [0,1,0,0,0,0|1,0,2]=4 1252 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [0,1,0,0,0,0|1,0,1]=3 1253 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [0,1,0,0,0,0|2,0,1]=4 1254 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [0,1,0,0,0,0|1,0,1]=3 1255 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [0,1,0,0,0,0|2,0,1]=4 1256 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [0,1,0,0,0,0|1,0,1]=3 1257 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [0,1,0,0,0,0|2,0,1]=4 1258 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [0,1,0,0,0,0|2,0,1]=4 1259 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [0,1,0,0,0,0|1,0,1]=3 1260 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [0,1,0,0,0,0|2,0,1]=4 1261 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [0,1,0,0,0,0|2,0,1]=4 1262 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [0,1,0,0,0,0|2,0,1]=4 1263 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [0,1,0,0,0,0|2,0,0]=3 1264 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [0,1,0,0,0,0|2,0,1]=4 1265 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [0,1,0,0,0,0|1,0,1]=3 1266 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [0,1,0,0,0,0|2,0,1]=4 1267 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [0,1,0,0,0,0|2,0,1]=4 1268 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [0,1,0,0,0,0|2,0,0]=3 1269 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [0,1,0,0,0,0|1,0,1]=3 1270 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [0,1,0,0,0,0|0,0,0]=1 1271 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [0,1,0,0,0,0|0,0,0]=1 1272 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [0,1,0,0,0,0|1,0,0]=2 1273 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [0,1,0,0,0,0|1,0,0]=2 1274 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb33223775 [0,1,0,0,0,0|1,0,0]=2 1275 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb33359225 [0,1,0,0,0,0|1,0,0]=2 1276 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [0,1,0,0,0,0|2,0,0]=3 1277 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [0,1,0,0,0,0|2,0,0]=3 1278 B11R1.91 CC(=O)\C=C\c1cncnc1 Amb32876838 [0,1,0,0,0,0|2,0,0]=3 1279 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [0,1,0,0,0,0|2,0,0]=3 1280 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [0,1,0,0,0,0|2,0,0]=3 1281 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [0,1,0,0,0,0|1,1,1]=4 1282 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [0,1,0,0,0,0|1,0,1]=3 1283 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [0,1,0,0,0,0|1,0,1]=3 1284 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [0,1,0,0,0,0|2,0,0]=3 1285 B11R1.91 CC(C)=CSc1ccccc1 Amb27767952 [0,1,0,0,0,0|2,0,0]=3 1286 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [0,1,0,0,0,0|2,0,1]=4 1287 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [0,1,0,0,0,0|1,0,1]=3 1288 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [0,1,0,0,0,0|1,0,1]=3 1289 B11R1.91 CC(C)\N=C\c1ccccc1 Amb4020035 [0,1,0,0,0,0|2,0,1]=4 1290 B11R1.91 CC(Cl)\C=C\c1cccnc1 Amb27881248 [0,1,0,0,0,0|2,0,1]=4 1291 B11R1.91 CC(Cl)\C=C\c1ccncc1 Amb27768545 [0,1,0,0,0,0|2,0,1]=4 1292 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [0,1,0,0,0,0|1,0,1]=3 1293 B11R1.91 CC(N)\C=C\c1ccccn1 Amb33172666 [0,1,0,0,0,0|2,0,1]=4 1294 B11R1.91 CC(N)\C=C\c1cccnc1 Amb33172475 [0,1,0,0,0,0|2,0,1]=4 1295 B11R1.91 CC(N)\C=C\c1ccncc1 Amb33359059 [0,1,0,0,0,0|2,0,1]=4 1296 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [0,1,0,0,0,0|0,0,2]=3 1297 B11R1.91 CC(O)\C=C\c1ccccn1 Amb576300 [0,1,0,0,0,0|1,0,2]=4 1298 B11R1.91 CC(O)\C=C\c1cccnc1 Amb25847379 [0,1,0,0,0,0|1,0,2]=4 1299 B11R1.91 CC(O)\C=C\c1ccncc1 Amb616107 [0,1,0,0,0,0|1,0,2]=4 1300 B11R1.91 CN(C)\C=C\c1ccncc1 Amb24355668 [0,1,0,0,0,0|3,0,0]=4 1301 B11R1.91 CN(C)\C=N\c1ccccc1 Amb33512937 [0,1,0,0,0,0|3,0,0]=4 1302 B11R1.91 CN(C)\N=C\c1ccccc1 Amb33512938 [0,1,0,0,0,0|3,0,0]=4 1303 B11R1.91 CS(=O)\N=C\c1ccccc1 Amb35681663 [0,1,0,0,0,0|2,0,0]=3 1304 B11R1.91 CS(=O)\N=C\c1ccccn1 Amb35681655 [0,1,0,0,0,0|3,0,0]=4 1305 B11R1.91 CS(=O)\N=C\c1cccnc1 Amb35681658 [0,1,0,0,0,0|3,0,0]=4 1306 B11R1.91 CS(=O)\N=C\c1ccncc1 Amb29858755 [0,1,0,0,0,0|3,0,0]=4 1307 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [0,1,0,0,0,0|1,0,1]=3 1308 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [0,1,0,0,0,0|0,0,2]=3 1309 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [0,1,0,0,0,0|1,0,1]=3 1310 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [0,1,0,0,0,0|0,0,2]=3 1311 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [0,1,0,0,0,0|2,0,1]=4 1312 B11R1.91 N=C(/N)SCc1ccccc1 Amb20655654 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [0,1,0,0,0,0|1,0,2]=4 1314 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [0,1,0,0,0,0|1,0,2]=4 1315 B11R1.91 N=C(N)COc1ccccc1 Amb2725000 [0,1,0,0,0,0|2,0,1]=4 1316 B11R1.91 N=C(N)COc1ccccc1 Amb33551040 [0,1,0,0,0,0|2,0,1]=4 1317 B11R1.91 N=C(N)CSc1ccccc1 Amb2726049 [0,1,0,0,0,0|2,0,1]=4 1318 B11R1.91 N=C(N)NCc1ccccc1 Amb22370878 [0,1,0,0,0,0|2,0,1]=4 1319 B11R1.91 N=C(N)NCc1ccccc1 Amb602728 [0,1,0,0,0,0|2,0,1]=4 1320 B11R1.91 N=C(N)NCc1ccccc1 Amb7990388 [0,1,0,0,0,0|2,0,1]=4 1321 B11R1.91 N=C(N)OCc1ccccc1 Amb6773970 [0,1,0,0,0,0|2,0,1]=4 1322 B11R1.91 N=C(N)SCc1ccccc1 Amb20676044 [0,1,0,0,0,0|2,0,1]=4 1323 B11R1.91 N=C(N)SCc1ccccc1 Amb2609643 [0,1,0,0,0,0|2,0,1]=4 1324 B11R1.91 N=C(N)SCc1ccccc1 Amb6296081 [0,1,0,0,0,0|2,0,1]=4 1325 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [0,1,0,0,0,0|1,0,0]=2 1326 B11R1.91 N=C(N)\C=C\c1cccnc1 Amb25992761 [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [0,1,0,0,0,0|2,0,1]=4 1328 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [0,1,0,0,0,0|0,0,2]=3 1329 B11R1.91 NC(=O)C#Cc1cccnc1 Amb28046809 [0,1,0,0,0,0|1,0,2]=4 1330 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [0,1,0,0,0,0|1,0,2]=4 1331 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [0,1,0,0,0,0|0,0,2]=3 1332 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [0,1,0,0,0,0|1,0,2]=4 1333 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [0,1,0,0,0,0|1,0,2]=4 1334 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [0,1,0,0,0,0|1,0,1]=3 1335 B11R1.91 NC(=O)CNc1ccccn1 Amb6658788 [0,1,0,0,0,0|2,0,1]=4 1336 B11R1.91 NC(=O)CNc1cccnc1 Amb27482670 [0,1,0,0,0,0|2,0,1]=4 1337 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [0,1,0,0,0,0|1,0,1]=3 1338 B11R1.91 NC(=O)COc1ccccn1 Amb27878790 [0,1,0,0,0,0|2,0,1]=4 1339 B11R1.91 NC(=O)COc1cccnc1 Amb6739850 [0,1,0,0,0,0|2,0,1]=4 1340 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [0,1,0,0,0,0|1,0,1]=3 1341 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [0,1,0,0,0,0|2,0,1]=4 1342 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [0,1,0,0,0,0|1,0,1]=3 1343 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [0,1,0,0,0,0|2,0,1]=4 1344 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [0,1,0,0,0,0|2,0,1]=4 1345 B11R1.91 NC(=O)NCc1ccncc1 Amb6658828 [0,1,0,0,0,0|2,0,1]=4 1346 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [0,1,0,0,0,0|2,0,0]=3 1347 B11R1.91 NC(=O)NNc1ccccn1 Amb28119875 [0,1,0,0,0,0|3,0,0]=4 1348 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [0,1,0,0,0,0|2,0,0]=3 1349 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [0,1,0,0,0,0|1,0,1]=3 1350 B11R1.91 NC(=O)OCc1cccnc1 Amb26464124 [0,1,0,0,0,0|2,0,1]=4 1351 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [0,1,0,0,0,0|1,0,1]=3 1352 B11R1.91 NC(=O)SCc1ccccn1 Amb28145815 [0,1,0,0,0,0|2,0,1]=4 1353 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [0,1,0,0,0,0|0,0,0]=1 1354 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [0,1,0,0,0,0|1,0,0]=2 1355 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [0,1,0,0,0,0|0,0,0]=1 1356 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [0,1,0,0,0,0|0,0,0]=1 1357 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [0,1,0,0,0,0|1,0,0]=2 1358 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [0,1,0,0,0,0|1,0,0]=2 1359 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [0,1,0,0,0,0|1,0,0]=2 1360 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [0,1,0,0,0,0|1,0,0]=2 1361 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [0,1,0,0,0,0|0,1,2]=4 1362 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [0,1,0,0,0,0|1,1,1]=4 1363 B11R1.91 NC(=S)CSc1ccccc1 Amb6572429 [0,1,0,0,0,0|1,1,1]=4 1364 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [0,1,0,0,0,0|1,1,1]=4 1365 B11R1.91 NC(=S)NCc1ccccc1 Amb32644733 [0,1,0,0,0,0|1,1,1]=4 1366 B11R1.91 NC(=S)NNc1ccccc1 Amb3429340 [0,1,0,0,0,0|2,1,0]=4 1367 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [0,1,0,0,0,0|0,1,0]=2 1368 B11R1.91 NC(=S)\C=C\c1ccccn1 Amb27233532 [0,1,0,0,0,0|1,1,0]=3 1369 B11R1.91 NC(=S)\C=C\c1cccnc1 Amb27232946 [0,1,0,0,0,0|1,1,0]=3 1370 B11R1.91 NC(=S)\N=N\c1ccccc1 Amb27984870 [0,1,0,0,0,0|2,1,0]=4 1371 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [0,1,0,0,0,0|2,0,1]=4 1372 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [0,1,0,0,0,0|2,0,1]=4 1373 B11R1.91 NC(N)=NNc1ccccc1 Amb24726173 [0,1,0,0,0,0|3,0,0]=4 1374 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [0,1,0,0,0,0|0,0,2]=3 1375 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [0,1,0,0,0,0|1,0,2]=4 1376 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [0,1,0,0,0,0|1,0,2]=4 1377 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [0,1,0,0,0,0|1,0,1]=3 1378 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [0,1,0,0,0,0|1,0,1]=3 1379 B11R1.91 O=C(Cl)CSc1ccccn1 Amb19650937 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.91 O=C(Cl)CSc1ccncc1 Amb22396542 [0,1,0,0,0,0|2,0,1]=4 1381 B11R1.91 O=C(Cl)CSc1ccncc1 Amb8629347 [0,1,0,0,0,0|2,0,1]=4 1382 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [0,1,0,0,0,0|1,0,1]=3 1383 B11R1.91 O=C(Cl)OCc1ccccn1 Amb33297000 [0,1,0,0,0,0|2,0,1]=4 1384 B11R1.91 O=C(Cl)OCc1cccnc1 Amb25852784 [0,1,0,0,0,0|2,0,1]=4 1385 B11R1.91 O=C(Cl)OCc1cccnc1 Amb33465543 [0,1,0,0,0,0|2,0,1]=4 1386 B11R1.91 O=C(Cl)OCc1ccncc1 Amb24559531 [0,1,0,0,0,0|2,0,1]=4 1387 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [0,1,0,0,0,0|0,0,0]=1 1388 B11R1.91 O=C(Cl)\C=C\c1cccnc1 Amb6307270 [0,1,0,0,0,0|1,0,0]=2 1389 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [0,1,0,0,0,0|1,0,1]=3 1390 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [0,1,0,0,0,0|0,0,2]=3 1391 B11R1.91 O=C(O)C#Cc1ccccn1 Amb16233314 [0,1,0,0,0,0|1,0,2]=4 1392 B11R1.91 O=C(O)C#Cc1cccnc1 Amb20673066 [0,1,0,0,0,0|1,0,2]=4 1393 B11R1.91 O=C(O)C#Cc1ccncc1 Amb20673077 [0,1,0,0,0,0|1,0,2]=4 1394 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [0,1,0,0,0,0|1,0,2]=4 1395 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [0,1,0,0,0,0|0,0,2]=3 1396 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [0,1,0,0,0,0|1,0,2]=4 1397 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [0,1,0,0,0,0|1,0,2]=4 1398 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [0,1,0,0,0,0|1,0,2]=4 1399 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [0,1,0,0,0,0|1,0,2]=4 1400 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [0,1,0,0,0,0|1,0,2]=4 1401 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [0,1,0,0,0,0|1,0,1]=3 1402 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [0,1,0,0,0,0|2,0,1]=4 1403 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [0,1,0,0,0,0|2,0,1]=4 1404 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [0,1,0,0,0,0|2,0,1]=4 1405 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [0,1,0,0,0,0|2,0,1]=4 1406 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [0,1,0,0,0,0|2,0,1]=4 1407 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [0,1,0,0,0,0|2,0,1]=4 1408 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [0,1,0,0,0,0|1,0,1]=3 1409 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [0,1,0,0,0,0|1,0,1]=3 1410 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [0,1,0,0,0,0|2,0,1]=4 1411 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [0,1,0,0,0,0|2,0,1]=4 1412 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [0,1,0,0,0,0|2,0,1]=4 1413 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [0,1,0,0,0,0|2,0,1]=4 1414 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [0,1,0,0,0,0|2,0,1]=4 1415 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [0,1,0,0,0,0|2,0,1]=4 1416 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [0,1,0,0,0,0|1,0,1]=3 1417 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [0,1,0,0,0,0|2,0,1]=4 1418 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [0,1,0,0,0,0|2,0,1]=4 1419 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [0,1,0,0,0,0|2,0,1]=4 1420 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [0,1,0,0,0,0|0,0,0]=1 1421 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [0,1,0,0,0,0|1,0,0]=2 1422 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [0,1,0,0,0,0|1,0,0]=2 1423 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [0,1,0,0,0,0|1,0,0]=2 1424 B11R1.91 O=C(O)\C=C/c1cncnc1 Amb27975406 [0,1,0,0,0,0|2,0,0]=3 1425 B11R1.91 O=C(O)\C=C\N1C=CC=CC1 Amb22015329 [0,1,0,0,0,0|1,0,1]=3 1426 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [0,1,0,0,0,0|0,0,0]=1 1427 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [0,1,0,0,0,0|0,0,0]=1 1428 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [0,1,0,0,0,0|1,0,0]=2 1429 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [0,1,0,0,0,0|1,0,0]=2 1430 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [0,1,0,0,0,0|1,0,0]=2 1431 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [0,1,0,0,0,0|2,0,0]=3 1432 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [0,1,0,0,0,0|1,0,0]=2 1433 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [0,1,0,0,0,0|2,0,0]=3 1434 B11R1.91 O=C(O)\C=C\c1ccnnc1 Amb18125071 [0,1,0,0,0,0|2,0,0]=3 1435 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [0,1,0,0,0,0|2,0,0]=3 1436 B11R1.91 O=C(O)\C=C\c1cncnc1 Amb9780324 [0,1,0,0,0,0|2,0,0]=3 1437 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [0,1,0,0,0,0|2,0,0]=3 1438 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [0,1,0,0,0,0|1,0,2]=4 1439 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [0,1,0,0,0,0|1,0,1]=3 1440 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [0,1,0,0,0,0|1,0,1]=3 1441 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [0,1,0,0,0,0|1,0,1]=3 1442 B11R1.91 O=C([O-])COc1ccccn1 Amb30584712 [0,1,0,0,0,0|2,0,1]=4 1443 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [0,1,0,0,0,0|0,0,0]=1 1444 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [0,1,0,0,0,0|0,0,0]=1 1445 B11R1.91 O=C([O-])\C=C\c1cccnc1 Amb33512942 [0,1,0,0,0,0|1,0,0]=2 1446 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [0,1,0,0,0,0|2,0,0]=3 1447 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [0,1,0,0,0,0|1,0,2]=4 1448 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [0,1,0,0,0,0|1,0,0]=2 1449 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [0,1,0,0,0,0|1,0,2]=4 1450 B11R1.91 O=S([O-])NCc1ccccc1 Amb22641608 [0,1,0,0,0,0|2,0,1]=4 1451 B11R1.91 O=S([O-])\C=C\c1ccccc1 Amb26016414 [0,1,0,0,0,0|1,0,0]=2 1452 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [0,1,0,0,0,0|1,0,2]=4 1453 B11R1.91 O=[N+]([O-])NCc1ccccc1 Amb26560440 [0,1,0,0,0,0|2,0,1]=4 1454 B11R1.91 O=[N+]([O-])NNc1ccccc1 Amb21953657 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.91 O=[N+]([O-])O[Hg]c1ccccc1 Amb22732287 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.91 O=[N+]([O-])\C=C/c1ccccc1 Amb4066298 [0,1,0,0,0,0|1,0,0]=2 1457 B11R1.91 O=[N+]([O-])\C=C/c1ccncc1 Amb1054083 [0,1,0,0,0,0|2,0,0]=3 1458 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb33719275 [0,1,0,0,0,0|1,0,0]=2 1459 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb8396046 [0,1,0,0,0,0|1,0,0]=2 1460 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb19373998 [0,1,0,0,0,0|2,0,0]=3 1461 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb24106744 [0,1,0,0,0,0|2,0,0]=3 1462 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb19515469 [0,1,0,0,0,0|2,0,0]=3 1463 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb33512945 [0,1,0,0,0,0|2,0,0]=3 1464 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb19374504 [0,1,0,0,0,0|2,0,0]=3 1465 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb24096963 [0,1,0,0,0,0|2,0,0]=3 1466 B11R1.91 O=[N+]([O-])\C=C\c1ccncn1 Amb33171845 [0,1,0,0,0,0|3,0,0]=4 1467 B11R1.91 O=[N+]([O-])\C=C\c1ccnnc1 Amb27193386 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.91 O=[N+]([O-])\C=C\c1cnccn1 Amb26880363 [0,1,0,0,0,0|3,0,0]=4 1469 B11R1.91 O=[N+]([O-])\C=C\c1cncnc1 Amb33481049 [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.91 O=[N+]([O-])\C=C\c1ncccn1 Amb27968261 [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [0,1,0,0,0,0|1,0,2]=4 1472 B11R1.91 OB(O)\C=C\c1ccccc1 Amb2447227 [0,1,0,0,0,0|1,0,1]=3 1473 B11R1.91 OB(O)\C=C\c1ccncc1 Amb26436877 [0,1,0,0,0,0|2,0,1]=4 1474 B11R1.91 S=C(Cl)NCc1ccccc1 Amb28436734 [0,1,0,0,0,0|1,1,1]=4 1475 B11R1.91 S=C(S)NCc1ccccc1 Amb26372903 [0,1,0,0,0,0|1,1,1]=4 1476 B11R1.91 S=C([S-])NCc1ccccc1 Amb33249792 [0,1,0,0,0,0|1,1,1]=4 1477 B9R0.18 C\C=C\C=C(C)\C=C\C=O Amb27881777 [0,0,1,0,0,0|0,0,2]=3 1478 B9R0.40 C=C\C=C(C#N)\C=C\C=O Amb27164073 [0,0,1,0,0,0|1,0,1]=3 1479 B9R0.40 C=C\C=C(C=O)\C=C\C=O Amb28199113 [0,0,1,0,0,0|1,0,0]=2 1480 B9R0.45 C=C\C=C\C=C\C=C\C=O Amb27841284 [0,0,1,0,0,0|0,0,0]=1 1481 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [0,0,1,0,0,0|0,0,2]=3 1482 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [0,0,1,0,0,0|0,0,2]=3 1483 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [0,0,1,0,0,0|0,0,2]=3 1484 B9R0.45 CO\C=C\C=C\C=C\C=O Amb27169346 [0,0,1,0,0,0|1,0,1]=3 1485 B9R0.45 C\C=C\C=C\C=C\C=C\Br Amb27451756 [0,0,1,0,0,0|1,0,1]=3 1486 B9R0.45 O=C\C=C\C=C\C=C\C=O Amb18643061 [0,0,1,0,0,0|1,0,0]=2 1487 B9R0.45 O=C\C=C\CC\C=C\C=O Amb27837987 [0,0,1,0,0,0|1,0,2]=4 1488 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [0,0,0,1,0,0|1,0,1]=3 1489 B11R2.1 Brc1ccc2ccccn12 Amb18061677 [0,0,0,1,0,0|2,0,0]=3 1490 B11R2.1 Brc1ccc2cccnn12 Amb18188207 [0,0,0,1,0,0|3,0,0]=4 1491 B11R2.1 Brc1ccc2ccncn12 Amb25082520 [0,0,0,1,0,0|3,0,0]=4 1492 B11R2.1 Brc1ccc2cnccn12 Amb18188551 [0,0,0,1,0,0|3,0,0]=4 1493 B11R2.1 Brc1ccn2ccncc12 Amb18188564 [0,0,0,1,0,0|3,0,0]=4 1494 B11R2.1 Brc1ccn2ncccc12 Amb24464326 [0,0,0,1,0,0|3,0,0]=4 1495 B11R2.1 Brc1cnc2ccccn12 Amb2389876 [0,0,0,1,0,0|3,0,0]=4 1496 B11R2.1 Brc1cnn2ccccc12 Amb2389879 [0,0,0,1,0,0|3,0,0]=4 1497 B11R2.1 Brc1coc2ccccc12 Amb6344810 [0,0,0,1,0,0|2,0,0]=3 1498 B11R2.1 Brc1coc2cccnc12 Amb18187782 [0,0,0,1,0,0|3,0,0]=4 1499 B11R2.1 Brc1coc2ccncc12 Amb18187801 [0,0,0,1,0,0|3,0,0]=4 1500 B11R2.1 Brc1coc2cnccc12 Amb26912398 [0,0,0,1,0,0|3,0,0]=4 1501 B11R2.1 Brc1coc2ncccc12 Amb18811362 [0,0,0,1,0,0|3,0,0]=4 1502 B11R2.1 Brc1csc2ccccc12 Amb2720075 [0,0,0,1,0,0|2,0,0]=3 1503 B11R2.1 Brc1csc2cccnc12 Amb10070411 [0,0,0,1,0,0|3,0,0]=4 1504 B11R2.1 Brc1csc2ccncc12 Amb10070410 [0,0,0,1,0,0|3,0,0]=4 1505 B11R2.1 Brc1csc2cnccc12 Amb10070409 [0,0,0,1,0,0|3,0,0]=4 1506 B11R2.1 Brc1csc2ncccc12 Amb10070408 [0,0,0,1,0,0|3,0,0]=4 1507 B11R2.1 Brc1ncc2ccccn12 Amb21926789 [0,0,0,1,0,0|3,0,0]=4 1508 B11R2.1 Brc1ncn2ccccc12 Amb20669228 [0,0,0,1,0,0|3,0,0]=4 1509 B11R2.1 Brc1noc2ccccc12 Amb18187786 [0,0,0,1,0,0|3,0,0]=4 1510 B11R2.1 Brc1nsc2ccccc12 Amb18769624 [0,0,0,1,0,0|3,0,0]=4 1511 B11R2.1 Brc1snc2ccccc12 Amb22496211 [0,0,0,1,0,0|3,0,0]=4 1512 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [0,0,0,1,0,0|1,0,2]=4 1513 B11R2.1 C=C1CNc2ccccc21 Amb27203251 [0,0,0,1,0,0|2,0,1]=4 1514 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [0,0,0,1,0,0|1,0,1]=3 1515 B11R2.1 CC1=CCc2cccnc21 Amb27838911 [0,0,0,1,0,0|2,0,1]=4 1516 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [0,0,0,1,0,0|1,0,1]=3 1517 B11R2.1 C[n+]1coc2ccccc21 Amb27961147 [0,0,0,1,0,0|3,0,0]=4 1518 B11R2.1 Cc1ccc2ccccn12 Amb28126713 [0,0,0,1,0,0|2,0,0]=3 1519 B11R2.1 Cc1cnc2ccccn12 Amb21960684 [0,0,0,1,0,0|3,0,0]=4 1520 B11R2.1 Cc1coc2ccccc12 Amb2684177 [0,0,0,1,0,0|2,0,0]=3 1521 B11R2.1 Cc1csc2ccccc12 Amb2689330 [0,0,0,1,0,0|2,0,0]=3 1522 B11R2.1 Cc1ncc2ccccn12 Amb1153642 [0,0,0,1,0,0|3,0,0]=4 1523 B11R2.1 Cc1ncn2ccccc12 Amb10070139 [0,0,0,1,0,0|3,0,0]=4 1524 B11R2.1 Cc1noc2ccccc12 Amb445022 [0,0,0,1,0,0|3,0,0]=4 1525 B11R2.1 Cc1nsc2ccccc12 Amb26599921 [0,0,0,1,0,0|3,0,0]=4 1526 B11R2.1 Cc1onc2ccccc12 Amb4120114 [0,0,0,1,0,0|3,0,0]=4 1527 B11R2.1 Clc1ccc2ccccn12 Amb27618437 [0,0,0,1,0,0|2,0,0]=3 1528 B11R2.1 Clc1cnn2ccccc12 Amb22899794 [0,0,0,1,0,0|3,0,0]=4 1529 B11R2.1 Clc1coc2ccccc12 Amb21963868 [0,0,0,1,0,0|2,0,0]=3 1530 B11R2.1 Clc1csc2ccccc12 Amb5494165 [0,0,0,1,0,0|2,0,0]=3 1531 B11R2.1 Clc1csc2cccnc12 Amb25721818 [0,0,0,1,0,0|3,0,0]=4 1532 B11R2.1 Clc1noc2ccccc12 Amb2724801 [0,0,0,1,0,0|3,0,0]=4 1533 B11R2.1 Clc1nsc2ccccc12 Amb1105427 [0,0,0,1,0,0|3,0,0]=4 1534 B11R2.1 Clc1snc2ccccc12 Amb13952486 [0,0,0,1,0,0|3,0,0]=4 1535 B11R2.1 Cln1ccc2ccccc21 Amb28050191 [0,0,0,1,0,0|2,0,0]=3 1536 B11R2.1 Cln1cnc2ccccc21 Amb24351571 [0,0,0,1,0,0|3,0,0]=4 1537 B11R2.1 Cn1ccc2ccccc21 Amb6297777 [0,0,0,1,0,0|2,0,0]=3 1538 B11R2.1 Cn1ccc2cccnc21 Amb10602466 [0,0,0,1,0,0|3,0,0]=4 1539 B11R2.1 Cn1ccc2ccncc21 Amb20671418 [0,0,0,1,0,0|3,0,0]=4 1540 B11R2.1 Cn1ccc2cnccc21 Amb27160678 [0,0,0,1,0,0|3,0,0]=4 1541 B11R2.1 Cn1ccc2ncccc21 Amb22900982 [0,0,0,1,0,0|3,0,0]=4 1542 B11R2.1 Cn1cnc2ccccc21 Amb6364694 [0,0,0,1,0,0|3,0,0]=4 1543 B11R2.1 Cn1ncc2ccccc21 Amb4009871 [0,0,0,1,0,0|3,0,0]=4 1544 B11R2.1 Fc1csc2ccccc12 Amb27667159 [0,0,0,1,0,0|2,0,0]=3 1545 B11R2.1 Fc1noc2ccccc12 Amb35642438 [0,0,0,1,0,0|3,0,0]=4 1546 B11R2.1 Fc1snc2ccccc12 Amb30034029 [0,0,0,1,0,0|3,0,0]=4 1547 B11R2.1 Ic1cnc2ccccn12 Amb8467865 [0,0,0,1,0,0|3,0,0]=4 1548 B11R2.1 Ic1cnn2ccccc12 Amb22585935 [0,0,0,1,0,0|3,0,0]=4 1549 B11R2.1 Ic1coc2ccccc12 Amb24622374 [0,0,0,1,0,0|2,0,0]=3 1550 B11R2.1 Ic1csc2ccccc12 Amb22002561 [0,0,0,1,0,0|2,0,0]=3 1551 B11R2.1 Ic1csc2cccnc12 Amb27613200 [0,0,0,1,0,0|3,0,0]=4 1552 B11R2.1 Ic1ncc2ccccn12 Amb25204219 [0,0,0,1,0,0|3,0,0]=4 1553 B11R2.1 Ic1ncn2ccccc12 Amb24481085 [0,0,0,1,0,0|3,0,0]=4 1554 B11R2.1 Ic1snc2ccccc12 Amb27406455 [0,0,0,1,0,0|3,0,0]=4 1555 B11R2.1 N=C1NCc2ccccc21 Amb7174277 [0,0,0,1,0,0|2,0,1]=4 1556 B11R2.1 NC1=NCc2ccccc21 Amb534105 [0,0,0,1,0,0|2,0,1]=4 1557 B11R2.1 NC1C=Cc2ccccc21 Amb17470367 [0,0,0,1,0,0|1,0,1]=3 1558 B11R2.1 Nc1ccc2ccccn12 Amb18061678 [0,0,0,1,0,0|2,0,0]=3 1559 B11R2.1 Nc1ccn2ccccc12 Amb28119363 [0,0,0,1,0,0|2,0,0]=3 1560 B11R2.1 Nc1ccn2cnccc12 Amb28205462 [0,0,0,1,0,0|3,0,0]=4 1561 B11R2.1 Nc1ccn2ncccc12 Amb28325554 [0,0,0,1,0,0|3,0,0]=4 1562 B11R2.1 Nc1cnc2ccccn12 Amb22276158 [0,0,0,1,0,0|3,0,0]=4 1563 B11R2.1 Nc1cnc2ccccn12 Amb33544829 [0,0,0,1,0,0|3,0,0]=4 1564 B11R2.1 Nc1cnn2ccccc12 Amb18203165 [0,0,0,1,0,0|3,0,0]=4 1565 B11R2.1 Nc1cnn2ccccc12 Amb21964646 [0,0,0,1,0,0|3,0,0]=4 1566 B11R2.1 Nc1cnn2ccccc12 Amb22755063 [0,0,0,1,0,0|3,0,0]=4 1567 B11R2.1 Nc1coc2ccccc12 Amb24371464 [0,0,0,1,0,0|2,0,0]=3 1568 B11R2.1 Nc1coc2cccnc12 Amb24742644 [0,0,0,1,0,0|3,0,0]=4 1569 B11R2.1 Nc1coc2ccncc12 Amb27813427 [0,0,0,1,0,0|3,0,0]=4 1570 B11R2.1 Nc1coc2cnccc12 Amb27633514 [0,0,0,1,0,0|3,0,0]=4 1571 B11R2.1 Nc1coc2ncccc12 Amb18522246 [0,0,0,1,0,0|3,0,0]=4 1572 B11R2.1 Nc1csc2ccccc12 Amb13890519 [0,0,0,1,0,0|2,0,0]=3 1573 B11R2.1 Nc1csc2ccccc12 Amb19957699 [0,0,0,1,0,0|2,0,0]=3 1574 B11R2.1 Nc1csc2cccnc12 Amb10070407 [0,0,0,1,0,0|3,0,0]=4 1575 B11R2.1 Nc1csc2ccncc12 Amb10070406 [0,0,0,1,0,0|3,0,0]=4 1576 B11R2.1 Nc1csc2cnccc12 Amb10067625 [0,0,0,1,0,0|3,0,0]=4 1577 B11R2.1 Nc1csc2ncccc12 Amb10070405 [0,0,0,1,0,0|3,0,0]=4 1578 B11R2.1 Nc1ncc2ccccn12 Amb22740154 [0,0,0,1,0,0|3,0,0]=4 1579 B11R2.1 Nc1ncn2ccccc12 Amb23560066 [0,0,0,1,0,0|3,0,0]=4 1580 B11R2.1 Nc1noc2ccccc12 Amb1323334 [0,0,0,1,0,0|3,0,0]=4 1581 B11R2.1 Nc1nsc2ccccc12 Amb1147286 [0,0,0,1,0,0|3,0,0]=4 1582 B11R2.1 Nc1nsc2ccccc12 Amb32665266 [0,0,0,1,0,0|3,0,0]=4 1583 B11R2.1 Nc1onc2ccccc12 Amb21857107 [0,0,0,1,0,0|3,0,0]=4 1584 B11R2.1 Nc1snc2ccccc12 Amb33542957 [0,0,0,1,0,0|3,0,0]=4 1585 B11R2.1 Nn1ccc2ccccc21 Amb16233739 [0,0,0,1,0,0|2,0,0]=3 1586 B11R2.1 Nn1cnc2ccccc21 Amb443894 [0,0,0,1,0,0|3,0,0]=4 1587 B11R2.1 Nn1ncc2ccccc21 Amb8630394 [0,0,0,1,0,0|3,0,0]=4 1588 B11R2.1 O=C1C=CC2=NCC=CN12 Amb28254538 [0,0,0,1,0,0|2,0,1]=4 1589 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [0,0,0,1,0,0|0,0,0]=1 1590 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [0,0,0,1,0,0|0,0,2]=3 1591 B11R2.1 O=C1CCc2cccnc21 Amb10602809 [0,0,0,1,0,0|1,0,2]=4 1592 B11R2.1 O=C1CCc2ccncc21 Amb22491415 [0,0,0,1,0,0|1,0,2]=4 1593 B11R2.1 O=C1CCc2ccncc21 Amb5719663 [0,0,0,1,0,0|1,0,2]=4 1594 B11R2.1 O=C1CCc2cnccc21 Amb22235532 [0,0,0,1,0,0|1,0,2]=4 1595 B11R2.1 O=C1CCc2cnccc21 Amb5719882 [0,0,0,1,0,0|1,0,2]=4 1596 B11R2.1 O=C1CCc2ncccc21 Amb22275948 [0,0,0,1,0,0|1,0,2]=4 1597 B11R2.1 O=C1CCc2ncccc21 Amb2695094 [0,0,0,1,0,0|1,0,2]=4 1598 B11R2.1 O=C1CN=C2NC=CC=C12 Amb22491902 [0,0,0,1,0,0|2,0,1]=4 1599 B11R2.1 O=C1CNc2cccc[n+]21 Amb32664845 [0,0,0,1,0,0|2,0,1]=4 1600 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [0,0,0,1,0,0|1,0,1]=3 1601 B11R2.1 O=C1COc2ccccc21 Amb33534383 [0,0,0,1,0,0|1,0,1]=3 1602 B11R2.1 O=C1COc2cccnc21 Amb22372216 [0,0,0,1,0,0|2,0,1]=4 1603 B11R2.1 O=C1COc2cnccc21 Amb20242099 [0,0,0,1,0,0|2,0,1]=4 1604 B11R2.1 O=C1COc2cnccc21 Amb22728783 [0,0,0,1,0,0|2,0,1]=4 1605 B11R2.1 O=C1COc2ncccc21 Amb20242022 [0,0,0,1,0,0|2,0,1]=4 1606 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [0,0,0,1,0,0|1,0,1]=3 1607 B11R2.1 O=C1CSc2cnccc21 Amb27265724 [0,0,0,1,0,0|2,0,1]=4 1608 B11R2.1 O=C1CSc2ncccc21 Amb27153117 [0,0,0,1,0,0|2,0,1]=4 1609 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [0,0,0,1,0,0|1,0,0]=2 1610 B11R2.1 O=C1N=Cc2ccncc21 Amb28252569 [0,0,0,1,0,0|2,0,0]=3 1611 B11R2.1 O=C1N=Nc2ccncc21 Amb28399448 [0,0,0,1,0,0|3,0,0]=4 1612 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [0,0,0,1,0,0|2,0,0]=3 1613 B11R2.1 O=C1NCc2ccccc21 Amb773532 [0,0,0,1,0,0|1,0,1]=3 1614 B11R2.1 O=C1NCc2cccnc21 Amb22276754 [0,0,0,1,0,0|2,0,1]=4 1615 B11R2.1 O=C1NCc2ccncc21 Amb22388464 [0,0,0,1,0,0|2,0,1]=4 1616 B11R2.1 O=C1NCc2ccncc21 Amb32675690 [0,0,0,1,0,0|2,0,1]=4 1617 B11R2.1 O=C1NCc2cnccc21 Amb23455305 [0,0,0,1,0,0|2,0,1]=4 1618 B11R2.1 O=C1NCc2ncccc21 Amb33530547 [0,0,0,1,0,0|2,0,1]=4 1619 B11R2.1 O=C1NN=C2C=CC=CN12 Amb18012675 [0,0,0,1,0,0|3,0,0]=4 1620 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [0,0,0,1,0,0|2,0,0]=3 1621 B11R2.1 O=C1NNc2cccnc21 Amb21857168 [0,0,0,1,0,0|3,0,0]=4 1622 B11R2.1 O=C1NNc2cnccc21 Amb21857177 [0,0,0,1,0,0|3,0,0]=4 1623 B11R2.1 O=C1NNc2ncccc21 Amb33528585 [0,0,0,1,0,0|3,0,0]=4 1624 B11R2.1 O=C1NOc2cnccc21 Amb22494128 [0,0,0,1,0,0|3,0,0]=4 1625 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [0,0,0,1,0,0|2,0,0]=3 1626 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [0,0,0,1,0,0|1,0,1]=3 1627 B11R2.1 O=C1OCc2cccnc21 Amb24081817 [0,0,0,1,0,0|2,0,1]=4 1628 B11R2.1 O=C1OCc2ccncc21 Amb22732365 [0,0,0,1,0,0|2,0,1]=4 1629 B11R2.1 O=C1OCc2ncccc21 Amb2612059 [0,0,0,1,0,0|2,0,1]=4 1630 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [0,0,0,1,0,0|2,0,0]=3 1631 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [0,0,0,1,0,0|1,0,1]=3 1632 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [0,0,0,1,0,0|2,0,0]=3 1633 B11R2.1 O=c1nsc2ncccc12 Amb2759329 [0,0,0,1,0,0|3,0,0]=4 1634 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [0,0,0,1,0,0|1,0,0]=2 1635 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|0,0,2]=3 1636 B11R2.1 OC1N=Cc2ccccc21 Amb27631731 [0,0,0,1,0,0|1,0,2]=4 1637 B11R2.1 Oc1ccc2cnccn12 Amb28201971 [0,0,0,1,0,0|2,0,1]=4 1638 B11R2.1 Oc1cnc2ccccn12 Amb24074110 [0,0,0,1,0,0|2,0,1]=4 1639 B11R2.1 Oc1cnn2ccccc12 Amb25359066 [0,0,0,1,0,0|2,0,1]=4 1640 B11R2.1 Oc1coc2ccccc12 Amb24097480 [0,0,0,1,0,0|1,0,1]=3 1641 B11R2.1 Oc1coc2cccnc12 Amb21963453 [0,0,0,1,0,0|2,0,1]=4 1642 B11R2.1 Oc1coc2cccnc12 Amb33996728 [0,0,0,1,0,0|2,0,1]=4 1643 B11R2.1 Oc1csc2ccccc12 Amb4009443 [0,0,0,1,0,0|1,0,1]=3 1644 B11R2.1 Oc1csc2cnccc12 Amb32669775 [0,0,0,1,0,0|2,0,1]=4 1645 B11R2.1 Oc1csc2ncccc12 Amb26464103 [0,0,0,1,0,0|2,0,1]=4 1646 B11R2.1 Oc1noc2ccccc12 Amb2725155 [0,0,0,1,0,0|2,0,1]=4 1647 B11R2.1 Oc1nsc2ccccc12 Amb22166851 [0,0,0,1,0,0|2,0,1]=4 1648 B11R2.1 On1ccc2ccccc21 Amb27243885 [0,0,0,1,0,0|1,0,1]=3 1649 B11R2.1 On1ccc2cccnc21 Amb25858298 [0,0,0,1,0,0|2,0,1]=4 1650 B11R2.1 On1cnc2ccccc21 Amb28318444 [0,0,0,1,0,0|2,0,1]=4 1651 B11R2.1 S=C1CNc2ccccc21 Amb27791107 [0,0,0,1,0,0|1,1,1]=4 1652 B11R2.1 S=C1NC=C2C=CC=CN12 Amb18042920 [0,0,0,1,0,0|2,1,0]=4 1653 B11R2.1 S=c1nnc2ccccc12 Amb24082861 [0,0,0,1,0,0|2,1,0]=4 1654 B11R2.1 Sc1cnn2ccccc12 Amb33147196 [0,0,0,1,0,0|2,1,0]=4 1655 B11R2.1 Sc1coc2ccccc12 Amb24061893 [0,0,0,1,0,0|1,1,0]=3 1656 B11R2.1 Sc1csc2ccccc12 Amb24396652 [0,0,0,1,0,0|1,1,0]=3 1657 B11R2.1 Sc1ncn2ccccc12 Amb23560018 [0,0,0,1,0,0|2,1,0]=4 1658 B11R2.1 Sc1nsc2ccccc12 Amb1136898 [0,0,0,1,0,0|2,1,0]=4 1659 B11R2.1 [NH3+]C1=NCc2ccccc21 Amb4239931 [0,0,0,1,0,0|2,0,1]=4 1660 B11R2.1 [O-][n+]1csc2ccccc21 Amb27767988 [0,0,0,1,0,0|2,0,1]=4 1661 B11R2.1 [O-]c1csc2cccc[n+]12 Amb24309273 [0,0,0,1,0,0|2,0,1]=4 1662 B11R2.1 [SiH3]n1ccc2cccnc21 Amb28135451 [0,0,0,1,0,0|3,0,0]=4 1663 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [0,0,0,1,0,0|2,0,0]=3 1664 B11R2.20 C1=CC2=CN=CNC2=CO1 Amb24505153 [0,0,0,1,0,0|3,0,0]=4 1665 B11R2.20 C1=CC2=CN=CNC2=CS1 Amb27251381 [0,0,0,1,0,0|3,0,0]=4 1666 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [0,0,0,1,0,0|1,0,1]=3 1667 B11R2.20 C1=CCc2ncccc2C1 Amb28146039 [0,0,0,1,0,0|1,0,2]=4 1668 B11R2.20 C1=CNC2=CSN=CC2=C1 Amb25943274 [0,0,0,1,0,0|3,0,0]=4 1669 B11R2.20 C1=CNc2ccncc2C1 Amb25933564 [0,0,0,1,0,0|2,0,1]=4 1670 B11R2.20 C1=COC2=CN=CNC2=C1 Amb24564703 [0,0,0,1,0,0|2,0,1]=4 1671 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [0,0,0,1,0,0|1,0,1]=3 1672 B11R2.20 C1=COc2cccnc2C1 Amb27860347 [0,0,0,1,0,0|1,0,2]=4 1673 B11R2.20 C1=COc2cccnc2N1 Amb27403264 [0,0,0,1,0,0|2,0,1]=4 1674 B11R2.20 C1=COc2ccncc2C1 Amb28050276 [0,0,0,1,0,0|1,0,2]=4 1675 B11R2.20 C1=CSC2=CN=CNC2=C1 Amb27245769 [0,0,0,1,0,0|2,1,0]=4 1676 B11R2.20 C1=CSc2ncccc2N1 Amb27954664 [0,0,0,1,0,0|2,1,0]=4 1677 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [0,0,0,1,0,0|1,0,1]=3 1678 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [0,0,0,1,0,0|2,0,0]=3 1679 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [0,0,0,1,0,0|2,0,0]=3 1680 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [0,0,0,1,0,0|1,0,1]=3 1681 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [0,0,0,1,0,0|0,0,2]=3 1682 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [0,0,0,1,0,0|0,1,1]=3 1683 B11R2.20 C1=NCCc2ccccc21 Amb10603654 [0,0,0,1,0,0|2,0,1]=4 1684 B11R2.20 C1=NCc2ccccc2N1 Amb19374085 [0,0,0,1,0,0|2,0,1]=4 1685 B11R2.20 C1=Nc2ccccc2NC1 Amb10174686 [0,0,0,1,0,0|2,0,1]=4 1686 B11R2.20 C1=Nc2ccccc2OC1 Amb28456926 [0,0,0,1,0,0|1,0,2]=4 1687 B11R2.20 C1=Nc2ccccc2SC1 Amb10976509 [0,0,0,1,0,0|1,1,1]=4 1688 B11R2.20 c1cc2ccncc2cn1 Amb20240662 [0,0,0,1,0,0|3,0,0]=4 1689 B11R2.20 c1cc2ccncc2cn1 Amb33456122 [0,0,0,1,0,0|3,0,0]=4 1690 B11R2.20 c1cc2cnccc2cn1 Amb10573720 [0,0,0,1,0,0|3,0,0]=4 1691 B11R2.20 c1cc2nccnc2cn1 Amb8438986 [0,0,0,1,0,0|3,0,0]=4 1692 B11R2.20 c1cc[n+]2cccnc2c1 Amb2603162 [0,0,0,1,0,0|2,0,0]=3 1693 B11R2.20 c1ccc2[nH+]cccc2c1 Amb10839799 [0,0,0,1,0,0|1,0,0]=2 1694 B11R2.20 c1ccc2ccccc2c1 Amb6608803 [0,0,0,1,0,0|1,0,0]=2 1695 B11R2.20 c1ccc2cnccc2c1 Amb2609970 [0,0,0,1,0,0|2,0,0]=3 1696 B11R2.20 c1ccc2cnncc2c1 Amb10552942 [0,0,0,1,0,0|3,0,0]=4 1697 B11R2.20 c1ccc2cnncc2c1 Amb8384453 [0,0,0,1,0,0|3,0,0]=4 1698 B11R2.20 c1ccc2ncccc2c1 Amb22002632 [0,0,0,1,0,0|1,0,0]=2 1699 B11R2.20 c1ccc2ncccc2c1 Amb2610545 [0,0,0,1,0,0|1,0,0]=2 1700 B11R2.20 c1ccc2nccnc2c1 Amb2099438 [0,0,0,1,0,0|2,0,0]=3 1701 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [0,0,0,1,0,0|2,0,0]=3 1702 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [0,0,0,1,0,0|2,0,0]=3 1703 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [0,0,0,1,0,0|2,0,0]=3 1704 B11R2.20 c1cnc2cccnc2c1 Amb1106274 [0,0,0,1,0,0|2,0,0]=3 1705 B11R2.20 c1cnc2ccncc2c1 Amb6565155 [0,0,0,1,0,0|2,0,0]=3 1706 B11R2.20 c1cnc2ccnnc2c1 Amb27470418 [0,0,0,1,0,0|3,0,0]=4 1707 B11R2.20 c1cnc2cnccc2c1 Amb4560929 [0,0,0,1,0,0|2,0,0]=3 1708 B11R2.20 c1cnc2ncccc2c1 Amb15692873 [0,0,0,1,0,0|2,0,0]=3 1709 B11R2.20 c1cnc2nccnc2c1 Amb33544339 [0,0,0,1,0,0|3,0,0]=4 1710 B11R2.238 C(=C1CC1)c2ccccc2 Amb19515480 [0,0,0,1,0,0|1,0,1]=3 1711 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [0,0,0,1,0,0|1,0,1]=3 1712 B11R2.239 C1=C(c2cccnc2)CC1 Amb32668896 [0,0,0,1,0,0|2,0,1]=4 1713 B11R2.988 C=CC1Cc2ccccc21 Amb17778869 [0,0,0,1,0,0|1,0,2]=4 1714 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [0,0,0,1,0,0|1,0,1]=3 1715 B11R2.988 COC1=Cc2ccccc21 Amb27267205 [0,0,0,1,0,0|2,0,0]=3 1716 B11R2.988 N#CC1=Cc2ccccc21 Amb22227852 [0,0,0,1,0,0|1,0,1]=3 1717 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [0,0,0,1,0,0|0,0,2]=3 1718 B11R2.988 O\N=C1/Cc2ccccc21 Amb3862130 [0,0,0,1,0,0|1,0,2]=4 1719 B9R1.12 BrC\C=C\c1ccco1 Amb27867174 [0,0,0,0,1,0|2,0,1]=4 1720 B9R1.12 Br\C=C\Sc1ccsc1 Amb27224331 [0,0,0,0,1,0|3,0,0]=4 1721 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [0,0,0,0,1,0|2,0,0]=3 1722 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [0,0,0,0,1,0|2,0,0]=3 1723 B9R1.12 C=C\N=C\c1cccs1 Amb27240018 [0,0,0,0,1,0|3,0,0]=4 1724 B9R1.12 CO\C=C\c1cccs1 Amb27638492 [0,0,0,0,1,0|3,0,0]=4 1725 B9R1.12 CO\C=C\c1ccoc1 Amb25349455 [0,0,0,0,1,0|3,0,0]=4 1726 B9R1.12 CO\C=C\c1ccsc1 Amb27246685 [0,0,0,0,1,0|3,0,0]=4 1727 B9R1.12 C\C=C/Cn1cccc1 Amb27790551 [0,0,0,0,1,0|2,0,1]=4 1728 B9R1.12 Cl\C=C\Cc1ccco1 Amb27843650 [0,0,0,0,1,0|2,0,1]=4 1729 B9R1.12 Cl\C=C\Sc1cccs1 Amb27444040 [0,0,0,0,1,0|3,0,0]=4 1730 B9R1.12 N#C\C=C/c1ccco1 Amb28200911 [0,0,0,0,1,0|2,0,1]=4 1731 B9R1.12 N#C\C=C\c1cccs1 Amb3429733 [0,0,0,0,1,0|2,0,1]=4 1732 B9R1.12 N#C\C=C\c1ccoc1 Amb27817415 [0,0,0,0,1,0|2,0,1]=4 1733 B9R1.12 NC\C=C/c1cccs1 Amb27167022 [0,0,0,0,1,0|2,0,1]=4 1734 B9R1.12 NC\C=C\c1ccco1 Amb10560864 [0,0,0,0,1,0|2,0,1]=4 1735 B9R1.12 NC\C=C\c1cccs1 Amb18563038 [0,0,0,0,1,0|2,0,1]=4 1736 B9R1.12 NC\C=C\c1ccoc1 Amb28347981 [0,0,0,0,1,0|2,0,1]=4 1737 B9R1.12 NC\C=C\c1ccsc1 Amb18643463 [0,0,0,0,1,0|2,0,1]=4 1738 B9R1.12 O=CC#Cc1ccoc1 Amb27966716 [0,0,0,0,1,0|1,0,2]=4 1739 B9R1.12 O=CCCc1ccco1 Amb17081672 [0,0,0,0,1,0|1,0,2]=4 1740 B9R1.12 O=CCCc1cccs1 Amb17081673 [0,0,0,0,1,0|1,0,2]=4 1741 B9R1.12 O=CCCc1ccoc1 Amb8394152 [0,0,0,0,1,0|1,0,2]=4 1742 B9R1.12 O=CCCc1ccsc1 Amb26961096 [0,0,0,0,1,0|1,0,2]=4 1743 B9R1.12 O=CCOc1ccsc1 Amb27191888 [0,0,0,0,1,0|2,0,1]=4 1744 B9R1.12 O=CCSc1cccs1 Amb17082929 [0,0,0,0,1,0|2,0,1]=4 1745 B9R1.12 O=CNCc1ccco1 Amb3319177 [0,0,0,0,1,0|2,0,1]=4 1746 B9R1.12 O=CNCc1cccs1 Amb27774671 [0,0,0,0,1,0|2,0,1]=4 1747 B9R1.12 O=CNCc1ccoc1 Amb28188531 [0,0,0,0,1,0|2,0,1]=4 1748 B9R1.12 O=COCc1ccco1 Amb26359842 [0,0,0,0,1,0|2,0,1]=4 1749 B9R1.12 O=COCn1cccc1 Amb26423885 [0,0,0,0,1,0|2,0,1]=4 1750 B9R1.12 O=C\C=C/c1ccco1 Amb27590405 [0,0,0,0,1,0|1,0,0]=2 1751 B9R1.12 O=C\C=C\c1ccco1 Amb33870988 [0,0,0,0,1,0|1,0,0]=2 1752 B9R1.12 O=C\C=C\c1cccs1 Amb17334164 [0,0,0,0,1,0|1,0,0]=2 1753 B9R1.12 O=C\C=C\c1ccns1 Amb35719811 [0,0,0,0,1,0|2,0,0]=3 1754 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [0,0,0,0,1,0|1,0,0]=2 1755 B9R1.12 O=C\C=C\c1ccon1 Amb33197559 [0,0,0,0,1,0|2,0,0]=3 1756 B9R1.12 O=C\C=C\c1ccsc1 Amb18643292 [0,0,0,0,1,0|1,0,0]=2 1757 B9R1.12 O=C\C=C\c1cnco1 Amb33414801 [0,0,0,0,1,0|2,0,0]=3 1758 B9R1.12 O=C\C=C\c1cncs1 Amb33079492 [0,0,0,0,1,0|2,0,0]=3 1759 B9R1.12 O=C\C=C\c1cscn1 Amb25299918 [0,0,0,0,1,0|2,0,0]=3 1760 B9R1.12 O=C\C=C\c1csnn1 Amb33079502 [0,0,0,0,1,0|3,0,0]=4 1761 B9R1.12 O=C\C=C\c1nccs1 Amb33359384 [0,0,0,0,1,0|2,0,0]=3 1762 B9R1.12 O=C\C=C\n1cccn1 Amb18642043 [0,0,0,0,1,0|2,0,0]=3 1763 B9R1.12 OC\C=C\c1ccco1 Amb837544 [0,0,0,0,1,0|1,0,2]=4 1764 B9R1.12 OC\C=C\c1cccs1 Amb23555588 [0,0,0,0,1,0|1,0,2]=4 1765 B9R1.12 OC\C=C\c1ccoc1 Amb33136449 [0,0,0,0,1,0|1,0,2]=4 1766 B9R1.12 OC\C=C\c1ccsc1 Amb33136405 [0,0,0,0,1,0|1,0,2]=4 1767 B9R1.12 OC\C=C\n1cccc1 Amb28049227 [0,0,0,0,1,0|1,0,2]=4 1768 B9R1.12 [N-]=[N+]=NC=C1C=CC=C1 Amb27424730 [0,0,0,0,1,0|3,0,0]=4 1769 B11R1.203 O=CCCC1C=CC=CC=C1 Amb27401095 [0,0,0,0,0,1|0,0,3]=4 1770 B8R0.1 C=C\C=C\C(=C)CC=O Amb26851275 [1,0,1,0,0,0|0,0,1]=3 1771 B8R0.1 CC(=C\C=O)\C=C\C=O Amb27227121 [1,0,1,0,0,0|1,0,1]=4 1772 B8R0.4 C\C=C\C=C\C=C\C=O Amb17593248 [1,0,1,0,0,0|0,0,1]=3 1773 B8R0.4 O=C\C=C\C=C/CC=O Amb28285297 [1,0,1,0,0,0|1,0,1]=4 1774 B8R0.4 O=C\C=C\C=C\C=C/Cl Amb27754044 [1,0,1,0,0,0|1,0,0]=3 1775 B8R0.4 O=C\C=C\C=C\CC=O Amb27841285 [1,0,1,0,0,0|1,0,1]=4 1776 B8R1.2 BrCc1ccccc1 Amb3939707 [2,0,0,0,0,0|1,0,1]=4 1777 B8R1.2 Br[Se]c1ccccc1 Amb8514629 [2,0,0,0,0,0|2,0,0]=4 1778 B8R1.2 C#Cc1ccccc1 Amb2793084 [2,0,0,0,0,0|0,0,2]=4 1779 B8R1.2 C=Cc1ccccc1 Amb6608811 [2,0,0,0,0,0|0,0,0]=2 1780 B8R1.2 C=Cc1ccccn1 Amb6600549 [2,0,0,0,0,0|1,0,0]=3 1781 B8R1.2 C=Cc1cccnc1 Amb33544464 [2,0,0,0,0,0|1,0,0]=3 1782 B8R1.2 C=Cc1cccnn1 Amb25026421 [2,0,0,0,0,0|2,0,0]=4 1783 B8R1.2 C=Cc1ccncc1 Amb3940417 [2,0,0,0,0,0|1,0,0]=3 1784 B8R1.2 C=Cc1ccncn1 Amb24056360 [2,0,0,0,0,0|2,0,0]=4 1785 B8R1.2 C=Cc1cnccn1 Amb2695475 [2,0,0,0,0,0|2,0,0]=4 1786 B8R1.2 C=Cc1cncnc1 Amb24056355 [2,0,0,0,0,0|2,0,0]=4 1787 B8R1.2 C=Cc1ncccn1 Amb23411991 [2,0,0,0,0,0|2,0,0]=4 1788 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,0]=3 1789 B8R1.2 C=Nc1ccccn1 Amb26956421 [2,0,0,0,0,0|2,0,0]=4 1790 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,2]=4 1791 B8R1.2 CNc1ccccc1 Amb2721038 [2,0,0,0,0,0|1,0,1]=4 1792 B8R1.2 CNc1ccccc1 Amb4037054 [2,0,0,0,0,0|1,0,1]=4 1793 B8R1.2 COc1ccccc1 Amb2842269 [2,0,0,0,0,0|1,0,1]=4 1794 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,1]=4 1795 B8R1.2 CSc1ccccc1 Amb2690593 [2,0,0,0,0,0|1,0,1]=4 1796 B8R1.2 ClCc1ccccc1 Amb2792911 [2,0,0,0,0,0|1,0,1]=4 1797 B8R1.2 Cl[Se]c1ccccc1 Amb8513798 [2,0,0,0,0,0|2,0,0]=4 1798 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 1799 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,1]=4 1800 B8R1.2 ICc1ccccc1 Amb4006861 [2,0,0,0,0,0|1,0,1]=4 1801 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 1802 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 1803 B8R1.2 N#Cc1ccccc1 Amb2793082 [2,0,0,0,0,0|1,0,1]=4 1804 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 1805 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,1]=4 1806 B8R1.2 NCc1ccccc1 Amb2725314 [2,0,0,0,0,0|1,0,1]=4 1807 B8R1.2 NCc1ccccc1 Amb2792834 [2,0,0,0,0,0|1,0,1]=4 1808 B8R1.2 NCc1ccccc1 Amb6383294 [2,0,0,0,0,0|1,0,1]=4 1809 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 1810 B8R1.2 NNc1ccccc1 Amb2793062 [2,0,0,0,0,0|2,0,0]=4 1811 B8R1.2 NNc1ccccc1 Amb8513467 [2,0,0,0,0,0|2,0,0]=4 1812 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 1813 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 1814 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,0]=3 1815 B8R1.2 O=CC1=CC=CSC1 Amb28194907 [2,0,0,0,0,0|1,0,1]=4 1816 B8R1.2 O=CC1=CCC=CO1 Amb27437201 [2,0,0,0,0,0|1,0,1]=4 1817 B8R1.2 O=CC1=CNC=CC1 Amb27216667 [2,0,0,0,0,0|1,0,1]=4 1818 B8R1.2 O=Cc1ccccc1 Amb2792754 [2,0,0,0,0,0|0,0,0]=2 1819 B8R1.2 O=Cc1ccccn1 Amb2720349 [2,0,0,0,0,0|1,0,0]=3 1820 B8R1.2 O=Cc1cccnc1 Amb2720350 [2,0,0,0,0,0|1,0,0]=3 1821 B8R1.2 O=Cc1cccnn1 Amb8010287 [2,0,0,0,0,0|2,0,0]=4 1822 B8R1.2 O=Cc1ccncc1 Amb932832 [2,0,0,0,0,0|1,0,0]=3 1823 B8R1.2 O=Cc1ccncn1 Amb8009550 [2,0,0,0,0,0|2,0,0]=4 1824 B8R1.2 O=Cc1ccnnc1 Amb8010397 [2,0,0,0,0,0|2,0,0]=4 1825 B8R1.2 O=Cc1cnccn1 Amb8009498 [2,0,0,0,0,0|2,0,0]=4 1826 B8R1.2 O=Cc1cncnc1 Amb2235993 [2,0,0,0,0,0|2,0,0]=4 1827 B8R1.2 O=Cc1ncccn1 Amb8010587 [2,0,0,0,0,0|2,0,0]=4 1828 B8R1.2 O=Nc1ccccc1 Amb9785158 [2,0,0,0,0,0|1,0,0]=3 1829 B8R1.2 O=Nc1ccccn1 Amb31031129 [2,0,0,0,0,0|2,0,0]=4 1830 B8R1.2 O=[IH2]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,0]=3 1831 B8R1.2 OCc1ccccc1 Amb3939216 [2,0,0,0,0,0|0,0,2]=4 1832 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,1]=4 1833 B8R1.2 SCc1ccccc1 Amb6608752 [2,0,0,0,0,0|0,1,1]=4 1834 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 1835 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,1]=4 1836 B8R1.2 [NH3+]Cc1ccccc1 Amb8488224 [2,0,0,0,0,0|1,0,1]=4 1837 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,1]=4 1838 B10R0.4 CN(C)\C=C\C=C\C=C\C=O Amb1770072 [0,1,1,0,0,0|1,0,1]=4 1839 B10R0.71 C\C=C\C=C\C=C\C=C\C=O Amb25384138 [0,1,1,0,0,0|0,0,0]=2 1840 B10R0.71 O=C\C=C\C=C\N\C=C\C=O Amb27986127 [0,1,1,0,0,0|1,0,0]=3 1841 B10R0.71 O=C\C=C\N=C\C=C\C=C\[O-] Amb27672465 [0,1,1,0,0,0|1,0,0]=3 1842 B10R0.74 C#C\C(C)=C/C=C/C=C/C=O Amb27481676 [0,1,1,0,0,0|0,0,2]=4 1843 B10R1.1 Br\C=C/c1ccc(Br)cc1 Amb25976770 [1,1,0,0,0,0|1,0,0]=3 1844 B10R1.1 Br\C=C\c1ccc(Br)cc1 Amb17609929 [1,1,0,0,0,0|1,0,0]=3 1845 B10R1.1 Br\C=C\c1ccc(I)cc1 Amb8392460 [1,1,0,0,0,0|1,0,0]=3 1846 B10R1.1 C=CC[n+]1ccc(C)cc1 Amb27764615 [1,1,0,0,0,0|1,0,1]=4 1847 B10R1.1 C=CCc1ccc(Br)cc1 Amb6298955 [1,1,0,0,0,0|0,0,1]=3 1848 B10R1.1 C=CCc1ccc(Br)nc1 Amb27974565 [1,1,0,0,0,0|1,0,1]=4 1849 B10R1.1 C=CCc1ccc(C)cc1 Amb6298999 [1,1,0,0,0,0|0,0,1]=3 1850 B10R1.1 C=CCc1ccc(C)nc1 Amb27450290 [1,1,0,0,0,0|1,0,1]=4 1851 B10R1.1 C=CCc1ccc(Cl)cc1 Amb6298977 [1,1,0,0,0,0|0,0,1]=3 1852 B10R1.1 C=CCc1ccc(F)cc1 Amb6299104 [1,1,0,0,0,0|0,0,1]=3 1853 B10R1.1 C=CCc1ccc(N)cc1 Amb27168671 [1,1,0,0,0,0|0,0,1]=3 1854 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|0,0,1]=3 1855 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|1,0,0]=3 1856 B10R1.1 C=COc1ccc(C)cc1 Amb17674188 [1,1,0,0,0,0|1,0,0]=3 1857 B10R1.1 C=COc1ccc(Cl)cc1 Amb28422277 [1,1,0,0,0,0|1,0,0]=3 1858 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|1,0,0]=3 1859 B10R1.1 C=COc1ccc(N)cc1 Amb2721808 [1,1,0,0,0,0|1,0,0]=3 1860 B10R1.1 C=CSc1ccc(Br)cc1 Amb25890192 [1,1,0,0,0,0|1,0,0]=3 1861 B10R1.1 C=CSc1ccc(C)cc1 Amb24375563 [1,1,0,0,0,0|1,0,0]=3 1862 B10R1.1 C=CSc1ccc(Cl)cc1 Amb27838962 [1,1,0,0,0,0|1,0,0]=3 1863 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb34050082 [1,1,0,0,0,0|0,0,1]=3 1864 B10R1.1 C\C=C\c1ccc(N)cc1 Amb26370017 [1,1,0,0,0,0|0,0,1]=3 1865 B10R1.1 C\C=C\c1ccc(N)cc1 Amb32653072 [1,1,0,0,0,0|0,0,1]=3 1866 B10R1.1 C\C=C\c1ccc(O)cn1 Amb18124456 [1,1,0,0,0,0|1,0,1]=4 1867 B10R1.1 C\C=N\c1ccc(Cl)cc1 Amb27173616 [1,1,0,0,0,0|1,0,1]=4 1868 B10R1.1 C\N=C\c1ccc(Cl)cc1 Amb26890786 [1,1,0,0,0,0|1,0,1]=4 1869 B10R1.1 Cc1ccc(CC=O)cc1 Amb3941002 [1,1,0,0,0,0|0,0,1]=3 1870 B10R1.1 Cc1ccc(CC=O)cn1 Amb26327214 [1,1,0,0,0,0|1,0,1]=4 1871 B10R1.1 Cc1ccc(CC=O)nc1 Amb28315857 [1,1,0,0,0,0|1,0,1]=4 1872 B10R1.1 Cc1ccc(N=C=O)cc1 Amb3939057 [1,1,0,0,0,0|1,0,1]=4 1873 B10R1.1 Cc1ccc(N=S=O)cc1 Amb22411290 [1,1,0,0,0,0|2,0,0]=4 1874 B10R1.1 Cc1ccc(NC=O)cc1 Amb2613776 [1,1,0,0,0,0|1,0,0]=3 1875 B10R1.1 Cc1ccc(NC=O)cn1 Amb28049376 [1,1,0,0,0,0|2,0,0]=4 1876 B10R1.1 Cc1ccc(OC=O)cc1 Amb25248584 [1,1,0,0,0,0|1,0,0]=3 1877 B10R1.1 Cc1ccc(\C=C\Br)cc1 Amb25987077 [1,1,0,0,0,0|1,0,0]=3 1878 B10R1.1 Cc1ccc(\C=C\Br)cn1 Amb28051441 [1,1,0,0,0,0|2,0,0]=4 1879 B10R1.1 Cc1ccc(\C=C\Br)nc1 Amb33135337 [1,1,0,0,0,0|2,0,0]=4 1880 B10R1.1 Cc1ccc(\C=N\N)cc1 Amb9817723 [1,1,0,0,0,0|2,0,0]=4 1881 B10R1.1 Cc1ccc(\C=N\O)cc1 Amb1152459 [1,1,0,0,0,0|1,0,1]=4 1882 B10R1.1 Cl\C=C\c1ccc(Cl)cc1 Amb10573154 [1,1,0,0,0,0|1,0,0]=3 1883 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,0]=3 1884 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb33291355 [1,1,0,0,0,0|1,0,0]=3 1885 B10R1.1 Fc1ccc(\C=C\Br)cn1 Amb33135266 [1,1,0,0,0,0|2,0,0]=4 1886 B10R1.1 N\N=C/c1ccc(F)cc1 Amb27834282 [1,1,0,0,0,0|2,0,0]=4 1887 B10R1.1 N\N=C\c1ccc(Cl)cc1 Amb3096519 [1,1,0,0,0,0|2,0,0]=4 1888 B10R1.1 N\N=C\c1ccc(N)cc1 Amb28188656 [1,1,0,0,0,0|2,0,0]=4 1889 B10R1.1 N\N=C\c1ccc(O)cc1 Amb3096562 [1,1,0,0,0,0|2,0,0]=4 1890 B10R1.1 Nc1ccc(NC=O)cc1 Amb17334152 [1,1,0,0,0,0|1,0,0]=3 1891 B10R1.1 Nc1ccc(NC=O)nc1 Amb26358579 [1,1,0,0,0,0|2,0,0]=4 1892 B10R1.1 Nc1ccc(\C=N\O)cc1 Amb28348427 [1,1,0,0,0,0|1,0,1]=4 1893 B10R1.1 O=C=Nc1ccc(Br)cc1 Amb3939126 [1,1,0,0,0,0|1,0,1]=4 1894 B10R1.1 O=C=Nc1ccc(Cl)cc1 Amb3939061 [1,1,0,0,0,0|1,0,1]=4 1895 B10R1.1 O=C=Nc1ccc(F)cc1 Amb2092739 [1,1,0,0,0,0|1,0,1]=4 1896 B10R1.1 O=C=Nc1ccc(I)cc1 Amb3939282 [1,1,0,0,0,0|1,0,1]=4 1897 B10R1.1 O=CCc1ccc(Br)cc1 Amb16230450 [1,1,0,0,0,0|0,0,1]=3 1898 B10R1.1 O=CCc1ccc(Br)cn1 Amb26008746 [1,1,0,0,0,0|1,0,1]=4 1899 B10R1.1 O=CCc1ccc(Br)nc1 Amb24068700 [1,1,0,0,0,0|1,0,1]=4 1900 B10R1.1 O=CCc1ccc(Cl)cc1 Amb10603161 [1,1,0,0,0,0|0,0,1]=3 1901 B10R1.1 O=CCc1ccc(Cl)cn1 Amb33390547 [1,1,0,0,0,0|1,0,1]=4 1902 B10R1.1 O=CCc1ccc(Cl)nc1 Amb27473344 [1,1,0,0,0,0|1,0,1]=4 1903 B10R1.1 O=CCc1ccc(F)cc1 Amb16230451 [1,1,0,0,0,0|0,0,1]=3 1904 B10R1.1 O=CCc1ccc(F)cn1 Amb33449540 [1,1,0,0,0,0|1,0,1]=4 1905 B10R1.1 O=CCc1ccc(F)nc1 Amb33426162 [1,1,0,0,0,0|1,0,1]=4 1906 B10R1.1 O=CCc1ccc(O)cc1 Amb9782679 [1,1,0,0,0,0|0,0,1]=3 1907 B10R1.1 O=CNc1ccc(Br)cc1 Amb6365477 [1,1,0,0,0,0|1,0,0]=3 1908 B10R1.1 O=CNc1ccc(Cl)cc1 Amb2720270 [1,1,0,0,0,0|1,0,0]=3 1909 B10R1.1 O=CNc1ccc(Cl)cn1 Amb3319172 [1,1,0,0,0,0|2,0,0]=4 1910 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,0]=3 1911 B10R1.1 O=CNc1ccc(F)cn1 Amb27192712 [1,1,0,0,0,0|2,0,0]=4 1912 B10R1.1 O=CNc1ccc(O)cc1 Amb2370690 [1,1,0,0,0,0|1,0,0]=3 1913 B10R1.1 O=COc1ccc(Cl)nc1 Amb27405361 [1,1,0,0,0,0|2,0,0]=4 1914 B10R1.1 O=S=Nc1ccc(Br)cc1 Amb22411348 [1,1,0,0,0,0|2,0,0]=4 1915 B10R1.1 O=S=Nc1ccc(Cl)cc1 Amb22411317 [1,1,0,0,0,0|2,0,0]=4 1916 B10R1.1 O\N=C\c1ccc(Br)cc1 Amb1152409 [1,1,0,0,0,0|1,0,1]=4 1917 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb1152205 [1,1,0,0,0,0|1,0,1]=4 1918 B10R1.1 O\N=C\c1ccc(Cl)cc1 Amb33714742 [1,1,0,0,0,0|1,0,1]=4 1919 B10R1.1 O\N=C\c1ccc(F)cc1 Amb33623403 [1,1,0,0,0,0|1,0,1]=4 1920 B10R1.1 O\N=C\c1ccc(I)cc1 Amb4035593 [1,1,0,0,0,0|1,0,1]=4 1921 B10R1.1 O\N=C\c1ccc(O)cc1 Amb5722541 [1,1,0,0,0,0|1,0,1]=4 1922 B10R1.1 Oc1ccc(\C=C\Br)cc1 Amb25945264 [1,1,0,0,0,0|1,0,0]=3 1923 B10R1.1 Oc1ccc(\C=C\Br)cn1 Amb33135244 [1,1,0,0,0,0|2,0,0]=4 1924 B10R1.1 Oc1ccc(\C=C\I)cc1 Amb27985402 [1,1,0,0,0,0|1,0,0]=3 1925 B10R1.1 [N-]=[N+]=Cc1ccc(Cl)cc1 Amb28076331 [1,1,0,0,0,0|2,0,0]=4 1926 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,0]=3 1927 B10R1.4 Brc1ccccc1\C=C\I Amb27843450 [1,1,0,0,0,0|1,0,0]=3 1928 B10R1.4 C=C=CC1=CC=CNC1=O Amb24563240 [1,1,0,0,0,0|1,0,1]=4 1929 B10R1.4 C=C=Cc1ccccc1O Amb26562140 [1,1,0,0,0,0|0,0,1]=3 1930 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|1,0,1]=4 1931 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|1,0,1]=4 1932 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|1,0,1]=4 1933 B10R1.4 C=CC[n+]1ccccc1C Amb27804600 [1,1,0,0,0,0|1,0,1]=4 1934 B10R1.4 C=CC[n+]1ccccc1F Amb28249373 [1,1,0,0,0,0|1,0,1]=4 1935 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|1,0,1]=4 1936 B10R1.4 C=CCc1ccccc1Br Amb26451399 [1,1,0,0,0,0|0,0,1]=3 1937 B10R1.4 C=CCc1ccccc1C Amb6298985 [1,1,0,0,0,0|0,0,1]=3 1938 B10R1.4 C=CCc1ccccc1Cl Amb6298963 [1,1,0,0,0,0|0,0,1]=3 1939 B10R1.4 C=CCc1ccccc1F Amb6299090 [1,1,0,0,0,0|0,0,1]=3 1940 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|0,0,1]=3 1941 B10R1.4 C=CCc1ccncc1Br Amb27483136 [1,1,0,0,0,0|1,0,1]=4 1942 B10R1.4 C=CCc1cnccc1C Amb28346870 [1,1,0,0,0,0|1,0,1]=4 1943 B10R1.4 C=CCc1ncccc1O Amb20248276 [1,1,0,0,0,0|1,0,1]=4 1944 B10R1.4 C=CNc1ccccc1C Amb27596514 [1,1,0,0,0,0|1,0,0]=3 1945 B10R1.4 C=COc1ccccc1Cl Amb28126760 [1,1,0,0,0,0|1,0,0]=3 1946 B10R1.4 C=COc1ccccc1F Amb26369650 [1,1,0,0,0,0|1,0,0]=3 1947 B10R1.4 C=COc1ccccc1I Amb27234455 [1,1,0,0,0,0|1,0,0]=3 1948 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|1,0,0]=3 1949 B10R1.4 C=COc1cccnc1C Amb28049671 [1,1,0,0,0,0|2,0,0]=4 1950 B10R1.4 C=CSc1ncccc1O Amb18644573 [1,1,0,0,0,0|2,0,0]=4 1951 B10R1.4 C=NNc1ccccc1N Amb27459715 [1,1,0,0,0,0|2,0,0]=4 1952 B10R1.4 C\C=C/N1C=CC=CC1=S Amb27453655 [1,1,0,0,0,0|1,0,1]=4 1953 B10R1.4 C\C=C/c1cccc[n+]1[O-] Amb28321004 [1,1,0,0,0,0|1,0,1]=4 1954 B10R1.4 C\C=C\N1C=CC=CC1=S Amb28075148 [1,1,0,0,0,0|1,0,1]=4 1955 B10R1.4 C\C=C\c1cccc[n+]1[O-] Amb27236131 [1,1,0,0,0,0|1,0,1]=4 1956 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|0,0,1]=3 1957 B10R1.4 C\C=C\c1ccccc1O Amb3372048 [1,1,0,0,0,0|0,0,1]=3 1958 B10R1.4 C\C=C\c1ccncc1Br Amb26051337 [1,1,0,0,0,0|1,0,1]=4 1959 B10R1.4 C\C=C\c1ncccc1C Amb28251646 [1,1,0,0,0,0|1,0,1]=4 1960 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|1,0,1]=4 1961 B10R1.4 C\N=C\c1ccccc1N Amb27619729 [1,1,0,0,0,0|1,0,1]=4 1962 B10R1.4 Cc1ccccc1CC=O Amb10844840 [1,1,0,0,0,0|0,0,1]=3 1963 B10R1.4 Cc1ccccc1N=C=O Amb2725632 [1,1,0,0,0,0|1,0,1]=4 1964 B10R1.4 Cc1ccccc1N=S=O Amb22411326 [1,1,0,0,0,0|2,0,0]=4 1965 B10R1.4 Cc1ccccc1NC=O Amb6366246 [1,1,0,0,0,0|1,0,0]=3 1966 B10R1.4 Cc1ccccc1NC=S Amb27407682 [1,1,0,0,0,0|1,1,0]=4 1967 B10R1.4 Cc1ccccc1\C=C\Br Amb8392461 [1,1,0,0,0,0|1,0,0]=3 1968 B10R1.4 Cc1ccccc1\C=C\Cl Amb8392459 [1,1,0,0,0,0|1,0,0]=3 1969 B10R1.4 Cc1ccccc1\C=N\O Amb1647706 [1,1,0,0,0,0|1,0,1]=4 1970 B10R1.4 Cc1cccnc1CC=O Amb33428807 [1,1,0,0,0,0|1,0,1]=4 1971 B10R1.4 Cc1cccnc1NC=O Amb3319169 [1,1,0,0,0,0|2,0,0]=4 1972 B10R1.4 Cc1cccnc1\C=C\Br Amb33135223 [1,1,0,0,0,0|2,0,0]=4 1973 B10R1.4 Cc1ccncc1CC=O Amb26369782 [1,1,0,0,0,0|1,0,1]=4 1974 B10R1.4 Cc1ccncc1\C=C\Br Amb33135340 [1,1,0,0,0,0|2,0,0]=4 1975 B10R1.4 Cc1cnccc1CC=O Amb25368595 [1,1,0,0,0,0|1,0,1]=4 1976 B10R1.4 Cc1ncccc1CC=O Amb32879665 [1,1,0,0,0,0|1,0,1]=4 1977 B10R1.4 Cc1ncccc1\C=C\Br Amb33135200 [1,1,0,0,0,0|2,0,0]=4 1978 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,0]=3 1979 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,0]=3 1980 B10R1.4 Cn1cccc\c1=N/C=O Amb24072921 [1,1,0,0,0,0|2,0,0]=4 1981 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,0]=3 1982 B10R1.4 Fc1cnccc1\C=C\Br Amb33135262 [1,1,0,0,0,0|2,0,0]=4 1983 B10R1.4 N=CCc1ccccc1N Amb27175164 [1,1,0,0,0,0|1,0,1]=4 1984 B10R1.4 N\C=N\c1ccccc1Cl Amb27803970 [1,1,0,0,0,0|2,0,0]=4 1985 B10R1.4 N\N=C\c1ccccc1O Amb594479 [1,1,0,0,0,0|2,0,0]=4 1986 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,0]=3 1987 B10R1.4 Nc1ccccc1\C=C\Cl Amb27223253 [1,1,0,0,0,0|1,0,0]=3 1988 B10R1.4 Nc1ccccc1\C=N\O Amb2608949 [1,1,0,0,0,0|1,0,1]=4 1989 B10R1.4 Nc1ccncc1\C=C\Br Amb33135084 [1,1,0,0,0,0|2,0,0]=4 1990 B10R1.4 Nc1cnccc1NC=O Amb27195027 [1,1,0,0,0,0|2,0,0]=4 1991 B10R1.4 Nc1ncccc1\C=C\Br Amb33135082 [1,1,0,0,0,0|2,0,0]=4 1992 B10R1.4 O=C=Nc1ccccc1Br Amb2726242 [1,1,0,0,0,0|1,0,1]=4 1993 B10R1.4 O=C=Nc1ccccc1Cl Amb2725609 [1,1,0,0,0,0|1,0,1]=4 1994 B10R1.4 O=C=Nc1ccccc1F Amb2725618 [1,1,0,0,0,0|1,0,1]=4 1995 B10R1.4 O=C=Nc1ccccc1I Amb2722514 [1,1,0,0,0,0|1,0,1]=4 1996 B10R1.4 O=CCc1cccc[n+]1[O-] Amb28383494 [1,1,0,0,0,0|1,0,1]=4 1997 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,1]=3 1998 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,1]=3 1999 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,1]=3 2000 B10R1.4 O=CCc1ccccc1O Amb6739922 [1,1,0,0,0,0|0,0,1]=3 2001 B10R1.4 O=CCc1cccnc1Br Amb24746150 [1,1,0,0,0,0|1,0,1]=4 2002 B10R1.4 O=CCc1cccnc1Cl Amb25768390 [1,1,0,0,0,0|1,0,1]=4 2003 B10R1.4 O=CCc1cccnc1F Amb33377654 [1,1,0,0,0,0|1,0,1]=4 2004 B10R1.4 O=CCc1ccncc1Br Amb26618713 [1,1,0,0,0,0|1,0,1]=4 2005 B10R1.4 O=CCc1ccncc1Cl Amb25250526 [1,1,0,0,0,0|1,0,1]=4 2006 B10R1.4 O=CCc1ccncc1F Amb24553979 [1,1,0,0,0,0|1,0,1]=4 2007 B10R1.4 O=CCc1ncccc1Br Amb28187085 [1,1,0,0,0,0|1,0,1]=4 2008 B10R1.4 O=CCc1ncccc1F Amb27837919 [1,1,0,0,0,0|1,0,1]=4 2009 B10R1.4 O=CNc1ccccc1Br Amb33718582 [1,1,0,0,0,0|1,0,0]=3 2010 B10R1.4 O=CNc1ccccc1Br Amb3988017 [1,1,0,0,0,0|1,0,0]=3 2011 B10R1.4 O=CNc1ccccc1Cl Amb2720271 [1,1,0,0,0,0|1,0,0]=3 2012 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,0]=3 2013 B10R1.4 O=CNc1ccccc1I Amb27770393 [1,1,0,0,0,0|1,0,0]=3 2014 B10R1.4 O=CNc1ccccc1O Amb3939439 [1,1,0,0,0,0|1,0,0]=3 2015 B10R1.4 O=CNc1cccnc1Cl Amb4035002 [1,1,0,0,0,0|2,0,0]=4 2016 B10R1.4 O=CNc1cccnc1F Amb30018365 [1,1,0,0,0,0|2,0,0]=4 2017 B10R1.4 O=CNc1ccncc1Br Amb28126797 [1,1,0,0,0,0|2,0,0]=4 2018 B10R1.4 O=CNc1ncccc1Cl Amb27809589 [1,1,0,0,0,0|2,0,0]=4 2019 B10R1.4 O=COc1ccccc1Cl Amb27878912 [1,1,0,0,0,0|1,0,0]=3 2020 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|1,0,0]=3 2021 B10R1.4 O=S=Nc1ccccc1Cl Amb22411311 [1,1,0,0,0,0|2,0,0]=4 2022 B10R1.4 O=S=Nc1ccccc1F Amb22411336 [1,1,0,0,0,0|2,0,0]=4 2023 B10R1.4 O=S=Nc1ccccc1O Amb28350841 [1,1,0,0,0,0|2,0,0]=4 2024 B10R1.4 O\N=C/c1ccccc1Br Amb25247795 [1,1,0,0,0,0|1,0,1]=4 2025 B10R1.4 O\N=C/c1ccccc1Cl Amb28239726 [1,1,0,0,0,0|1,0,1]=4 2026 B10R1.4 O\N=C\c1ccccc1Br Amb33788652 [1,1,0,0,0,0|1,0,1]=4 2027 B10R1.4 O\N=C\c1ccccc1Cl Amb1152026 [1,1,0,0,0,0|1,0,1]=4 2028 B10R1.4 O\N=C\c1ccccc1F Amb30585239 [1,1,0,0,0,0|1,0,1]=4 2029 B10R1.4 O\N=C\c1ccccc1I Amb1782090 [1,1,0,0,0,0|1,0,1]=4 2030 B10R1.4 O\N=C\c1ccccc1O Amb6608695 [1,1,0,0,0,0|1,0,1]=4 2031 B10R1.4 Oc1ccccc1\C=C\Br Amb33134797 [1,1,0,0,0,0|1,0,0]=3 2032 B10R1.4 Oc1ccccc1\C=C\Cl Amb28244760 [1,1,0,0,0,0|1,0,0]=3 2033 B10R1.4 Oc1ccccc1\C=N\F Amb27232421 [1,1,0,0,0,0|2,0,0]=4 2034 B10R1.4 S=CNc1ccccc1Cl Amb27478105 [1,1,0,0,0,0|1,1,0]=4 2035 B10R1.4 [N-]=[N+]=Cc1ccccc1Cl Amb27755498 [1,1,0,0,0,0|2,0,0]=4 2036 B10R1.10 Brc1cccc(\C=C/I)c1 Amb22231752 [1,1,0,0,0,0|1,0,0]=3 2037 B10R1.10 Brc1cccc(\C=C\I)c1 Amb27865347 [1,1,0,0,0,0|1,0,0]=3 2038 B10R1.10 C=CCc1cccc(Br)c1 Amb6298947 [1,1,0,0,0,0|0,0,1]=3 2039 B10R1.10 C=CCc1cccc(C)c1 Amb2689628 [1,1,0,0,0,0|0,0,1]=3 2040 B10R1.10 C=CCc1cccc(C)n1 Amb6299552 [1,1,0,0,0,0|1,0,1]=4 2041 B10R1.10 C=CCc1cccc(Cl)c1 Amb2686405 [1,1,0,0,0,0|0,0,1]=3 2042 B10R1.10 C=CCc1cccc(F)c1 Amb2688385 [1,1,0,0,0,0|0,0,1]=3 2043 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|0,0,1]=3 2044 B10R1.10 C=CCc1cccc(N)c1 Amb32698606 [1,1,0,0,0,0|0,0,1]=3 2045 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|0,0,1]=3 2046 B10R1.10 C=CCc1cncc(Br)c1 Amb26510579 [1,1,0,0,0,0|1,0,1]=4 2047 B10R1.10 C=COc1cccc(C)c1 Amb17674187 [1,1,0,0,0,0|1,0,0]=3 2048 B10R1.10 C=COc1cccc(F)c1 Amb27869917 [1,1,0,0,0,0|1,0,0]=3 2049 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|1,0,0]=3 2050 B10R1.10 C\C=C\c1cc(C)ccn1 Amb26917251 [1,1,0,0,0,0|1,0,1]=4 2051 B10R1.10 C\C=C\c1cccc(N)c1 Amb27162745 [1,1,0,0,0,0|0,0,1]=3 2052 B10R1.10 C\N=C\c1cccc(C)c1 Amb24524529 [1,1,0,0,0,0|1,0,1]=4 2053 B10R1.10 C\N=C\c1cccc(O)c1 Amb19115409 [1,1,0,0,0,0|1,0,1]=4 2054 B10R1.10 Cc1cc(CC=O)ccn1 Amb32732937 [1,1,0,0,0,0|1,0,1]=4 2055 B10R1.10 Cc1cc(NC=O)ccn1 Amb28199358 [1,1,0,0,0,0|2,0,0]=4 2056 B10R1.10 Cc1cc(\C=C\Br)ccn1 Amb33135327 [1,1,0,0,0,0|2,0,0]=4 2057 B10R1.10 Cc1cccc(CC=O)c1 Amb16230453 [1,1,0,0,0,0|0,0,1]=3 2058 B10R1.10 Cc1cccc(CC=O)n1 Amb27473724 [1,1,0,0,0,0|1,0,1]=4 2059 B10R1.10 Cc1cccc(N=C=O)c1 Amb2093133 [1,1,0,0,0,0|1,0,1]=4 2060 B10R1.10 Cc1cccc(N=S=O)c1 Amb22411325 [1,1,0,0,0,0|2,0,0]=4 2061 B10R1.10 Cc1cccc(NC=O)n1 Amb3319171 [1,1,0,0,0,0|2,0,0]=4 2062 B10R1.10 Cc1cccc(NC=S)c1 Amb27624548 [1,1,0,0,0,0|1,1,0]=4 2063 B10R1.10 Cc1cccc(\C=C/Cl)c1 Amb27823592 [1,1,0,0,0,0|1,0,0]=3 2064 B10R1.10 Cc1cccc(\C=C\Br)c1 Amb27260630 [1,1,0,0,0,0|1,0,0]=3 2065 B10R1.10 Cc1cccc(\C=C\Cl)c1 Amb27231853 [1,1,0,0,0,0|1,0,0]=3 2066 B10R1.10 Cc1cccc(\C=N\O)c1 Amb18041948 [1,1,0,0,0,0|1,0,1]=4 2067 B10R1.10 Cc1ccnc(CC=O)c1 Amb33318101 [1,1,0,0,0,0|1,0,1]=4 2068 B10R1.10 Cc1cncc(CC=O)c1 Amb26596943 [1,1,0,0,0,0|1,0,1]=4 2069 B10R1.10 Clc1cccc(\C=C\Br)c1 Amb25262044 [1,1,0,0,0,0|1,0,0]=3 2070 B10R1.10 Fc1cccc(\C=C\Br)c1 Amb26010127 [1,1,0,0,0,0|1,0,0]=3 2071 B10R1.10 Fc1cccc(\C=C\Br)n1 Amb33135235 [1,1,0,0,0,0|2,0,0]=4 2072 B10R1.10 N\N=C\c1cccc(Cl)c1 Amb3096261 [1,1,0,0,0,0|2,0,0]=4 2073 B10R1.10 N\N=C\c1cccc(F)c1 Amb3788106 [1,1,0,0,0,0|2,0,0]=4 2074 B10R1.10 N\N=C\c1cccc(I)c1 Amb27467050 [1,1,0,0,0,0|2,0,0]=4 2075 B10R1.10 N\N=C\c1cccc(O)c1 Amb28049819 [1,1,0,0,0,0|2,0,0]=4 2076 B10R1.10 Nc1cccc(NC=O)c1 Amb26052512 [1,1,0,0,0,0|1,0,0]=3 2077 B10R1.10 O=C=Nc1cccc(Br)c1 Amb33532814 [1,1,0,0,0,0|1,0,1]=4 2078 B10R1.10 O=C=Nc1cccc(Cl)c1 Amb3939128 [1,1,0,0,0,0|1,0,1]=4 2079 B10R1.10 O=C=Nc1cccc(F)c1 Amb2093115 [1,1,0,0,0,0|1,0,1]=4 2080 B10R1.10 O=C=Nc1cccc(I)c1 Amb3939281 [1,1,0,0,0,0|1,0,1]=4 2081 B10R1.10 O=CCc1cc(F)ccn1 Amb33320277 [1,1,0,0,0,0|1,0,1]=4 2082 B10R1.10 O=CCc1cccc(Br)c1 Amb16230449 [1,1,0,0,0,0|0,0,1]=3 2083 B10R1.10 O=CCc1cccc(Br)n1 Amb21858958 [1,1,0,0,0,0|1,0,1]=4 2084 B10R1.10 O=CCc1cccc(Cl)c1 Amb10844835 [1,1,0,0,0,0|0,0,1]=3 2085 B10R1.10 O=CCc1cccc(Cl)n1 Amb33222659 [1,1,0,0,0,0|1,0,1]=4 2086 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,1]=3 2087 B10R1.10 O=CCc1cccc(O)c1 Amb17089543 [1,1,0,0,0,0|0,0,1]=3 2088 B10R1.10 O=CCc1ccnc(Cl)c1 Amb33407331 [1,1,0,0,0,0|1,0,1]=4 2089 B10R1.10 O=CCc1cncc(Br)c1 Amb27967852 [1,1,0,0,0,0|1,0,1]=4 2090 B10R1.10 O=CCc1cncc(F)c1 Amb26079176 [1,1,0,0,0,0|1,0,1]=4 2091 B10R1.10 O=CNc1cc(Br)ccn1 Amb26369777 [1,1,0,0,0,0|2,0,0]=4 2092 B10R1.10 O=CNc1cc(Cl)ccn1 Amb27256931 [1,1,0,0,0,0|2,0,0]=4 2093 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,0]=3 2094 B10R1.10 O=CNc1cccc(Br)n1 Amb24371374 [1,1,0,0,0,0|2,0,0]=4 2095 B10R1.10 O=CNc1cccc(Cl)c1 Amb4007703 [1,1,0,0,0,0|1,0,0]=3 2096 B10R1.10 O=CNc1cccc(O)c1 Amb371592 [1,1,0,0,0,0|1,0,0]=3 2097 B10R1.10 O=CNc1cncc(Cl)c1 Amb3319174 [1,1,0,0,0,0|2,0,0]=4 2098 B10R1.10 O=C\C=C1/NC=CC(=O)N1 Amb24100369 [1,1,0,0,0,0|2,0,0]=4 2099 B10R1.10 O=S=Nc1cccc(Br)c1 Amb22411349 [1,1,0,0,0,0|2,0,0]=4 2100 B10R1.10 O=S=Nc1cccc(Cl)c1 Amb22411319 [1,1,0,0,0,0|2,0,0]=4 2101 B10R1.10 O=S=Nc1cccc(F)c1 Amb22411338 [1,1,0,0,0,0|2,0,0]=4 2102 B10R1.10 O\N=C/c1cccc(Cl)c1 Amb28135506 [1,1,0,0,0,0|1,0,1]=4 2103 B10R1.10 O\N=C\c1cccc(Br)c1 Amb6297363 [1,1,0,0,0,0|1,0,1]=4 2104 B10R1.10 O\N=C\c1cccc(Cl)c1 Amb1776533 [1,1,0,0,0,0|1,0,1]=4 2105 B10R1.10 O\N=C\c1cccc(F)c1 Amb1152958 [1,1,0,0,0,0|1,0,1]=4 2106 B10R1.10 O\N=C\c1cccc(I)c1 Amb1831123 [1,1,0,0,0,0|1,0,1]=4 2107 B10R1.10 O\N=C\c1cccc(O)c1 Amb5837376 [1,1,0,0,0,0|1,0,1]=4 2108 B10R1.10 Oc1cc(\C=C\Br)ccn1 Amb33135314 [1,1,0,0,0,0|2,0,0]=4 2109 B10R1.10 Oc1cccc(\C=C\Br)c1 Amb24518614 [1,1,0,0,0,0|1,0,0]=3 2110 B10R1.10 S=CNc1cccc(Br)c1 Amb27239434 [1,1,0,0,0,0|1,1,0]=4 2111 B10R1.10 Sc1cccc(\C=C\Br)c1 Amb33135147 [1,1,0,0,0,0|1,0,0]=3 2112 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [1,1,0,0,0,0|1,0,0]=3 2113 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [1,1,0,0,0,0|0,0,2]=4 2114 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [1,1,0,0,0,0|1,0,1]=4 2115 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [1,1,0,0,0,0|0,0,0]=2 2116 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [1,1,0,0,0,0|1,0,1]=4 2117 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [1,1,0,0,0,0|1,0,1]=4 2118 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [1,1,0,0,0,0|1,0,1]=4 2119 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [1,1,0,0,0,0|1,0,1]=4 2120 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [1,1,0,0,0,0|0,0,2]=4 2121 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [1,1,0,0,0,0|1,0,1]=4 2122 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [1,1,0,0,0,0|0,0,0]=2 2123 B10R1.15 C=CC(=C)c1cccnc1 Amb27591416 [1,1,0,0,0,0|1,0,0]=3 2124 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [1,1,0,0,0,0|0,0,0]=2 2125 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [1,1,0,0,0,0|1,0,0]=3 2126 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [1,1,0,0,0,0|1,0,0]=3 2127 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [1,1,0,0,0,0|1,0,0]=3 2128 B10R1.15 C=CC(=O)c1ccncn1 Amb27203886 [1,1,0,0,0,0|2,0,0]=4 2129 B10R1.15 C=CC(=O)c1ccnnc1 Amb28135491 [1,1,0,0,0,0|2,0,0]=4 2130 B10R1.15 C=CC(=O)c1cnccn1 Amb26594874 [1,1,0,0,0,0|2,0,0]=4 2131 B10R1.15 C=CC(=O)c1cncnc1 Amb26325709 [1,1,0,0,0,0|2,0,0]=4 2132 B10R1.15 C=CC(=O)c1ncccn1 Amb27794168 [1,1,0,0,0,0|2,0,0]=4 2133 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [1,1,0,0,0,0|0,0,1]=3 2134 B10R1.15 C=CC(C)c1ccccn1 Amb27838866 [1,1,0,0,0,0|1,0,1]=4 2135 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [1,1,0,0,0,0|0,0,1]=3 2136 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [1,1,0,0,0,0|0,0,1]=3 2137 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,1,0,0,0,0|0,0,1]=3 2138 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,1,0,0,0,0|0,0,1]=3 2139 B10R1.15 C=CC(N)c1ccccn1 Amb24561652 [1,1,0,0,0,0|1,0,1]=4 2140 B10R1.15 C=CC(N)c1cccnc1 Amb28193260 [1,1,0,0,0,0|1,0,1]=4 2141 B10R1.15 C=CC(N)c1ccncc1 Amb25789567 [1,1,0,0,0,0|1,0,1]=4 2142 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,1,0,0,0,0|0,0,1]=3 2143 B10R1.15 C=CC(O)c1ccccn1 Amb26021512 [1,1,0,0,0,0|1,0,1]=4 2144 B10R1.15 C=CC(O)c1cccnc1 Amb26845235 [1,1,0,0,0,0|1,0,1]=4 2145 B10R1.15 C=CC(O)c1ccncc1 Amb24546417 [1,1,0,0,0,0|1,0,1]=4 2146 B10R1.15 C=CN(C)c1ccccc1 Amb27878913 [1,1,0,0,0,0|1,0,0]=3 2147 B10R1.15 C=CN(C)c1ccncc1 Amb26031722 [1,1,0,0,0,0|2,0,0]=4 2148 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,1,0,0,0,0|1,0,0]=3 2149 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [1,1,0,0,0,0|0,0,1]=3 2150 B10R1.15 C=C[C@@H](N)c1cccnc1 Amb28289124 [1,1,0,0,0,0|1,0,1]=4 2151 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,1,0,0,0,0|0,0,1]=3 2152 B10R1.15 C=C[C@H](N)c1ccccn1 Amb25237215 [1,1,0,0,0,0|1,0,1]=4 2153 B10R1.15 C=C[C@H](N)c1cccnc1 Amb28280521 [1,1,0,0,0,0|1,0,1]=4 2154 B10R1.15 C=C[C@H](N)c1ccncc1 Amb27770577 [1,1,0,0,0,0|1,0,1]=4 2155 B10R1.15 C=C[SiH](C)c1ccccc1 Amb8515879 [1,1,0,0,0,0|0,1,0]=3 2156 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [1,1,0,0,0,0|0,0,1]=3 2157 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [1,1,0,0,0,0|1,0,1]=4 2158 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [1,1,0,0,0,0|1,0,1]=4 2159 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [1,1,0,0,0,0|1,0,1]=4 2160 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [1,1,0,0,0,0|0,0,2]=4 2161 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [1,1,0,0,0,0|1,0,0]=3 2162 B10R1.15 CN(C=O)c1ccccn1 Amb8396240 [1,1,0,0,0,0|2,0,0]=4 2163 B10R1.15 CN(C=O)c1cccnc1 Amb27262216 [1,1,0,0,0,0|2,0,0]=4 2164 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [1,1,0,0,0,0|2,0,0]=4 2165 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,1,0,0,0,0|1,0,1]=4 2166 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [1,1,0,0,0,0|1,0,1]=4 2167 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [1,1,0,0,0,0|1,0,1]=4 2168 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,1,0,0,0,0|1,0,1]=4 2169 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [1,1,0,0,0,0|1,0,1]=4 2170 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [1,1,0,0,0,0|1,0,1]=4 2171 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [1,1,0,0,0,0|1,0,1]=4 2172 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,1,0,0,0,0|1,0,1]=4 2173 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,1,0,0,0,0|1,0,1]=4 2174 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,1,0,0,0,0|1,0,1]=4 2175 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,1,0,0,0,0|0,0,1]=3 2176 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,1,0,0,0,0|0,0,1]=3 2177 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [1,1,0,0,0,0|1,0,0]=3 2178 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [1,1,0,0,0,0|1,0,0]=3 2179 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [1,1,0,0,0,0|1,0,0]=3 2180 B10R1.15 C\C(=C\Br)c1ccccn1 Amb25248819 [1,1,0,0,0,0|2,0,0]=4 2181 B10R1.15 C\C(=C\Br)c1cccnc1 Amb27471976 [1,1,0,0,0,0|2,0,0]=4 2182 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [1,1,0,0,0,0|1,0,0]=3 2183 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [1,1,0,0,0,0|2,0,0]=4 2184 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [1,1,0,0,0,0|1,0,1]=4 2185 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [1,1,0,0,0,0|1,0,1]=4 2186 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [1,1,0,0,0,0|0,0,1]=3 2187 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [1,1,0,0,0,0|1,0,1]=4 2188 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [1,1,0,0,0,0|0,0,1]=3 2189 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,1,0,0,0,0|0,0,1]=3 2190 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [1,1,0,0,0,0|0,0,1]=3 2191 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [1,1,0,0,0,0|1,0,1]=4 2192 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [1,1,0,0,0,0|1,0,0]=3 2193 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [1,1,0,0,0,0|1,0,1]=4 2194 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [1,1,0,0,0,0|2,0,0]=4 2195 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [1,1,0,0,0,0|1,0,0]=3 2196 B10R1.15 NC(=S=O)c1ccccn1 Amb28291302 [1,1,0,0,0,0|2,0,0]=4 2197 B10R1.15 NC(=S=O)c1cccnc1 Amb27791856 [1,1,0,0,0,0|2,0,0]=4 2198 B10R1.15 NC(=S=O)c1ccncc1 Amb28137969 [1,1,0,0,0,0|2,0,0]=4 2199 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [1,1,0,0,0,0|0,0,1]=3 2200 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,1,0,0,0,0|1,0,1]=4 2201 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [1,1,0,0,0,0|1,0,1]=4 2202 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,1,0,0,0,0|2,0,0]=4 2203 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,1,0,0,0,0|2,0,0]=4 2204 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [1,1,0,0,0,0|1,0,1]=4 2205 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [1,1,0,0,0,0|1,0,1]=4 2206 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [1,1,0,0,0,0|1,0,1]=4 2207 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [1,1,0,0,0,0|2,0,0]=4 2208 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [1,1,0,0,0,0|2,0,0]=4 2209 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [1,1,0,0,0,0|2,0,0]=4 2210 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [1,1,0,0,0,0|1,0,1]=4 2211 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [1,1,0,0,0,0|1,0,1]=4 2212 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [1,1,0,0,0,0|1,0,1]=4 2213 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,1,0,0,0,0|1,0,1]=4 2214 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [1,1,0,0,0,0|0,0,2]=4 2215 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [1,1,0,0,0,0|0,1,1]=4 2216 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [1,1,0,0,0,0|2,0,0]=4 2217 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [1,1,0,0,0,0|1,0,1]=4 2218 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [1,1,0,0,0,0|1,0,1]=4 2219 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [1,1,0,0,0,0|1,0,1]=4 2220 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [1,1,0,0,0,0|0,0,0]=2 2221 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [1,1,0,0,0,0|0,0,0]=2 2222 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [1,1,0,0,0,0|1,0,0]=3 2223 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,1,0,0,0,0|0,0,1]=3 2224 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,1,0,0,0,0|0,0,1]=3 2225 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [1,1,0,0,0,0|0,0,1]=3 2226 B10R1.15 O=CC(O)c1ccccn1 Amb28321322 [1,1,0,0,0,0|1,0,1]=4 2227 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [1,1,0,0,0,0|0,0,1]=3 2228 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [1,1,0,0,0,0|0,0,1]=3 2229 B10R1.15 O=NN(O)c1ccccc1 Amb17666641 [1,1,0,0,0,0|2,0,0]=4 2230 B10R1.15 O=NN([O-])c1ccccc1 Amb34915564 [1,1,0,0,0,0|2,0,0]=4 2231 B10R1.15 O=NN([O-])c1ccccc1 Amb8514053 [1,1,0,0,0,0|2,0,0]=4 2232 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [1,1,0,0,0,0|1,0,1]=4 2233 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [1,1,0,0,0,0|1,0,1]=4 2234 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [1,1,0,0,0,0|1,0,1]=4 2235 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [1,1,0,0,0,0|1,0,1]=4 2236 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [1,1,0,0,0,0|1,0,1]=4 2237 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,1,0,0,0,0|1,0,0]=3 2238 B10R1.18 BrC(Br)=Cc1cccnc1 Amb24349522 [1,1,0,0,0,0|2,0,0]=4 2239 B10R1.18 BrC(Br)=Cc1ccncc1 Amb26516830 [1,1,0,0,0,0|2,0,0]=4 2240 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [1,1,0,0,0,0|0,0,1]=3 2241 B10R1.18 C=C(C)Cc1cccnc1 Amb27624891 [1,1,0,0,0,0|1,0,1]=4 2242 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [1,1,0,0,0,0|0,0,1]=3 2243 B10R1.18 C=C(Cl)Cc1ccccn1 Amb6299557 [1,1,0,0,0,0|1,0,1]=4 2244 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [1,1,0,0,0,0|0,0,1]=3 2245 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|1,0,1]=4 2246 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,1]=4 2247 B10R1.18 CC(=O)C[n+]1ccccc1 Amb4018023 [1,1,0,0,0,0|1,0,1]=4 2248 B10R1.18 CC(=O)C[n+]1ccccc1 Amb6366487 [1,1,0,0,0,0|1,0,1]=4 2249 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [1,1,0,0,0,0|0,0,1]=3 2250 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [1,1,0,0,0,0|1,0,1]=4 2251 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,1]=4 2252 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [1,1,0,0,0,0|1,0,1]=4 2253 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,1]=4 2254 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [1,1,0,0,0,0|1,0,1]=4 2255 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [1,1,0,0,0,0|1,0,0]=3 2256 B10R1.18 CC(=O)Nc1ccccn1 Amb6374183 [1,1,0,0,0,0|2,0,0]=4 2257 B10R1.18 CC(=O)Nc1cccnc1 Amb6608635 [1,1,0,0,0,0|2,0,0]=4 2258 B10R1.18 CC(=O)Nc1ccncc1 Amb6395765 [1,1,0,0,0,0|2,0,0]=4 2259 B10R1.18 CC(=O)Oc1cccnc1 Amb6297781 [1,1,0,0,0,0|2,0,0]=4 2260 B10R1.18 CC(=O)Oc1ccncc1 Amb22522585 [1,1,0,0,0,0|2,0,0]=4 2261 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,0]=3 2262 B10R1.18 CC(=O)Sc1cccnc1 Amb27429372 [1,1,0,0,0,0|2,0,0]=4 2263 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [1,1,0,0,0,0|1,0,1]=4 2264 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [1,1,0,0,0,0|0,0,1]=3 2265 B10R1.18 CC(C)=Cc1ccncc1 Amb27658833 [1,1,0,0,0,0|1,0,1]=4 2266 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,1]=4 2267 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [1,1,0,0,0,0|2,0,0]=4 2268 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,1]=3 2269 B10R1.18 C\[N+]([O-])=C/c1ccccc1 Amb3988092 [1,1,0,0,0,0|1,0,1]=4 2270 B10R1.18 C\[N+]([O-])=C\c1ccccc1 Amb2420785 [1,1,0,0,0,0|1,0,1]=4 2271 B10R1.18 ClC(Cl)=Cc1ccccc1 Amb26554175 [1,1,0,0,0,0|1,0,0]=3 2272 B10R1.18 ClC(Cl)=Cc1ccccn1 Amb27603877 [1,1,0,0,0,0|2,0,0]=4 2273 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,1,0,0,0,0|2,0,0]=4 2274 B10R1.18 F\C(Br)=C\c1ccccc1 Amb24053589 [1,1,0,0,0,0|1,0,0]=3 2275 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [1,1,0,0,0,0|1,0,1]=4 2276 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [1,1,0,0,0,0|1,0,1]=4 2277 B10R1.18 N=C(N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|2,0,0]=4 2278 B10R1.18 N=C(N)Nc1ccccc1 Amb30982925 [1,1,0,0,0,0|2,0,0]=4 2279 B10R1.18 N=C(N)Nc1ccccc1 Amb8384582 [1,1,0,0,0,0|2,0,0]=4 2280 B10R1.18 N=C(N)Nc1ccccc1 Amb8629200 [1,1,0,0,0,0|2,0,0]=4 2281 B10R1.18 N=C(N)Sc1ccccc1 Amb27837617 [1,1,0,0,0,0|2,0,0]=4 2282 B10R1.18 N=C(N)[NH2+]c1ccccc1 Amb27773651 [1,1,0,0,0,0|2,0,0]=4 2283 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,1]=4 2284 B10R1.18 NC(=O)C[n+]1ccccc1 Amb2684428 [1,1,0,0,0,0|1,0,1]=4 2285 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,1]=3 2286 B10R1.18 NC(=O)Cc1cccnc1 Amb21856113 [1,1,0,0,0,0|1,0,1]=4 2287 B10R1.18 NC(=O)Cc1ccncc1 Amb4010849 [1,1,0,0,0,0|1,0,1]=4 2288 B10R1.18 NC(=O)Nc1ccccc1 Amb3106756 [1,1,0,0,0,0|1,0,0]=3 2289 B10R1.18 NC(=O)Nc1ccccn1 Amb2691587 [1,1,0,0,0,0|2,0,0]=4 2290 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,1,0,0,0,0|2,0,0]=4 2291 B10R1.18 NC(=O)Nc1ccncc1 Amb23581130 [1,1,0,0,0,0|2,0,0]=4 2292 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [1,1,0,0,0,0|1,0,0]=3 2293 B10R1.18 NC(=O)Sc1ccccc1 Amb28182472 [1,1,0,0,0,0|1,0,0]=3 2294 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,1,1]=4 2295 B10R1.18 NC(=S)Nc1ccccc1 Amb6356934 [1,1,0,0,0,0|1,1,0]=4 2296 B10R1.18 NC(=S)Oc1ccccc1 Amb27453485 [1,1,0,0,0,0|1,1,0]=4 2297 B10R1.18 NC(=S)Sc1ccccc1 Amb27407677 [1,1,0,0,0,0|1,1,0]=4 2298 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|2,0,0]=4 2299 B10R1.18 NC(N)=Nc1ccccc1 Amb2722869 [1,1,0,0,0,0|2,0,0]=4 2300 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [1,1,0,0,0,0|1,0,1]=4 2301 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [1,1,0,0,0,0|0,0,1]=3 2302 B10R1.18 O=C(Br)Nc1ccccc1 Amb27229968 [1,1,0,0,0,0|1,0,0]=3 2303 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [1,1,0,0,0,0|0,0,1]=3 2304 B10R1.18 O=C(Cl)Cc1ccccn1 Amb26458529 [1,1,0,0,0,0|1,0,1]=4 2305 B10R1.18 O=C(Cl)Cc1cccnc1 Amb24605722 [1,1,0,0,0,0|1,0,1]=4 2306 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,1,0,0,0,0|1,0,0]=3 2307 B10R1.18 O=C(Cl)Nc1cccnc1 Amb35637042 [1,1,0,0,0,0|2,0,0]=4 2308 B10R1.18 O=C(Cl)Nc1ccncc1 Amb32789666 [1,1,0,0,0,0|2,0,0]=4 2309 B10R1.18 O=C(Cl)Oc1ccccc1 Amb6296594 [1,1,0,0,0,0|1,0,0]=3 2310 B10R1.18 O=C(Cl)Oc1ccccn1 Amb33296824 [1,1,0,0,0,0|2,0,0]=4 2311 B10R1.18 O=C(Cl)Oc1cccnc1 Amb26956091 [1,1,0,0,0,0|2,0,0]=4 2312 B10R1.18 O=C(Cl)Oc1ccncc1 Amb33297023 [1,1,0,0,0,0|2,0,0]=4 2313 B10R1.18 O=C(Cl)Sc1ccccc1 Amb4006578 [1,1,0,0,0,0|1,0,0]=3 2314 B10R1.18 O=C(Cl)[NH2+]c1ccccc1 Amb9787354 [1,1,0,0,0,0|1,0,0]=3 2315 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,1,0,0,0,0|1,0,0]=3 2316 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,1]=4 2317 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,1]=4 2318 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,1]=4 2319 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [1,1,0,0,0,0|0,0,1]=3 2320 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [1,1,0,0,0,0|1,0,1]=4 2321 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [1,1,0,0,0,0|1,0,1]=4 2322 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [1,1,0,0,0,0|1,0,1]=4 2323 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [1,1,0,0,0,0|1,0,1]=4 2324 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [1,1,0,0,0,0|1,0,1]=4 2325 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [1,1,0,0,0,0|1,0,1]=4 2326 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [1,1,0,0,0,0|1,0,0]=3 2327 B10R1.18 O=C(O)Nc1cccnc1 Amb24102579 [1,1,0,0,0,0|2,0,0]=4 2328 B10R1.18 O=C(O)Nc1ccncc1 Amb24070647 [1,1,0,0,0,0|2,0,0]=4 2329 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,1]=3 2330 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,1]=3 2331 B10R1.18 O=C([O-])Cc1ccccn1 Amb22000882 [1,1,0,0,0,0|1,0,1]=4 2332 B10R1.18 O=C([O-])Cc1cccnc1 Amb33513106 [1,1,0,0,0,0|1,0,1]=4 2333 B10R1.18 O=C([O-])Oc1ccccc1 Amb5540415 [1,1,0,0,0,0|1,0,0]=3 2334 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [1,1,0,0,0,0|1,0,1]=4 2335 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [1,1,0,0,0,0|1,0,1]=4 2336 B10R1.18 O=S(O)Oc1ccccc1 Amb27964140 [1,1,0,0,0,0|2,0,0]=4 2337 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [1,1,0,0,0,0|1,0,1]=4 2338 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,1]=4 2339 B10R1.18 O=[N+]([O-])Nc1ccccc1 Amb17939349 [1,1,0,0,0,0|2,0,0]=4 2340 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,0,1]=4 2341 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,2]=4 2342 B10R1.18 S=C(Cl)Cc1ccccc1 Amb28203639 [1,1,0,0,0,0|0,1,1]=4 2343 B10R1.18 S=C(Cl)Oc1ccccc1 Amb6365789 [1,1,0,0,0,0|1,1,0]=4 2344 B10R1.18 S=C(Cl)Sc1ccccc1 Amb9800285 [1,1,0,0,0,0|1,1,0]=4 2345 B10R1.18 S=C(S)Nc1ccccc1 Amb28049925 [1,1,0,0,0,0|1,1,0]=4 2346 B10R1.11 O=C(\C=C\Cl)c1cccs1 Amb24478325 [0,1,0,0,1,0|2,0,0]=4 2347 B10R1.11 O=C(\C=C\Cl)c1ccoc1 Amb29880172 [0,1,0,0,1,0|2,0,0]=4 2348 B10R1.11 O=C(\C=C\Cl)c1ccsc1 Amb29880143 [0,1,0,0,1,0|2,0,0]=4 2349 B10R1.11 O=C(\C=C\[O-])c1ccco1 Amb24121225 [0,1,0,0,1,0|1,0,1]=4 2350 B10R1.11 O=C(\C=C\[O-])c1cccs1 Amb27251932 [0,1,0,0,1,0|1,0,1]=4 2351 B10R1.11 O=C(\C=C\[O-])c1ccsc1 Amb27655311 [0,1,0,0,1,0|1,0,1]=4 2352 B10R1.11 O=CCC(=O)c1ccco1 Amb9204969 [0,1,0,0,1,0|1,0,1]=4 2353 B10R1.11 O=CCC(=O)c1cccs1 Amb9204971 [0,1,0,0,1,0|1,0,1]=4 2354 B10R1.11 O=CCC(=O)c1ccoc1 Amb25251013 [0,1,0,0,1,0|1,0,1]=4 2355 B10R1.11 O=CCC(=O)c1ccsc1 Amb18799499 [0,1,0,0,1,0|1,0,1]=4 2356 B10R1.11 O=CNC(=O)c1cccs1 Amb5282864 [0,1,0,0,1,0|2,0,0]=4 2357 B10R1.11 O=C\C=C(/Cl)c1cccs1 Amb28076086 [0,1,0,0,1,0|1,0,0]=3 2358 B10R1.11 O=C\C=C(/Cl)c1ccsc1 Amb13777329 [0,1,0,0,1,0|1,0,0]=3 2359 B10R1.11 O=C\C=C(\Cl)c1cccs1 Amb28049394 [0,1,0,0,1,0|1,0,0]=3 2360 B10R1.16 Cc1cc(\C=C\C=O)no1 Amb33316704 [0,1,0,0,1,0|2,0,0]=4 2361 B10R1.16 Cc1cc(\C=C\C=O)on1 Amb33429946 [0,1,0,0,1,0|2,0,0]=4 2362 B10R1.16 Cc1cc(\C=C\C=O)sn1 Amb35719815 [0,1,0,0,1,0|2,0,0]=4 2363 B10R1.16 Cc1ccc(\C=C\C=O)o1 Amb17593442 [0,1,0,0,1,0|1,0,0]=3 2364 B10R1.16 Cc1ccc(\C=C\C=O)s1 Amb33136417 [0,1,0,0,1,0|1,0,0]=3 2365 B10R1.16 Cc1cnc(\C=C\C=O)s1 Amb28057892 [0,1,0,0,1,0|2,0,0]=4 2366 B10R1.16 Cc1csc(\C=C\C=O)c1 Amb33427137 [0,1,0,0,1,0|1,0,0]=3 2367 B10R1.16 Cc1nc(\C=C\C=O)cs1 Amb32954224 [0,1,0,0,1,0|2,0,0]=4 2368 B10R1.16 Cc1ncc(\C=C\C=O)s1 Amb32953984 [0,1,0,0,1,0|2,0,0]=4 2369 B10R1.16 Cn1cc(\C=C\C=O)cn1 Amb33136420 [0,1,0,0,1,0|2,0,0]=4 2370 B10R1.16 Cn1ccc(\C=C\C=O)n1 Amb32725249 [0,1,0,0,1,0|2,0,0]=4 2371 B10R1.16 Cn1cnc(\C=C\C=O)c1 Amb33359161 [0,1,0,0,1,0|2,0,0]=4 2372 B10R1.16 O=C\C=C/C1=CC(=O)OC1 Amb18643212 [0,1,0,0,1,0|1,0,1]=4 2373 B10R1.16 O=C\C=C\C1C=CC(=O)O1 Amb27185828 [0,1,0,0,1,0|1,0,1]=4 2374 B10R1.16 O=C\C=C\c1cc(Br)co1 Amb33431864 [0,1,0,0,1,0|1,0,0]=3 2375 B10R1.16 O=C\C=C\c1cc(Br)cs1 Amb33136419 [0,1,0,0,1,0|1,0,0]=3 2376 B10R1.16 O=C\C=C\c1cc(Cl)cs1 Amb27238215 [0,1,0,0,1,0|1,0,0]=3 2377 B10R1.16 O=C\C=C\c1ccc(Br)o1 Amb18130678 [0,1,0,0,1,0|1,0,0]=3 2378 B10R1.16 O=C\C=C\c1ccc(Br)s1 Amb27184057 [0,1,0,0,1,0|1,0,0]=3 2379 B10R1.16 O=C\C=C\c1ccc(Cl)o1 Amb18644875 [0,1,0,0,1,0|1,0,0]=3 2380 B10R1.16 O=C\C=C\c1ccc(Cl)s1 Amb33261658 [0,1,0,0,1,0|1,0,0]=3 2381 B10R1.16 O=C\C=C\c1cnc(Cl)s1 Amb33221345 [0,1,0,0,1,0|2,0,0]=4 2382 B10R1.16 O=C\C=C\c1csc(Br)c1 Amb33451389 [0,1,0,0,1,0|1,0,0]=3 2383 B10R1.16 O=C\C=C\c1csc(Br)n1 Amb33335373 [0,1,0,0,1,0|2,0,0]=4 2384 B10R1.16 O=C\C=C\c1ncc(Br)s1 Amb33436092 [0,1,0,0,1,0|2,0,0]=4 2385 B10R1.16 O=C\C=C\c1ncc(I)s1 Amb27960225 [0,1,0,0,1,0|2,0,0]=4 2386 B10R1.21 O=C=N\C=C\c1ccco1 Amb27984198 [0,1,0,0,1,0|1,0,1]=4 2387 B10R1.21 O=C=N\C=C\c1cccs1 Amb25945396 [0,1,0,0,1,0|1,0,1]=4 2388 B10R1.21 O=CN\C=C\c1cccs1 Amb27482776 [0,1,0,0,1,0|1,0,0]=3 2389 B10R1.21 O=CN\N=C\c1ccco1 Amb28184754 [0,1,0,0,1,0|2,0,0]=4 2390 B10R1.21 O=CO\C=C\c1ccco1 Amb28436284 [0,1,0,0,1,0|1,0,0]=3 2391 B10R1.21 O\N=C\C=C\c1ccco1 Amb27765781 [0,1,0,0,1,0|1,0,1]=4 2392 B10R1.27 C=C\C(C)=C/c1ccco1 Amb27440408 [0,1,0,0,1,0|2,0,0]=4 2393 B10R1.27 C=C\C(C)=C\c1ccco1 Amb33359794 [0,1,0,0,1,0|2,0,0]=4 2394 B10R1.27 C\C(C=O)=C/c1ccco1 Amb3599297 [0,1,0,0,1,0|1,0,0]=3 2395 B10R1.27 C\C(C=O)=C/c1cccs1 Amb17334333 [0,1,0,0,1,0|1,0,0]=3 2396 B10R1.27 C\C(C=O)=C/c1ccns1 Amb35719812 [0,1,0,0,1,0|2,0,0]=4 2397 B10R1.27 C\C(C=O)=C/c1ccsc1 Amb18644530 [0,1,0,0,1,0|1,0,0]=3 2398 B10R1.27 C\C(C=O)=C/c1cncs1 Amb27405461 [0,1,0,0,1,0|2,0,0]=4 2399 B10R1.27 C\C(C=O)=C\c1ccco1 Amb2792767 [0,1,0,0,1,0|1,0,0]=3 2400 B10R1.27 C\C(C=O)=C\c1ccoc1 Amb28050918 [0,1,0,0,1,0|1,0,0]=3 2401 B10R1.27 C\C(C=O)=C\c1ccsc1 Amb27402244 [0,1,0,0,1,0|1,0,0]=3 2402 B10R1.27 C\C(C=O)=C\c1nccs1 Amb27172890 [0,1,0,0,1,0|2,0,0]=4 2403 B10R1.27 O=CC(=O)Cc1ccco1 Amb27180510 [0,1,0,0,1,0|1,0,1]=4 2404 B10R1.27 O=C\C(Cl)=C/c1cccs1 Amb27227152 [0,1,0,0,1,0|1,0,0]=3 2405 B10R1.27 O=C\C(Cl)=C\c1ccco1 Amb27166107 [0,1,0,0,1,0|1,0,0]=3 2406 B10R1.27 O=C\C(F)=C\c1cccs1 Amb27770449 [0,1,0,0,1,0|1,0,0]=3 2407 B10R1.29 Cc1ccoc1\C=C\C=O Amb32954708 [0,1,0,0,1,0|1,0,0]=3 2408 B10R1.29 Cc1ccsc1\C=C\C=O Amb33136416 [0,1,0,0,1,0|1,0,0]=3 2409 B10R1.29 Cc1cscc1\C=C\C=O Amb33145868 [0,1,0,0,1,0|1,0,0]=3 2410 B10R1.29 Cc1ncsc1\C=C\C=O Amb33358465 [0,1,0,0,1,0|2,0,0]=4 2411 B10R1.29 Cc1occc1\C=C\C=O Amb33358783 [0,1,0,0,1,0|1,0,0]=3 2412 B10R1.29 Cc1oncc1\C=C\C=O Amb33361406 [0,1,0,0,1,0|2,0,0]=4 2413 B10R1.29 Cn1cccc1\C=C\C=O Amb18124458 [0,1,0,0,1,0|1,0,0]=3 2414 B10R1.29 Cn1ccnc1\C=C\C=O Amb33359231 [0,1,0,0,1,0|2,0,0]=4 2415 B10R1.29 Cn1cncc1\C=C\C=O Amb28312849 [0,1,0,0,1,0|2,0,0]=4 2416 B10R1.29 Cn1nccc1\C=C\C=O Amb33080181 [0,1,0,0,1,0|2,0,0]=4 2417 B10R1.29 O=C\C=C\c1occc1Br Amb27839525 [0,1,0,0,1,0|1,0,0]=3 2418 B10R1.29 O=C\C=C\c1sccc1Br Amb33242845 [0,1,0,0,1,0|1,0,0]=3 2419 B10R1.29 O=C\C=C\c1sccc1Cl Amb27847772 [0,1,0,0,1,0|1,0,0]=3 2420 B10R1.66 CC(=O)\C=C/c1ccco1 Amb25066388 [0,1,0,0,1,0|1,0,0]=3 2421 B10R1.66 CC(=O)\C=C\c1ccco1 Amb6608963 [0,1,0,0,1,0|1,0,0]=3 2422 B10R1.66 CC(=O)\C=C\c1cccs1 Amb33512960 [0,1,0,0,1,0|1,0,0]=3 2423 B10R1.66 CC(=O)\C=C\c1ccns1 Amb35720406 [0,1,0,0,1,0|2,0,0]=4 2424 B10R1.66 CC(=O)\C=C\c1ccoc1 Amb24479175 [0,1,0,0,1,0|1,0,0]=3 2425 B10R1.66 CC(=O)\C=C\c1ccon1 Amb33199366 [0,1,0,0,1,0|2,0,0]=4 2426 B10R1.66 CC(=O)\C=C\c1ccsc1 Amb22370887 [0,1,0,0,1,0|1,0,0]=3 2427 B10R1.66 CC(=O)\C=C\c1cnco1 Amb33319933 [0,1,0,0,1,0|2,0,0]=4 2428 B10R1.66 CC(=O)\C=C\c1cncs1 Amb33359799 [0,1,0,0,1,0|2,0,0]=4 2429 B10R1.66 CC(=O)\C=C\c1cnsc1 Amb26986340 [0,1,0,0,1,0|2,0,0]=4 2430 B10R1.66 CC(=O)\C=C\c1cscn1 Amb32954498 [0,1,0,0,1,0|2,0,0]=4 2431 B10R1.66 CC(=O)\C=C\c1nccs1 Amb33449103 [0,1,0,0,1,0|2,0,0]=4 2432 B10R1.66 NC(=O)\C=C/c1ccoc1 Amb27493171 [0,1,0,0,1,0|1,0,0]=3 2433 B10R1.66 NC(=O)\C=C\c1ccco1 Amb6387328 [0,1,0,0,1,0|1,0,0]=3 2434 B10R1.66 NC(=O)\C=C\c1cccs1 Amb3429140 [0,1,0,0,1,0|1,0,0]=3 2435 B10R1.66 NC(=O)\C=C\c1ccns1 Amb24558336 [0,1,0,0,1,0|2,0,0]=4 2436 B10R1.66 NC(=O)\C=C\c1cscn1 Amb28370560 [0,1,0,0,1,0|2,0,0]=4 2437 B10R1.66 NC(=S)\C=C/c1ccco1 Amb18108368 [0,1,0,0,1,0|1,1,0]=4 2438 B10R1.66 O=C(Cl)\C=C/c1ccco1 Amb26581586 [0,1,0,0,1,0|1,0,0]=3 2439 B10R1.66 O=C(Cl)\C=C\c1ccco1 Amb16230244 [0,1,0,0,1,0|1,0,0]=3 2440 B10R1.66 O=C(Cl)\C=C\c1cccs1 Amb7173093 [0,1,0,0,1,0|1,0,0]=3 2441 B10R1.66 O=C(Cl)\C=C\c1ccsc1 Amb8385105 [0,1,0,0,1,0|1,0,0]=3 2442 B10R1.66 O=C(O)\C=C/c1ccco1 Amb26458726 [0,1,0,0,1,0|1,0,0]=3 2443 B10R1.66 O=C(O)\C=C/c1cccs1 Amb27658635 [0,1,0,0,1,0|1,0,0]=3 2444 B10R1.66 O=C(O)\C=C/c1ccsc1 Amb10071559 [0,1,0,0,1,0|1,0,0]=3 2445 B10R1.66 O=C(O)\C=C\c1ccco1 Amb6335256 [0,1,0,0,1,0|1,0,0]=3 2446 B10R1.66 O=C(O)\C=C\c1cccs1 Amb24076486 [0,1,0,0,1,0|1,0,0]=3 2447 B10R1.66 O=C(O)\C=C\c1cccs1 Amb33716246 [0,1,0,0,1,0|1,0,0]=3 2448 B10R1.66 O=C(O)\C=C\c1ccno1 Amb27851739 [0,1,0,0,1,0|2,0,0]=4 2449 B10R1.66 O=C(O)\C=C\c1ccns1 Amb27234709 [0,1,0,0,1,0|2,0,0]=4 2450 B10R1.66 O=C(O)\C=C\c1ccoc1 Amb33946022 [0,1,0,0,1,0|1,0,0]=3 2451 B10R1.66 O=C(O)\C=C\c1ccon1 Amb33198351 [0,1,0,0,1,0|2,0,0]=4 2452 B10R1.66 O=C(O)\C=C\c1ccsc1 Amb1154295 [0,1,0,0,1,0|1,0,0]=3 2453 B10R1.66 O=C(O)\C=C\c1ccsn1 Amb24624065 [0,1,0,0,1,0|2,0,0]=4 2454 B10R1.66 O=C(O)\C=C\c1cnco1 Amb32954265 [0,1,0,0,1,0|2,0,0]=4 2455 B10R1.66 O=C(O)\C=C\c1cncs1 Amb33473685 [0,1,0,0,1,0|2,0,0]=4 2456 B10R1.66 O=C(O)\C=C\c1cnsc1 Amb28239806 [0,1,0,0,1,0|2,0,0]=4 2457 B10R1.66 O=C(O)\C=C\c1cocn1 Amb24638306 [0,1,0,0,1,0|2,0,0]=4 2458 B10R1.66 O=C(O)\C=C\c1cscn1 Amb8836304 [0,1,0,0,1,0|2,0,0]=4 2459 B10R1.66 O=C(O)\C=C\c1ncco1 Amb26921286 [0,1,0,0,1,0|2,0,0]=4 2460 B10R1.66 O=C(O)\C=C\c1nccs1 Amb8836307 [0,1,0,0,1,0|2,0,0]=4 2461 B10R1.66 O=C(O)\C=C\n1ccnc1 Amb26919413 [0,1,0,0,1,0|2,0,0]=4 2462 B10R1.66 O=C([O-])\C=C\c1ccsc1 Amb33512980 [0,1,0,0,1,0|1,0,0]=3 2463 B10R1.66 O=N(=O)\C=C\c1cccs1 Amb20621961 [0,1,0,0,1,0|2,0,0]=4 2464 B10R1.66 O=[N+]([O-])\C=C/c1cccs1 Amb4015634 [0,1,0,0,1,0|2,0,0]=4 2465 B10R1.66 O=[N+]([O-])\C=C\c1ccco1 Amb6316064 [0,1,0,0,1,0|2,0,0]=4 2466 B10R1.66 O=[N+]([O-])\C=C\c1cccs1 Amb6739796 [0,1,0,0,1,0|2,0,0]=4 2467 B10R1.66 O=[N+]([O-])\C=C\c1ccoc1 Amb22643231 [0,1,0,0,1,0|2,0,0]=4 2468 B10R1.66 O=[N+]([O-])\C=C\c1ccsc1 Amb2764123 [0,1,0,0,1,0|2,0,0]=4 2469 B12R1.1343 NC(=O)NN=C1C=CC=CC=C1 Amb28458283 [0,1,0,0,0,1|2,0,0]=4 2470 B12R1.1414 O=C\C=C\C=C1C=CC=CC=C1 Amb26393515 [0,1,0,0,0,1|0,0,0]=2 2471 B12R1.1564 O=C\C=C(\Cl)C1=CC=CC=CC1 Amb27202784 [0,1,0,0,0,1|0,0,0]=2 2472 B12R1.1 BrCC\C=C\c1ccc(Br)cc1 Amb17175754 [0,2,0,0,0,0|1,0,1]=4 2473 B12R1.1 C#CC\C=C\c1ccc(F)cc1 Amb33202431 [0,2,0,0,0,0|1,0,1]=4 2474 B12R1.1 C#C\C=C\Oc1ccc(N)cc1 Amb27243926 [0,2,0,0,0,0|1,0,1]=4 2475 B12R1.1 C=CC\C=C\c1ccc(C)cc1 Amb8394000 [0,2,0,0,0,0|1,0,0]=3 2476 B12R1.1 C=CC\C=C\c1ccc(Cl)cc1 Amb8393999 [0,2,0,0,0,0|1,0,0]=3 2477 B12R1.1 C=C\C=C\CN1C=CC(=O)C=C1 Amb25964735 [0,2,0,0,0,0|2,0,0]=4 2478 B12R1.1 CCC\C=C\c1ccc(Cl)cc1 Amb10566844 [0,2,0,0,0,0|1,0,1]=4 2479 B12R1.1 CCC\C=C\c1ccc(N)cc1 Amb27644670 [0,2,0,0,0,0|1,0,1]=4 2480 B12R1.1 CNC\C=C\c1ccc(Br)cc1 Amb23555646 [0,2,0,0,0,0|1,0,1]=4 2481 B12R1.1 CNC\C=C\c1ccc(C)cc1 Amb23442830 [0,2,0,0,0,0|1,0,1]=4 2482 B12R1.1 CNC\C=C\c1ccc(Cl)cc1 Amb23555634 [0,2,0,0,0,0|1,0,1]=4 2483 B12R1.1 CNC\C=C\c1ccc(F)cc1 Amb33136447 [0,2,0,0,0,0|1,0,1]=4 2484 B12R1.1 C\C=C\C=C\c1ccc(O)cc1 Amb28285927 [0,2,0,0,0,0|1,0,0]=3 2485 B12R1.1 C\C=C\C=N\c1ccc(O)cc1 Amb27626909 [0,2,0,0,0,0|1,0,0]=3 2486 B12R1.1 C\C=C\CNc1ccc(C)cc1 Amb4017479 [0,2,0,0,0,0|1,0,1]=4 2487 B12R1.1 C\C=C\CNc1ccc(Cl)cc1 Amb28458551 [0,2,0,0,0,0|1,0,1]=4 2488 B12R1.1 C\C=C\COc1ccc(Br)cc1 Amb9727095 [0,2,0,0,0,0|1,0,1]=4 2489 B12R1.1 C\C=C\COc1ccc(C)cc1 Amb27586223 [0,2,0,0,0,0|1,0,1]=4 2490 B12R1.1 C\C=C\CSc1ccc(Cl)cc1 Amb28126400 [0,2,0,0,0,0|1,0,1]=4 2491 B12R1.1 C\C=C\CSc1ccc(F)cc1 Amb27588597 [0,2,0,0,0,0|1,0,1]=4 2492 B12R1.1 Cc1ccc(C#C\C=C\Cl)cc1 Amb24634236 [0,2,0,0,0,0|1,0,1]=4 2493 B12R1.1 Cc1ccc(C=C=CC=O)cc1 Amb27797313 [0,2,0,0,0,0|0,0,0]=2 2494 B12R1.1 Cc1ccc(CCCC=O)cc1 Amb17089167 [0,2,0,0,0,0|0,0,2]=4 2495 B12R1.1 Cc1ccc(N\C=C/C=O)cc1 Amb27268477 [0,2,0,0,0,0|0,0,0]=2 2496 B12R1.1 Cc1ccc(OCCC=O)cc1 Amb5731761 [0,2,0,0,0,0|0,0,2]=4 2497 B12R1.1 Cc1ccc(OC\C=C/Cl)cc1 Amb28365557 [0,2,0,0,0,0|1,0,1]=4 2498 B12R1.1 Cc1ccc(O\C=C\CO)cc1 Amb28455048 [0,2,0,0,0,0|0,0,2]=4 2499 B12R1.1 Cc1ccc(SCCC=O)cc1 Amb17082944 [0,2,0,0,0,0|0,0,2]=4 2500 B12R1.1 Cc1ccc(SCNC=O)cc1 Amb28368453 [0,2,0,0,0,0|1,0,1]=4 2501 B12R1.1 Cc1ccc(SC\C=C\Cl)cc1 Amb27762218 [0,2,0,0,0,0|1,0,1]=4 2502 B12R1.1 Cc1ccc(\C=C\CCBr)cc1 Amb17142004 [0,2,0,0,0,0|1,0,1]=4 2503 B12R1.1 Cc1ccc(\C=C\CCCl)cc1 Amb17233776 [0,2,0,0,0,0|1,0,1]=4 2504 B12R1.1 Cc1ccc(\C=C\CCN)cc1 Amb17138533 [0,2,0,0,0,0|1,0,1]=4 2505 B12R1.1 Cc1ccc(\C=C\N=C=O)cc1 Amb23569114 [0,2,0,0,0,0|0,0,1]=3 2506 B12R1.1 Cc1ccc(\C=C\NC=O)cc1 Amb27605974 [0,2,0,0,0,0|0,0,0]=2 2507 B12R1.1 ClCC\C=C\c1ccc(Br)cc1 Amb17258088 [0,2,0,0,0,0|1,0,1]=4 2508 B12R1.1 ClCC\C=C\c1ccc(Cl)cc1 Amb17237225 [0,2,0,0,0,0|1,0,1]=4 2509 B12R1.1 ClC\C=C\Cc1ccc(Cl)cc1 Amb27791894 [0,2,0,0,0,0|1,0,1]=4 2510 B12R1.1 Cl\C=C\CNc1ccc(I)cc1 Amb28123810 [0,2,0,0,0,0|1,0,1]=4 2511 B12R1.1 Cl\C=C\COc1ccc(Cl)cc1 Amb6334883 [0,2,0,0,0,0|1,0,1]=4 2512 B12R1.1 Clc1ccc(\C=C\CCBr)cc1 Amb17159818 [0,2,0,0,0,0|1,0,1]=4 2513 B12R1.1 Fc1ccc(NC\C=C\Cl)cc1 Amb27635095 [0,2,0,0,0,0|1,0,1]=4 2514 B12R1.1 Fc1ccc(OC\C=C\Cl)cc1 Amb27229704 [0,2,0,0,0,0|1,0,1]=4 2515 B12R1.1 Fc1ccc(\C=C\CCBr)cc1 Amb17142520 [0,2,0,0,0,0|1,0,1]=4 2516 B12R1.1 Fc1ccc(\C=C\CCCl)cc1 Amb17234149 [0,2,0,0,0,0|1,0,1]=4 2517 B12R1.1 Fc1ccc(\C=C\CCS)cc1 Amb33201176 [0,2,0,0,0,0|0,1,1]=4 2518 B12R1.1 N#CC\C=C\c1ccc(Br)cc1 Amb25127627 [0,2,0,0,0,0|1,0,1]=4 2519 B12R1.1 N#CC\C=C\c1ccc(F)cc1 Amb27230841 [0,2,0,0,0,0|1,0,1]=4 2520 B12R1.1 NCC\C=C\c1ccc(Br)cc1 Amb17142136 [0,2,0,0,0,0|1,0,1]=4 2521 B12R1.1 NCC\C=C\c1ccc(Br)cc1 Amb30584899 [0,2,0,0,0,0|1,0,1]=4 2522 B12R1.1 NCC\C=C\c1ccc(Cl)cc1 Amb17139018 [0,2,0,0,0,0|1,0,1]=4 2523 B12R1.1 NCC\C=C\c1ccc(F)cc1 Amb17138587 [0,2,0,0,0,0|1,0,1]=4 2524 B12R1.1 NNC\C=C\c1ccc(Cl)cc1 Amb18648722 [0,2,0,0,0,0|1,0,1]=4 2525 B12R1.1 NNC\C=C\c1ccc(F)cc1 Amb33202749 [0,2,0,0,0,0|1,0,1]=4 2526 B12R1.1 NOC\C=C\c1ccc(F)cc1 Amb33203068 [0,2,0,0,0,0|0,0,2]=4 2527 B12R1.1 N\N=C\C=C\c1ccc(F)cc1 Amb28078412 [0,2,0,0,0,0|1,0,0]=3 2528 B12R1.1 Nc1ccc(S\C=C/CO)cc1 Amb27876550 [0,2,0,0,0,0|0,0,2]=4 2529 B12R1.1 O=C=N\C=C\c1ccc(F)cc1 Amb23569111 [0,2,0,0,0,0|0,0,1]=3 2530 B12R1.1 O=CCCCc1ccc(Br)cc1 Amb17089176 [0,2,0,0,0,0|0,0,2]=4 2531 B12R1.1 O=CCCCc1ccc(Cl)cc1 Amb17089175 [0,2,0,0,0,0|0,0,2]=4 2532 B12R1.1 O=CCCCc1ccc(F)cc1 Amb17089174 [0,2,0,0,0,0|0,0,2]=4 2533 B12R1.1 O=CCCCc1ccc(O)cc1 Amb33359533 [0,2,0,0,0,0|0,0,2]=4 2534 B12R1.1 O=CCCOc1ccc(Cl)cc1 Amb5731776 [0,2,0,0,0,0|0,0,2]=4 2535 B12R1.1 O=CCCOc1ccc(F)cc1 Amb5731762 [0,2,0,0,0,0|0,0,2]=4 2536 B12R1.1 O=CCCSc1ccc(Br)cc1 Amb17082947 [0,2,0,0,0,0|0,0,2]=4 2537 B12R1.1 O=CCCSc1ccc(Cl)cc1 Amb17082946 [0,2,0,0,0,0|0,0,2]=4 2538 B12R1.1 O=CCCSc1ccc(F)cc1 Amb17082945 [0,2,0,0,0,0|0,0,2]=4 2539 B12R1.1 O=CCSCc1ccc(Cl)cc1 Amb32683088 [0,2,0,0,0,0|0,0,2]=4 2540 B12R1.1 O=CC\C=C\c1ccc(F)cc1 Amb33203072 [0,2,0,0,0,0|0,0,0]=2 2541 B12R1.1 O=CNCCc1ccc(Br)cc1 Amb28366607 [0,2,0,0,0,0|0,0,2]=4 2542 B12R1.1 O=CNCCc1ccc(F)cc1 Amb27267670 [0,2,0,0,0,0|0,0,2]=4 2543 B12R1.1 O=CNCCc1ccc(O)cc1 Amb8399387 [0,2,0,0,0,0|0,0,2]=4 2544 B12R1.1 O=CN\N=C\c1ccc(Cl)cc1 Amb355482 [0,2,0,0,0,0|1,0,0]=3 2545 B12R1.1 O=C\C=C\Nc1ccc(Cl)cc1 Amb18648566 [0,2,0,0,0,0|0,0,0]=2 2546 B12R1.1 OCC=C=Cc1ccc(F)cc1 Amb27653190 [0,2,0,0,0,0|0,0,2]=4 2547 B12R1.1 OCC\C=C\c1ccc(F)cc1 Amb24763739 [0,2,0,0,0,0|0,0,2]=4 2548 B12R1.1 OC\C=C\Cc1ccc(Cl)cc1 Amb27662231 [0,2,0,0,0,0|0,0,2]=4 2549 B12R1.1 ONC\C=C\c1ccc(F)cc1 Amb33327071 [0,2,0,0,0,0|0,0,2]=4 2550 B12R1.1 [C-]#[N+]C\C=C\c1ccc(F)cc1 Amb33326578 [0,2,0,0,0,0|1,0,1]=4 2551 B12R1.16 C=CCC(=O)c1ccc(Br)cc1 Amb17343203 [0,2,0,0,0,0|1,0,1]=4 2552 B12R1.16 C=CCC(=O)c1ccc(C)cc1 Amb10563159 [0,2,0,0,0,0|1,0,1]=4 2553 B12R1.16 C=CCC(=O)c1ccc(Cl)cc1 Amb17335459 [0,2,0,0,0,0|1,0,1]=4 2554 B12R1.16 C=CCC(=O)c1ccc(F)cc1 Amb17334601 [0,2,0,0,0,0|1,0,1]=4 2555 B12R1.16 C=CCC(=O)c1ccc(I)cc1 Amb27171953 [0,2,0,0,0,0|1,0,1]=4 2556 B12R1.16 C=CCC(=O)c1ccc(O)cc1 Amb17334557 [0,2,0,0,0,0|1,0,1]=4 2557 B12R1.16 C=COC(=O)c1ccc(O)cc1 Amb18645955 [0,2,0,0,0,0|2,0,0]=4 2558 B12R1.16 CC(CC=O)c1ccc(F)cc1 Amb27827352 [0,2,0,0,0,0|0,0,2]=4 2559 B12R1.16 CC(CC=O)c1ccc(I)cc1 Amb27416593 [0,2,0,0,0,0|0,0,2]=4 2560 B12R1.16 CC(NC=O)c1ccc(Br)cc1 Amb4149067 [0,2,0,0,0,0|1,0,1]=4 2561 B12R1.16 CC(NC=O)c1ccc(Cl)cc1 Amb24692281 [0,2,0,0,0,0|1,0,1]=4 2562 B12R1.16 CC(\C=C\Br)c1ccc(F)cc1 Amb33135459 [0,2,0,0,0,0|1,0,1]=4 2563 B12R1.16 CC\C=C(\Cl)c1ccc(F)cc1 Amb27800091 [0,2,0,0,0,0|1,0,1]=4 2564 B12R1.16 CN\C=C(\C)c1ccc(Cl)cc1 Amb27814193 [0,2,0,0,0,0|2,0,0]=4 2565 B12R1.16 C\C(=C/C#N)c1ccc(O)cc1 Amb28202232 [0,2,0,0,0,0|1,0,1]=4 2566 B12R1.16 C\C(=C/CN)c1ccc(Br)cc1 Amb31098021 [0,2,0,0,0,0|1,0,1]=4 2567 B12R1.16 C\C(=C/CN)c1ccc(C)cc1 Amb31099547 [0,2,0,0,0,0|1,0,1]=4 2568 B12R1.16 C\C(=C/CN)c1ccc(Cl)cc1 Amb31096965 [0,2,0,0,0,0|1,0,1]=4 2569 B12R1.16 C\C(=C/CN)c1ccc(F)cc1 Amb31099551 [0,2,0,0,0,0|1,0,1]=4 2570 B12R1.16 C\C(=C/CO)c1ccc(Cl)cc1 Amb27815981 [0,2,0,0,0,0|0,0,2]=4 2571 B12R1.16 C\C(=C\C#N)c1ccc(C)cc1 Amb27260810 [0,2,0,0,0,0|1,0,1]=4 2572 B12R1.16 C\C(=C\C#N)c1ccc(F)cc1 Amb27260805 [0,2,0,0,0,0|1,0,1]=4 2573 B12R1.16 C\C(=C\CN)c1ccc(F)cc1 Amb24662850 [0,2,0,0,0,0|1,0,1]=4 2574 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [0,2,0,0,0,0|1,0,1]=4 2575 B12R1.16 C\C=C\C(O)c1ccc(F)cc1 Amb27615221 [0,2,0,0,0,0|1,0,1]=4 2576 B12R1.16 Cc1ccc(C(=O)C=C=O)cc1 Amb28141131 [0,2,0,0,0,0|0,0,1]=3 2577 B12R1.16 Cc1ccc(C(=O)C=[N+]=[N-])cc1 Amb26961733 [0,2,0,0,0,0|2,0,0]=4 2578 B12R1.16 Cc1ccc(C(=O)CC=O)cc1 Amb9204941 [0,2,0,0,0,0|0,0,1]=3 2579 B12R1.16 Cc1ccc(C(=O)CC=O)cn1 Amb28046304 [0,2,0,0,0,0|1,0,1]=4 2580 B12R1.16 Cc1ccc(C(=O)CC=O)nc1 Amb28313709 [0,2,0,0,0,0|1,0,1]=4 2581 B12R1.16 Cc1ccc(C(=O)N=C=O)cc1 Amb6252633 [0,2,0,0,0,0|1,0,1]=4 2582 B12R1.16 Cc1ccc(C(=O)[CH-]C=O)cc1 Amb28076867 [0,2,0,0,0,0|0,0,1]=3 2583 B12R1.16 Cc1ccc(C(=O)\C=C\Cl)cc1 Amb25774994 [0,2,0,0,0,0|1,0,0]=3 2584 B12R1.16 Cc1ccc(C(=O)\C=C\Cl)cn1 Amb29880188 [0,2,0,0,0,0|2,0,0]=4 2585 B12R1.16 Cc1ccc(C(=O)\C=C\[O-])cc1 Amb474680 [0,2,0,0,0,0|0,0,1]=3 2586 B12R1.16 Cc1ccc(C(=O)\C=N\O)cc1 Amb2609882 [0,2,0,0,0,0|1,0,1]=4 2587 B12R1.16 Cc1ccc(C(C)CC=O)cc1 Amb18645706 [0,2,0,0,0,0|0,0,2]=4 2588 B12R1.16 Cc1ccc(C(C)\C=C\Br)cc1 Amb33135290 [0,2,0,0,0,0|1,0,1]=4 2589 B12R1.16 Cc1ccc(\C(Br)=C\C=O)cc1 Amb27840600 [0,2,0,0,0,0|0,0,0]=2 2590 B12R1.16 Cc1ccc(\C(Cl)=C\C#N)cc1 Amb9213562 [0,2,0,0,0,0|1,0,1]=4 2591 B12R1.16 Cc1ccc(\C(Cl)=C\C=O)cc1 Amb17233768 [0,2,0,0,0,0|0,0,0]=2 2592 B12R1.16 N#C\C=C(/Cl)c1ccc(Br)cc1 Amb8841485 [0,2,0,0,0,0|1,0,1]=4 2593 B12R1.16 N#C\C=C(/Cl)c1ccc(Cl)cc1 Amb2685801 [0,2,0,0,0,0|1,0,1]=4 2594 B12R1.16 N#C\C=C(/Cl)c1ccc(F)cc1 Amb33301213 [0,2,0,0,0,0|1,0,1]=4 2595 B12R1.16 N#C\C=C(/N)c1ccc(Br)cc1 Amb16231157 [0,2,0,0,0,0|1,0,1]=4 2596 B12R1.16 N#C\C=C(/N)c1ccc(Cl)cc1 Amb33292515 [0,2,0,0,0,0|1,0,1]=4 2597 B12R1.16 N#C\C=C(/N)c1ccc(F)cc1 Amb18126319 [0,2,0,0,0,0|1,0,1]=4 2598 B12R1.16 N#C\C=C(\Cl)c1ccc(Br)cc1 Amb8629453 [0,2,0,0,0,0|1,0,1]=4 2599 B12R1.16 N#C\C=C(\Cl)c1ccc(F)cc1 Amb4511671 [0,2,0,0,0,0|1,0,1]=4 2600 B12R1.16 N#C\C=C(\Cl)c1ccc(I)cc1 Amb27247983 [0,2,0,0,0,0|1,0,1]=4 2601 B12R1.16 N#C\C=C(\N)c1ccc(Br)cc1 Amb2435537 [0,2,0,0,0,0|1,0,1]=4 2602 B12R1.16 N#C\C=C(\N)c1ccc(Cl)cc1 Amb2435534 [0,2,0,0,0,0|1,0,1]=4 2603 B12R1.16 N#C\C=C(\N)c1ccc(I)cc1 Amb27170265 [0,2,0,0,0,0|1,0,1]=4 2604 B12R1.16 N#N=CC(=O)c1ccc(Br)cc1 Amb9827070 [0,2,0,0,0,0|2,0,0]=4 2605 B12R1.16 N#N=CC(=O)c1ccc(Cl)cc1 Amb9827157 [0,2,0,0,0,0|2,0,0]=4 2606 B12R1.16 NC\C=C(\Cl)c1ccc(F)cc1 Amb27201340 [0,2,0,0,0,0|1,0,1]=4 2607 B12R1.16 N\C(=C/C=O)c1ccc(Cl)cc1 Amb28054819 [0,2,0,0,0,0|0,0,0]=2 2608 B12R1.16 N\C=C\C(=O)c1ccc(Cl)cc1 Amb27614726 [0,2,0,0,0,0|1,0,0]=3 2609 B12R1.16 N\N=C\C(=O)c1ccc(Br)cc1 Amb9824987 [0,2,0,0,0,0|2,0,0]=4 2610 B12R1.16 N\N=C\C(=O)c1ccc(Cl)cc1 Amb9824986 [0,2,0,0,0,0|2,0,0]=4 2611 B12R1.16 O=C(\C=C/[O-])c1ccc(Cl)cc1 Amb24121228 [0,2,0,0,0,0|0,0,1]=3 2612 B12R1.16 O=C(\C=C\Cl)c1ccc(Br)cc1 Amb33832699 [0,2,0,0,0,0|1,0,0]=3 2613 B12R1.16 O=C(\C=C\Cl)c1ccc(Br)cn1 Amb35628658 [0,2,0,0,0,0|2,0,0]=4 2614 B12R1.16 O=C(\C=C\Cl)c1ccc(Cl)cc1 Amb33832700 [0,2,0,0,0,0|1,0,0]=3 2615 B12R1.16 O=C(\C=C\Cl)c1ccc(Cl)cn1 Amb35628801 [0,2,0,0,0,0|2,0,0]=4 2616 B12R1.16 O=C(\C=C\Cl)c1ccc(F)cc1 Amb27409141 [0,2,0,0,0,0|1,0,0]=3 2617 B12R1.16 O=C(\C=C\Cl)c1ccc(F)cn1 Amb35628675 [0,2,0,0,0,0|2,0,0]=4 2618 B12R1.16 O=C(\C=C\Cl)c1ccc(I)cc1 Amb35609460 [0,2,0,0,0,0|1,0,0]=3 2619 B12R1.16 O=C(\C=C\Cl)c1ccc(O)cc1 Amb35645312 [0,2,0,0,0,0|1,0,0]=3 2620 B12R1.16 O=C(\C=C\[O-])c1ccc(Br)cc1 Amb27639750 [0,2,0,0,0,0|0,0,1]=3 2621 B12R1.16 O=C(\C=C\[O-])c1ccc(Br)cn1 Amb29853966 [0,2,0,0,0,0|1,0,1]=4 2622 B12R1.16 O=C(\C=C\[O-])c1ccc(Cl)cc1 Amb24109294 [0,2,0,0,0,0|0,0,1]=3 2623 B12R1.16 O=C(\C=C\[O-])c1ccc(Cl)cc1 Amb30584833 [0,2,0,0,0,0|0,0,1]=3 2624 B12R1.16 O=C(\C=C\[O-])c1ccc(Cl)cn1 Amb29853961 [0,2,0,0,0,0|1,0,1]=4 2625 B12R1.16 O=C(\C=C\[O-])c1ccc(F)cc1 Amb416271 [0,2,0,0,0,0|0,0,1]=3 2626 B12R1.16 O=C(\C=N/O)c1ccc(O)cc1 Amb27263002 [0,2,0,0,0,0|1,0,1]=4 2627 B12R1.16 O=C(\C=N\O)c1ccc(Br)cc1 Amb27875418 [0,2,0,0,0,0|1,0,1]=4 2628 B12R1.16 O=C(\C=N\O)c1ccc(Cl)cc1 Amb2434431 [0,2,0,0,0,0|1,0,1]=4 2629 B12R1.16 O=C(\C=N\O)c1ccc(F)cc1 Amb4479325 [0,2,0,0,0,0|1,0,1]=4 2630 B12R1.16 O=C(\C=N\O)c1ccc(O)cc1 Amb25113482 [0,2,0,0,0,0|1,0,1]=4 2631 B12R1.16 O=C=NC(=O)c1ccc(Br)cc1 Amb17247242 [0,2,0,0,0,0|1,0,1]=4 2632 B12R1.16 O=C=NC(=O)c1ccc(Cl)cc1 Amb6252632 [0,2,0,0,0,0|1,0,1]=4 2633 B12R1.16 O=C=NC(=O)c1ccc(F)cc1 Amb6252631 [0,2,0,0,0,0|1,0,1]=4 2634 B12R1.16 O=C=NC(=O)c1ccc(O)cc1 Amb26874443 [0,2,0,0,0,0|1,0,1]=4 2635 B12R1.16 O=CCC(=O)c1ccc(Br)cc1 Amb9204942 [0,2,0,0,0,0|0,0,1]=3 2636 B12R1.16 O=CCC(=O)c1ccc(Br)cn1 Amb29853965 [0,2,0,0,0,0|1,0,1]=4 2637 B12R1.16 O=CCC(=O)c1ccc(Cl)cc1 Amb5717711 [0,2,0,0,0,0|0,0,1]=3 2638 B12R1.16 O=CCC(=O)c1ccc(Cl)cn1 Amb25986699 [0,2,0,0,0,0|1,0,1]=4 2639 B12R1.16 O=CCC(=O)c1ccc(Cl)nc1 Amb27478289 [0,2,0,0,0,0|1,0,1]=4 2640 B12R1.16 O=CCC(=O)c1ccc(F)cc1 Amb9204897 [0,2,0,0,0,0|0,0,1]=3 2641 B12R1.16 O=CCC(=O)c1ccc(F)cn1 Amb24732595 [0,2,0,0,0,0|1,0,1]=4 2642 B12R1.16 O=CCC(=O)c1ccc(F)nc1 Amb26948643 [0,2,0,0,0,0|1,0,1]=4 2643 B12R1.16 O=CCC(=O)c1ccc(I)cc1 Amb24748951 [0,2,0,0,0,0|0,0,1]=3 2644 B12R1.16 O=CCC(=O)c1ccc(O)cc1 Amb27168149 [0,2,0,0,0,0|0,0,1]=3 2645 B12R1.16 O=CCC(=S)c1ccc(Cl)cc1 Amb27268390 [0,2,0,0,0,0|0,0,1]=3 2646 B12R1.16 O=CCC(O)c1ccc(I)cc1 Amb27954814 [0,2,0,0,0,0|0,0,2]=4 2647 B12R1.16 O=CCS(=O)c1ccc(Br)cc1 Amb28366521 [0,2,0,0,0,0|1,0,1]=4 2648 B12R1.16 O=CCS(=O)c1ccc(F)cc1 Amb27641790 [0,2,0,0,0,0|1,0,1]=4 2649 B12R1.16 O=CC[C@@H](O)c1ccc(Cl)cc1 Amb27770788 [0,2,0,0,0,0|0,0,2]=4 2650 B12R1.16 O=CNC(=O)c1ccc(Br)cc1 Amb28251420 [0,2,0,0,0,0|1,0,0]=3 2651 B12R1.16 O=CNC(=O)c1ccc(Cl)cc1 Amb27849669 [0,2,0,0,0,0|1,0,0]=3 2652 B12R1.16 O=CNC(=S)c1ccc(Cl)cc1 Amb27451685 [0,2,0,0,0,0|1,0,0]=3 2653 B12R1.16 O=C\C=C(/Cl)c1ccc(Br)cc1 Amb17258082 [0,2,0,0,0,0|0,0,0]=2 2654 B12R1.16 O=C\C=C(/Cl)c1ccc(Cl)cc1 Amb17237218 [0,2,0,0,0,0|0,0,0]=2 2655 B12R1.16 O=C\C=C(/Cl)c1ccc(F)cc1 Amb17234142 [0,2,0,0,0,0|0,0,0]=2 2656 B12R1.16 O=C\C=C(\Cl)c1ccc(Br)cc1 Amb10608566 [0,2,0,0,0,0|0,0,0]=2 2657 B12R1.16 O=C\C=C(\Cl)c1ccc(Cl)cc1 Amb8629220 [0,2,0,0,0,0|0,0,0]=2 2658 B12R1.16 [N-]=[N+]=CC(=O)c1ccc(F)cc1 Amb26514940 [0,2,0,0,0,0|2,0,0]=4 2659 B12R1.21 CC(=O)CCc1ccc(Br)cc1 Amb5740059 [0,2,0,0,0,0|0,0,2]=4 2660 B12R1.21 CC(=O)CCc1ccc(C)cc1 Amb5740050 [0,2,0,0,0,0|0,0,2]=4 2661 B12R1.21 CC(=O)CCc1ccc(Cl)cc1 Amb5740058 [0,2,0,0,0,0|0,0,2]=4 2662 B12R1.21 CC(=O)CCc1ccc(F)cc1 Amb5740057 [0,2,0,0,0,0|0,0,2]=4 2663 B12R1.21 CC(=O)CCc1ccc(I)cc1 Amb26325783 [0,2,0,0,0,0|0,0,2]=4 2664 B12R1.21 CC(=O)CCc1ccc(N)cc1 Amb27637738 [0,2,0,0,0,0|0,0,2]=4 2665 B12R1.21 CC(=O)CCc1ccc(O)cc1 Amb533055 [0,2,0,0,0,0|0,0,2]=4 2666 B12R1.21 CC(=O)COc1ccc(Cl)cc1 Amb1094739 [0,2,0,0,0,0|1,0,1]=4 2667 B12R1.21 CC(=O)COc1ccc(F)cc1 Amb9269853 [0,2,0,0,0,0|1,0,1]=4 2668 B12R1.21 CC(=O)COc1ccc(I)cc1 Amb26363908 [0,2,0,0,0,0|1,0,1]=4 2669 B12R1.21 CC(=O)COc1ccc(N)cc1 Amb17110083 [0,2,0,0,0,0|1,0,1]=4 2670 B12R1.21 CC(=O)CSc1ccc(Br)cc1 Amb2608948 [0,2,0,0,0,0|1,0,1]=4 2671 B12R1.21 CC(=O)CSc1ccc(C)cc1 Amb2725052 [0,2,0,0,0,0|1,0,1]=4 2672 B12R1.21 CC(=O)CSc1ccc(Cl)cc1 Amb2686419 [0,2,0,0,0,0|1,0,1]=4 2673 B12R1.21 CC(=O)CSc1ccc(F)cc1 Amb3429089 [0,2,0,0,0,0|1,0,1]=4 2674 B12R1.21 CC(=O)CSc1ccc(N)cc1 Amb28255271 [0,2,0,0,0,0|1,0,1]=4 2675 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [0,2,0,0,0,0|1,0,1]=4 2676 B12R1.21 CC(=O)NCc1ccc(C)cc1 Amb3358096 [0,2,0,0,0,0|1,0,1]=4 2677 B12R1.21 CC(=O)NCc1ccc(Cl)cc1 Amb3094821 [0,2,0,0,0,0|1,0,1]=4 2678 B12R1.21 CC(=O)NCc1ccc(F)cc1 Amb8020832 [0,2,0,0,0,0|1,0,1]=4 2679 B12R1.21 CC(=O)NCc1ccc(N)cc1 Amb4017045 [0,2,0,0,0,0|1,0,1]=4 2680 B12R1.21 CC(=O)NCc1ccc(O)cc1 Amb10549495 [0,2,0,0,0,0|1,0,1]=4 2681 B12R1.21 CC(=O)NNc1ccc(Br)cc1 Amb1040272 [0,2,0,0,0,0|2,0,0]=4 2682 B12R1.21 CC(=O)NNc1ccc(F)cc1 Amb4362485 [0,2,0,0,0,0|2,0,0]=4 2683 B12R1.21 CC(=O)NNc1ccc(I)cc1 Amb4362486 [0,2,0,0,0,0|2,0,0]=4 2684 B12R1.21 CC(=O)OCc1ccc(Cl)cc1 Amb2421366 [0,2,0,0,0,0|1,0,1]=4 2685 B12R1.21 CC(=O)ON=C1C=CC(=O)C=C1 Amb27175819 [0,2,0,0,0,0|2,0,0]=4 2686 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [0,2,0,0,0,0|1,0,1]=4 2687 B12R1.21 CC(=O)SCc1ccc(O)cc1 Amb27256344 [0,2,0,0,0,0|1,0,1]=4 2688 B12R1.21 CC(=O)\C=C\c1cc[n+](C)cc1 Amb4248214 [0,2,0,0,0,0|1,0,0]=3 2689 B12R1.21 CC(=O)\C=C\c1ccc(Br)cc1 Amb534305 [0,2,0,0,0,0|0,0,0]=2 2690 B12R1.21 CC(=O)\C=C\c1ccc(Br)cn1 Amb27803623 [0,2,0,0,0,0|1,0,0]=3 2691 B12R1.21 CC(=O)\C=C\c1ccc(Br)nc1 Amb33388886 [0,2,0,0,0,0|1,0,0]=3 2692 B12R1.21 CC(=O)\C=C\c1ccc(C)cc1 Amb4421820 [0,2,0,0,0,0|0,0,0]=2 2693 B12R1.21 CC(=O)\C=C\c1ccc(C)cn1 Amb24527877 [0,2,0,0,0,0|1,0,0]=3 2694 B12R1.21 CC(=O)\C=C\c1ccc(C)nc1 Amb27487978 [0,2,0,0,0,0|1,0,0]=3 2695 B12R1.21 CC(=O)\C=C\c1ccc(Cl)cc1 Amb33870385 [0,2,0,0,0,0|0,0,0]=2 2696 B12R1.21 CC(=O)\C=C\c1ccc(Cl)cn1 Amb33223976 [0,2,0,0,0,0|1,0,0]=3 2697 B12R1.21 CC(=O)\C=C\c1ccc(Cl)nc1 Amb33261607 [0,2,0,0,0,0|1,0,0]=3 2698 B12R1.21 CC(=O)\C=C\c1ccc(F)cc1 Amb3428861 [0,2,0,0,0,0|0,0,0]=2 2699 B12R1.21 CC(=O)\C=C\c1ccc(F)cn1 Amb33317373 [0,2,0,0,0,0|1,0,0]=3 2700 B12R1.21 CC(=O)\C=C\c1ccc(F)nc1 Amb33425140 [0,2,0,0,0,0|1,0,0]=3 2701 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [0,2,0,0,0,0|0,0,0]=2 2702 B12R1.21 CC(=O)\C=C\c1ccc(O)cc1 Amb6357952 [0,2,0,0,0,0|0,0,0]=2 2703 B12R1.21 CC(=O)\C=C\c1cnc(C)cn1 Amb33376977 [0,2,0,0,0,0|2,0,0]=4 2704 B12R1.21 CC(=O)\C=C\c1ncc(Br)cn1 Amb33335104 [0,2,0,0,0,0|2,0,0]=4 2705 B12R1.21 CC(=O)\C=C\c1ncc(F)cn1 Amb26075862 [0,2,0,0,0,0|2,0,0]=4 2706 B12R1.21 CC(=O)\N=C/c1ccc(Cl)cc1 Amb24073008 [0,2,0,0,0,0|1,0,0]=3 2707 B12R1.21 CC(Br)\C=C\c1ccc(Br)cc1 Amb27416893 [0,2,0,0,0,0|1,0,1]=4 2708 B12R1.21 CC(Br)\C=C\c1ccc(I)cc1 Amb27659558 [0,2,0,0,0,0|1,0,1]=4 2709 B12R1.21 CC(C)\C=C\c1ccc(O)cc1 Amb18645701 [0,2,0,0,0,0|1,0,1]=4 2710 B12R1.21 CC(N)\C=C\c1ccc(Br)cc1 Amb33450910 [0,2,0,0,0,0|1,0,1]=4 2711 B12R1.21 CC(N)\C=C\c1ccc(Cl)cc1 Amb27759797 [0,2,0,0,0,0|1,0,1]=4 2712 B12R1.21 CC(N)\C=C\c1ccc(F)cc1 Amb27663585 [0,2,0,0,0,0|1,0,1]=4 2713 B12R1.21 CC(N)\C=C\c1ccc(I)cc1 Amb28146161 [0,2,0,0,0,0|1,0,1]=4 2714 B12R1.21 CC(N)\C=C\c1ccc(O)cc1 Amb33361052 [0,2,0,0,0,0|1,0,1]=4 2715 B12R1.21 CC(O)\C=C\c1ccc(Br)cc1 Amb26842748 [0,2,0,0,0,0|0,0,2]=4 2716 B12R1.21 CC(O)\C=C\c1ccc(Cl)cc1 Amb26363210 [0,2,0,0,0,0|0,0,2]=4 2717 B12R1.21 CC(O)\C=C\c1ccc(F)cc1 Amb26392384 [0,2,0,0,0,0|0,0,2]=4 2718 B12R1.21 CC(O)\C=C\c1ccc(N)cc1 Amb35622609 [0,2,0,0,0,0|0,0,2]=4 2719 B12R1.21 CN(C)\C=C\c1ccc(Cl)cc1 Amb27616221 [0,2,0,0,0,0|2,0,0]=4 2720 B12R1.21 CS(=O)\C=C/c1ccc(Cl)cc1 Amb24309137 [0,2,0,0,0,0|1,0,0]=3 2721 B12R1.21 CS(=O)\N=C\c1ccc(Br)cc1 Amb35681670 [0,2,0,0,0,0|2,0,0]=4 2722 B12R1.21 CS(=O)\N=C\c1ccc(Cl)cc1 Amb35681671 [0,2,0,0,0,0|2,0,0]=4 2723 B12R1.21 CS(=O)\N=C\c1ccc(F)cc1 Amb35681675 [0,2,0,0,0,0|2,0,0]=4 2724 B12R1.21 CS(=O)\N=C\c1ccc(I)cc1 Amb35692841 [0,2,0,0,0,0|2,0,0]=4 2725 B12R1.21 CS(=O)\N=C\c1ccc(O)cc1 Amb35681664 [0,2,0,0,0,0|2,0,0]=4 2726 B12R1.21 C[C@@H](N)\C=C\c1ccc(Cl)cc1 Amb27880882 [0,2,0,0,0,0|1,0,1]=4 2727 B12R1.21 C[C@@H](N)\C=C\c1ccc(F)cc1 Amb33326717 [0,2,0,0,0,0|1,0,1]=4 2728 B12R1.21 C[C@@H](O)\C=C\c1ccc(F)cc1 Amb33474738 [0,2,0,0,0,0|0,0,2]=4 2729 B12R1.21 C[C@H](N)\C=C\c1ccc(F)cc1 Amb33326714 [0,2,0,0,0,0|1,0,1]=4 2730 B12R1.21 C[C@H](O)\C=C\c1ccc(Br)cc1 Amb27495626 [0,2,0,0,0,0|0,0,2]=4 2731 B12R1.21 C[C@H](O)\C=C\c1ccc(F)cc1 Amb33080147 [0,2,0,0,0,0|0,0,2]=4 2732 B12R1.21 Cc1ccc(C#CC(=O)O)cc1 Amb17138496 [0,2,0,0,0,0|0,0,2]=4 2733 B12R1.21 Cc1ccc(CCC(=O)Cl)cc1 Amb17142993 [0,2,0,0,0,0|0,0,2]=4 2734 B12R1.21 Cc1ccc(CCC(=O)O)cc1 Amb1225383 [0,2,0,0,0,0|0,0,2]=4 2735 B12R1.21 Cc1ccc(CCC(N)=O)cc1 Amb8998651 [0,2,0,0,0,0|0,0,2]=4 2736 B12R1.21 Cc1ccc(CNC(=O)Cl)cc1 Amb35637117 [0,2,0,0,0,0|1,0,1]=4 2737 B12R1.21 Cc1ccc(CNC(N)=O)cc1 Amb1134976 [0,2,0,0,0,0|1,0,1]=4 2738 B12R1.21 Cc1ccc(COC(=O)Cl)cc1 Amb27816885 [0,2,0,0,0,0|1,0,1]=4 2739 B12R1.21 Cc1ccc(NCC(=O)Cl)cc1 Amb27425242 [0,2,0,0,0,0|1,0,1]=4 2740 B12R1.21 Cc1ccc(NCC(=O)O)cc1 Amb1106469 [0,2,0,0,0,0|1,0,1]=4 2741 B12R1.21 Cc1ccc(NCC(N)=O)cc1 Amb845278 [0,2,0,0,0,0|1,0,1]=4 2742 B12R1.21 Cc1ccc(NNC(N)=O)cc1 Amb24585130 [0,2,0,0,0,0|2,0,0]=4 2743 B12R1.21 Cc1ccc(OCC(=O)Cl)cc1 Amb10880011 [0,2,0,0,0,0|1,0,1]=4 2744 B12R1.21 Cc1ccc(OCC(=O)O)cc1 Amb6336447 [0,2,0,0,0,0|1,0,1]=4 2745 B12R1.21 Cc1ccc(OCC(N)=O)cc1 Amb6346004 [0,2,0,0,0,0|1,0,1]=4 2746 B12R1.21 Cc1ccc(SCC(=O)O)cc1 Amb1197696 [0,2,0,0,0,0|1,0,1]=4 2747 B12R1.21 Cc1ccc(SCC(N)=O)cc1 Amb3836116 [0,2,0,0,0,0|1,0,1]=4 2748 B12R1.21 Cc1ccc(\C=C/C(=O)O)cc1 Amb27474899 [0,2,0,0,0,0|0,0,0]=2 2749 B12R1.21 Cc1ccc(\C=C/C(N)=O)cc1 Amb27974609 [0,2,0,0,0,0|0,0,0]=2 2750 B12R1.21 Cc1ccc(\C=C/[N+](=O)[O-])cc1 Amb2714244 [0,2,0,0,0,0|1,0,0]=3 2751 B12R1.21 Cc1ccc(\C=C\B(O)O)cc1 Amb20671353 [0,2,0,0,0,0|1,0,1]=4 2752 B12R1.21 Cc1ccc(\C=C\C(=O)Cl)cc1 Amb16230247 [0,2,0,0,0,0|0,0,0]=2 2753 B12R1.21 Cc1ccc(\C=C\C(=O)O)cc1 Amb8513247 [0,2,0,0,0,0|0,0,0]=2 2754 B12R1.21 Cc1ccc(\C=C\C(=O)O)cn1 Amb18645813 [0,2,0,0,0,0|1,0,0]=3 2755 B12R1.21 Cc1ccc(\C=C\C(=O)O)cn1 Amb28555739 [0,2,0,0,0,0|1,0,0]=3 2756 B12R1.21 Cc1ccc(\C=C\C(=O)O)nc1 Amb30584979 [0,2,0,0,0,0|1,0,0]=3 2757 B12R1.21 Cc1ccc(\C=C\C(=O)O)nn1 Amb33470102 [0,2,0,0,0,0|2,0,0]=4 2758 B12R1.21 Cc1ccc(\C=C\C(C)Br)cc1 Amb27854032 [0,2,0,0,0,0|1,0,1]=4 2759 B12R1.21 Cc1ccc(\C=C\C(C)Cl)cc1 Amb27260599 [0,2,0,0,0,0|1,0,1]=4 2760 B12R1.21 Cc1ccc(\C=C\C(C)N)cc1 Amb33359227 [0,2,0,0,0,0|1,0,1]=4 2761 B12R1.21 Cc1ccc(\C=C\C(C)O)cc1 Amb24707156 [0,2,0,0,0,0|0,0,2]=4 2762 B12R1.21 Cc1ccc(\C=C\C(N)=S)cc1 Amb18106294 [0,2,0,0,0,0|0,1,0]=3 2763 B12R1.21 Cc1ccc(\C=C\S(=O)[O-])cc1 Amb32753899 [0,2,0,0,0,0|1,0,0]=3 2764 B12R1.21 Cc1ccc(\C=C\[N+](=O)[O-])cc1 Amb2689571 [0,2,0,0,0,0|1,0,0]=3 2765 B12R1.21 Cc1ccc(\C=C\[N+](=O)[O-])cn1 Amb34916434 [0,2,0,0,0,0|2,0,0]=4 2766 B12R1.21 Cc1ccc(\C=C\[N+](=O)[O-])nc1 Amb25915197 [0,2,0,0,0,0|2,0,0]=4 2767 B12R1.21 Cc1ccc(\C=N\C(=N)N)cc1 Amb26904633 [0,2,0,0,0,0|2,0,0]=4 2768 B12R1.21 Cc1ccc(\C=N\C(N)=O)cc1 Amb28385505 [0,2,0,0,0,0|1,0,0]=3 2769 B12R1.21 Cc1ccc(\C=N\S(C)=O)cc1 Amb29858778 [0,2,0,0,0,0|2,0,0]=4 2770 B12R1.21 Cc1cnc(\C=C\C(=O)O)cn1 Amb33223719 [0,2,0,0,0,0|2,0,0]=4 2771 B12R1.21 Cc1ncc(\C=C\C(=O)O)cn1 Amb12805675 [0,2,0,0,0,0|2,0,0]=4 2772 B12R1.21 N=C(N)\C=C\c1ccc(F)cc1 Amb24567885 [0,2,0,0,0,0|1,0,0]=3 2773 B12R1.21 NC(=O)C#Cc1ccc(Br)cc1 Amb24116419 [0,2,0,0,0,0|0,0,2]=4 2774 B12R1.21 NC(=O)C#Cc1ccc(Cl)cc1 Amb23401544 [0,2,0,0,0,0|0,0,2]=4 2775 B12R1.21 NC(=O)C#Cc1ccc(O)cc1 Amb27469684 [0,2,0,0,0,0|0,0,2]=4 2776 B12R1.21 NC(=O)CCc1ccc(Br)cc1 Amb17407065 [0,2,0,0,0,0|0,0,2]=4 2777 B12R1.21 NC(=O)CCc1ccc(Cl)cc1 Amb17142998 [0,2,0,0,0,0|0,0,2]=4 2778 B12R1.21 NC(=O)CCc1ccc(F)cc1 Amb33545740 [0,2,0,0,0,0|0,0,2]=4 2779 B12R1.21 NC(=O)CCc1ccc(N)cc1 Amb8941624 [0,2,0,0,0,0|0,0,2]=4 2780 B12R1.21 NC(=O)CCc1ccc(O)cc1 Amb3939533 [0,2,0,0,0,0|0,0,2]=4 2781 B12R1.21 NC(=O)CNc1ccc(Br)cc1 Amb6712185 [0,2,0,0,0,0|1,0,1]=4 2782 B12R1.21 NC(=O)CNc1ccc(Cl)cc1 Amb6711941 [0,2,0,0,0,0|1,0,1]=4 2783 B12R1.21 NC(=O)CNc1ccc(F)cc1 Amb6712287 [0,2,0,0,0,0|1,0,1]=4 2784 B12R1.21 NC(=O)CNc1ccc(I)cc1 Amb7758090 [0,2,0,0,0,0|1,0,1]=4 2785 B12R1.21 NC(=O)CNc1ccc(O)cc1 Amb27814221 [0,2,0,0,0,0|1,0,1]=4 2786 B12R1.21 NC(=O)COc1ccc(Br)cc1 Amb6275646 [0,2,0,0,0,0|1,0,1]=4 2787 B12R1.21 NC(=O)COc1ccc(Cl)cc1 Amb2772617 [0,2,0,0,0,0|1,0,1]=4 2788 B12R1.21 NC(=O)COc1ccc(F)cc1 Amb2456996 [0,2,0,0,0,0|1,0,1]=4 2789 B12R1.21 NC(=O)COc1ccc(I)cc1 Amb173371 [0,2,0,0,0,0|1,0,1]=4 2790 B12R1.21 NC(=O)COc1ccc(N)cc1 Amb33536515 [0,2,0,0,0,0|1,0,1]=4 2791 B12R1.21 NC(=O)COc1ccc(O)cc1 Amb8837230 [0,2,0,0,0,0|1,0,1]=4 2792 B12R1.21 NC(=O)CSc1ccc(Br)cc1 Amb1218433 [0,2,0,0,0,0|1,0,1]=4 2793 B12R1.21 NC(=O)CSc1ccc(Cl)cc1 Amb1530887 [0,2,0,0,0,0|1,0,1]=4 2794 B12R1.21 NC(=O)CSc1ccc(F)cc1 Amb1646201 [0,2,0,0,0,0|1,0,1]=4 2795 B12R1.21 NC(=O)CSc1ccc(N)cc1 Amb8930380 [0,2,0,0,0,0|1,0,1]=4 2796 B12R1.21 NC(=O)NCc1ccc(Br)cc1 Amb1139295 [0,2,0,0,0,0|1,0,1]=4 2797 B12R1.21 NC(=O)NCc1ccc(Cl)cc1 Amb2435054 [0,2,0,0,0,0|1,0,1]=4 2798 B12R1.21 NC(=O)NCc1ccc(F)cc1 Amb1128118 [0,2,0,0,0,0|1,0,1]=4 2799 B12R1.21 NC(=O)NCc1ccc(N)cc1 Amb8631169 [0,2,0,0,0,0|1,0,1]=4 2800 B12R1.21 NC(=O)NN=C1C=CC(=O)C=C1 Amb3690631 [0,2,0,0,0,0|2,0,0]=4 2801 B12R1.21 NC(=O)NNc1ccc(F)cc1 Amb9786687 [0,2,0,0,0,0|2,0,0]=4 2802 B12R1.21 NC(=O)OCc1ccc(O)cc1 Amb28243920 [0,2,0,0,0,0|1,0,1]=4 2803 B12R1.21 NC(=O)SCc1ccc(Cl)cc1 Amb27636965 [0,2,0,0,0,0|1,0,1]=4 2804 B12R1.21 NC(=O)\C=C/c1ccc(Cl)cc1 Amb17142990 [0,2,0,0,0,0|0,0,0]=2 2805 B12R1.21 NC(=O)\C=C/c1ccc(F)nc1 Amb28437309 [0,2,0,0,0,0|1,0,0]=3 2806 B12R1.21 NC(=O)\C=C/c1ccc(O)nc1 Amb27640274 [0,2,0,0,0,0|1,0,0]=3 2807 B12R1.21 NC(=O)\C=C/c1cnc(N)nc1 Amb28057708 [0,2,0,0,0,0|2,0,0]=4 2808 B12R1.21 NC(=O)\C=C\c1cc[n+]([O-])cc1 Amb28384346 [0,2,0,0,0,0|1,0,0]=3 2809 B12R1.21 NC(=O)\C=C\c1ccc(Br)cc1 Amb8858355 [0,2,0,0,0,0|0,0,0]=2 2810 B12R1.21 NC(=O)\C=C\c1ccc(Br)nc1 Amb27239372 [0,2,0,0,0,0|1,0,0]=3 2811 B12R1.21 NC(=O)\C=C\c1ccc(Cl)cc1 Amb2720976 [0,2,0,0,0,0|0,0,0]=2 2812 B12R1.21 NC(=O)\C=C\c1ccc(F)cc1 Amb3736713 [0,2,0,0,0,0|0,0,0]=2 2813 B12R1.21 NC(=O)\C=C\c1ccc(I)cc1 Amb24758181 [0,2,0,0,0,0|0,0,0]=2 2814 B12R1.21 NC(=O)\C=C\c1cnc(N)nc1 Amb27843459 [0,2,0,0,0,0|2,0,0]=4 2815 B12R1.21 NC(=O)\N=N\c1ccc(F)cc1 Amb27983758 [0,2,0,0,0,0|2,0,0]=4 2816 B12R1.21 NC(=S)\C=C\c1ccc(Cl)cc1 Amb18108355 [0,2,0,0,0,0|0,1,0]=3 2817 B12R1.21 NC(=S)\C=C\c1ccc(F)cc1 Amb18627061 [0,2,0,0,0,0|0,1,0]=3 2818 B12R1.21 Nc1ccc(C#CC(=O)O)cc1 Amb25111179 [0,2,0,0,0,0|0,0,2]=4 2819 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb30588024 [0,2,0,0,0,0|0,0,2]=4 2820 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb6315800 [0,2,0,0,0,0|0,0,2]=4 2821 B12R1.21 Nc1ccc(NCC(=O)O)cc1 Amb18296058 [0,2,0,0,0,0|1,0,1]=4 2822 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb1034889 [0,2,0,0,0,0|1,0,1]=4 2823 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb2608856 [0,2,0,0,0,0|1,0,1]=4 2824 B12R1.21 Nc1ccc(SCC(=O)O)cc1 Amb2684510 [0,2,0,0,0,0|1,0,1]=4 2825 B12R1.21 Nc1ccc(\C=C/C(=O)O)cn1 Amb28134108 [0,2,0,0,0,0|1,0,0]=3 2826 B12R1.21 Nc1ccc(\C=C\B(O)O)cc1 Amb24642812 [0,2,0,0,0,0|1,0,1]=4 2827 B12R1.21 Nc1ccc(\C=C\C(=O)O)cc1 Amb30584953 [0,2,0,0,0,0|0,0,0]=2 2828 B12R1.21 Nc1ccc(\C=C\C(=O)O)cn1 Amb19958812 [0,2,0,0,0,0|1,0,0]=3 2829 B12R1.21 Nc1ncc(\C=C\C(=O)O)cn1 Amb837214 [0,2,0,0,0,0|2,0,0]=4 2830 B12R1.21 O=C(Cl)CCc1ccc(Br)cc1 Amb28240937 [0,2,0,0,0,0|0,0,2]=4 2831 B12R1.21 O=C(Cl)CCc1ccc(Cl)cc1 Amb17143273 [0,2,0,0,0,0|0,0,2]=4 2832 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [0,2,0,0,0,0|0,0,2]=4 2833 B12R1.21 O=C(Cl)CCc1ccc(I)cc1 Amb27973226 [0,2,0,0,0,0|0,0,2]=4 2834 B12R1.21 O=C(Cl)COc1ccc(Br)cc1 Amb16186415 [0,2,0,0,0,0|1,0,1]=4 2835 B12R1.21 O=C(Cl)COc1ccc(Cl)cc1 Amb2716229 [0,2,0,0,0,0|1,0,1]=4 2836 B12R1.21 O=C(Cl)COc1ccc(F)cc1 Amb844299 [0,2,0,0,0,0|1,0,1]=4 2837 B12R1.21 O=C(Cl)COc1ccc(I)cc1 Amb28131033 [0,2,0,0,0,0|1,0,1]=4 2838 B12R1.21 O=C(Cl)CSc1ccc(Br)cc1 Amb27770810 [0,2,0,0,0,0|1,0,1]=4 2839 B12R1.21 O=C(Cl)CSc1ccc(Cl)cc1 Amb17143821 [0,2,0,0,0,0|1,0,1]=4 2840 B12R1.21 O=C(Cl)CSc1ccc(F)cc1 Amb9174973 [0,2,0,0,0,0|1,0,1]=4 2841 B12R1.21 O=C(Cl)NCc1ccc(Br)cc1 Amb35625815 [0,2,0,0,0,0|1,0,1]=4 2842 B12R1.21 O=C(Cl)NCc1ccc(F)cc1 Amb27178203 [0,2,0,0,0,0|1,0,1]=4 2843 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [0,2,0,0,0,0|1,0,1]=4 2844 B12R1.21 O=C(Cl)OCc1ccc(Cl)cc1 Amb33531980 [0,2,0,0,0,0|1,0,1]=4 2845 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [0,2,0,0,0,0|1,0,1]=4 2846 B12R1.21 O=C(Cl)\C=C\c1ccc(Br)cc1 Amb16230246 [0,2,0,0,0,0|0,0,0]=2 2847 B12R1.21 O=C(Cl)\C=C\c1ccc(Cl)cc1 Amb16186540 [0,2,0,0,0,0|0,0,0]=2 2848 B12R1.21 O=C(Cl)\C=C\c1ccc(F)cc1 Amb2688311 [0,2,0,0,0,0|0,0,0]=2 2849 B12R1.21 O=C(Cl)\C=C\c1ccc(O)cc1 Amb26652435 [0,2,0,0,0,0|0,0,0]=2 2850 B12R1.21 O=C(F)NCc1ccc(Cl)cc1 Amb27876366 [0,2,0,0,0,0|1,0,1]=4 2851 B12R1.21 O=C(O)C#Cc1ccc(Br)cc1 Amb2610347 [0,2,0,0,0,0|0,0,2]=4 2852 B12R1.21 O=C(O)C#Cc1ccc(Cl)cc1 Amb10575987 [0,2,0,0,0,0|0,0,2]=4 2853 B12R1.21 O=C(O)C#Cc1ccc(F)cc1 Amb17138570 [0,2,0,0,0,0|0,0,2]=4 2854 B12R1.21 O=C(O)C#Cc1ccc(O)cc1 Amb23569631 [0,2,0,0,0,0|0,0,2]=4 2855 B12R1.21 O=C(O)CCc1ccc(Br)cc1 Amb1220330 [0,2,0,0,0,0|0,0,2]=4 2856 B12R1.21 O=C(O)CCc1ccc(Cl)cc1 Amb1093991 [0,2,0,0,0,0|0,0,2]=4 2857 B12R1.21 O=C(O)CCc1ccc(F)cc1 Amb1214879 [0,2,0,0,0,0|0,0,2]=4 2858 B12R1.21 O=C(O)CCc1ccc(I)cc1 Amb6297807 [0,2,0,0,0,0|0,0,2]=4 2859 B12R1.21 O=C(O)CCc1ccc(O)cc1 Amb533172 [0,2,0,0,0,0|0,0,2]=4 2860 B12R1.21 O=C(O)CCc1ccc(S)cc1 Amb6296145 [0,2,0,0,0,0|0,0,2]=4 2861 B12R1.21 O=C(O)CNc1ccc(Br)cc1 Amb1981434 [0,2,0,0,0,0|1,0,1]=4 2862 B12R1.21 O=C(O)CNc1ccc(Cl)cc1 Amb1486152 [0,2,0,0,0,0|1,0,1]=4 2863 B12R1.21 O=C(O)CNc1ccc(F)cc1 Amb840523 [0,2,0,0,0,0|1,0,1]=4 2864 B12R1.21 O=C(O)CNc1ccc(I)cc1 Amb4598598 [0,2,0,0,0,0|1,0,1]=4 2865 B12R1.21 O=C(O)CNc1ccc(O)cc1 Amb1950558 [0,2,0,0,0,0|1,0,1]=4 2866 B12R1.21 O=C(O)COc1ccc(Br)cc1 Amb6336449 [0,2,0,0,0,0|1,0,1]=4 2867 B12R1.21 O=C(O)COc1ccc(Cl)cc1 Amb1830178 [0,2,0,0,0,0|1,0,1]=4 2868 B12R1.21 O=C(O)COc1ccc(F)cc1 Amb1210357 [0,2,0,0,0,0|1,0,1]=4 2869 B12R1.21 O=C(O)COc1ccc(I)cc1 Amb1152251 [0,2,0,0,0,0|1,0,1]=4 2870 B12R1.21 O=C(O)COc1ccc(O)cc1 Amb2819510 [0,2,0,0,0,0|1,0,1]=4 2871 B12R1.21 O=C(O)CSc1ccc(Br)cc1 Amb1208368 [0,2,0,0,0,0|1,0,1]=4 2872 B12R1.21 O=C(O)CSc1ccc(Cl)cc1 Amb6335201 [0,2,0,0,0,0|1,0,1]=4 2873 B12R1.21 O=C(O)CSc1ccc(F)cc1 Amb1209262 [0,2,0,0,0,0|1,0,1]=4 2874 B12R1.21 O=C(O)CSc1ccc(O)cc1 Amb18291566 [0,2,0,0,0,0|1,0,1]=4 2875 B12R1.21 O=C(O)\C=C/c1ccc(Cl)cc1 Amb2553273 [0,2,0,0,0,0|0,0,0]=2 2876 B12R1.21 O=C(O)\C=C/c1ccc(F)cc1 Amb24712642 [0,2,0,0,0,0|0,0,0]=2 2877 B12R1.21 O=C(O)\C=C\C1=NNC(=O)C=C1 Amb18212061 [0,2,0,0,0,0|2,0,0]=4 2878 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb33714741 [0,2,0,0,0,0|0,0,0]=2 2879 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb8517406 [0,2,0,0,0,0|0,0,0]=2 2880 B12R1.21 O=C(O)\C=C\c1ccc(Br)cn1 Amb24593980 [0,2,0,0,0,0|1,0,0]=3 2881 B12R1.21 O=C(O)\C=C\c1ccc(Br)nc1 Amb33451134 [0,2,0,0,0,0|1,0,0]=3 2882 B12R1.21 O=C(O)\C=C\c1ccc(Cl)cc1 Amb6608688 [0,2,0,0,0,0|0,0,0]=2 2883 B12R1.21 O=C(O)\C=C\c1ccc(Cl)cn1 Amb26946002 [0,2,0,0,0,0|1,0,0]=3 2884 B12R1.21 O=C(O)\C=C\c1ccc(Cl)nc1 Amb22002669 [0,2,0,0,0,0|1,0,0]=3 2885 B12R1.21 O=C(O)\C=C\c1ccc(F)cc1 Amb6608746 [0,2,0,0,0,0|0,0,0]=2 2886 B12R1.21 O=C(O)\C=C\c1ccc(F)cn1 Amb21962831 [0,2,0,0,0,0|1,0,0]=3 2887 B12R1.21 O=C(O)\C=C\c1ccc(F)cn1 Amb33171971 [0,2,0,0,0,0|1,0,0]=3 2888 B12R1.21 O=C(O)\C=C\c1ccc(F)nc1 Amb32645871 [0,2,0,0,0,0|1,0,0]=3 2889 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb24079623 [0,2,0,0,0,0|0,0,0]=2 2890 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb35826750 [0,2,0,0,0,0|0,0,0]=2 2891 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 Amb1207922 [0,2,0,0,0,0|0,0,0]=2 2892 B12R1.21 O=C(O)\C=C\c1ccc(O)nc1 Amb25111280 [0,2,0,0,0,0|1,0,0]=3 2893 B12R1.21 O=C(O)\C=C\c1ncc(Br)cn1 Amb33470108 [0,2,0,0,0,0|2,0,0]=4 2894 B12R1.21 O=C([O-])CCc1ccc(F)cc1 Amb33513062 [0,2,0,0,0,0|0,0,2]=4 2895 B12R1.21 O=C([O-])COc1ccc(Cl)cc1 Amb8383883 [0,2,0,0,0,0|1,0,1]=4 2896 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb2371026 [0,2,0,0,0,0|1,0,1]=4 2897 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb44363 [0,2,0,0,0,0|1,0,1]=4 2898 B12R1.21 O=C1C=CC(=NCC(=O)O)C=C1 Amb26847942 [0,2,0,0,0,0|1,0,1]=4 2899 B12R1.21 O=N(=O)\C=C\c1ccc(Cl)cc1 Amb20620832 [0,2,0,0,0,0|1,0,0]=3 2900 B12R1.21 O=N(=O)\C=C\c1ccc(O)cc1 Amb2793622 [0,2,0,0,0,0|1,0,0]=3 2901 B12R1.21 O=S(O)\C=C\c1ccc(Br)cc1 Amb32753690 [0,2,0,0,0,0|1,0,0]=3 2902 B12R1.21 O=S([O-])\C=C\c1ccc(Br)cc1 Amb24629048 [0,2,0,0,0,0|1,0,0]=3 2903 B12R1.21 O=S([O-])\C=C\c1ccc(Cl)cc1 Amb32753904 [0,2,0,0,0,0|1,0,0]=3 2904 B12R1.21 O=S([O-])\C=C\c1ccc(F)cc1 Amb25180163 [0,2,0,0,0,0|1,0,0]=3 2905 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Br)cc1 Amb24078358 [0,2,0,0,0,0|1,0,0]=3 2906 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Br)cn1 Amb28456909 [0,2,0,0,0,0|2,0,0]=4 2907 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Br)nc1 Amb33456680 [0,2,0,0,0,0|2,0,0]=4 2908 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)cc1 Amb33715892 [0,2,0,0,0,0|1,0,0]=3 2909 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)cc1 Amb6374141 [0,2,0,0,0,0|1,0,0]=3 2910 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)cn1 Amb33456686 [0,2,0,0,0,0|2,0,0]=4 2911 B12R1.21 O=[N+]([O-])\C=C\c1ccc(Cl)nc1 Amb33456675 [0,2,0,0,0,0|2,0,0]=4 2912 B12R1.21 O=[N+]([O-])\C=C\c1ccc(F)cc1 Amb33513055 [0,2,0,0,0,0|1,0,0]=3 2913 B12R1.21 O=[N+]([O-])\C=C\c1ccc(F)cn1 Amb33317369 [0,2,0,0,0,0|2,0,0]=4 2914 B12R1.21 O=[N+]([O-])\C=C\c1ccc(F)nc1 Amb27962678 [0,2,0,0,0,0|2,0,0]=4 2915 B12R1.21 O=[N+]([O-])\C=C\c1ccc(I)cc1 Amb24641629 [0,2,0,0,0,0|1,0,0]=3 2916 B12R1.21 O=[N+]([O-])\C=C\c1ccc(O)cc1 Amb2459904 [0,2,0,0,0,0|1,0,0]=3 2917 B12R1.21 O=[N+]([O-])\C=C\c1ccc(O)nc1 Amb25064721 [0,2,0,0,0,0|2,0,0]=4 2918 B12R1.21 OB(O)\C=C\c1ccc(Br)cc1 Amb26553688 [0,2,0,0,0,0|1,0,1]=4 2919 B12R1.21 OB(O)\C=C\c1ccc(Cl)cc1 Amb2455790 [0,2,0,0,0,0|1,0,1]=4 2920 B12R1.21 OB(O)\C=C\c1ccc(F)cc1 Amb2455999 [0,2,0,0,0,0|1,0,1]=4 2921 B12R1.49 C=CC(=O)Cc1ccc(F)cc1 Amb2699674 [0,2,0,0,0,0|1,0,1]=4 2922 B12R1.49 C=CC(=O)Cc1ccc(I)cc1 Amb27412684 [0,2,0,0,0,0|1,0,1]=4 2923 B12R1.49 C=CC(=O)Cc1ccc(O)cc1 Amb27164620 [0,2,0,0,0,0|1,0,1]=4 2924 B12R1.49 C=CC(=O)Nc1ccc(Br)cc1 Amb6843658 [0,2,0,0,0,0|2,0,0]=4 2925 B12R1.49 C=CC(=O)Nc1ccc(C)cc1 Amb6843669 [0,2,0,0,0,0|2,0,0]=4 2926 B12R1.49 C=CC(=O)Nc1ccc(Cl)cc1 Amb33532238 [0,2,0,0,0,0|2,0,0]=4 2927 B12R1.49 C=CC(=O)Nc1ccc(F)cc1 Amb6843679 [0,2,0,0,0,0|2,0,0]=4 2928 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,2,0,0,0,0|2,0,0]=4 2929 B12R1.49 C=CC(=O)Oc1ccc(I)cc1 Amb28188352 [0,2,0,0,0,0|2,0,0]=4 2930 B12R1.49 C=CC(=O)Oc1ccc(O)cc1 Amb27668978 [0,2,0,0,0,0|2,0,0]=4 2931 B12R1.49 CC(C=O)Cc1ccc(Br)cc1 Amb25060263 [0,2,0,0,0,0|0,0,2]=4 2932 B12R1.49 CC(C=O)Cc1ccc(Cl)cc1 Amb18648716 [0,2,0,0,0,0|0,0,2]=4 2933 B12R1.49 CC(C=O)Cc1ccc(F)cc1 Amb26011993 [0,2,0,0,0,0|0,0,2]=4 2934 B12R1.49 CC(C=O)Cc1ccc(I)cc1 Amb28187361 [0,2,0,0,0,0|0,0,2]=4 2935 B12R1.49 CC(C=O)Cc1ccc(N)cc1 Amb27398345 [0,2,0,0,0,0|0,0,2]=4 2936 B12R1.49 CC(C=O)Oc1ccc(Br)cc1 Amb30020612 [0,2,0,0,0,0|1,0,1]=4 2937 B12R1.49 CC(C=O)Oc1ccc(Cl)cc1 Amb27619207 [0,2,0,0,0,0|1,0,1]=4 2938 B12R1.49 CC(C=O)Oc1ccc(F)cc1 Amb30020594 [0,2,0,0,0,0|1,0,1]=4 2939 B12R1.49 CC(C=O)Oc1ccc(I)cc1 Amb30020617 [0,2,0,0,0,0|1,0,1]=4 2940 B12R1.49 CC(C=O)Sc1ccc(Br)cc1 Amb30020877 [0,2,0,0,0,0|1,0,1]=4 2941 B12R1.49 CC(C=O)Sc1ccc(Cl)cc1 Amb30020870 [0,2,0,0,0,0|1,0,1]=4 2942 B12R1.49 CC(C=O)Sc1ccc(F)cc1 Amb30020862 [0,2,0,0,0,0|1,0,1]=4 2943 B12R1.49 CN(C=O)Cc1ccc(Br)cc1 Amb28456997 [0,2,0,0,0,0|1,0,1]=4 2944 B12R1.49 C\C(=C/c1ccc(F)cc1)CCl Amb27392272 [0,2,0,0,0,0|1,0,1]=4 2945 B12R1.49 C\C(=C/c1ccc(F)cc1)CN Amb18646339 [0,2,0,0,0,0|1,0,1]=4 2946 B12R1.49 C\C(=C\Cl)Sc1ccc(C)cc1 Amb27216507 [0,2,0,0,0,0|2,0,0]=4 2947 B12R1.49 C\C(=C\c1ccc(Br)cc1)CBr Amb27260624 [0,2,0,0,0,0|1,0,1]=4 2948 B12R1.49 C\C(=C\c1ccc(C)cc1)CBr Amb27801976 [0,2,0,0,0,0|1,0,1]=4 2949 B12R1.49 C\C(=C\c1ccc(F)cc1)CN Amb27950381 [0,2,0,0,0,0|1,0,1]=4 2950 B12R1.49 C\C(=C\c1ccc(O)cc1)CO Amb27490394 [0,2,0,0,0,0|0,0,2]=4 2951 B12R1.49 C\C(C#N)=C\c1ccc(F)cc1 Amb26641810 [0,2,0,0,0,0|1,0,1]=4 2952 B12R1.49 C\C(C#N)=C\c1ccc(O)cc1 Amb28422701 [0,2,0,0,0,0|1,0,1]=4 2953 B12R1.49 C\C(C=O)=C/c1ccc(Br)cc1 Amb17343202 [0,2,0,0,0,0|0,0,0]=2 2954 B12R1.49 C\C(C=O)=C/c1ccc(C)cc1 Amb17334499 [0,2,0,0,0,0|0,0,0]=2 2955 B12R1.49 C\C(C=O)=C/c1ccc(Cl)cc1 Amb17335458 [0,2,0,0,0,0|0,0,0]=2 2956 B12R1.49 C\C(C=O)=C/c1ccc(F)cc1 Amb17334600 [0,2,0,0,0,0|0,0,0]=2 2957 B12R1.49 C\C(C=O)=C/c1ccc(O)cc1 Amb17334556 [0,2,0,0,0,0|0,0,0]=2 2958 B12R1.49 C\C(C=O)=C\c1ccc(Br)cn1 Amb28369368 [0,2,0,0,0,0|1,0,0]=3 2959 B12R1.49 C\C(C=O)=C\c1ccc(C)cn1 Amb27766685 [0,2,0,0,0,0|1,0,0]=3 2960 B12R1.49 C\C(C=O)=C\c1ccc(C)nc1 Amb28043537 [0,2,0,0,0,0|1,0,0]=3 2961 B12R1.49 C\C(C=O)=C\c1ccc(Cl)cc1 Amb27474894 [0,2,0,0,0,0|0,0,0]=2 2962 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,2,0,0,0,0|0,0,2]=4 2963 B12R1.49 Cc1ccc(CC(Cl)C=O)cc1 Amb17204328 [0,2,0,0,0,0|0,0,2]=4 2964 B12R1.49 Cc1ccc(CC(N)=S=O)cc1 Amb28250028 [0,2,0,0,0,0|1,0,1]=4 2965 B12R1.49 Cc1ccc(OC(C)C=O)cc1 Amb27827460 [0,2,0,0,0,0|1,0,1]=4 2966 B12R1.49 Cc1ccc(O\C(F)=C/Cl)cc1 Amb27407024 [0,2,0,0,0,0|2,0,0]=4 2967 B12R1.49 Cc1ccc(O\C(F)=C\Cl)cc1 Amb27865489 [0,2,0,0,0,0|2,0,0]=4 2968 B12R1.49 Cc1ccc(SC(C)C=O)cc1 Amb18648416 [0,2,0,0,0,0|1,0,1]=4 2969 B12R1.49 Cc1ccc(\C=C(/Cl)C=O)cc1 Amb27751333 [0,2,0,0,0,0|0,0,0]=2 2970 B12R1.49 Cc1ccc(\C=C(/F)C=O)cc1 Amb28251072 [0,2,0,0,0,0|0,0,0]=2 2971 B12R1.49 Cc1ccc(\C=C(\F)C=O)cc1 Amb27850071 [0,2,0,0,0,0|0,0,0]=2 2972 B12R1.49 N#C\C(F)=C\c1ccc(Br)cc1 Amb24053596 [0,2,0,0,0,0|1,0,1]=4 2973 B12R1.49 N#C\C(F)=C\c1ccc(Cl)cc1 Amb24053597 [0,2,0,0,0,0|1,0,1]=4 2974 B12R1.49 NC(C=O)Cc1ccc(O)cc1 Amb28208235 [0,2,0,0,0,0|0,0,2]=4 2975 B12R1.49 O=CC(=O)Cc1ccc(Cl)cc1 Amb27873325 [0,2,0,0,0,0|0,0,1]=3 2976 B12R1.49 O=CC(=O)Cc1ccc(F)cc1 Amb28247135 [0,2,0,0,0,0|0,0,1]=3 2977 B12R1.49 O=CC(=O)Nc1ccc(O)cc1 Amb27748423 [0,2,0,0,0,0|1,0,0]=3 2978 B12R1.49 O=CC(=O)Oc1ccc(O)cc1 Amb27769980 [0,2,0,0,0,0|1,0,0]=3 2979 B12R1.49 O=CC(Cl)Cc1ccc(Br)cc1 Amb17204706 [0,2,0,0,0,0|0,0,2]=4 2980 B12R1.49 O=CC(Cl)Cc1ccc(Cl)cc1 Amb17204403 [0,2,0,0,0,0|0,0,2]=4 2981 B12R1.49 O=CC(Cl)Cc1ccc(F)cc1 Amb17204342 [0,2,0,0,0,0|0,0,2]=4 2982 B12R1.49 O=C\C(F)=C\c1ccc(Cl)cc1 Amb28317406 [0,2,0,0,0,0|0,0,0]=2 2983 B12R1.49 O=C\C(I)=C/c1ccc(F)cc1 Amb27449860 [0,2,0,0,0,0|0,0,0]=2 2984 B12R1.49 O=C\C(O)=C\c1ccc(Cl)cc1 Amb18648698 [0,2,0,0,0,0|0,0,0]=2 2985 B12R1.49 O=C\C(O)=C\c1ccc(F)cc1 Amb27769969 [0,2,0,0,0,0|0,0,0]=2 2986 B12R1.69 C\C=C\Cc1ccc(C)cc1O Amb24408311 [0,2,0,0,0,0|1,0,1]=4 2987 B12R1.69 Cc1cc(Br)ccc1CCC=O Amb18070232 [0,2,0,0,0,0|0,0,2]=4 2988 B12R1.69 Cc1cc(Br)ccc1OCC=O Amb17099968 [0,2,0,0,0,0|1,0,1]=4 2989 B12R1.69 Cc1cc(Br)ccc1\C=C\C#N Amb17245312 [0,2,0,0,0,0|1,0,1]=4 2990 B12R1.69 Cc1cc(Br)ccc1\C=C\C=O Amb17246869 [0,2,0,0,0,0|0,0,0]=2 2991 B12R1.69 Cc1cc(Br)ccc1\C=C\CN Amb26883804 [0,2,0,0,0,0|1,0,1]=4 2992 B12R1.69 Cc1cc(Br)ccc1\C=C\CO Amb25160043 [0,2,0,0,0,0|0,0,2]=4 2993 B12R1.69 Cc1cc(Cl)ccc1CCC=O Amb18564228 [0,2,0,0,0,0|0,0,2]=4 2994 B12R1.69 Cc1cc(Cl)ccc1OCC=O Amb19075146 [0,2,0,0,0,0|1,0,1]=4 2995 B12R1.69 Cc1cc(Cl)ccc1\C=C\C#N Amb17233379 [0,2,0,0,0,0|1,0,1]=4 2996 B12R1.69 Cc1cc(Cl)ccc1\C=C\C=O Amb17233766 [0,2,0,0,0,0|0,0,0]=2 2997 B12R1.69 Cc1cc(Cl)ccc1\C=C\CBr Amb27209445 [0,2,0,0,0,0|1,0,1]=4 2998 B12R1.69 Cc1cc(Cl)ccc1\C=C\CN Amb26608515 [0,2,0,0,0,0|1,0,1]=4 2999 B12R1.69 Cc1cc(Cl)ccc1\C=C\CO Amb25324808 [0,2,0,0,0,0|0,0,2]=4 3000 B12R1.69 Cc1cc(F)ccc1CCC=O Amb25691957 [0,2,0,0,0,0|0,0,2]=4 3001 B12R1.69 Cc1cc(F)ccc1SCC=O Amb17082917 [0,2,0,0,0,0|1,0,1]=4 3002 B12R1.69 Cc1cc(F)ccc1\C=C\C=O Amb33172235 [0,2,0,0,0,0|0,0,0]=2 3003 B12R1.69 Cc1cc(F)ccc1\C=C\CN Amb33448878 [0,2,0,0,0,0|1,0,1]=4 3004 B12R1.69 Cc1cc(F)ccc1\C=C\CO Amb33448810 [0,2,0,0,0,0|0,0,2]=4 3005 B12R1.69 Cc1cc(O)ccc1\C=C\C=O Amb27433076 [0,2,0,0,0,0|0,0,0]=2 3006 B12R1.69 Cc1cc(S)ccc1CCC=O Amb28246213 [0,2,0,0,0,0|0,0,2]=4 3007 B12R1.69 Cc1ccc(CCC=O)c(Br)c1 Amb18070227 [0,2,0,0,0,0|0,0,2]=4 3008 B12R1.69 Cc1ccc(CCC=O)c(C)c1 Amb18563553 [0,2,0,0,0,0|0,0,2]=4 3009 B12R1.69 Cc1ccc(CCC=O)c(Cl)c1 Amb24484219 [0,2,0,0,0,0|0,0,2]=4 3010 B12R1.69 Cc1ccc(CCC=O)c(F)c1 Amb25773961 [0,2,0,0,0,0|0,0,2]=4 3011 B12R1.69 Cc1ccc(CCC=O)c(I)c1 Amb24594357 [0,2,0,0,0,0|0,0,2]=4 3012 B12R1.69 Cc1ccc(CCC=O)c(O)c1 Amb25253209 [0,2,0,0,0,0|0,0,2]=4 3013 B12R1.69 Cc1ccc(OCC=O)c(Br)c1 Amb17099967 [0,2,0,0,0,0|1,0,1]=4 3014 B12R1.69 Cc1ccc(OCC=O)c(C)c1 Amb5731828 [0,2,0,0,0,0|1,0,1]=4 3015 B12R1.69 Cc1ccc(OCC=O)c(Cl)c1 Amb19069174 [0,2,0,0,0,0|1,0,1]=4 3016 B12R1.69 Cc1ccc(SCC=O)c(C)c1 Amb17082910 [0,2,0,0,0,0|1,0,1]=4 3017 B12R1.69 Cc1ccc(\C=C/CCl)c(O)c1 Amb27400330 [0,2,0,0,0,0|1,0,1]=4 3018 B12R1.69 Cc1ccc(\C=C\C#N)c(Br)c1 Amb17245311 [0,2,0,0,0,0|1,0,1]=4 3019 B12R1.69 Cc1ccc(\C=C\C#N)c(C)c1 Amb17232210 [0,2,0,0,0,0|1,0,1]=4 3020 B12R1.69 Cc1ccc(\C=C\C#N)c(Cl)c1 Amb35611187 [0,2,0,0,0,0|1,0,1]=4 3021 B12R1.69 Cc1ccc(\C=C\C=O)c(Br)c1 Amb17246868 [0,2,0,0,0,0|0,0,0]=2 3022 B12R1.69 Cc1ccc(\C=C\C=O)c(C)c1 Amb17232316 [0,2,0,0,0,0|0,0,0]=2 3023 B12R1.69 Cc1ccc(\C=C\C=O)c(C)n1 Amb22896948 [0,2,0,0,0,0|1,0,0]=3 3024 B12R1.69 Cc1ccc(\C=C\C=O)c(Cl)c1 Amb35711141 [0,2,0,0,0,0|0,0,0]=2 3025 B12R1.69 Cc1ccc(\C=C\C=O)c(Cl)n1 Amb33260202 [0,2,0,0,0,0|1,0,0]=3 3026 B12R1.69 Cc1ccc(\C=C\C=O)c(F)c1 Amb33171696 [0,2,0,0,0,0|0,0,0]=2 3027 B12R1.69 Cc1ccc(\C=C\C=O)c(O)c1 Amb33426010 [0,2,0,0,0,0|0,0,0]=2 3028 B12R1.69 Cc1ccc(\C=C\CBr)c(Cl)c1 Amb30012825 [0,2,0,0,0,0|1,0,1]=4 3029 B12R1.69 Cc1ccc(\C=C\CCl)c(Cl)c1 Amb30012824 [0,2,0,0,0,0|1,0,1]=4 3030 B12R1.69 Cc1ccc(\C=C\CN)c(Br)c1 Amb27190788 [0,2,0,0,0,0|1,0,1]=4 3031 B12R1.69 Cc1ccc(\C=C\CN)c(C)c1 Amb18563538 [0,2,0,0,0,0|1,0,1]=4 3032 B12R1.69 Cc1ccc(\C=C\CN)c(Cl)c1 Amb29867432 [0,2,0,0,0,0|1,0,1]=4 3033 B12R1.69 Cc1ccc(\C=C\CN)c(F)c1 Amb33324283 [0,2,0,0,0,0|1,0,1]=4 3034 B12R1.69 Cc1ccc(\C=C\CN)c(O)c1 Amb33426009 [0,2,0,0,0,0|1,0,1]=4 3035 B12R1.69 Cc1ccc(\C=C\CO)c(Br)c1 Amb28243139 [0,2,0,0,0,0|0,0,2]=4 3036 B12R1.69 Cc1ccc(\C=C\CO)c(C)c1 Amb27989228 [0,2,0,0,0,0|0,0,2]=4 3037 B12R1.69 Cc1ccc(\C=C\CO)c(Cl)c1 Amb35711132 [0,2,0,0,0,0|0,0,2]=4 3038 B12R1.69 Cc1ccc(\C=C\CO)c(F)c1 Amb33324286 [0,2,0,0,0,0|0,0,2]=4 3039 B12R1.69 Cc1ccc(\C=C\CO)c(O)c1 Amb28422712 [0,2,0,0,0,0|0,0,2]=4 3040 B12R1.69 Clc1cc(Br)ccc1\C=C\CBr Amb27235527 [0,2,0,0,0,0|1,0,1]=4 3041 B12R1.69 Fc1cc(Cl)ccc1\C=C\CCl Amb28193606 [0,2,0,0,0,0|1,0,1]=4 3042 B12R1.69 Fc1ccc(\C=C\CBr)c(Cl)c1 Amb27801457 [0,2,0,0,0,0|1,0,1]=4 3043 B12R1.69 Fc1ccc(\C=C\CBr)c(F)c1 Amb22737942 [0,2,0,0,0,0|1,0,1]=4 3044 B12R1.69 N#C\C=C\c1ccc(Br)cc1Cl Amb27780438 [0,2,0,0,0,0|1,0,1]=4 3045 B12R1.69 N#C\C=C\c1ccc(Br)cc1F Amb24631241 [0,2,0,0,0,0|1,0,1]=4 3046 B12R1.69 N#C\C=C\c1ccc(Cl)cc1Cl Amb2766629 [0,2,0,0,0,0|1,0,1]=4 3047 B12R1.69 N#C\C=C\c1ccc(F)cc1Br Amb27963604 [0,2,0,0,0,0|1,0,1]=4 3048 B12R1.69 N#C\C=C\c1ccc(F)cc1F Amb17232512 [0,2,0,0,0,0|1,0,1]=4 3049 B12R1.69 N#C\C=C\c1ccc(O)cc1F Amb35688534 [0,2,0,0,0,0|1,0,1]=4 3050 B12R1.69 NC1=NC(=O)N(\C=C\C=O)C=C1 Amb26865731 [0,2,0,0,0,0|2,0,0]=4 3051 B12R1.69 NC\C=C\c1ccc(Br)cc1Cl Amb33451165 [0,2,0,0,0,0|1,0,1]=4 3052 B12R1.69 NC\C=C\c1ccc(Br)cc1F Amb33136526 [0,2,0,0,0,0|1,0,1]=4 3053 B12R1.69 NC\C=C\c1ccc(Br)cc1O Amb33389594 [0,2,0,0,0,0|1,0,1]=4 3054 B12R1.69 NC\C=C\c1ccc(Cl)cc1Br Amb33451289 [0,2,0,0,0,0|1,0,1]=4 3055 B12R1.69 NC\C=C\c1ccc(Cl)cc1Cl Amb33136523 [0,2,0,0,0,0|1,0,1]=4 3056 B12R1.69 NC\C=C\c1ccc(Cl)cc1F Amb27164354 [0,2,0,0,0,0|1,0,1]=4 3057 B12R1.69 NC\C=C\c1ccc(Cl)cc1O Amb33263455 [0,2,0,0,0,0|1,0,1]=4 3058 B12R1.69 NC\C=C\c1ccc(F)cc1Br Amb33242770 [0,2,0,0,0,0|1,0,1]=4 3059 B12R1.69 NC\C=C\c1ccc(F)cc1Cl Amb27167325 [0,2,0,0,0,0|1,0,1]=4 3060 B12R1.69 NC\C=C\c1ccc(F)cc1F Amb18563893 [0,2,0,0,0,0|1,0,1]=4 3061 B12R1.69 NC\C=C\c1ccc(O)cc1Cl Amb33223628 [0,2,0,0,0,0|1,0,1]=4 3062 B12R1.69 NC\C=C\c1ccc(O)cc1F Amb33375276 [0,2,0,0,0,0|1,0,1]=4 3063 B12R1.69 NC\C=C\c1ccc(O)cc1O Amb33269717 [0,2,0,0,0,0|1,0,1]=4 3064 B12R1.69 Nc1cc(F)ccc1CCC=O Amb28130009 [0,2,0,0,0,0|0,0,2]=4 3065 B12R1.69 Nc1ccc(CCC=O)c(Br)c1 Amb28196038 [0,2,0,0,0,0|0,0,2]=4 3066 B12R1.69 O=CCCc1ccc(Br)cc1Br Amb25995251 [0,2,0,0,0,0|0,0,2]=4 3067 B12R1.69 O=CCCc1ccc(Br)cc1Cl Amb24455343 [0,2,0,0,0,0|0,0,2]=4 3068 B12R1.69 O=CCCc1ccc(Br)cc1F Amb24078525 [0,2,0,0,0,0|0,0,2]=4 3069 B12R1.69 O=CCCc1ccc(Br)cc1I Amb28398138 [0,2,0,0,0,0|0,0,2]=4 3070 B12R1.69 O=CCCc1ccc(Br)cc1O Amb25883424 [0,2,0,0,0,0|0,0,2]=4 3071 B12R1.69 O=CCCc1ccc(Cl)cc1Br Amb24483728 [0,2,0,0,0,0|0,0,2]=4 3072 B12R1.69 O=CCCc1ccc(Cl)cc1Cl Amb17612588 [0,2,0,0,0,0|0,0,2]=4 3073 B12R1.69 O=CCCc1ccc(Cl)cc1F Amb25149928 [0,2,0,0,0,0|0,0,2]=4 3074 B12R1.69 O=CCCc1ccc(Cl)cc1I Amb26048883 [0,2,0,0,0,0|0,0,2]=4 3075 B12R1.69 O=CCCc1ccc(Cl)cc1O Amb27175625 [0,2,0,0,0,0|0,0,2]=4 3076 B12R1.69 O=CCCc1ccc(F)cc1Br Amb25189497 [0,2,0,0,0,0|0,0,2]=4 3077 B12R1.69 O=CCCc1ccc(F)cc1Cl Amb19070647 [0,2,0,0,0,0|0,0,2]=4 3078 B12R1.69 O=CCCc1ccc(F)cc1F Amb18801723 [0,2,0,0,0,0|0,0,2]=4 3079 B12R1.69 O=CCCc1ccc(F)cc1I Amb25305164 [0,2,0,0,0,0|0,0,2]=4 3080 B12R1.69 O=CCCc1ccc(F)cc1O Amb26517520 [0,2,0,0,0,0|0,0,2]=4 3081 B12R1.69 O=CCCc1ccc(I)cc1Br Amb27461905 [0,2,0,0,0,0|0,0,2]=4 3082 B12R1.69 O=CCCc1ccc(I)cc1Cl Amb27461948 [0,2,0,0,0,0|0,0,2]=4 3083 B12R1.69 O=CCCc1ccc(I)cc1F Amb24728158 [0,2,0,0,0,0|0,0,2]=4 3084 B12R1.69 O=CCCc1ccc(I)cc1O Amb27238630 [0,2,0,0,0,0|0,0,2]=4 3085 B12R1.69 O=CCCc1ccc(I)cc1S Amb27423734 [0,2,0,0,0,0|0,0,2]=4 3086 B12R1.69 O=CCCc1ccc(O)cc1Cl Amb28291426 [0,2,0,0,0,0|0,0,2]=4 3087 B12R1.69 O=CCCc1ccc(O)cc1F Amb26880100 [0,2,0,0,0,0|0,0,2]=4 3088 B12R1.69 O=CCCc1ccc(O)cc1O Amb25993938 [0,2,0,0,0,0|0,0,2]=4 3089 B12R1.69 O=CCCc1ccc(S)cc1F Amb28287544 [0,2,0,0,0,0|0,0,2]=4 3090 B12R1.69 O=CCCc1ccc(S)cc1I Amb27647094 [0,2,0,0,0,0|0,0,2]=4 3091 B12R1.69 O=CCOc1ccc(Br)cc1Cl Amb17099944 [0,2,0,0,0,0|1,0,1]=4 3092 B12R1.69 O=CCOc1ccc(Cl)cc1Cl Amb4035219 [0,2,0,0,0,0|1,0,1]=4 3093 B12R1.69 O=CCOc1ccc(F)cc1Cl Amb18330025 [0,2,0,0,0,0|1,0,1]=4 3094 B12R1.69 O=CCOc1ccc(F)cc1F Amb18807299 [0,2,0,0,0,0|1,0,1]=4 3095 B12R1.69 O=CCSc1ccc(Cl)cc1Cl Amb26845113 [0,2,0,0,0,0|1,0,1]=4 3096 B12R1.69 O=CCSc1ccc(F)cc1F Amb19077117 [0,2,0,0,0,0|1,0,1]=4 3097 B12R1.69 O=CNCc1ccc(Cl)cc1Cl Amb19844259 [0,2,0,0,0,0|1,0,1]=4 3098 B12R1.69 O=C\C=C\c1ccc(Br)cc1Br Amb33382892 [0,2,0,0,0,0|0,0,0]=2 3099 B12R1.69 O=C\C=C\c1ccc(Br)cc1Cl Amb28060546 [0,2,0,0,0,0|0,0,0]=2 3100 B12R1.69 O=C\C=C\c1ccc(Br)cc1F Amb27474247 [0,2,0,0,0,0|0,0,0]=2 3101 B12R1.69 O=C\C=C\c1ccc(Br)cc1O Amb33389591 [0,2,0,0,0,0|0,0,0]=2 3102 B12R1.69 O=C\C=C\c1ccc(Cl)cc1Br Amb33451136 [0,2,0,0,0,0|0,0,0]=2 3103 B12R1.69 O=C\C=C\c1ccc(Cl)cc1Cl Amb9797323 [0,2,0,0,0,0|0,0,0]=2 3104 B12R1.69 O=C\C=C\c1ccc(Cl)cc1F Amb27649460 [0,2,0,0,0,0|0,0,0]=2 3105 B12R1.69 O=C\C=C\c1ccc(Cl)cc1O Amb33263454 [0,2,0,0,0,0|0,0,0]=2 3106 B12R1.69 O=C\C=C\c1ccc(F)cc1Br Amb33451075 [0,2,0,0,0,0|0,0,0]=2 3107 B12R1.69 O=C\C=C\c1ccc(F)cc1Cl Amb25877424 [0,2,0,0,0,0|0,0,0]=2 3108 B12R1.69 O=C\C=C\c1ccc(F)cc1F Amb17232659 [0,2,0,0,0,0|0,0,0]=2 3109 B12R1.69 O=C\C=C\c1ccc(O)cc1Cl Amb25713587 [0,2,0,0,0,0|0,0,0]=2 3110 B12R1.69 O=C\C=C\c1ccc(O)cc1F Amb35688755 [0,2,0,0,0,0|0,0,0]=2 3111 B12R1.69 O=C\C=C\c1ccc(O)cc1O Amb33227102 [0,2,0,0,0,0|0,0,0]=2 3112 B12R1.69 O=C\C=C\c1cnc(Cl)cc1Cl Amb33257276 [0,2,0,0,0,0|1,0,0]=3 3113 B12R1.69 OC\C=C\c1ccc(Br)cc1Cl Amb33240476 [0,2,0,0,0,0|0,0,2]=4 3114 B12R1.69 OC\C=C\c1ccc(Br)cc1F Amb26961555 [0,2,0,0,0,0|0,0,2]=4 3115 B12R1.69 OC\C=C\c1ccc(Br)cc1O Amb33389592 [0,2,0,0,0,0|0,0,2]=4 3116 B12R1.69 OC\C=C\c1ccc(Cl)cc1Br Amb33451394 [0,2,0,0,0,0|0,0,2]=4 3117 B12R1.69 OC\C=C\c1ccc(Cl)cc1Cl Amb22499014 [0,2,0,0,0,0|0,0,2]=4 3118 B12R1.69 OC\C=C\c1ccc(Cl)cc1F Amb25697673 [0,2,0,0,0,0|0,0,2]=4 3119 B12R1.69 OC\C=C\c1ccc(Cl)cc1O Amb33260514 [0,2,0,0,0,0|0,0,2]=4 3120 B12R1.69 OC\C=C\c1ccc(F)cc1Br Amb33242604 [0,2,0,0,0,0|0,0,2]=4 3121 B12R1.69 OC\C=C\c1ccc(F)cc1Cl Amb27390354 [0,2,0,0,0,0|0,0,2]=4 3122 B12R1.69 OC\C=C\c1ccc(F)cc1F Amb23442759 [0,2,0,0,0,0|0,0,2]=4 3123 B12R1.69 OC\C=C\c1ccc(O)cc1Cl Amb33226011 [0,2,0,0,0,0|0,0,2]=4 3124 B12R1.69 OC\C=C\c1ccc(O)cc1F Amb35696348 [0,2,0,0,0,0|0,0,2]=4 3125 B12R1.69 OC\C=C\c1ccc(O)cc1O Amb33269718 [0,2,0,0,0,0|0,0,2]=4 3126 B12R1.71 C#Cc1ccc(CCC=O)cc1 Amb32882245 [0,2,0,0,0,0|0,0,2]=4 3127 B12R1.71 C#Cc1ccc(\C=C\C=O)cc1 Amb33267361 [0,2,0,0,0,0|0,0,0]=2 3128 B12R1.71 C#Cc1ccc(\C=C\CN)cc1 Amb33267359 [0,2,0,0,0,0|1,0,1]=4 3129 B12R1.71 C#Cc1ccc(\C=C\CO)cc1 Amb33267354 [0,2,0,0,0,0|0,0,2]=4 3130 B12R1.71 C=C\C=C/c1ccc(C#N)cc1 Amb22546621 [0,2,0,0,0,0|1,0,0]=3 3131 B12R1.71 C=C\C=C/c1ccc(C=O)cc1 Amb24103176 [0,2,0,0,0,0|1,0,0]=3 3132 B12R1.71 C=C\C=C\c1ccc(OC)cc1 Amb22546592 [0,2,0,0,0,0|1,0,0]=3 3133 B12R1.71 C=Cc1ccc(\C=C\C#N)cc1 Amb25972406 [0,2,0,0,0,0|1,0,1]=4 3134 B12R1.71 C=Cc1ccc(\C=C\CO)cc1 Amb27836019 [0,2,0,0,0,0|0,0,2]=4 3135 B12R1.71 CCc1ccc(CCC=O)cc1 Amb17081676 [0,2,0,0,0,0|0,0,2]=4 3136 B12R1.71 CCc1ccc(CNC=O)cc1 Amb26358462 [0,2,0,0,0,0|1,0,1]=4 3137 B12R1.71 CCc1ccc(OCC=O)cc1 Amb5731831 [0,2,0,0,0,0|1,0,1]=4 3138 B12R1.71 CCc1ccc(SCC=O)cc1 Amb17082912 [0,2,0,0,0,0|1,0,1]=4 3139 B12R1.71 CCc1ccc(\C=C\C#N)cc1 Amb17232215 [0,2,0,0,0,0|1,0,1]=4 3140 B12R1.71 CCc1ccc(\C=C\C=O)cc1 Amb17232321 [0,2,0,0,0,0|0,0,0]=2 3141 B12R1.71 CCc1ccc(\C=C\CN)cc1 Amb18563523 [0,2,0,0,0,0|1,0,1]=4 3142 B12R1.71 CCc1ccc(\C=C\CO)cc1 Amb23442835 [0,2,0,0,0,0|0,0,2]=4 3143 B12R1.71 CO\C=C\c1ccc(C#N)cc1 Amb28201836 [0,2,0,0,0,0|2,0,0]=4 3144 B12R1.71 CO\C=C\c1ccc(C=O)cc1 Amb18645648 [0,2,0,0,0,0|2,0,0]=4 3145 B12R1.71 COc1ccc(C#CC=O)cc1 Amb18116391 [0,2,0,0,0,0|0,0,2]=4 3146 B12R1.71 COc1ccc(CCC=O)cc1 Amb6306199 [0,2,0,0,0,0|0,0,2]=4 3147 B12R1.71 COc1ccc(CNC=O)cc1 Amb19871485 [0,2,0,0,0,0|1,0,1]=4 3148 B12R1.71 COc1ccc(OCC=O)cc1 Amb5731834 [0,2,0,0,0,0|1,0,1]=4 3149 B12R1.71 COc1ccc(SCC=O)cc1 Amb17082908 [0,2,0,0,0,0|1,0,1]=4 3150 B12R1.71 COc1ccc(\C=C/CO)cc1 Amb27668023 [0,2,0,0,0,0|0,0,2]=4 3151 B12R1.71 COc1ccc(\C=C\C#N)cc1 Amb654037 [0,2,0,0,0,0|1,0,1]=4 3152 B12R1.71 COc1ccc(\C=C\C=O)cc1 Amb6296108 [0,2,0,0,0,0|0,0,0]=2 3153 B12R1.71 COc1ccc(\C=C\C=O)cn1 Amb32953972 [0,2,0,0,0,0|1,0,0]=3 3154 B12R1.71 COc1ccc(\C=C\C=O)nc1 Amb33204115 [0,2,0,0,0,0|1,0,0]=3 3155 B12R1.71 COc1ccc(\C=C\CN)cc1 Amb10560866 [0,2,0,0,0,0|1,0,1]=4 3156 B12R1.71 COc1ccc(\C=C\CO)cc1 Amb837391 [0,2,0,0,0,0|0,0,2]=4 3157 B12R1.71 COc1ccc(\C=C\SC)cc1 Amb2636932 [0,2,0,0,0,0|2,0,0]=4 3158 B12R1.71 CSc1ccc(CCC=O)cc1 Amb24093033 [0,2,0,0,0,0|0,0,2]=4 3159 B12R1.71 CSc1ccc(\C=C\C=O)cc1 Amb33136432 [0,2,0,0,0,0|0,0,0]=2 3160 B12R1.71 CSc1ccc(\C=C\CCl)cc1 Amb27390804 [0,2,0,0,0,0|1,0,1]=4 3161 B12R1.71 CSc1ccc(\C=C\CN)cc1 Amb33136532 [0,2,0,0,0,0|1,0,1]=4 3162 B12R1.71 CSc1ccc(\C=C\CO)cc1 Amb33136408 [0,2,0,0,0,0|0,0,2]=4 3163 B12R1.71 C\C=C\Oc1ccc(C=O)cc1 Amb25272957 [0,2,0,0,0,0|2,0,0]=4 3164 B12R1.71 N#C\C=C/c1ccc(C=O)cc1 Amb28202277 [0,2,0,0,0,0|1,0,1]=4 3165 B12R1.71 N#C\C=C\c1ccc(C=O)cc1 Amb18644894 [0,2,0,0,0,0|1,0,1]=4 3166 B12R1.71 N#C\C=C\c1ccc(CBr)cc1 Amb28400705 [0,2,0,0,0,0|1,0,1]=4 3167 B12R1.71 N#C\C=C\c1ccc(CN)cc1 Amb18251545 [0,2,0,0,0,0|1,0,1]=4 3168 B12R1.71 N#Cc1ccc(CCC=O)cc1 Amb24093122 [0,2,0,0,0,0|0,0,2]=4 3169 B12R1.71 N#Cc1ccc(OCC=O)cc1 Amb18800495 [0,2,0,0,0,0|1,0,1]=4 3170 B12R1.71 N#Cc1ccc(\C=C/C=O)cc1 Amb27267322 [0,2,0,0,0,0|0,0,0]=2 3171 B12R1.71 N#Cc1ccc(\C=C\C=O)cc1 Amb32693428 [0,2,0,0,0,0|0,0,0]=2 3172 B12R1.71 N#Cc1ccc(\C=C\CBr)cc1 Amb18658517 [0,2,0,0,0,0|1,0,1]=4 3173 B12R1.71 N#Cc1ccc(\C=C\CN)cc1 Amb26425072 [0,2,0,0,0,0|1,0,1]=4 3174 B12R1.71 N#Cc1ccc(\C=C\CO)cc1 Amb33136409 [0,2,0,0,0,0|0,0,2]=4 3175 B12R1.71 NC\C=C\c1ccc(CO)cc1 Amb26598809 [0,2,0,0,0,0|1,0,1]=4 3176 B12R1.71 O=Cc1ccc(\C=C\CO)cc1 Amb27974046 [0,2,0,0,0,0|0,0,2]=4 3177 B12R1.71 OC\C=C\c1ccc(CO)cc1 Amb28064189 [0,2,0,0,0,0|0,0,2]=4 3178 B12R1.385 Cc1cc(CCC=O)ccc1Br Amb18070236 [0,2,0,0,0,0|0,0,2]=4 3179 B12R1.385 Cc1cc(CCC=O)ccc1Cl Amb28146066 [0,2,0,0,0,0|0,0,2]=4 3180 B12R1.385 Cc1cc(CCC=O)ccc1F Amb25682112 [0,2,0,0,0,0|0,0,2]=4 3181 B12R1.385 Cc1cc(CCC=O)ccc1I Amb24603486 [0,2,0,0,0,0|0,0,2]=4 3182 B12R1.385 Cc1cc(CCC=O)ccc1N Amb27616080 [0,2,0,0,0,0|0,0,2]=4 3183 B12R1.385 Cc1cc(OCC=O)ccc1Br Amb17099969 [0,2,0,0,0,0|1,0,1]=4 3184 B12R1.385 Cc1cc(OCC=O)ccc1Cl Amb5731848 [0,2,0,0,0,0|1,0,1]=4 3185 B12R1.385 Cc1cc(OCC=O)ccc1F Amb27825819 [0,2,0,0,0,0|1,0,1]=4 3186 B12R1.385 Cc1cc(SCC=O)ccc1Cl Amb17082933 [0,2,0,0,0,0|1,0,1]=4 3187 B12R1.385 Cc1cc(SCC=O)ccc1F Amb17082916 [0,2,0,0,0,0|1,0,1]=4 3188 B12R1.385 Cc1cc(\C=C\C#N)ccc1Br Amb17245313 [0,2,0,0,0,0|1,0,1]=4 3189 B12R1.385 Cc1cc(\C=C\C=O)ccc1Br Amb17246870 [0,2,0,0,0,0|0,0,0]=2 3190 B12R1.385 Cc1cc(\C=C\C=O)ccc1F Amb33079202 [0,2,0,0,0,0|0,0,0]=2 3191 B12R1.385 Cc1cc(\C=C\C=O)cnc1Cl Amb33058878 [0,2,0,0,0,0|1,0,0]=3 3192 B12R1.385 Cc1cc(\C=C\CCl)ccc1Br Amb27779534 [0,2,0,0,0,0|1,0,1]=4 3193 B12R1.385 Cc1cc(\C=C\CN)ccc1Br Amb27397361 [0,2,0,0,0,0|1,0,1]=4 3194 B12R1.385 Cc1cc(\C=C\CN)ccc1F Amb18563686 [0,2,0,0,0,0|1,0,1]=4 3195 B12R1.385 Cc1cc(\C=C\CO)ccc1Br Amb25133361 [0,2,0,0,0,0|0,0,2]=4 3196 B12R1.385 Cc1cc(\C=C\CO)ccc1F Amb33449467 [0,2,0,0,0,0|0,0,2]=4 3197 B12R1.385 Cc1ccc(CCC=O)cc1Br Amb18069967 [0,2,0,0,0,0|0,0,2]=4 3198 B12R1.385 Cc1ccc(CCC=O)cc1C Amb18798124 [0,2,0,0,0,0|0,0,2]=4 3199 B12R1.385 Cc1ccc(CCC=O)cc1Cl Amb18564229 [0,2,0,0,0,0|0,0,2]=4 3200 B12R1.385 Cc1ccc(CCC=O)cc1F Amb24093026 [0,2,0,0,0,0|0,0,2]=4 3201 B12R1.385 Cc1ccc(CCC=O)cc1N Amb27962410 [0,2,0,0,0,0|0,0,2]=4 3202 B12R1.385 Cc1ccc(CCC=O)cc1O Amb26625979 [0,2,0,0,0,0|0,0,2]=4 3203 B12R1.385 Cc1ccc(OCC=O)cc1C Amb5731823 [0,2,0,0,0,0|1,0,1]=4 3204 B12R1.385 Cc1ccc(OCC=O)cc1F Amb27465764 [0,2,0,0,0,0|1,0,1]=4 3205 B12R1.385 Cc1ccc(SCC=O)cc1C Amb17082909 [0,2,0,0,0,0|1,0,1]=4 3206 B12R1.385 Cc1ccc(\C=C\C#N)cc1Br Amb17245310 [0,2,0,0,0,0|1,0,1]=4 3207 B12R1.385 Cc1ccc(\C=C\C#N)cc1C Amb17232212 [0,2,0,0,0,0|1,0,1]=4 3208 B12R1.385 Cc1ccc(\C=C\C#N)cc1Cl Amb17233380 [0,2,0,0,0,0|1,0,1]=4 3209 B12R1.385 Cc1ccc(\C=C\C=O)cc1Br Amb17246867 [0,2,0,0,0,0|0,0,0]=2 3210 B12R1.385 Cc1ccc(\C=C\C=O)cc1C Amb17232318 [0,2,0,0,0,0|0,0,0]=2 3211 B12R1.385 Cc1ccc(\C=C\C=O)cc1Cl Amb17233767 [0,2,0,0,0,0|0,0,0]=2 3212 B12R1.385 Cc1ccc(\C=C\C=O)cc1F Amb33136431 [0,2,0,0,0,0|0,0,0]=2 3213 B12R1.385 Cc1ccc(\C=C\C=O)cc1O Amb33310494 [0,2,0,0,0,0|0,0,0]=2 3214 B12R1.385 Cc1ccc(\C=C\CBr)cc1Br Amb27968553 [0,2,0,0,0,0|1,0,1]=4 3215 B12R1.385 Cc1ccc(\C=C\CBr)cc1F Amb27485238 [0,2,0,0,0,0|1,0,1]=4 3216 B12R1.385 Cc1ccc(\C=C\CCl)cc1F Amb27947848 [0,2,0,0,0,0|1,0,1]=4 3217 B12R1.385 Cc1ccc(\C=C\CN)cc1Br Amb24593307 [0,2,0,0,0,0|1,0,1]=4 3218 B12R1.385 Cc1ccc(\C=C\CN)cc1C Amb18563533 [0,2,0,0,0,0|1,0,1]=4 3219 B12R1.385 Cc1ccc(\C=C\CN)cc1Cl Amb27478651 [0,2,0,0,0,0|1,0,1]=4 3220 B12R1.385 Cc1ccc(\C=C\CN)cc1F Amb33136494 [0,2,0,0,0,0|1,0,1]=4 3221 B12R1.385 Cc1ccc(\C=C\CN)cc1O Amb33427949 [0,2,0,0,0,0|1,0,1]=4 3222 B12R1.385 Cc1ccc(\C=C\CO)cc1Br Amb25331292 [0,2,0,0,0,0|0,0,2]=4 3223 B12R1.385 Cc1ccc(\C=C\CO)cc1C Amb27494401 [0,2,0,0,0,0|0,0,2]=4 3224 B12R1.385 Cc1ccc(\C=C\CO)cc1Cl Amb26877487 [0,2,0,0,0,0|0,0,2]=4 3225 B12R1.385 Cc1ccc(\C=C\CO)cc1F Amb28126070 [0,2,0,0,0,0|0,0,2]=4 3226 B12R1.385 Cc1ccc(\C=C\CO)cc1O Amb33310493 [0,2,0,0,0,0|0,0,2]=4 3227 B12R1.385 Clc1ccc(\C=C\CBr)cc1Br Amb27881194 [0,2,0,0,0,0|1,0,1]=4 3228 B12R1.385 Fc1cc(\C=C\CCl)ccc1Cl Amb27619632 [0,2,0,0,0,0|1,0,1]=4 3229 B12R1.385 Fc1ccc(C\C=C\Br)cc1F Amb33135527 [0,2,0,0,0,0|1,0,1]=4 3230 B12R1.385 Fc1ccc(\C=C\CCl)cc1Br Amb27864779 [0,2,0,0,0,0|1,0,1]=4 3231 B12R1.385 N#C\C=C\c1ccc(Br)c(Br)c1 Amb27225670 [0,2,0,0,0,0|1,0,1]=4 3232 B12R1.385 N#C\C=C\c1ccc(Br)c(Cl)c1 Amb27642993 [0,2,0,0,0,0|1,0,1]=4 3233 B12R1.385 N#C\C=C\c1ccc(Cl)c(Cl)c1 Amb17236711 [0,2,0,0,0,0|1,0,1]=4 3234 B12R1.385 N#C\C=C\c1ccc(Cl)c(F)c1 Amb28350574 [0,2,0,0,0,0|1,0,1]=4 3235 B12R1.385 N#C\C=C\c1ccc(F)c(Cl)c1 Amb17233864 [0,2,0,0,0,0|1,0,1]=4 3236 B12R1.385 N#C\C=C\c1ccc(F)c(F)c1 Amb17232513 [0,2,0,0,0,0|1,0,1]=4 3237 B12R1.385 N#C\C=C\c1ccc(O)c(Cl)c1 Amb25205397 [0,2,0,0,0,0|1,0,1]=4 3238 B12R1.385 N#C\C=C\c1ccc(O)c(F)c1 Amb27232603 [0,2,0,0,0,0|1,0,1]=4 3239 B12R1.385 NC\C=C\c1ccc(Br)c(Br)c1 Amb27223544 [0,2,0,0,0,0|1,0,1]=4 3240 B12R1.385 NC\C=C\c1ccc(Br)c(Cl)c1 Amb33241855 [0,2,0,0,0,0|1,0,1]=4 3241 B12R1.385 NC\C=C\c1ccc(Br)c(F)c1 Amb28350572 [0,2,0,0,0,0|1,0,1]=4 3242 B12R1.385 NC\C=C\c1ccc(Cl)c(Br)c1 Amb33430083 [0,2,0,0,0,0|1,0,1]=4 3243 B12R1.385 NC\C=C\c1ccc(Cl)c(Cl)c1 Amb33136504 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.385 NC\C=C\c1ccc(Cl)c(F)c1 Amb28323838 [0,2,0,0,0,0|1,0,1]=4 3245 B12R1.385 NC\C=C\c1ccc(F)c(Br)c1 Amb33136518 [0,2,0,0,0,0|1,0,1]=4 3246 B12R1.385 NC\C=C\c1ccc(F)c(Cl)c1 Amb27178357 [0,2,0,0,0,0|1,0,1]=4 3247 B12R1.385 NC\C=C\c1ccc(F)c(F)c1 Amb18563890 [0,2,0,0,0,0|1,0,1]=4 3248 B12R1.385 NC\C=C\c1ccc(O)c(Br)c1 Amb33389536 [0,2,0,0,0,0|1,0,1]=4 3249 B12R1.385 NC\C=C\c1ccc(O)c(Cl)c1 Amb33256104 [0,2,0,0,0,0|1,0,1]=4 3250 B12R1.385 NC\C=C\c1ccc(O)c(F)c1 Amb33420957 [0,2,0,0,0,0|1,0,1]=4 3251 B12R1.385 NC\C=C\c1ccc(O)c(O)c1 Amb27242615 [0,2,0,0,0,0|1,0,1]=4 3252 B12R1.385 Nc1cc(CCC=O)ccc1F Amb27209902 [0,2,0,0,0,0|0,0,2]=4 3253 B12R1.385 Nc1cc(CCC=O)ccc1S Amb27864232 [0,2,0,0,0,0|0,0,2]=4 3254 B12R1.385 Nc1ccc(CCC=O)cc1Br Amb27847020 [0,2,0,0,0,0|0,0,2]=4 3255 B12R1.385 Nc1ccc(CCC=O)cc1F Amb27798934 [0,2,0,0,0,0|0,0,2]=4 3256 B12R1.385 Nc1ccc(CCC=O)cc1S Amb27792278 [0,2,0,0,0,0|0,0,2]=4 3257 B12R1.385 O=C1C=CC(\C=C\CO)=CC1=O Amb24631190 [0,2,0,0,0,0|0,0,2]=4 3258 B12R1.385 O=CC#Cc1ccc(Cl)c(Cl)c1 Amb18635850 [0,2,0,0,0,0|0,0,2]=4 3259 B12R1.385 O=CC#Cc1ccc(F)c(F)c1 Amb18635747 [0,2,0,0,0,0|0,0,2]=4 3260 B12R1.385 O=CCCc1ccc(Br)c(Br)c1 Amb25301219 [0,2,0,0,0,0|0,0,2]=4 3261 B12R1.385 O=CCCc1ccc(Br)c(Cl)c1 Amb26567218 [0,2,0,0,0,0|0,0,2]=4 3262 B12R1.385 O=CCCc1ccc(Br)c(F)c1 Amb25733243 [0,2,0,0,0,0|0,0,2]=4 3263 B12R1.385 O=CCCc1ccc(Br)c(I)c1 Amb25301482 [0,2,0,0,0,0|0,0,2]=4 3264 B12R1.385 O=CCCc1ccc(Br)c(O)c1 Amb24341987 [0,2,0,0,0,0|0,0,2]=4 3265 B12R1.385 O=CCCc1ccc(Br)c(S)c1 Amb27638357 [0,2,0,0,0,0|0,0,2]=4 3266 B12R1.385 O=CCCc1ccc(Cl)c(Br)c1 Amb24382161 [0,2,0,0,0,0|0,0,2]=4 3267 B12R1.385 O=CCCc1ccc(Cl)c(Cl)c1 Amb24093018 [0,2,0,0,0,0|0,0,2]=4 3268 B12R1.385 O=CCCc1ccc(Cl)c(F)c1 Amb25836345 [0,2,0,0,0,0|0,0,2]=4 3269 B12R1.385 O=CCCc1ccc(Cl)c(I)c1 Amb25690980 [0,2,0,0,0,0|0,0,2]=4 3270 B12R1.385 O=CCCc1ccc(F)c(Br)c1 Amb24093021 [0,2,0,0,0,0|0,0,2]=4 3271 B12R1.385 O=CCCc1ccc(F)c(Cl)c1 Amb18564403 [0,2,0,0,0,0|0,0,2]=4 3272 B12R1.385 O=CCCc1ccc(F)c(F)c1 Amb18563918 [0,2,0,0,0,0|0,0,2]=4 3273 B12R1.385 O=CCCc1ccc(F)c(O)c1 Amb25360910 [0,2,0,0,0,0|0,0,2]=4 3274 B12R1.385 O=CCCc1ccc(F)c(S)c1 Amb27263901 [0,2,0,0,0,0|0,0,2]=4 3275 B12R1.385 O=CCCc1ccc(I)c(Br)c1 Amb27606295 [0,2,0,0,0,0|0,0,2]=4 3276 B12R1.385 O=CCCc1ccc(I)c(Cl)c1 Amb25268272 [0,2,0,0,0,0|0,0,2]=4 3277 B12R1.385 O=CCCc1ccc(I)c(F)c1 Amb26995809 [0,2,0,0,0,0|0,0,2]=4 3278 B12R1.385 O=CCCc1ccc(I)c(I)c1 Amb27208788 [0,2,0,0,0,0|0,0,2]=4 3279 B12R1.385 O=CCCc1ccc(I)c(O)c1 Amb26608948 [0,2,0,0,0,0|0,0,2]=4 3280 B12R1.385 O=CCCc1ccc(O)c(Br)c1 Amb27750842 [0,2,0,0,0,0|0,0,2]=4 3281 B12R1.385 O=CCCc1ccc(O)c(Cl)c1 Amb25150852 [0,2,0,0,0,0|0,0,2]=4 3282 B12R1.385 O=CCCc1ccc(O)c(F)c1 Amb26895467 [0,2,0,0,0,0|0,0,2]=4 3283 B12R1.385 O=CCCc1ccc(O)c(I)c1 Amb24758933 [0,2,0,0,0,0|0,0,2]=4 3284 B12R1.385 O=CCCc1ccc(O)c(O)c1 Amb26948669 [0,2,0,0,0,0|0,0,2]=4 3285 B12R1.385 O=CCOc1ccc(Cl)c(Cl)c1 Amb5731861 [0,2,0,0,0,0|1,0,1]=4 3286 B12R1.385 O=CCOc1ccc(F)c(Cl)c1 Amb18330026 [0,2,0,0,0,0|1,0,1]=4 3287 B12R1.385 O=CCOc1ccc(F)c(F)c1 Amb18807300 [0,2,0,0,0,0|1,0,1]=4 3288 B12R1.385 O=CCOc1ccc(O)c(Cl)c1 Amb27828941 [0,2,0,0,0,0|1,0,1]=4 3289 B12R1.385 O=CCSc1ccc(Cl)c(Cl)c1 Amb17082918 [0,2,0,0,0,0|1,0,1]=4 3290 B12R1.385 O=CCSc1ccc(F)c(F)c1 Amb19077116 [0,2,0,0,0,0|1,0,1]=4 3291 B12R1.385 O=C\C=C\c1ccc(Br)c(Br)c1 Amb27796770 [0,2,0,0,0,0|0,0,0]=2 3292 B12R1.385 O=C\C=C\c1ccc(Br)c(Cl)c1 Amb33451154 [0,2,0,0,0,0|0,0,0]=2 3293 B12R1.385 O=C\C=C\c1ccc(Br)c(F)c1 Amb28347786 [0,2,0,0,0,0|0,0,0]=2 3294 B12R1.385 O=C\C=C\c1ccc(Cl)c(Br)c1 Amb33451400 [0,2,0,0,0,0|0,0,0]=2 3295 B12R1.385 O=C\C=C\c1ccc(Cl)c(Cl)c1 Amb33379054 [0,2,0,0,0,0|0,0,0]=2 3296 B12R1.385 O=C\C=C\c1ccc(Cl)c(F)c1 Amb33136418 [0,2,0,0,0,0|0,0,0]=2 3297 B12R1.385 O=C\C=C\c1ccc(F)c(Br)c1 Amb33136423 [0,2,0,0,0,0|0,0,0]=2 3298 B12R1.385 O=C\C=C\c1ccc(F)c(Cl)c1 Amb17234141 [0,2,0,0,0,0|0,0,0]=2 3299 B12R1.385 O=C\C=C\c1ccc(F)c(F)c1 Amb17232660 [0,2,0,0,0,0|0,0,0]=2 3300 B12R1.385 O=C\C=C\c1ccc(O)c(Br)c1 Amb33388591 [0,2,0,0,0,0|0,0,0]=2 3301 B12R1.385 O=C\C=C\c1ccc(O)c(Cl)c1 Amb33390541 [0,2,0,0,0,0|0,0,0]=2 3302 B12R1.385 O=C\C=C\c1ccc(O)c(F)c1 Amb33450047 [0,2,0,0,0,0|0,0,0]=2 3303 B12R1.385 O=C\C=C\c1ccc(O)c(O)c1 Amb33136429 [0,2,0,0,0,0|0,0,0]=2 3304 B12R1.385 O=C\C=C\c1cnc(Cl)c(Cl)c1 Amb33413969 [0,2,0,0,0,0|1,0,0]=3 3305 B12R1.385 OC\C=C\c1ccc(Br)c(Br)c1 Amb28123256 [0,2,0,0,0,0|0,0,2]=4 3306 B12R1.385 OC\C=C\c1ccc(Br)c(Cl)c1 Amb28387654 [0,2,0,0,0,0|0,0,2]=4 3307 B12R1.385 OC\C=C\c1ccc(Br)c(F)c1 Amb33451817 [0,2,0,0,0,0|0,0,2]=4 3308 B12R1.385 OC\C=C\c1ccc(Cl)c(Br)c1 Amb33451242 [0,2,0,0,0,0|0,0,2]=4 3309 B12R1.385 OC\C=C\c1ccc(Cl)c(Cl)c1 Amb23442815 [0,2,0,0,0,0|0,0,2]=4 3310 B12R1.385 OC\C=C\c1ccc(Cl)c(F)c1 Amb33136402 [0,2,0,0,0,0|0,0,2]=4 3311 B12R1.385 OC\C=C\c1ccc(F)c(Br)c1 Amb27648497 [0,2,0,0,0,0|0,0,2]=4 3312 B12R1.385 OC\C=C\c1ccc(F)c(Cl)c1 Amb27865700 [0,2,0,0,0,0|0,0,2]=4 3313 B12R1.385 OC\C=C\c1ccc(F)c(F)c1 Amb23555608 [0,2,0,0,0,0|0,0,2]=4 3314 B12R1.385 OC\C=C\c1ccc(O)c(Br)c1 Amb33478361 [0,2,0,0,0,0|0,0,2]=4 3315 B12R1.385 OC\C=C\c1ccc(O)c(Cl)c1 Amb33406395 [0,2,0,0,0,0|0,0,2]=4 3316 B12R1.385 OC\C=C\c1ccc(O)c(F)c1 Amb33359297 [0,2,0,0,0,0|0,0,2]=4 3317 B12R1.385 OC\C=C\c1ccc(O)c(O)c1 Amb33136453 [0,2,0,0,0,0|0,0,2]=4 3318 B12R1.385 Oc1ccc(C\C=C\Cl)cc1Cl Amb26361664 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.3 C#C\C(=C\C=O)c1ccccc1 Amb25759544 [0,2,0,0,0,0|0,0,0]=2 3320 B12R1.3 C#C\C(=C\CO)c1ccccc1 Amb27829961 [0,2,0,0,0,0|0,0,2]=4 3321 B12R1.3 C#C\C=C(\CO)c1ccccc1 Amb27662379 [0,2,0,0,0,0|1,0,1]=4 3322 B12R1.3 C=C\C(=C/CCl)c1ccccc1 Amb27865659 [0,2,0,0,0,0|1,0,1]=4 3323 B12R1.3 CC=C=C(CO)c1ccccc1 Amb27978491 [0,2,0,0,0,0|1,0,1]=4 3324 B12R1.3 CCC(NC=O)c1ccccc1 Amb27781012 [0,2,0,0,0,0|1,0,1]=4 3325 B12R1.3 CCC(\C=C\Br)c1ccccc1 Amb33135174 [0,2,0,0,0,0|1,0,1]=4 3326 B12R1.3 CC[C@H](NC=O)c1ccccc1 Amb27643444 [0,2,0,0,0,0|1,0,1]=4 3327 B12R1.3 CC\C=C(/C#N)c1ccccc1 Amb17232217 [0,2,0,0,0,0|1,0,1]=4 3328 B12R1.3 CC\C=C(\C=O)c1ccccc1 Amb10807890 [0,2,0,0,0,0|1,0,1]=4 3329 B12R1.3 CN\C(=C/C=O)c1ccccc1 Amb28458550 [0,2,0,0,0,0|0,0,0]=2 3330 B12R1.3 CN\C(=C\C#N)c1ccccc1 Amb27402560 [0,2,0,0,0,0|1,0,1]=4 3331 B12R1.3 CN\C=C(\C#N)c1ccccc1 Amb27211595 [0,2,0,0,0,0|2,0,0]=4 3332 B12R1.3 CO\C(=C\C=O)c1ccccc1 Amb27237640 [0,2,0,0,0,0|0,0,0]=2 3333 B12R1.3 CO\C=C(/C=O)c1ccccc1 Amb18126326 [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.3 CS\C=C(\CO)c1ccccc1 Amb27831038 [0,2,0,0,0,0|2,0,0]=4 3335 B12R1.3 N#CC(NC=O)c1ccccc1 Amb27216719 [0,2,0,0,0,0|1,0,1]=4 3336 B12R1.3 N#C\C(=C/O[Na])c1ccccc1 Amb19747652 [0,2,0,0,0,0|2,0,0]=4 3337 B12R1.3 N#C\C(=C\CO)c1ccccc1 Amb27197973 [0,2,0,0,0,0|0,0,2]=4 3338 B12R1.3 NC\C(=C\CBr)c1ccccc1 Amb28294157 [0,2,0,0,0,0|1,0,1]=4 3339 B12R1.3 NC\C(=C\CCl)c1ccccc1 Amb27658977 [0,2,0,0,0,0|1,0,1]=4 3340 B12R1.3 O=C\C(=C/NO)c1ccccc1 Amb17777667 [0,2,0,0,0,0|1,0,1]=4 3341 B12R1.3 O\N=C(/C=N/O)c1ccccc1 Amb1085990 [0,2,0,0,0,0|1,0,1]=4 3342 B12R1.3 O\N=C\C(=N\O)c1ccccc1 Amb3445039 [0,2,0,0,0,0|1,0,1]=4 3343 B12R1.3 [C-]#[N+]\C(=C\NC)c1ccccc1 Amb26078141 [0,2,0,0,0,0|2,0,0]=4 3344 B12R1.17 C=C=CC(=O)c1cccc(Cl)c1 Amb27164588 [0,2,0,0,0,0|1,0,1]=4 3345 B12R1.17 C=CCC(=O)c1cccc(Br)c1 Amb17343201 [0,2,0,0,0,0|1,0,1]=4 3346 B12R1.17 C=CCC(=O)c1cccc(C)c1 Amb17334498 [0,2,0,0,0,0|1,0,1]=4 3347 B12R1.17 C=CCC(=O)c1cccc(Cl)c1 Amb17335457 [0,2,0,0,0,0|1,0,1]=4 3348 B12R1.17 C=CCC(=O)c1cccc(F)c1 Amb18788273 [0,2,0,0,0,0|1,0,1]=4 3349 B12R1.17 C=CCC(=O)c1cccc(I)c1 Amb27601489 [0,2,0,0,0,0|1,0,1]=4 3350 B12R1.17 C=CCC(=O)c1cccc(O)c1 Amb17334559 [0,2,0,0,0,0|1,0,1]=4 3351 B12R1.17 CC(NC=O)c1cccc(Br)c1 Amb28396418 [0,2,0,0,0,0|1,0,1]=4 3352 B12R1.17 C[C@@H](NC=O)c1cccc(F)c1 Amb27950150 [0,2,0,0,0,0|1,0,1]=4 3353 B12R1.17 C[C@H](NC=O)c1cccc(Cl)c1 Amb28130598 [0,2,0,0,0,0|1,0,1]=4 3354 B12R1.17 C\C(=C/C=O)c1cccc(Cl)c1 Amb27948581 [0,2,0,0,0,0|0,0,0]=2 3355 B12R1.17 C\C(=C/CN)c1cccc(Br)c1 Amb31098023 [0,2,0,0,0,0|1,0,1]=4 3356 B12R1.17 C\C(=C/CN)c1cccc(C)c1 Amb31099549 [0,2,0,0,0,0|1,0,1]=4 3357 B12R1.17 C\C(=C/CN)c1cccc(F)c1 Amb31099553 [0,2,0,0,0,0|1,0,1]=4 3358 B12R1.17 C\C(=C/CO)c1cccc(Br)c1 Amb27248580 [0,2,0,0,0,0|0,0,2]=4 3359 B12R1.17 C\C(=C/CO)c1cccc(Cl)c1 Amb27628731 [0,2,0,0,0,0|0,0,2]=4 3360 B12R1.17 C\C(=C\C#N)c1cccc(Cl)c1 Amb28124075 [0,2,0,0,0,0|1,0,1]=4 3361 B12R1.17 C\C(=C\C#N)c1cccc(F)c1 Amb28124074 [0,2,0,0,0,0|1,0,1]=4 3362 B12R1.17 C\C(=C\CCl)c1cccc(Cl)c1 Amb27428002 [0,2,0,0,0,0|1,0,1]=4 3363 B12R1.17 C\C=C\C(=O)c1cccc(Cl)c1 Amb27243983 [0,2,0,0,0,0|1,0,0]=3 3364 B12R1.17 Cc1cc(C(=O)CC=O)ccn1 Amb24655807 [0,2,0,0,0,0|1,0,1]=4 3365 B12R1.17 Cc1cc(C(=O)\C=C\Cl)ccn1 Amb35628820 [0,2,0,0,0,0|2,0,0]=4 3366 B12R1.17 Cc1cccc(C(=O)C=[N+]=[N-])c1 Amb25761996 [0,2,0,0,0,0|2,0,0]=4 3367 B12R1.17 Cc1cccc(C(=O)CC=O)c1 Amb18788116 [0,2,0,0,0,0|0,0,1]=3 3368 B12R1.17 Cc1cccc(C(=O)CC=O)n1 Amb27788286 [0,2,0,0,0,0|1,0,1]=4 3369 B12R1.17 Cc1cccc(C(=O)N=C=O)c1 Amb6252639 [0,2,0,0,0,0|1,0,1]=4 3370 B12R1.17 Cc1cccc(C(=O)\C=C\Cl)n1 Amb29880191 [0,2,0,0,0,0|2,0,0]=4 3371 B12R1.17 Cc1cccc(C(=O)\C=C\[O-])c1 Amb28077592 [0,2,0,0,0,0|0,0,1]=3 3372 B12R1.17 Cc1cccc(C(=O)\C=N\O)c1 Amb26975599 [0,2,0,0,0,0|1,0,1]=4 3373 B12R1.17 Cc1cccc(C(=S)N=C=O)c1 Amb28185820 [0,2,0,0,0,0|1,0,1]=4 3374 B12R1.17 Cc1cccc(\C(Br)=C\C=O)c1 Amb27615276 [0,2,0,0,0,0|0,0,0]=2 3375 B12R1.17 Cc1cccc(\C(Cl)=C\C=O)c1 Amb27615418 [0,2,0,0,0,0|0,0,0]=2 3376 B12R1.17 Cc1cncc(C(=O)\C=C\Cl)c1 Amb29880234 [0,2,0,0,0,0|2,0,0]=4 3377 B12R1.17 N#C\C=C(/Cl)c1cccc(F)c1 Amb8845687 [0,2,0,0,0,0|1,0,1]=4 3378 B12R1.17 N#C\C=C(/N)c1cccc(Br)c1 Amb18134102 [0,2,0,0,0,0|1,0,1]=4 3379 B12R1.17 N#C\C=C(\N)c1cccc(Br)c1 Amb28293406 [0,2,0,0,0,0|1,0,1]=4 3380 B12R1.17 N\C=C\C(=O)c1cccc(Cl)c1 Amb27190737 [0,2,0,0,0,0|1,0,0]=3 3381 B12R1.17 O=C(\C=C/[O-])c1cccc(Br)c1 Amb24121221 [0,2,0,0,0,0|0,0,1]=3 3382 B12R1.17 O=C(\C=C\Br)c1cccc(O)c1 Amb33135431 [0,2,0,0,0,0|1,0,0]=3 3383 B12R1.17 O=C(\C=C\Cl)c1cccc(Br)c1 Amb35609465 [0,2,0,0,0,0|1,0,0]=3 3384 B12R1.17 O=C(\C=C\Cl)c1cccc(Cl)c1 Amb35609457 [0,2,0,0,0,0|1,0,0]=3 3385 B12R1.17 O=C(\C=C\Cl)c1cccc(F)c1 Amb35585506 [0,2,0,0,0,0|1,0,0]=3 3386 B12R1.17 O=C(\C=C\Cl)c1cccc(I)c1 Amb35609472 [0,2,0,0,0,0|1,0,0]=3 3387 B12R1.17 O=C(\C=C\Cl)c1cccc(O)c1 Amb35645315 [0,2,0,0,0,0|1,0,0]=3 3388 B12R1.17 O=C(\C=C\Cl)c1cncc(Br)c1 Amb35609477 [0,2,0,0,0,0|2,0,0]=4 3389 B12R1.17 O=C(\C=C\Cl)c1cncc(Cl)c1 Amb35628793 [0,2,0,0,0,0|2,0,0]=4 3390 B12R1.17 O=C(\C=C\Cl)c1cncc(F)c1 Amb35628824 [0,2,0,0,0,0|2,0,0]=4 3391 B12R1.17 O=C(\C=C\[O-])c1cncc(Br)c1 Amb29853964 [0,2,0,0,0,0|1,0,1]=4 3392 B12R1.17 O=C(\C=C\[O-])c1cncc(F)c1 Amb28317248 [0,2,0,0,0,0|1,0,1]=4 3393 B12R1.17 O=C(\C=N/O)c1cccc(O)c1 Amb28070820 [0,2,0,0,0,0|1,0,1]=4 3394 B12R1.17 O=C(\C=N\O)c1cccc(O)c1 Amb25706998 [0,2,0,0,0,0|1,0,1]=4 3395 B12R1.17 O=C=NC(=O)c1cccc(Br)c1 Amb17247241 [0,2,0,0,0,0|1,0,1]=4 3396 B12R1.17 O=C=NC(=O)c1cccc(Cl)c1 Amb6252638 [0,2,0,0,0,0|1,0,1]=4 3397 B12R1.17 O=C=NC(=O)c1cccc(F)c1 Amb6252637 [0,2,0,0,0,0|1,0,1]=4 3398 B12R1.17 O=CCC(=O)c1cccc(Br)c1 Amb9204925 [0,2,0,0,0,0|0,0,1]=3 3399 B12R1.17 O=CCC(=O)c1cccc(Cl)c1 Amb7766342 [0,2,0,0,0,0|0,0,1]=3 3400 B12R1.17 O=CCC(=O)c1cccc(Cl)n1 Amb28314685 [0,2,0,0,0,0|1,0,1]=4 3401 B12R1.17 O=CCC(=O)c1cccc(F)c1 Amb9204905 [0,2,0,0,0,0|0,0,1]=3 3402 B12R1.17 O=CCC(=O)c1cccc(F)n1 Amb25865390 [0,2,0,0,0,0|1,0,1]=4 3403 B12R1.17 O=CCC(=O)c1ccnc(Cl)c1 Amb28189551 [0,2,0,0,0,0|1,0,1]=4 3404 B12R1.17 O=CCC(=O)c1cncc(Br)c1 Amb29853963 [0,2,0,0,0,0|1,0,1]=4 3405 B12R1.17 O=CCC(=O)c1cncc(F)c1 Amb26418654 [0,2,0,0,0,0|1,0,1]=4 3406 B12R1.17 O=CCC(O)c1cccc(I)c1 Amb28066980 [0,2,0,0,0,0|0,0,2]=4 3407 B12R1.17 O=C\C=C(/Cl)c1cccc(Cl)c1 Amb27616831 [0,2,0,0,0,0|0,0,0]=2 3408 B12R1.17 O=C\C=C(/Cl)c1cccc(F)c1 Amb24465529 [0,2,0,0,0,0|0,0,0]=2 3409 B12R1.17 [N-]=[N+]=CC(=O)c1cccc(Br)c1 Amb26883796 [0,2,0,0,0,0|2,0,0]=4 3410 B12R1.17 [N-]=[N+]=CC(=O)c1cccc(F)c1 Amb25320625 [0,2,0,0,0,0|2,0,0]=4 3411 B12R1.30 C#C\C=C\C(=O)c1ccccc1 Amb8389984 [0,2,0,0,0,0|1,0,0]=3 3412 B12R1.30 C=C=CCC(=O)c1ccccc1 Amb27177995 [0,2,0,0,0,0|1,0,1]=4 3413 B12R1.30 C=CC#CC(=O)c1ccccc1 Amb27802550 [0,2,0,0,0,0|1,0,1]=4 3414 B12R1.30 C=CCCC(=O)c1ccccc1 Amb9031540 [0,2,0,0,0,0|1,0,1]=4 3415 B12R1.30 C=CCNC(=N)c1ccccc1 Amb26517100 [0,2,0,0,0,0|1,0,1]=4 3416 B12R1.30 C=CCNC(=O)c1ccccc1 Amb3098985 [0,2,0,0,0,0|1,0,1]=4 3417 B12R1.30 C=CCNC(=S)c1ccccc1 Amb27482551 [0,2,0,0,0,0|1,0,1]=4 3418 B12R1.30 C=CCOC(=O)c1ccccc1 Amb4034453 [0,2,0,0,0,0|1,0,1]=4 3419 B12R1.30 C=C\C=C\C(=O)c1ccccc1 Amb27267134 [0,2,0,0,0,0|1,0,0]=3 3420 B12R1.30 C=C\C=C\N(C)c1ccccc1 Amb27875410 [0,2,0,0,0,0|1,0,0]=3 3421 B12R1.30 CC(CCC=O)c1ccccc1 Amb18645711 [0,2,0,0,0,0|0,0,2]=4 3422 B12R1.30 CC(CNC=O)c1ccccc1 Amb27776616 [0,2,0,0,0,0|0,0,2]=4 3423 B12R1.30 CC(NC=S=O)c1ccccc1 Amb27614786 [0,2,0,0,0,0|1,0,1]=4 3424 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb33042868 [0,2,0,0,0,0|0,0,0]=2 3425 B12R1.30 CC(\C=C\CBr)c1ccccc1 Amb27495265 [0,2,0,0,0,0|1,0,1]=4 3426 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,2,0,0,0,0|1,0,1]=4 3427 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb33042866 [0,2,0,0,0,0|1,0,1]=4 3428 B12R1.30 CC(\C=C\CO)c1ccccc1 Amb33042867 [0,2,0,0,0,0|0,0,2]=4 3429 B12R1.30 CC=C=CC(=O)c1ccccc1 Amb28144211 [0,2,0,0,0,0|1,0,0]=3 3430 B12R1.30 CCC\C=C(\N)c1ccccc1 Amb27965051 [0,2,0,0,0,0|1,0,1]=4 3431 B12R1.30 CCN\C=C(/N)c1ccccc1 Amb27668811 [0,2,0,0,0,0|1,0,1]=4 3432 B12R1.30 CC\C=C\C(N)c1ccccc1 Amb27790820 [0,2,0,0,0,0|1,0,1]=4 3433 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,2,0,0,0,0|1,0,1]=4 3434 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [0,2,0,0,0,0|1,0,1]=4 3435 B12R1.30 CN(C#CC=O)c1ccccc1 Amb27830078 [0,2,0,0,0,0|0,0,2]=4 3436 B12R1.30 CN(C\C=C\Cl)c1ccccc1 Amb27409057 [0,2,0,0,0,0|1,0,1]=4 3437 B12R1.30 CN(\C=C/C=O)c1ccccc1 Amb27848292 [0,2,0,0,0,0|0,0,0]=2 3438 B12R1.30 CN(\C=C\C=O)c1ccccc1 Amb34006653 [0,2,0,0,0,0|0,0,0]=2 3439 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [0,2,0,0,0,0|1,0,1]=4 3440 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [0,2,0,0,0,0|1,0,1]=4 3441 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,2,0,0,0,0|1,0,0]=3 3442 B12R1.30 CN\C=C\C(=S)c1ccccc1 Amb27462236 [0,2,0,0,0,0|1,0,0]=3 3443 B12R1.30 CS\C=C\C(=O)c1ccccc1 Amb27973048 [0,2,0,0,0,0|0,1,0]=3 3444 B12R1.30 C\C(=C/CCBr)c1ccccc1 Amb17246875 [0,2,0,0,0,0|1,0,1]=4 3445 B12R1.30 C\C(=C/CCCl)c1ccccc1 Amb17233775 [0,2,0,0,0,0|1,0,1]=4 3446 B12R1.30 C\C(=C/CCN)c1ccccc1 Amb17232384 [0,2,0,0,0,0|1,0,1]=4 3447 B12R1.30 C\C(=C/CCO)c1ccccc1 Amb28421884 [0,2,0,0,0,0|0,0,2]=4 3448 B12R1.30 C\C(=C\CC=O)c1ccccc1 Amb24757521 [0,2,0,0,0,0|0,0,0]=2 3449 B12R1.30 C\C(=C\CCN)c1ccccc1 Amb27453270 [0,2,0,0,0,0|1,0,1]=4 3450 B12R1.30 C\C(=C\CCO)c1ccccc1 Amb27840638 [0,2,0,0,0,0|0,0,2]=4 3451 B12R1.30 C\C(=C\CNN)c1ccccc1 Amb28429635 [0,2,0,0,0,0|1,0,1]=4 3452 B12R1.30 C\C(=C\NC=O)c1ccccc1 Amb27848948 [0,2,0,0,0,0|0,0,0]=2 3453 B12R1.30 C\C=C/CC(N)c1ccccc1 Amb28140782 [0,2,0,0,0,0|1,0,1]=4 3454 B12R1.30 C\C=C\CC(C)c1ccccc1 Amb26891020 [0,2,0,0,0,0|1,0,1]=4 3455 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,2,0,0,0,0|1,0,1]=4 3456 B12R1.30 C\C=C\CS(=O)c1ccccc1 Amb28365911 [0,2,0,0,0,0|1,0,1]=4 3457 B12R1.30 C\C=C\C[C@H](O)c1ccccc1 Amb28241948 [0,2,0,0,0,0|1,0,1]=4 3458 B12R1.30 C\C=C\NC(=O)c1ccccc1 Amb27800283 [0,2,0,0,0,0|1,0,0]=3 3459 B12R1.30 C\C=C\NC(C)c1ccccc1 Amb27791879 [0,2,0,0,0,0|1,0,1]=4 3460 B12R1.30 C\C=N/NC(=O)c1ccccc1 Amb24072878 [0,2,0,0,0,0|2,0,0]=4 3461 B12R1.30 C\C=N\N=C(/N)c1ccccc1 Amb27476220 [0,2,0,0,0,0|2,0,0]=4 3462 B12R1.30 C\C=N\NC(=O)c1ccccc1 Amb4431611 [0,2,0,0,0,0|2,0,0]=4 3463 B12R1.30 N=CNNC(=O)c1ccccc1 Amb27179869 [0,2,0,0,0,0|2,0,0]=4 3464 B12R1.30 NC\C=C\C(O)c1ccccc1 Amb26551917 [0,2,0,0,0,0|1,0,1]=4 3465 B12R1.30 N\C(=N\NC=O)c1ccccc1 Amb27796251 [0,2,0,0,0,0|1,0,0]=3 3466 B12R1.30 O=C(O\C=C\Cl)c1ccccc1 Amb26397046 [0,2,0,0,0,0|1,0,0]=3 3467 B12R1.30 O=C(O\N=C/Cl)c1ccccc1 Amb27858713 [0,2,0,0,0,0|2,0,0]=4 3468 B12R1.30 O=C(\C=C\CCl)c1ccccc1 Amb27983598 [0,2,0,0,0,0|1,0,0]=3 3469 B12R1.30 O=C(\C=C\O[Na])c1ccccc1 Amb2370899 [0,2,0,0,0,0|0,0,1]=3 3470 B12R1.30 O=CC#CC(O)c1ccccc1 Amb27268389 [0,2,0,0,0,0|0,0,2]=4 3471 B12R1.30 O=CCCC(=O)c1cccnc1 Amb17618984 [0,2,0,0,0,0|1,0,1]=4 3472 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,2,0,0,0,0|0,0,1]=3 3473 B12R1.30 O=CCNC(=O)c1cccnc1 Amb17102107 [0,2,0,0,0,0|1,0,1]=4 3474 B12R1.30 O=CNCC(=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|0,0,1]=3 3475 B12R1.30 O=CNCC(O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|0,0,2]=4 3476 B12R1.30 O=CNNC(=O)c1ccccc1 Amb27406610 [0,2,0,0,0,0|1,0,0]=3 3477 B12R1.30 O=C\C=C\C(O)c1ccccc1 Amb18645664 [0,2,0,0,0,0|0,0,0]=2 3478 B12R1.30 O=C\C=C\[C@@H](O)c1ccccc1 Amb28239465 [0,2,0,0,0,0|0,0,0]=2 3479 B12R1.30 OC(C\C=C\Cl)c1ccccc1 Amb27419899 [0,2,0,0,0,0|1,0,1]=4 3480 B12R1.30 OC(C\C=C\F)c1ccccc1 Amb27766637 [0,2,0,0,0,0|1,0,1]=4 3481 B12R1.30 OC\C=C/C(O)c1ccccc1 Amb30621777 [0,2,0,0,0,0|0,0,2]=4 3482 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|0,0,2]=4 3483 B12R1.30 OC\C=C\[C@H](O)c1ccccc1 Amb28244279 [0,2,0,0,0,0|0,0,2]=4 3484 B12R1.34 C=C(C(=O)CC)c1ccccc1 Amb27177863 [0,2,0,0,0,0|1,0,1]=4 3485 B12R1.34 C=C(C(=O)CO)c1ccccc1 Amb27175970 [0,2,0,0,0,0|0,0,2]=4 3486 B12R1.34 C=C(C(=O)OC)c1ccccc1 Amb8392364 [0,2,0,0,0,0|2,0,0]=4 3487 B12R1.34 C=C(C=O)C(C)c1ccccc1 Amb8392634 [0,2,0,0,0,0|0,0,1]=3 3488 B12R1.34 C=C(CO)C(=C)c1ccccc1 Amb27432138 [0,2,0,0,0,0|0,0,2]=4 3489 B12R1.34 C=C(OC)C(=O)c1ccccc1 Amb17594034 [0,2,0,0,0,0|2,0,0]=4 3490 B12R1.34 C=CC(=C)[C@H](O)c1ccccc1 Amb28138679 [0,2,0,0,0,0|1,0,1]=4 3491 B12R1.34 C=CC(=O)C(C)c1ccccc1 Amb24537754 [0,2,0,0,0,0|1,0,1]=4 3492 B12R1.34 C=CC(=O)N(C)c1ccccc1 Amb9480405 [0,2,0,0,0,0|2,0,0]=4 3493 B12R1.34 C=CC(C)C(=O)c1ccccc1 Amb27749794 [0,2,0,0,0,0|1,0,1]=4 3494 B12R1.34 C=CC(Cl)C(=O)c1ccccc1 Amb27841407 [0,2,0,0,0,0|1,0,1]=4 3495 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,2,0,0,0,0|0,0,1]=3 3496 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [0,2,0,0,0,0|0,0,2]=4 3497 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [0,2,0,0,0,0|0,0,2]=4 3498 B12R1.34 CC(C=O)S(=O)c1ccccc1 Amb27224791 [0,2,0,0,0,0|1,0,1]=4 3499 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [0,2,0,0,0,0|0,0,2]=4 3500 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [0,2,0,0,0,0|0,0,2]=4 3501 B12R1.34 CC(c1ccccc1)N(O)C=O Amb10606548 [0,2,0,0,0,0|1,0,1]=4 3502 B12R1.34 CCC(=N)C(=O)c1ccccc1 Amb27590280 [0,2,0,0,0,0|1,0,1]=4 3503 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,2,0,0,0,0|1,0,1]=4 3504 B12R1.34 CN(C(=O)C=O)c1ccccc1 Amb28287730 [0,2,0,0,0,0|1,0,0]=3 3505 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,2,0,0,0,0|2,0,0]=4 3506 B12R1.34 COC(=O)C(=O)c1ccccc1 Amb6296065 [0,2,0,0,0,0|2,0,0]=4 3507 B12R1.34 C[C@H](C=O)N(O)c1ccccc1 Amb27780818 [0,2,0,0,0,0|1,0,1]=4 3508 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [0,2,0,0,0,0|0,0,2]=4 3509 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [0,2,0,0,0,0|0,0,2]=4 3510 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [0,2,0,0,0,0|0,0,2]=4 3511 B12R1.34 C\C(=C(\F)C=O)c1ccccc1 Amb24757282 [0,2,0,0,0,0|0,0,0]=2 3512 B12R1.34 C\C(=C(\N)C#N)c1ccccc1 Amb28385624 [0,2,0,0,0,0|1,0,1]=4 3513 B12R1.34 C\C(=C(\O)C=O)c1ccccc1 Amb27797353 [0,2,0,0,0,0|0,0,0]=2 3514 B12R1.34 C\C(=C/Cl)C(=O)c1ccccc1 Amb28290358 [0,2,0,0,0,0|1,0,0]=3 3515 B12R1.34 C\C(=C/O)C(=O)c1ccccc1 Amb28386635 [0,2,0,0,0,0|0,0,1]=3 3516 B12R1.34 C\C(=C\F)C(=O)c1ccccc1 Amb27854298 [0,2,0,0,0,0|1,0,0]=3 3517 B12R1.34 C\C(=C\N)C(=O)c1ccccc1 Amb2386654 [0,2,0,0,0,0|1,0,0]=3 3518 B12R1.34 C\C(=N/O)C(=O)c1ccccc1 Amb2720251 [0,2,0,0,0,0|1,0,1]=4 3519 B12R1.34 C\C(=N\N)C(=O)c1ccccc1 Amb24745786 [0,2,0,0,0,0|2,0,0]=4 3520 B12R1.34 C\C(C#N)=C(\Br)c1ccccc1 Amb4016262 [0,2,0,0,0,0|1,0,1]=4 3521 B12R1.34 C\C(C#N)=C(\N)c1ccccc1 Amb2602491 [0,2,0,0,0,0|1,0,1]=4 3522 B12R1.34 C\C(C=O)=C(\Cl)c1ccccc1 Amb18648444 [0,2,0,0,0,0|0,0,0]=2 3523 B12R1.34 C\C(C=O)=C(\S)c1ccccc1 Amb18648152 [0,2,0,0,0,0|0,0,0]=2 3524 B12R1.34 C\C=C(/F)C(=O)c1ccccc1 Amb27176127 [0,2,0,0,0,0|1,0,0]=3 3525 B12R1.34 C\C=C(\Br)C(=O)c1ccccc1 Amb27776890 [0,2,0,0,0,0|1,0,0]=3 3526 B12R1.34 C\C=C(\C)C(=O)c1ccccc1 Amb25730208 [0,2,0,0,0,0|1,0,0]=3 3527 B12R1.34 C\C=C(\C)C(O)c1ccccc1 Amb27764784 [0,2,0,0,0,0|1,0,1]=4 3528 B12R1.34 C\C=C(\Cl)N(C)c1ccccc1 Amb27619788 [0,2,0,0,0,0|2,0,0]=4 3529 B12R1.34 N#CC(=O)C(=O)c1ccccc1 Amb27433531 [0,2,0,0,0,0|1,0,1]=4 3530 B12R1.34 NC(=S=O)C(=O)c1ccccc1 Amb27483110 [0,2,0,0,0,0|1,0,0]=3 3531 B12R1.34 O=C(CBr)C(=O)c1ccccc1 Amb17406921 [0,2,0,0,0,0|1,0,1]=4 3532 B12R1.34 O=C(CO)C(=O)c1ccccc1 Amb27178026 [0,2,0,0,0,0|0,0,2]=4 3533 B12R1.34 O=C(\C(Cl)=C/Cl)c1ccccc1 Amb26558724 [0,2,0,0,0,0|1,0,0]=3 3534 B12R1.34 O=C(\C(Cl)=C\Cl)c1ccccc1 Amb27402575 [0,2,0,0,0,0|1,0,0]=3 3535 B12R1.34 O=CC(Cl)C(=O)c1ccccc1 Amb28364135 [0,2,0,0,0,0|0,0,1]=3 3536 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [0,2,0,0,0,0|0,0,2]=4 3537 B12R1.34 O=CC(F)C(=O)c1ccccc1 Amb26485248 [0,2,0,0,0,0|0,0,1]=3 3538 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [0,2,0,0,0,0|0,0,2]=4 3539 B12R1.34 OC\C(F)=C(\F)c1ccccc1 Amb27426618 [0,2,0,0,0,0|0,0,2]=4 3540 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|0,0,2]=4 3541 B12R1.39 CC(C)(NC=O)c1ccccc1 Amb27875118 [0,2,0,0,0,0|1,0,1]=4 3542 B12R1.39 CC(C)(\C=C\Cl)c1ccccc1 Amb27444624 [0,2,0,0,0,0|1,0,1]=4 3543 B12R1.39 CC(N)(\C=C\Cl)c1ccccc1 Amb28396503 [0,2,0,0,0,0|1,0,1]=4 3544 B12R1.39 CP(C)(=CC=O)c1ccccc1 Amb27614688 [0,2,0,0,0,0|1,0,0]=3 3545 B12R1.39 C[C@](O)(CC=O)c1ccccc1 Amb27855035 [0,2,0,0,0,0|0,0,2]=4 3546 B12R1.39 C\C=C\S(=O)(=O)c1ccccc1 Amb24484200 [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.39 N\C=C\S(=O)(=O)c1ccccc1 Amb25719150 [0,2,0,0,0,0|2,0,0]=4 3548 B12R1.39 O=CCC(F)(F)c1ccccc1 Amb26558709 [0,2,0,0,0,0|0,0,2]=4 3549 B12R1.39 O=CNS(=O)(=O)c1ccccc1 Amb27445435 [0,2,0,0,0,0|2,0,0]=4 3550 B12R1.39 [BH3-][P@+](C)(CC=O)c1ccccc1 Amb27260522 [0,2,0,0,0,0|1,0,1]=4 3551 B12R1.39 [BH3-][P@@+](C)(CC=O)c1ccccc1 Amb27972984 [0,2,0,0,0,0|1,0,1]=4 3552 B12R1.107 C=C(C)CC(=O)c1ccccc1 Amb18563490 [0,2,0,0,0,0|1,0,1]=4 3553 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [0,2,0,0,0,0|0,0,1]=3 3554 B12R1.107 C=C(NC(C)=O)c1ccccc1 Amb8394362 [0,2,0,0,0,0|1,0,0]=3 3555 B12R1.107 C=C(NC(C)=O)c1ccccn1 Amb28243818 [0,2,0,0,0,0|2,0,0]=4 3556 B12R1.107 CC(=N)CC(=O)c1ccccc1 Amb4354188 [0,2,0,0,0,0|1,0,1]=4 3557 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [0,2,0,0,0,0|0,0,1]=3 3558 B12R1.107 CC(=O)CC(=O)c1ccccn1 Amb9204928 [0,2,0,0,0,0|1,0,1]=4 3559 B12R1.107 CC(=O)CC(=O)c1cccnc1 Amb33528506 [0,2,0,0,0,0|1,0,1]=4 3560 B12R1.107 CC(=O)CC(=O)c1ccncc1 Amb9204940 [0,2,0,0,0,0|1,0,1]=4 3561 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [0,2,0,0,0,0|0,0,2]=4 3562 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [0,2,0,0,0,0|0,0,2]=4 3563 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [0,2,0,0,0,0|0,0,2]=4 3564 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [0,2,0,0,0,0|0,0,2]=4 3565 B12R1.107 CC(=O)NC(C)c1ccccc1 Amb6390965 [0,2,0,0,0,0|1,0,1]=4 3566 B12R1.107 CC(=O)NN(C)c1ccccc1 Amb6400375 [0,2,0,0,0,0|2,0,0]=4 3567 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 Amb8516282 [0,2,0,0,0,0|1,0,1]=4 3568 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 Amb2742666 [0,2,0,0,0,0|1,0,1]=4 3569 B12R1.107 CC(=O)OC(C)c1ccccc1 Amb4037062 [0,2,0,0,0,0|1,0,1]=4 3570 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [0,2,0,0,0,0|1,0,1]=4 3571 B12R1.107 CC(=O)\C=C(/N)c1ccncc1 Amb27616615 [0,2,0,0,0,0|1,0,0]=3 3572 B12R1.107 CC(=O)\C=C(/O)c1ccccn1 Amb24309430 [0,2,0,0,0,0|1,0,0]=3 3573 B12R1.107 CC(=O)\C=C(\C)c1ccncn1 Amb27803171 [0,2,0,0,0,0|2,0,0]=4 3574 B12R1.107 CC(=O)\C=C(\C)c1cnccn1 Amb28124096 [0,2,0,0,0,0|2,0,0]=4 3575 B12R1.107 CC(=O)\C=C(\N)c1cccnc1 Amb27875125 [0,2,0,0,0,0|1,0,0]=3 3576 B12R1.107 CC(=O)\C=C(\S)c1ccccc1 Amb27428395 [0,2,0,0,0,0|0,0,0]=2 3577 B12R1.107 CC(=O)\N=C(\N)c1ccccc1 Amb25150972 [0,2,0,0,0,0|1,0,0]=3 3578 B12R1.107 CC(C)=CC(=O)c1ccccc1 Amb10874044 [0,2,0,0,0,0|1,0,0]=3 3579 B12R1.107 CC(C)=C[C@@H](O)c1ccccc1 Amb27432272 [0,2,0,0,0,0|1,0,1]=4 3580 B12R1.107 CC(CC(=O)Cl)c1ccccc1 Amb2690275 [0,2,0,0,0,0|0,0,2]=4 3581 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [0,2,0,0,0,0|0,0,2]=4 3582 B12R1.107 CC(CC(N)=O)c1ccccc1 Amb3886650 [0,2,0,0,0,0|0,0,2]=4 3583 B12R1.107 CC(NC(N)=O)c1ccccc1 Amb1135151 [0,2,0,0,0,0|1,0,1]=4 3584 B12R1.107 CC(O)\C=C(\Cl)c1ccccc1 Amb27451951 [0,2,0,0,0,0|0,0,2]=4 3585 B12R1.107 CC(OC(=O)Cl)c1ccccc1 Amb27181225 [0,2,0,0,0,0|1,0,1]=4 3586 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [0,2,0,0,0,0|2,0,0]=4 3587 B12R1.107 CN(CC(=O)Cl)c1ccccc1 Amb17142999 [0,2,0,0,0,0|1,0,1]=4 3588 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [0,2,0,0,0,0|1,0,1]=4 3589 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [0,2,0,0,0,0|1,0,1]=4 3590 B12R1.107 CN(CC(N)=O)c1ccccc1 Amb8342086 [0,2,0,0,0,0|1,0,1]=4 3591 B12R1.107 CN(NC(N)=O)c1ccccc1 Amb26620313 [0,2,0,0,0,0|2,0,0]=4 3592 B12R1.107 C[C@@H](CC(=O)Cl)c1ccccc1 Amb28139675 [0,2,0,0,0,0|0,0,2]=4 3593 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [0,2,0,0,0,0|0,0,2]=4 3594 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,2,0,0,0,0|1,0,1]=4 3595 B12R1.107 C[C@@H](OC(=O)Cl)c1ccccc1 Amb33297316 [0,2,0,0,0,0|1,0,1]=4 3596 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [0,2,0,0,0,0|0,0,2]=4 3597 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,2,0,0,0,0|1,0,1]=4 3598 B12R1.107 C[C@H](OC(=O)Cl)c1ccccc1 Amb33297317 [0,2,0,0,0,0|1,0,1]=4 3599 B12R1.107 C\C(=C/B(O)O)c1ccccc1 Amb27389405 [0,2,0,0,0,0|1,0,1]=4 3600 B12R1.107 C\C(=C/C(=O)O)c1ccccc1 Amb6749182 [0,2,0,0,0,0|0,0,0]=2 3601 B12R1.107 C\C(=C/C(=O)O)c1cccnc1 Amb26839028 [0,2,0,0,0,0|1,0,0]=3 3602 B12R1.107 C\C(=C/C(=O)O)c1ccncc1 Amb34203576 [0,2,0,0,0,0|1,0,0]=3 3603 B12R1.107 C\C(=C/C(=O)O)c1cnccn1 Amb33292425 [0,2,0,0,0,0|2,0,0]=4 3604 B12R1.107 C\C(=C/C(N)=O)c1ccccc1 Amb24648875 [0,2,0,0,0,0|0,0,0]=2 3605 B12R1.107 C\C(=C\C(=O)O)c1ccccn1 Amb24393080 [0,2,0,0,0,0|1,0,0]=3 3606 B12R1.107 C\C(=C\C(=O)O)c1cccnc1 Amb20626498 [0,2,0,0,0,0|1,0,0]=3 3607 B12R1.107 C\C(=C\C(=O)O)c1ccncc1 Amb20626499 [0,2,0,0,0,0|1,0,0]=3 3608 B12R1.107 C\C(=C\C(=O)O)c1cnccn1 Amb27825968 [0,2,0,0,0,0|2,0,0]=4 3609 B12R1.107 C\C(=C\C(C)C)c1ccccc1 Amb4018527 [0,2,0,0,0,0|1,0,1]=4 3610 B12R1.107 C\C(=C\[C@H](C)O)c1ccccc1 Amb27650888 [0,2,0,0,0,0|0,0,2]=4 3611 B12R1.107 C\C(=N\S(C)=O)c1ccccc1 Amb35681678 [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.107 C\C(N)=C/C(=O)c1ccccc1 Amb27666841 [0,2,0,0,0,0|1,0,0]=3 3613 B12R1.107 C\C(N)=C/C(=O)c1ccccn1 Amb10242646 [0,2,0,0,0,0|2,0,0]=4 3614 B12R1.107 C\C(N)=C\C(=O)c1ccccc1 Amb2386640 [0,2,0,0,0,0|1,0,0]=3 3615 B12R1.107 C\C(N)=C\C(=O)c1cccnc1 Amb28052006 [0,2,0,0,0,0|2,0,0]=4 3616 B12R1.107 C\C(N)=C\C(=O)c1ccncc1 Amb26338235 [0,2,0,0,0,0|2,0,0]=4 3617 B12R1.107 C\C(N)=C\S(=O)c1ccccc1 Amb26974071 [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.107 ClC(Cl)=C=C(Cl)c1ccccc1 Amb4012516 [0,2,0,0,0,0|1,0,1]=4 3619 B12R1.107 N=C(N)CC(=O)c1ccccc1 Amb26371399 [0,2,0,0,0,0|1,0,1]=4 3620 B12R1.107 N=C(N)NC(=O)c1ccccc1 Amb25703047 [0,2,0,0,0,0|2,0,0]=4 3621 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb21955775 [0,2,0,0,0,0|2,0,0]=4 3622 B12R1.107 N=C(N)SC(=O)c1ccccc1 Amb9901863 [0,2,0,0,0,0|2,0,0]=4 3623 B12R1.107 N=C(NC(N)=O)c1cccnc1 Amb28141853 [0,2,0,0,0,0|2,0,0]=4 3624 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [0,2,0,0,0,0|0,0,1]=3 3625 B12R1.107 NC(=O)CC(=S)c1ccccc1 Amb28384134 [0,2,0,0,0,0|0,0,1]=3 3626 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609847 [0,2,0,0,0,0|0,0,2]=4 3627 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609952 [0,2,0,0,0,0|0,0,2]=4 3628 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb6264599 [0,2,0,0,0,0|0,0,2]=4 3629 B12R1.107 NC(=O)CS(=O)c1ccccc1 Amb26536440 [0,2,0,0,0,0|1,0,1]=4 3630 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|0,0,2]=4 3631 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb32661465 [0,2,0,0,0,0|0,0,2]=4 3632 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb28129120 [0,2,0,0,0,0|0,0,2]=4 3633 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb32661309 [0,2,0,0,0,0|0,0,2]=4 3634 B12R1.107 NC(=O)NC(=O)c1ccccc1 Amb3989198 [0,2,0,0,0,0|1,0,0]=3 3635 B12R1.107 NC(=O)NC(=O)c1ccccn1 Amb27866159 [0,2,0,0,0,0|2,0,0]=4 3636 B12R1.107 NC(=O)\C=C(\O)c1cccnc1 Amb28291337 [0,2,0,0,0,0|1,0,0]=3 3637 B12R1.107 NC(=O)\C=C(\O)c1ccncc1 Amb27165220 [0,2,0,0,0,0|1,0,0]=3 3638 B12R1.107 NC(=O)\C=C(\S)c1ccccc1 Amb27862500 [0,2,0,0,0,0|0,0,0]=2 3639 B12R1.107 NC(=S)CC(=O)c1ccccc1 Amb26430207 [0,2,0,0,0,0|0,1,1]=4 3640 B12R1.107 NC(=S)NC(=O)c1ccccc1 Amb2684614 [0,2,0,0,0,0|1,1,0]=4 3641 B12R1.107 NC(=S)\C=C(/N)c1ccccc1 Amb19374001 [0,2,0,0,0,0|0,1,0]=3 3642 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [0,2,0,0,0,0|0,0,2]=4 3643 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [0,2,0,0,0,0|0,0,2]=4 3644 B12R1.107 NC(N)=CC(=O)c1ccccc1 Amb25108111 [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.107 NN(CC(=O)O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|1,0,1]=4 3646 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [0,2,0,0,0,0|0,0,2]=4 3647 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [0,2,0,0,0,0|0,0,2]=4 3648 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [0,2,0,0,0,0|0,0,2]=4 3649 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [0,2,0,0,0,0|0,0,2]=4 3650 B12R1.107 O=C(C=C(Cl)Cl)c1ccccc1 Amb27753874 [0,2,0,0,0,0|1,0,0]=3 3651 B12R1.107 O=C(C[N+](=O)[O-])c1ccccc1 Amb3687238 [0,2,0,0,0,0|1,0,1]=4 3652 B12R1.107 O=C(O)CC(=S)c1ccccc1 Amb27433886 [0,2,0,0,0,0|0,0,1]=3 3653 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [0,2,0,0,0,0|0,0,2]=4 3654 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|0,0,2]=4 3655 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [0,2,0,0,0,0|0,0,2]=4 3656 B12R1.107 O=C(O)CN(Cl)c1ccccc1 Amb27984830 [0,2,0,0,0,0|1,0,1]=4 3657 B12R1.107 O=C(O)CN(O)c1ccccc1 Amb27984844 [0,2,0,0,0,0|1,0,1]=4 3658 B12R1.107 O=C(O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|1,0,1]=4 3659 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [0,2,0,0,0,0|0,0,2]=4 3660 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [0,2,0,0,0,0|0,0,2]=4 3661 B12R1.107 O=C(O)\C=C(/Cl)c1ccccc1 Amb17594707 [0,2,0,0,0,0|0,0,0]=2 3662 B12R1.107 O=C(O)\C=C(/I)c1ccccc1 Amb33620462 [0,2,0,0,0,0|0,0,0]=2 3663 B12R1.107 O=C(O)\C=C(\O)c1ccccc1 Amb28052099 [0,2,0,0,0,0|0,0,0]=2 3664 B12R1.107 O=C(S)CC(O)c1ccccc1 Amb27197171 [0,2,0,0,0,0|0,0,2]=4 3665 B12R1.107 O=S(C=C(Cl)Cl)c1ccccc1 Amb24483631 [0,2,0,0,0,0|2,0,0]=4 3666 B12R1.107 O=S([O-])\C=C(/F)c1ccccc1 Amb32754936 [0,2,0,0,0,0|1,0,0]=3 3667 B12R1.107 OC(C=C(F)F)c1ccccc1 Amb28244314 [0,2,0,0,0,0|1,0,1]=4 3668 B12R1.308 C=C=CC(=O)c1ccccc1F Amb26475428 [0,2,0,0,0,0|1,0,1]=4 3669 B12R1.308 C=CCC(=O)c1ccccc1C Amb17334496 [0,2,0,0,0,0|1,0,1]=4 3670 B12R1.308 C=CCC(=O)c1ccccc1Cl Amb17335455 [0,2,0,0,0,0|1,0,1]=4 3671 B12R1.308 C=CCC(=O)c1ccccc1F Amb17334599 [0,2,0,0,0,0|1,0,1]=4 3672 B12R1.308 C=CCC(=O)c1ccccc1N Amb28145692 [0,2,0,0,0,0|1,0,1]=4 3673 B12R1.308 C=COC(=O)c1ccccc1O Amb4020572 [0,2,0,0,0,0|2,0,0]=4 3674 B12R1.308 CC(NC=O)c1ccccc1Br Amb27770008 [0,2,0,0,0,0|1,0,1]=4 3675 B12R1.308 C\C(=C/C#N)c1ccccc1N Amb18645061 [0,2,0,0,0,0|1,0,1]=4 3676 B12R1.308 C\C(=C/CCl)c1ccccc1Cl Amb28343242 [0,2,0,0,0,0|1,0,1]=4 3677 B12R1.308 C\C(=C/CN)c1ccccc1Br Amb31098022 [0,2,0,0,0,0|1,0,1]=4 3678 B12R1.308 C\C(=C/CN)c1ccccc1C Amb31099548 [0,2,0,0,0,0|1,0,1]=4 3679 B12R1.308 C\C(=C/CN)c1ccccc1F Amb31099552 [0,2,0,0,0,0|1,0,1]=4 3680 B12R1.308 C\C(=C/CO)c1ccccc1Cl Amb27416537 [0,2,0,0,0,0|0,0,2]=4 3681 B12R1.308 C\C(=C/CO)c1ccccc1O Amb27749760 [0,2,0,0,0,0|0,0,2]=4 3682 B12R1.308 C\C(=C\C#N)c1ccccc1F Amb28141407 [0,2,0,0,0,0|1,0,1]=4 3683 B12R1.308 C\C(=C\C=O)c1ccccc1F Amb27476015 [0,2,0,0,0,0|0,0,0]=2 3684 B12R1.308 C\C(=C\CCl)c1ccccc1Cl Amb28318469 [0,2,0,0,0,0|1,0,1]=4 3685 B12R1.308 C\C=C/C(O)c1ccccc1O Amb28324317 [0,2,0,0,0,0|1,0,1]=4 3686 B12R1.308 C\C=C\C(=O)c1ccccc1Cl Amb25816329 [0,2,0,0,0,0|1,0,0]=3 3687 B12R1.308 C\C=C\C(=O)c1cccnc1N Amb27825890 [0,2,0,0,0,0|2,0,0]=4 3688 B12R1.308 C\C=C\C(=O)c1cnccc1N Amb27870353 [0,2,0,0,0,0|2,0,0]=4 3689 B12R1.308 C\C=C\N(C)c1ccccc1O Amb28351392 [0,2,0,0,0,0|2,0,0]=4 3690 B12R1.308 Cc1ccccc1C(=O)C=[N+]=[N-] Amb24644060 [0,2,0,0,0,0|2,0,0]=4 3691 B12R1.308 Cc1ccccc1C(=O)CC=O Amb7766349 [0,2,0,0,0,0|0,0,1]=3 3692 B12R1.308 Cc1ccccc1C(=O)N=C=O Amb17232351 [0,2,0,0,0,0|1,0,1]=4 3693 B12R1.308 Cc1ccccc1C(=O)\C=C\[O-] Amb27624352 [0,2,0,0,0,0|0,0,1]=3 3694 B12R1.308 Cc1ccccc1C(=S)N=C=O Amb27876364 [0,2,0,0,0,0|1,0,1]=4 3695 B12R1.308 Cc1cccnc1C(=O)CC=O Amb25824146 [0,2,0,0,0,0|1,0,1]=4 3696 B12R1.308 Cc1cccnc1C(=O)\C=C\Cl Amb29880226 [0,2,0,0,0,0|2,0,0]=4 3697 B12R1.308 Cc1ccncc1C(=O)CC=O Amb25791118 [0,2,0,0,0,0|1,0,1]=4 3698 B12R1.308 Cc1ccncc1C(=O)\C=C\Cl Amb35628815 [0,2,0,0,0,0|2,0,0]=4 3699 B12R1.308 Cc1cnccc1C(=O)\C=C\Cl Amb35628816 [0,2,0,0,0,0|2,0,0]=4 3700 B12R1.308 Cc1ncccc1C(=O)\C=C\Cl Amb29880213 [0,2,0,0,0,0|2,0,0]=4 3701 B12R1.308 N#C\C=C(/N)c1ccccc1F Amb18126318 [0,2,0,0,0,0|1,0,1]=4 3702 B12R1.308 N#C\C=C(\Cl)c1ccccc1I Amb27952507 [0,2,0,0,0,0|1,0,1]=4 3703 B12R1.308 Nc1cnccc1C(=O)CC=O Amb24460251 [0,2,0,0,0,0|1,0,1]=4 3704 B12R1.308 O=C(\C=C\Cl)c1ccccc1Br Amb35645308 [0,2,0,0,0,0|1,0,0]=3 3705 B12R1.308 O=C(\C=C\Cl)c1ccccc1Cl Amb35645309 [0,2,0,0,0,0|1,0,0]=3 3706 B12R1.308 O=C(\C=C\Cl)c1ccccc1I Amb35609469 [0,2,0,0,0,0|1,0,0]=3 3707 B12R1.308 O=C(\C=C\Cl)c1ccccc1O Amb35645316 [0,2,0,0,0,0|1,0,0]=3 3708 B12R1.308 O=C(\C=C\Cl)c1ccncc1Br Amb35628798 [0,2,0,0,0,0|2,0,0]=4 3709 B12R1.308 O=C(\C=C\Cl)c1ccncc1Cl Amb35628605 [0,2,0,0,0,0|2,0,0]=4 3710 B12R1.308 O=C(\C=C\Cl)c1ccncc1F Amb35628651 [0,2,0,0,0,0|2,0,0]=4 3711 B12R1.308 O=C(\C=C\Cl)c1ccncc1O Amb35628819 [0,2,0,0,0,0|2,0,0]=4 3712 B12R1.308 O=C(\C=C\Cl)c1ncccc1Br Amb35628611 [0,2,0,0,0,0|2,0,0]=4 3713 B12R1.308 O=C(\C=C\[O-])c1ccccc1Cl Amb27258626 [0,2,0,0,0,0|0,0,1]=3 3714 B12R1.308 O=C(\C=C\[O-])c1ccccc1F Amb27265418 [0,2,0,0,0,0|0,0,1]=3 3715 B12R1.308 O=C=NC(=O)c1ccccc1Br Amb17247240 [0,2,0,0,0,0|1,0,1]=4 3716 B12R1.308 O=C=NC(=O)c1ccccc1Cl Amb17233863 [0,2,0,0,0,0|1,0,1]=4 3717 B12R1.308 O=C=NC(=O)c1ccccc1F Amb17232511 [0,2,0,0,0,0|1,0,1]=4 3718 B12R1.308 O=C=NC(=O)c1ccccc1I Amb27871128 [0,2,0,0,0,0|1,0,1]=4 3719 B12R1.308 O=CCC(=O)c1ccccc1Br Amb9204919 [0,2,0,0,0,0|0,0,1]=3 3720 B12R1.308 O=CCC(=O)c1ccccc1Cl Amb7766339 [0,2,0,0,0,0|0,0,1]=3 3721 B12R1.308 O=CCC(=O)c1ccccc1F Amb9204907 [0,2,0,0,0,0|0,0,1]=3 3722 B12R1.308 O=CCC(=O)c1ccccc1O Amb18645953 [0,2,0,0,0,0|0,0,1]=3 3723 B12R1.308 O=CCC(=O)c1cccnc1Cl Amb25891338 [0,2,0,0,0,0|1,0,1]=4 3724 B12R1.308 O=CCC(=O)c1cccnc1F Amb25723019 [0,2,0,0,0,0|1,0,1]=4 3725 B12R1.308 O=CCC(=O)c1ccncc1F Amb25149834 [0,2,0,0,0,0|1,0,1]=4 3726 B12R1.308 O=CCC(=O)c1ncccc1F Amb27788287 [0,2,0,0,0,0|1,0,1]=4 3727 B12R1.308 O=CCC(O)c1ccccc1F Amb27947440 [0,2,0,0,0,0|0,0,2]=4 3728 B12R1.308 O=CCS(=O)c1ccccc1Br Amb27861640 [0,2,0,0,0,0|1,0,1]=4 3729 B12R1.308 O=CCS(=O)c1ccccc1Cl Amb27763167 [0,2,0,0,0,0|1,0,1]=4 3730 B12R1.308 O=CNC(=O)c1ccccc1O Amb17621622 [0,2,0,0,0,0|1,0,0]=3 3731 B12R1.308 O=C\C=C(\Cl)c1ccccc1Cl Amb28140307 [0,2,0,0,0,0|0,0,0]=2 3732 B12R1.308 [N-]=[N+]=CC(=O)c1ccccc1F Amb24497496 [0,2,0,0,0,0|2,0,0]=4 3733 B12R1.25 CO\C=C\c1cccc(Br)c1C Amb27660779 [0,2,0,0,0,0|2,0,0]=4 3734 B12R1.25 Cc1c(Br)cccc1CCC=O Amb26607997 [0,2,0,0,0,0|0,0,2]=4 3735 B12R1.25 Cc1c(Br)cccc1\C=C\C=O Amb33476887 [0,2,0,0,0,0|0,0,0]=2 3736 B12R1.25 Cc1c(Br)cccc1\C=C\CN Amb33476891 [0,2,0,0,0,0|1,0,1]=4 3737 B12R1.25 Cc1c(Br)cccc1\C=C\CO Amb33476888 [0,2,0,0,0,0|0,0,2]=4 3738 B12R1.25 Cc1c(Cl)cccc1CCC=O Amb18564226 [0,2,0,0,0,0|0,0,2]=4 3739 B12R1.25 Cc1c(Cl)cccc1\C=C\C#N Amb17233377 [0,2,0,0,0,0|1,0,1]=4 3740 B12R1.25 Cc1c(Cl)cccc1\C=C\C=O Amb17233764 [0,2,0,0,0,0|0,0,0]=2 3741 B12R1.25 Cc1c(Cl)cccc1\C=C\CN Amb25083344 [0,2,0,0,0,0|1,0,1]=4 3742 B12R1.25 Cc1c(Cl)cccc1\C=C\CO Amb26883887 [0,2,0,0,0,0|0,0,2]=4 3743 B12R1.25 Cc1c(F)cccc1CCC=O Amb25299267 [0,2,0,0,0,0|0,0,2]=4 3744 B12R1.25 Cc1c(F)cccc1\C=C/C#N Amb28254664 [0,2,0,0,0,0|1,0,1]=4 3745 B12R1.25 Cc1c(F)cccc1\C=C\C=O Amb33225511 [0,2,0,0,0,0|0,0,0]=2 3746 B12R1.25 Cc1c(F)cccc1\C=C\CN Amb33359745 [0,2,0,0,0,0|1,0,1]=4 3747 B12R1.25 Cc1c(F)cccc1\C=C\CO Amb32953976 [0,2,0,0,0,0|0,0,2]=4 3748 B12R1.25 Cc1c(N)cccc1CCC=O Amb27624875 [0,2,0,0,0,0|0,0,2]=4 3749 B12R1.25 Cc1c(O)cccc1CCC=O Amb27199497 [0,2,0,0,0,0|0,0,2]=4 3750 B12R1.25 Cc1c(S)cccc1CCC=O Amb27623403 [0,2,0,0,0,0|0,0,2]=4 3751 B12R1.25 Cc1cccc(CCC=O)c1Br Amb24532658 [0,2,0,0,0,0|0,0,2]=4 3752 B12R1.25 Cc1cccc(CCC=O)c1C Amb18563554 [0,2,0,0,0,0|0,0,2]=4 3753 B12R1.25 Cc1cccc(CCC=O)c1Cl Amb26880111 [0,2,0,0,0,0|0,0,2]=4 3754 B12R1.25 Cc1cccc(CCC=O)c1F Amb24093002 [0,2,0,0,0,0|0,0,2]=4 3755 B12R1.25 Cc1cccc(CCC=O)c1I Amb28251276 [0,2,0,0,0,0|0,0,2]=4 3756 B12R1.25 Cc1cccc(CCC=O)c1N Amb27847134 [0,2,0,0,0,0|0,0,2]=4 3757 B12R1.25 Cc1cccc(C\C=C\Cl)c1O Amb18648712 [0,2,0,0,0,0|1,0,1]=4 3758 B12R1.25 Cc1cccc(OCC=O)c1C Amb5731827 [0,2,0,0,0,0|1,0,1]=4 3759 B12R1.25 Cc1cccc(OCC=O)c1F Amb27765287 [0,2,0,0,0,0|1,0,1]=4 3760 B12R1.25 Cc1cccc(\C=C\C#N)c1C Amb17232214 [0,2,0,0,0,0|1,0,1]=4 3761 B12R1.25 Cc1cccc(\C=C\C=O)c1C Amb17232320 [0,2,0,0,0,0|0,0,0]=2 3762 B12R1.25 Cc1cccc(\C=C\C=O)c1F Amb33326133 [0,2,0,0,0,0|0,0,0]=2 3763 B12R1.25 Cc1cccc(\C=C\C=O)c1O Amb23596357 [0,2,0,0,0,0|0,0,0]=2 3764 B12R1.25 Cc1cccc(\C=C\CCl)c1F Amb27213009 [0,2,0,0,0,0|1,0,1]=4 3765 B12R1.25 Cc1cccc(\C=C\CN)c1C Amb26634800 [0,2,0,0,0,0|1,0,1]=4 3766 B12R1.25 Cc1cccc(\C=C\CN)c1F Amb28062875 [0,2,0,0,0,0|1,0,1]=4 3767 B12R1.25 Cc1cccc(\C=C\CO)c1C Amb25139939 [0,2,0,0,0,0|0,0,2]=4 3768 B12R1.25 Cc1cccc(\C=C\CO)c1F Amb33080305 [0,2,0,0,0,0|0,0,2]=4 3769 B12R1.25 ClC\C=C\c1cccc(Cl)c1Cl Amb27639199 [0,2,0,0,0,0|1,0,1]=4 3770 B12R1.25 Fc1cccc(\C=C\CBr)c1Br Amb27191662 [0,2,0,0,0,0|1,0,1]=4 3771 B12R1.25 Fc1cccc(\C=C\CCl)c1F Amb27871136 [0,2,0,0,0,0|1,0,1]=4 3772 B12R1.25 N#C\C=C\c1cccc(Br)c1F Amb28285421 [0,2,0,0,0,0|1,0,1]=4 3773 B12R1.25 N#C\C=C\c1cccc(Cl)c1Cl Amb17236714 [0,2,0,0,0,0|1,0,1]=4 3774 B12R1.25 N#C\C=C\c1cccc(Cl)c1F Amb27748448 [0,2,0,0,0,0|1,0,1]=4 3775 B12R1.25 NC\C=C\c1cccc(Br)c1F Amb28244905 [0,2,0,0,0,0|1,0,1]=4 3776 B12R1.25 NC\C=C\c1cccc(Br)c1O Amb33332550 [0,2,0,0,0,0|1,0,1]=4 3777 B12R1.25 NC\C=C\c1cccc(Cl)c1Cl Amb23555624 [0,2,0,0,0,0|1,0,1]=4 3778 B12R1.25 NC\C=C\c1cccc(Cl)c1F Amb33261978 [0,2,0,0,0,0|1,0,1]=4 3779 B12R1.25 NC\C=C\c1cccc(Cl)c1O Amb33056884 [0,2,0,0,0,0|1,0,1]=4 3780 B12R1.25 NC\C=C\c1cccc(F)c1Br Amb33450561 [0,2,0,0,0,0|1,0,1]=4 3781 B12R1.25 NC\C=C\c1cccc(F)c1F Amb33172322 [0,2,0,0,0,0|1,0,1]=4 3782 B12R1.25 NC\C=C\c1cccc(F)c1O Amb33310900 [0,2,0,0,0,0|1,0,1]=4 3783 B12R1.25 NC\C=C\c1cccc(O)c1Br Amb33386837 [0,2,0,0,0,0|1,0,1]=4 3784 B12R1.25 NC\C=C\c1cccc(O)c1O Amb33269469 [0,2,0,0,0,0|1,0,1]=4 3785 B12R1.25 Nc1cccc(CCC=O)c1N Amb27246821 [0,2,0,0,0,0|0,0,2]=4 3786 B12R1.25 Nc1cccc(CCC=O)c1O Amb27215519 [0,2,0,0,0,0|0,0,2]=4 3787 B12R1.25 O=CC#Cc1cccc(Cl)c1Cl Amb18117834 [0,2,0,0,0,0|0,0,2]=4 3788 B12R1.25 O=CCCc1cccc(Br)c1Br Amb26844644 [0,2,0,0,0,0|0,0,2]=4 3789 B12R1.25 O=CCCc1cccc(Br)c1Cl Amb24483778 [0,2,0,0,0,0|0,0,2]=4 3790 B12R1.25 O=CCCc1cccc(Br)c1F Amb25739079 [0,2,0,0,0,0|0,0,2]=4 3791 B12R1.25 O=CCCc1cccc(Br)c1I Amb26880680 [0,2,0,0,0,0|0,0,2]=4 3792 B12R1.25 O=CCCc1cccc(Br)c1O Amb24728306 [0,2,0,0,0,0|0,0,2]=4 3793 B12R1.25 O=CCCc1cccc(Cl)c1Cl Amb18066576 [0,2,0,0,0,0|0,0,2]=4 3794 B12R1.25 O=CCCc1cccc(Cl)c1F Amb26315353 [0,2,0,0,0,0|0,0,2]=4 3795 B12R1.25 O=CCCc1cccc(Cl)c1I Amb26935759 [0,2,0,0,0,0|0,0,2]=4 3796 B12R1.25 O=CCCc1cccc(Cl)c1O Amb26898533 [0,2,0,0,0,0|0,0,2]=4 3797 B12R1.25 O=CCCc1cccc(F)c1Br Amb27876559 [0,2,0,0,0,0|0,0,2]=4 3798 B12R1.25 O=CCCc1cccc(F)c1Cl Amb27798762 [0,2,0,0,0,0|0,0,2]=4 3799 B12R1.25 O=CCCc1cccc(F)c1F Amb18801722 [0,2,0,0,0,0|0,0,2]=4 3800 B12R1.25 O=CCCc1cccc(F)c1I Amb26880769 [0,2,0,0,0,0|0,0,2]=4 3801 B12R1.25 O=CCCc1cccc(F)c1O Amb26339327 [0,2,0,0,0,0|0,0,2]=4 3802 B12R1.25 O=CCCc1cccc(I)c1Br Amb25890570 [0,2,0,0,0,0|0,0,2]=4 3803 B12R1.25 O=CCCc1cccc(I)c1Cl Amb28119151 [0,2,0,0,0,0|0,0,2]=4 3804 B12R1.25 O=CCCc1cccc(I)c1I Amb27633745 [0,2,0,0,0,0|0,0,2]=4 3805 B12R1.25 O=CCCc1cccc(I)c1O Amb27800783 [0,2,0,0,0,0|0,0,2]=4 3806 B12R1.25 O=CCCc1cccc(O)c1Br Amb28123651 [0,2,0,0,0,0|0,0,2]=4 3807 B12R1.25 O=CCCc1cccc(O)c1Cl Amb27632383 [0,2,0,0,0,0|0,0,2]=4 3808 B12R1.25 O=CCCc1cccc(O)c1F Amb25831101 [0,2,0,0,0,0|0,0,2]=4 3809 B12R1.25 O=CCCc1cccc(O)c1I Amb26645175 [0,2,0,0,0,0|0,0,2]=4 3810 B12R1.25 O=CCCc1cccc(O)c1O Amb27192383 [0,2,0,0,0,0|0,0,2]=4 3811 B12R1.25 O=CCCc1cccc(O)c1S Amb27423590 [0,2,0,0,0,0|0,0,2]=4 3812 B12R1.25 O=CCCc1cccc(S)c1Br Amb27964574 [0,2,0,0,0,0|0,0,2]=4 3813 B12R1.25 O=CCCc1cccc(S)c1Cl Amb28196073 [0,2,0,0,0,0|0,0,2]=4 3814 B12R1.25 O=CCCc1cccc(S)c1O Amb27965652 [0,2,0,0,0,0|0,0,2]=4 3815 B12R1.25 O=CCCc1cccc(S)c1S Amb28196024 [0,2,0,0,0,0|0,0,2]=4 3816 B12R1.25 O=CCOc1cccc(Cl)c1Cl Amb5731859 [0,2,0,0,0,0|1,0,1]=4 3817 B12R1.25 O=CNCc1cccc(Cl)c1Cl Amb35701182 [0,2,0,0,0,0|1,0,1]=4 3818 B12R1.25 O=C\C=C\c1cccc(Br)c1F Amb33387301 [0,2,0,0,0,0|0,0,0]=2 3819 B12R1.25 O=C\C=C\c1cccc(Br)c1O Amb33385964 [0,2,0,0,0,0|0,0,0]=2 3820 B12R1.25 O=C\C=C\c1cccc(Cl)c1Cl Amb17237217 [0,2,0,0,0,0|0,0,0]=2 3821 B12R1.25 O=C\C=C\c1cccc(Cl)c1F Amb33262388 [0,2,0,0,0,0|0,0,0]=2 3822 B12R1.25 O=C\C=C\c1cccc(Cl)c1O Amb33406953 [0,2,0,0,0,0|0,0,0]=2 3823 B12R1.25 O=C\C=C\c1cccc(F)c1Br Amb28201845 [0,2,0,0,0,0|0,0,0]=2 3824 B12R1.25 O=C\C=C\c1cccc(F)c1F Amb24717591 [0,2,0,0,0,0|0,0,0]=2 3825 B12R1.25 O=C\C=C\c1cccc(F)c1O Amb33372819 [0,2,0,0,0,0|0,0,0]=2 3826 B12R1.25 O=C\C=C\c1cccc(O)c1Br Amb33386835 [0,2,0,0,0,0|0,0,0]=2 3827 B12R1.25 O=C\C=C\c1cccc(O)c1O Amb33268790 [0,2,0,0,0,0|0,0,0]=2 3828 B12R1.25 OC\C=C\c1cccc(Br)c1F Amb33386602 [0,2,0,0,0,0|0,0,2]=4 3829 B12R1.25 OC\C=C\c1cccc(Br)c1O Amb33332546 [0,2,0,0,0,0|0,0,2]=4 3830 B12R1.25 OC\C=C\c1cccc(Cl)c1Cl Amb23555632 [0,2,0,0,0,0|0,0,2]=4 3831 B12R1.25 OC\C=C\c1cccc(Cl)c1F Amb33261804 [0,2,0,0,0,0|0,0,2]=4 3832 B12R1.25 OC\C=C\c1cccc(Cl)c1O Amb33056880 [0,2,0,0,0,0|0,0,2]=4 3833 B12R1.25 OC\C=C\c1cccc(F)c1Br Amb33450558 [0,2,0,0,0,0|0,0,2]=4 3834 B12R1.25 OC\C=C\c1cccc(F)c1F Amb24593079 [0,2,0,0,0,0|0,0,2]=4 3835 B12R1.25 OC\C=C\c1cccc(F)c1O Amb33372345 [0,2,0,0,0,0|0,0,2]=4 3836 B12R1.25 OC\C=C\c1cccc(O)c1Br Amb33386836 [0,2,0,0,0,0|0,0,2]=4 3837 B12R1.25 OC\C=C\c1cccc(O)c1O Amb33268789 [0,2,0,0,0,0|0,0,2]=4 3838 B12R1.121 C#Cc1ccccc1CCC=O Amb24422382 [0,2,0,0,0,0|0,0,2]=4 3839 B12R1.121 C#Cc1ccccc1\C=C\C=O Amb33080081 [0,2,0,0,0,0|0,0,0]=2 3840 B12R1.121 C#Cc1ccccc1\C=C\CN Amb33223717 [0,2,0,0,0,0|1,0,1]=4 3841 B12R1.121 C#Cc1ccccc1\C=C\CO Amb33374286 [0,2,0,0,0,0|0,0,2]=4 3842 B12R1.121 C=Cc1ccccc1CNC=O Amb27243925 [0,2,0,0,0,0|1,0,1]=4 3843 B12R1.121 CCc1ccccc1CCC=O Amb33448757 [0,2,0,0,0,0|0,0,2]=4 3844 B12R1.121 CCc1ccccc1OCC=O Amb5731829 [0,2,0,0,0,0|1,0,1]=4 3845 B12R1.121 CCc1ccccc1\C=C\C=O Amb33079602 [0,2,0,0,0,0|0,0,0]=2 3846 B12R1.121 CCc1ccccc1\C=C\CN Amb28200469 [0,2,0,0,0,0|1,0,1]=4 3847 B12R1.121 CCc1ccccc1\C=C\CO Amb33171632 [0,2,0,0,0,0|0,0,2]=4 3848 B12R1.121 CN\C=C/c1ccccc1OC Amb27828629 [0,2,0,0,0,0|2,0,0]=4 3849 B12R1.121 CN\C=C\c1ccccc1OC Amb28051924 [0,2,0,0,0,0|2,0,0]=4 3850 B12R1.121 CNc1ccccc1\C=C\C#N Amb28123108 [0,2,0,0,0,0|1,0,1]=4 3851 B12R1.121 COc1ccccc1CCC=O Amb17081677 [0,2,0,0,0,0|0,0,2]=4 3852 B12R1.121 COc1ccccc1OCC=O Amb5731832 [0,2,0,0,0,0|1,0,1]=4 3853 B12R1.121 COc1ccccc1SCC=O Amb18809763 [0,2,0,0,0,0|1,0,1]=4 3854 B12R1.121 COc1ccccc1\C=C\C#N Amb17477659 [0,2,0,0,0,0|1,0,1]=4 3855 B12R1.121 COc1ccccc1\C=C\C=O Amb6608853 [0,2,0,0,0,0|0,0,0]=2 3856 B12R1.121 COc1ccccc1\C=C\CN Amb10560867 [0,2,0,0,0,0|1,0,1]=4 3857 B12R1.121 COc1ccccc1\C=C\CO Amb1110152 [0,2,0,0,0,0|0,0,2]=4 3858 B12R1.121 COc1cccnc1\C=C\C=O Amb33272635 [0,2,0,0,0,0|1,0,0]=3 3859 B12R1.121 COc1ncccc1\C=C\C=O Amb33378961 [0,2,0,0,0,0|1,0,0]=3 3860 B12R1.121 CSc1ccccc1CCC=O Amb33473857 [0,2,0,0,0,0|0,0,2]=4 3861 B12R1.121 CSc1ccccc1\C=C\C=O Amb33448986 [0,2,0,0,0,0|0,0,0]=2 3862 B12R1.121 CSc1ccccc1\C=C\CN Amb33472929 [0,2,0,0,0,0|1,0,1]=4 3863 B12R1.121 CSc1ccccc1\C=C\CO Amb33465828 [0,2,0,0,0,0|0,0,2]=4 3864 B12R1.121 C\C=C/Oc1ccccc1C=O Amb27268574 [0,2,0,0,0,0|2,0,0]=4 3865 B12R1.121 C\C=C\Cc1ccccc1NC Amb27477966 [0,2,0,0,0,0|1,0,1]=4 3866 B12R1.121 N#C\C=C\c1ccccc1C=O Amb25892218 [0,2,0,0,0,0|1,0,1]=4 3867 B12R1.121 N#Cc1ccccc1CCC=O Amb25685434 [0,2,0,0,0,0|0,0,2]=4 3868 B12R1.121 N#Cc1ccccc1\C=C/C=O Amb28194555 [0,2,0,0,0,0|0,0,0]=2 3869 B12R1.121 N#Cc1ccccc1\C=C\C=O Amb33474618 [0,2,0,0,0,0|0,0,0]=2 3870 B12R1.121 N#Cc1ccccc1\C=C\CN Amb33450118 [0,2,0,0,0,0|1,0,1]=4 3871 B12R1.121 N#Cc1ccccc1\C=C\CO Amb18645181 [0,2,0,0,0,0|0,0,2]=4 3872 B12R1.121 OC\C=C\c1ccccc1CO Amb27764799 [0,2,0,0,0,0|0,0,2]=4 3873 B12R1.125 C=C(C)\C=C\c1ccccc1N Amb27627468 [0,2,0,0,0,0|1,0,0]=3 3874 B12R1.125 C=C(C)\C=C\c1ccccc1O Amb25915366 [0,2,0,0,0,0|1,0,0]=3 3875 B12R1.125 CC(=O)C#Cc1ccccc1C Amb23438225 [0,2,0,0,0,0|0,0,2]=4 3876 B12R1.125 CC(=O)CCc1ccccc1Br Amb9031563 [0,2,0,0,0,0|0,0,2]=4 3877 B12R1.125 CC(=O)CCc1ccccc1C Amb9031558 [0,2,0,0,0,0|0,0,2]=4 3878 B12R1.125 CC(=O)CCc1ccccc1Cl Amb9031570 [0,2,0,0,0,0|0,0,2]=4 3879 B12R1.125 CC(=O)CCc1ccccc1F Amb9031573 [0,2,0,0,0,0|0,0,2]=4 3880 B12R1.125 CC(=O)CCc1ccccc1N Amb27246247 [0,2,0,0,0,0|0,0,2]=4 3881 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [0,2,0,0,0,0|0,0,2]=4 3882 B12R1.125 CC(=O)CNc1ccccc1C Amb25062983 [0,2,0,0,0,0|1,0,1]=4 3883 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [0,2,0,0,0,0|1,0,1]=4 3884 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [0,2,0,0,0,0|1,0,1]=4 3885 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [0,2,0,0,0,0|1,0,1]=4 3886 B12R1.125 CC(=O)CSc1ccccc1Br Amb9229574 [0,2,0,0,0,0|1,0,1]=4 3887 B12R1.125 CC(=O)CSc1ccccc1C Amb18796318 [0,2,0,0,0,0|1,0,1]=4 3888 B12R1.125 CC(=O)CSc1ccccc1Cl Amb4744662 [0,2,0,0,0,0|1,0,1]=4 3889 B12R1.125 CC(=O)CSc1ccccc1F Amb9268572 [0,2,0,0,0,0|1,0,1]=4 3890 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [0,2,0,0,0,0|1,0,1]=4 3891 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [0,2,0,0,0,0|1,0,1]=4 3892 B12R1.125 CC(=O)NCc1ccccc1Cl Amb3094828 [0,2,0,0,0,0|1,0,1]=4 3893 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [0,2,0,0,0,0|1,0,1]=4 3894 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [0,2,0,0,0,0|1,0,1]=4 3895 B12R1.125 CC(=O)NNc1ccccc1C Amb4362488 [0,2,0,0,0,0|2,0,0]=4 3896 B12R1.125 CC(=O)NNc1ccccc1F Amb27414447 [0,2,0,0,0,0|2,0,0]=4 3897 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [0,2,0,0,0,0|2,0,0]=4 3898 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [0,2,0,0,0,0|1,0,1]=4 3899 B12R1.125 CC(=O)OCc1ccccc1N Amb27985013 [0,2,0,0,0,0|1,0,1]=4 3900 B12R1.125 CC(=O)SCc1ccccc1Cl Amb27767953 [0,2,0,0,0,0|1,0,1]=4 3901 B12R1.125 CC(=O)\C=C\C1=CC=CNC1=O Amb25780424 [0,2,0,0,0,0|1,0,0]=3 3902 B12R1.125 CC(=O)\C=C\c1cccc[n+]1C Amb3428953 [0,2,0,0,0,0|1,0,0]=3 3903 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [0,2,0,0,0,0|0,0,0]=2 3904 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb32954781 [0,2,0,0,0,0|0,0,0]=2 3905 B12R1.125 CC(=O)\C=C\c1ccccc1Cl Amb2724535 [0,2,0,0,0,0|0,0,0]=2 3906 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [0,2,0,0,0,0|0,0,0]=2 3907 B12R1.125 CC(=O)\C=C\c1ccccc1N Amb25975457 [0,2,0,0,0,0|0,0,0]=2 3908 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb24065680 [0,2,0,0,0,0|0,0,0]=2 3909 B12R1.125 CC(=O)\C=C\c1cccnc1Br Amb33388125 [0,2,0,0,0,0|1,0,0]=3 3910 B12R1.125 CC(=O)\C=C\c1cccnc1C Amb32878339 [0,2,0,0,0,0|1,0,0]=3 3911 B12R1.125 CC(=O)\C=C\c1cccnc1Cl Amb33257396 [0,2,0,0,0,0|1,0,0]=3 3912 B12R1.125 CC(=O)\C=C\c1cccnc1F Amb33377142 [0,2,0,0,0,0|1,0,0]=3 3913 B12R1.125 CC(=O)\C=C\c1ccncc1Br Amb33388703 [0,2,0,0,0,0|1,0,0]=3 3914 B12R1.125 CC(=O)\C=C\c1ccncc1C Amb33426426 [0,2,0,0,0,0|1,0,0]=3 3915 B12R1.125 CC(=O)\C=C\c1ccncc1Cl Amb33413822 [0,2,0,0,0,0|1,0,0]=3 3916 B12R1.125 CC(=O)\C=C\c1ccncc1F Amb33316817 [0,2,0,0,0,0|1,0,0]=3 3917 B12R1.125 CC(=O)\C=C\c1cnccc1C Amb33474389 [0,2,0,0,0,0|1,0,0]=3 3918 B12R1.125 CC(=O)\C=C\c1cncnc1C Amb33149095 [0,2,0,0,0,0|2,0,0]=4 3919 B12R1.125 CC(=O)\C=C\c1ncccc1Br Amb33336115 [0,2,0,0,0,0|1,0,0]=3 3920 B12R1.125 CC(=O)\C=C\c1ncccc1C Amb33360223 [0,2,0,0,0,0|1,0,0]=3 3921 B12R1.125 CC(=O)\C=C\c1ncccc1F Amb33419610 [0,2,0,0,0,0|1,0,0]=3 3922 B12R1.125 CC(=O)\C=C\c1nccnc1C Amb35601038 [0,2,0,0,0,0|2,0,0]=4 3923 B12R1.125 CC(=O)\N=C/c1ccccc1Cl Amb27616938 [0,2,0,0,0,0|1,0,0]=3 3924 B12R1.125 CC(=O)\N=C\c1ccccc1O Amb27592432 [0,2,0,0,0,0|1,0,0]=3 3925 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [0,2,0,0,0,0|1,0,1]=4 3926 B12R1.125 CC(N)\C=C\c1ccccc1Br Amb33242295 [0,2,0,0,0,0|1,0,1]=4 3927 B12R1.125 CC(N)\C=C\c1ccccc1Cl Amb33406514 [0,2,0,0,0,0|1,0,1]=4 3928 B12R1.125 CC(N)\C=C\c1ccccc1F Amb33448885 [0,2,0,0,0,0|1,0,1]=4 3929 B12R1.125 CC(N)\C=C\c1ccccc1O Amb33429328 [0,2,0,0,0,0|1,0,1]=4 3930 B12R1.125 CC(O)\C=C\c1ccccc1Br Amb25086864 [0,2,0,0,0,0|0,0,2]=4 3931 B12R1.125 CC(O)\C=C\c1ccccc1Cl Amb26073532 [0,2,0,0,0,0|0,0,2]=4 3932 B12R1.125 CC(O)\C=C\c1ccccc1F Amb26539993 [0,2,0,0,0,0|0,0,2]=4 3933 B12R1.125 CS(=O)\C=C/c1ccccc1N Amb28254539 [0,2,0,0,0,0|1,0,0]=3 3934 B12R1.125 CS(=O)\N=C\c1ccccc1Br Amb35718864 [0,2,0,0,0,0|2,0,0]=4 3935 B12R1.125 CS(=O)\N=C\c1ccccc1Cl Amb35681665 [0,2,0,0,0,0|2,0,0]=4 3936 B12R1.125 CS(=O)\N=C\c1ccccc1F Amb29858758 [0,2,0,0,0,0|2,0,0]=4 3937 B12R1.125 Cc1cccc[n+]1\C=C\C(=O)O Amb28366211 [0,2,0,0,0,0|1,0,0]=3 3938 B12R1.125 Cc1ccccc1C#CC(=O)O Amb20673097 [0,2,0,0,0,0|0,0,2]=4 3939 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [0,2,0,0,0,0|0,0,2]=4 3940 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [0,2,0,0,0,0|0,0,2]=4 3941 B12R1.125 Cc1ccccc1CCC(N)=O Amb17400134 [0,2,0,0,0,0|0,0,2]=4 3942 B12R1.125 Cc1ccccc1CNC(=O)Cl Amb35625504 [0,2,0,0,0,0|1,0,1]=4 3943 B12R1.125 Cc1ccccc1COC(=O)Cl Amb27416351 [0,2,0,0,0,0|1,0,1]=4 3944 B12R1.125 Cc1ccccc1NCC(=O)Cl Amb27400550 [0,2,0,0,0,0|1,0,1]=4 3945 B12R1.125 Cc1ccccc1NCC(=O)O Amb1258286 [0,2,0,0,0,0|1,0,1]=4 3946 B12R1.125 Cc1ccccc1NCC(N)=O Amb845279 [0,2,0,0,0,0|1,0,1]=4 3947 B12R1.125 Cc1ccccc1NNC(N)=O Amb3378061 [0,2,0,0,0,0|2,0,0]=4 3948 B12R1.125 Cc1ccccc1OCC(=O)Cl Amb10880009 [0,2,0,0,0,0|1,0,1]=4 3949 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [0,2,0,0,0,0|1,0,1]=4 3950 B12R1.125 Cc1ccccc1OCC(N)=O Amb6334508 [0,2,0,0,0,0|1,0,1]=4 3951 B12R1.125 Cc1ccccc1SCC(=O)O Amb1205492 [0,2,0,0,0,0|1,0,1]=4 3952 B12R1.125 Cc1ccccc1\C=C/C(=O)O Amb27871584 [0,2,0,0,0,0|0,0,0]=2 3953 B12R1.125 Cc1ccccc1\C=C/[N+](=O)[O-] Amb24537629 [0,2,0,0,0,0|1,0,0]=3 3954 B12R1.125 Cc1ccccc1\C=C\B(O)O Amb22011802 [0,2,0,0,0,0|1,0,1]=4 3955 B12R1.125 Cc1ccccc1\C=C\C(=O)Cl Amb2690621 [0,2,0,0,0,0|0,0,0]=2 3956 B12R1.125 Cc1ccccc1\C=C\C(=O)O Amb6555165 [0,2,0,0,0,0|0,0,0]=2 3957 B12R1.125 Cc1ccccc1\C=C\C(C)N Amb33475216 [0,2,0,0,0,0|1,0,1]=4 3958 B12R1.125 Cc1ccccc1\C=C\C(C)O Amb27748478 [0,2,0,0,0,0|0,0,2]=4 3959 B12R1.125 Cc1ccccc1\C=C\C(N)=O Amb8997714 [0,2,0,0,0,0|0,0,0]=2 3960 B12R1.125 Cc1ccccc1\C=C\[N+](=O)[O-] Amb33868901 [0,2,0,0,0,0|1,0,0]=3 3961 B12R1.125 Cc1ccccc1\C=N\S(C)=O Amb29858776 [0,2,0,0,0,0|2,0,0]=4 3962 B12R1.125 Cc1cccnc1\C=C\C(=O)O Amb30584981 [0,2,0,0,0,0|1,0,0]=3 3963 B12R1.125 Cc1cccnc1\C=C\C(=O)O Amb32990226 [0,2,0,0,0,0|1,0,0]=3 3964 B12R1.125 Cc1cccnc1\C=C\C(N)=O Amb28127171 [0,2,0,0,0,0|1,0,0]=3 3965 B12R1.125 Cc1cccnc1\C=C\[N+](=O)[O-] Amb33428733 [0,2,0,0,0,0|2,0,0]=4 3966 B12R1.125 Cc1ccncc1\C=C\C(=O)O Amb17844101 [0,2,0,0,0,0|1,0,0]=3 3967 B12R1.125 Cc1ccncc1\C=C\C(=O)O Amb32718732 [0,2,0,0,0,0|1,0,0]=3 3968 B12R1.125 Cc1ccncc1\C=C\[N+](=O)[O-] Amb28186702 [0,2,0,0,0,0|2,0,0]=4 3969 B12R1.125 Cc1cnccc1\C=C\C(=O)O Amb30584980 [0,2,0,0,0,0|1,0,0]=3 3970 B12R1.125 Cc1cnccc1\C=C\[N+](=O)[O-] Amb33414324 [0,2,0,0,0,0|2,0,0]=4 3971 B12R1.125 Cc1ncccc1\C=C\C(=O)O Amb28653059 [0,2,0,0,0,0|1,0,0]=3 3972 B12R1.125 Cc1ncccc1\C=C\C(=O)O Amb32662803 [0,2,0,0,0,0|1,0,0]=3 3973 B12R1.125 Cc1ncccc1\C=C\[N+](=O)[O-] Amb32878958 [0,2,0,0,0,0|2,0,0]=4 3974 B12R1.125 Cc1nccnc1\C=C\C(=O)O Amb35600937 [0,2,0,0,0,0|2,0,0]=4 3975 B12R1.125 Cc1ncncc1\C=C\C(=O)O Amb27193885 [0,2,0,0,0,0|2,0,0]=4 3976 B12R1.125 Cc1nnccc1\C=C\C(=O)O Amb33470115 [0,2,0,0,0,0|2,0,0]=4 3977 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [0,2,0,0,0,0|0,0,2]=4 3978 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [0,2,0,0,0,0|0,0,2]=4 3979 B12R1.125 NC(=O)CCc1ccccc1F Amb8341221 [0,2,0,0,0,0|0,0,2]=4 3980 B12R1.125 NC(=O)CCc1ccccc1N Amb8941622 [0,2,0,0,0,0|0,0,2]=4 3981 B12R1.125 NC(=O)CCc1ccccc1O Amb2695332 [0,2,0,0,0,0|0,0,2]=4 3982 B12R1.125 NC(=O)CNc1ccccc1Br Amb6712122 [0,2,0,0,0,0|1,0,1]=4 3983 B12R1.125 NC(=O)CNc1ccccc1Cl Amb500616 [0,2,0,0,0,0|1,0,1]=4 3984 B12R1.125 NC(=O)CNc1ccccc1F Amb6712534 [0,2,0,0,0,0|1,0,1]=4 3985 B12R1.125 NC(=O)CNc1ccccc1O Amb28323151 [0,2,0,0,0,0|1,0,1]=4 3986 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [0,2,0,0,0,0|1,0,1]=4 3987 B12R1.125 NC(=O)COc1ccccc1Cl Amb3738387 [0,2,0,0,0,0|1,0,1]=4 3988 B12R1.125 NC(=O)COc1ccccc1F Amb8335270 [0,2,0,0,0,0|1,0,1]=4 3989 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [0,2,0,0,0,0|1,0,1]=4 3990 B12R1.125 NC(=O)COc1ccccc1N Amb6662641 [0,2,0,0,0,0|1,0,1]=4 3991 B12R1.125 NC(=O)COc1ccccc1O Amb8505284 [0,2,0,0,0,0|1,0,1]=4 3992 B12R1.125 NC(=O)CSc1ccccc1Cl Amb4534168 [0,2,0,0,0,0|1,0,1]=4 3993 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [0,2,0,0,0,0|1,0,1]=4 3994 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [0,2,0,0,0,0|1,0,1]=4 3995 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [0,2,0,0,0,0|1,0,1]=4 3996 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [0,2,0,0,0,0|1,0,1]=4 3997 B12R1.125 NC(=O)NCc1ccccc1O Amb27401863 [0,2,0,0,0,0|1,0,1]=4 3998 B12R1.125 NC(=O)NNc1ccccc1F Amb26495079 [0,2,0,0,0,0|2,0,0]=4 3999 B12R1.125 NC(=O)OCc1ccccc1Cl Amb27233024 [0,2,0,0,0,0|1,0,1]=4 4000 B12R1.125 NC(=O)OCc1ccccc1F Amb27770205 [0,2,0,0,0,0|1,0,1]=4 4001 B12R1.125 NC(=O)\C=C\c1ccccc1Br Amb8997717 [0,2,0,0,0,0|0,0,0]=2 4002 B12R1.125 NC(=O)\C=C\c1ccccc1F Amb8997697 [0,2,0,0,0,0|0,0,0]=2 4003 B12R1.125 NC(=O)\C=C\c1ccccc1I Amb26608900 [0,2,0,0,0,0|0,0,0]=2 4004 B12R1.125 NC(=O)\C=C\c1ccccc1N Amb28202728 [0,2,0,0,0,0|0,0,0]=2 4005 B12R1.125 NC(=O)\C=C\c1ccccc1O Amb18645808 [0,2,0,0,0,0|0,0,0]=2 4006 B12R1.125 NC(=O)\C=C\c1cnccc1N Amb27878871 [0,2,0,0,0,0|1,0,0]=3 4007 B12R1.125 NC(=O)\N=C\c1ccccc1O Amb27256381 [0,2,0,0,0,0|1,0,0]=3 4008 B12R1.125 NC(=O)\N=N\c1ccccc1F Amb27409027 [0,2,0,0,0,0|2,0,0]=4 4009 B12R1.125 NC(=O)\N=N\c1ccccc1O Amb24341737 [0,2,0,0,0,0|2,0,0]=4 4010 B12R1.125 NC(=S)\C=C\c1ccccc1Cl Amb27984695 [0,2,0,0,0,0|0,1,0]=3 4011 B12R1.125 NC(=S)\C=C\c1ccccc1O Amb27399525 [0,2,0,0,0,0|0,1,0]=3 4012 B12R1.125 Nc1ccccc1C#CC(=O)O Amb24355867 [0,2,0,0,0,0|0,0,2]=4 4013 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [0,2,0,0,0,0|0,0,2]=4 4014 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [0,2,0,0,0,0|0,0,2]=4 4015 B12R1.125 Nc1ccccc1CCC(=O)[O-] Amb34189651 [0,2,0,0,0,0|0,0,2]=4 4016 B12R1.125 Nc1ccccc1OCC(=O)O Amb4065760 [0,2,0,0,0,0|1,0,1]=4 4017 B12R1.125 Nc1ccccc1OCC(=O)[O-] Amb21972214 [0,2,0,0,0,0|1,0,1]=4 4018 B12R1.125 Nc1ccccc1SCC(=O)Cl Amb28073003 [0,2,0,0,0,0|1,0,1]=4 4019 B12R1.125 Nc1ccccc1SCC(=O)O Amb6267584 [0,2,0,0,0,0|1,0,1]=4 4020 B12R1.125 Nc1ccccc1\C=C\C(=O)O Amb17777291 [0,2,0,0,0,0|0,0,0]=2 4021 B12R1.125 Nc1cnccc1\C=C\C(=O)O Amb4560900 [0,2,0,0,0,0|1,0,0]=3 4022 B12R1.125 Nc1ncccc1\C=C\C(=O)O Amb2697575 [0,2,0,0,0,0|1,0,0]=3 4023 B12R1.125 O=C(Br)COc1ccccc1Cl Amb27481125 [0,2,0,0,0,0|1,0,1]=4 4024 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [0,2,0,0,0,0|0,0,2]=4 4025 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [0,2,0,0,0,0|0,0,2]=4 4026 B12R1.125 O=C(Cl)CCc1ccccc1F Amb10838958 [0,2,0,0,0,0|0,0,2]=4 4027 B12R1.125 O=C(Cl)CNc1ccccc1Cl Amb28239488 [0,2,0,0,0,0|1,0,1]=4 4028 B12R1.125 O=C(Cl)COc1ccccc1Br Amb16230053 [0,2,0,0,0,0|1,0,1]=4 4029 B12R1.125 O=C(Cl)COc1ccccc1Cl Amb16230049 [0,2,0,0,0,0|1,0,1]=4 4030 B12R1.125 O=C(Cl)COc1ccccc1F Amb10880012 [0,2,0,0,0,0|1,0,1]=4 4031 B12R1.125 O=C(Cl)CSc1ccccc1Cl Amb17143819 [0,2,0,0,0,0|1,0,1]=4 4032 B12R1.125 O=C(Cl)NCc1ccccc1Br Amb35625598 [0,2,0,0,0,0|1,0,1]=4 4033 B12R1.125 O=C(Cl)NCc1ccccc1Cl Amb35637057 [0,2,0,0,0,0|1,0,1]=4 4034 B12R1.125 O=C(Cl)NCc1ccccc1F Amb35625946 [0,2,0,0,0,0|1,0,1]=4 4035 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [0,2,0,0,0,0|1,0,1]=4 4036 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [0,2,0,0,0,0|1,0,1]=4 4037 B12R1.125 O=C(Cl)\C=C/c1ccccc1Cl Amb10070071 [0,2,0,0,0,0|0,0,0]=2 4038 B12R1.125 O=C(Cl)\C=C\c1ccccc1Br Amb16230254 [0,2,0,0,0,0|0,0,0]=2 4039 B12R1.125 O=C(Cl)\C=C\c1ccccc1Cl Amb8629219 [0,2,0,0,0,0|0,0,0]=2 4040 B12R1.125 O=C(Cl)\C=C\c1ccccc1F Amb2688309 [0,2,0,0,0,0|0,0,0]=2 4041 B12R1.125 O=C(O)C#Cc1ccccc1Br Amb25266206 [0,2,0,0,0,0|0,0,2]=4 4042 B12R1.125 O=C(O)C#Cc1ccccc1Cl Amb2616696 [0,2,0,0,0,0|0,0,2]=4 4043 B12R1.125 O=C(O)C#Cc1ccccc1F Amb7172545 [0,2,0,0,0,0|0,0,2]=4 4044 B12R1.125 O=C(O)C#Cc1ccccc1O Amb25921689 [0,2,0,0,0,0|0,0,2]=4 4045 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [0,2,0,0,0,0|0,0,2]=4 4046 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [0,2,0,0,0,0|0,0,2]=4 4047 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [0,2,0,0,0,0|0,0,2]=4 4048 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [0,2,0,0,0,0|0,0,2]=4 4049 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [0,2,0,0,0,0|0,0,2]=4 4050 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [0,2,0,0,0,0|0,0,2]=4 4051 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [0,2,0,0,0,0|1,0,1]=4 4052 B12R1.125 O=C(O)CNc1ccccc1Cl Amb33528017 [0,2,0,0,0,0|1,0,1]=4 4053 B12R1.125 O=C(O)CNc1ccccc1F Amb840521 [0,2,0,0,0,0|1,0,1]=4 4054 B12R1.125 O=C(O)CNc1ccccc1O Amb842591 [0,2,0,0,0,0|1,0,1]=4 4055 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [0,2,0,0,0,0|1,0,1]=4 4056 B12R1.125 O=C(O)COc1ccccc1Cl Amb6336452 [0,2,0,0,0,0|1,0,1]=4 4057 B12R1.125 O=C(O)COc1ccccc1F Amb6335614 [0,2,0,0,0,0|1,0,1]=4 4058 B12R1.125 O=C(O)COc1ccccc1I Amb9339538 [0,2,0,0,0,0|1,0,1]=4 4059 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [0,2,0,0,0,0|1,0,1]=4 4060 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [0,2,0,0,0,0|1,0,1]=4 4061 B12R1.125 O=C(O)CSc1ccccc1Cl Amb1105912 [0,2,0,0,0,0|1,0,1]=4 4062 B12R1.125 O=C(O)CSc1ccccc1F Amb1105913 [0,2,0,0,0,0|1,0,1]=4 4063 B12R1.125 O=C(O)CSc1ccccc1O Amb18294823 [0,2,0,0,0,0|1,0,1]=4 4064 B12R1.125 O=C(O)\C=C\C1=CN=CNC1=O Amb18646423 [0,2,0,0,0,0|2,0,0]=4 4065 B12R1.125 O=C(O)\C=C\N1C=CC=CC1=S Amb27657743 [0,2,0,0,0,0|1,0,0]=3 4066 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb33718813 [0,2,0,0,0,0|0,0,0]=2 4067 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb6664185 [0,2,0,0,0,0|0,0,0]=2 4068 B12R1.125 O=C(O)\C=C\c1ccccc1Cl Amb6336512 [0,2,0,0,0,0|0,0,0]=2 4069 B12R1.125 O=C(O)\C=C\c1ccccc1F Amb6545502 [0,2,0,0,0,0|0,0,0]=2 4070 B12R1.125 O=C(O)\C=C\c1ccccc1I Amb22584152 [0,2,0,0,0,0|0,0,0]=2 4071 B12R1.125 O=C(O)\C=C\c1ccccc1O Amb8513188 [0,2,0,0,0,0|0,0,0]=2 4072 B12R1.125 O=C(O)\C=C\c1cccnc1Br Amb33451204 [0,2,0,0,0,0|1,0,0]=3 4073 B12R1.125 O=C(O)\C=C\c1cccnc1F Amb33473819 [0,2,0,0,0,0|1,0,0]=3 4074 B12R1.125 O=C(O)\C=C\c1ccncc1Br Amb18659757 [0,2,0,0,0,0|1,0,0]=3 4075 B12R1.125 O=C(O)\C=C\c1ccncc1Cl Amb33261635 [0,2,0,0,0,0|1,0,0]=3 4076 B12R1.125 O=C(O)\C=C\c1ccncc1F Amb26946507 [0,2,0,0,0,0|1,0,0]=3 4077 B12R1.125 O=C(O)\C=C\c1cnccc1O Amb18646198 [0,2,0,0,0,0|1,0,0]=3 4078 B12R1.125 O=C(O)\C=C\c1ncccc1Br Amb25975550 [0,2,0,0,0,0|1,0,0]=3 4079 B12R1.125 O=C(O)\C=C\c1ncccc1Cl Amb26552463 [0,2,0,0,0,0|1,0,0]=3 4080 B12R1.125 O=C(O)\C=C\c1ncccc1F Amb32662908 [0,2,0,0,0,0|1,0,0]=3 4081 B12R1.125 O=C(O)\C=C\c1ncncc1Br Amb33470080 [0,2,0,0,0,0|2,0,0]=4 4082 B12R1.125 O=C([O-])CCc1ccccc1F Amb15692476 [0,2,0,0,0,0|0,0,2]=4 4083 B12R1.125 O=S([O-])\C=C\c1ccccc1Br Amb32754055 [0,2,0,0,0,0|1,0,0]=3 4084 B12R1.125 O=S([O-])\C=C\c1ccccc1F Amb32754864 [0,2,0,0,0,0|1,0,0]=3 4085 B12R1.125 O=[N+]([O-])\C=C/c1ccccc1F Amb10839832 [0,2,0,0,0,0|1,0,0]=3 4086 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1Cl Amb2762665 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1Cl Amb33714745 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1F Amb6876254 [0,2,0,0,0,0|1,0,0]=3 4089 B12R1.125 O=[N+]([O-])\C=C\c1ccccc1O Amb32953488 [0,2,0,0,0,0|1,0,0]=3 4090 B12R1.125 O=[N+]([O-])\C=C\c1cccnc1Br Amb33456682 [0,2,0,0,0,0|2,0,0]=4 4091 B12R1.125 O=[N+]([O-])\C=C\c1cccnc1Cl Amb33257377 [0,2,0,0,0,0|2,0,0]=4 4092 B12R1.125 O=[N+]([O-])\C=C\c1cccnc1F Amb33377188 [0,2,0,0,0,0|2,0,0]=4 4093 B12R1.125 O=[N+]([O-])\C=C\c1ccncc1Br Amb33478363 [0,2,0,0,0,0|2,0,0]=4 4094 B12R1.125 O=[N+]([O-])\C=C\c1ccncc1Cl Amb33456677 [0,2,0,0,0,0|2,0,0]=4 4095 B12R1.125 O=[N+]([O-])\C=C\c1ccncc1F Amb33317166 [0,2,0,0,0,0|2,0,0]=4 4096 B12R1.125 O=[N+]([O-])\C=C\c1cnccc1Cl Amb27224416 [0,2,0,0,0,0|2,0,0]=4 4097 B12R1.125 O=[N+]([O-])\C=C\c1ncccc1Br Amb33336106 [0,2,0,0,0,0|2,0,0]=4 4098 B12R1.125 O=[N+]([O-])\C=C\c1ncccc1F Amb33456685 [0,2,0,0,0,0|2,0,0]=4 4099 B12R1.267 CCO\C=C\c1ccccc1Cl Amb24603799 [0,2,0,0,0,0|1,0,1]=4 4100 B12R1.267 CNC\C=C\c1ccccc1C Amb23442941 [0,2,0,0,0,0|1,0,1]=4 4101 B12R1.267 CNC\C=C\c1ccccc1F Amb23442841 [0,2,0,0,0,0|1,0,1]=4 4102 B12R1.267 C\C=C/C=C\c1ccccc1O Amb28122369 [0,2,0,0,0,0|1,0,0]=3 4103 B12R1.267 C\C=C\CCc1ccccc1C Amb27267945 [0,2,0,0,0,0|1,0,1]=4 4104 B12R1.267 C\C=C\CNc1ccccc1C Amb27606301 [0,2,0,0,0,0|1,0,1]=4 4105 B12R1.267 C\C=C\COc1ccccc1N Amb18290042 [0,2,0,0,0,0|1,0,1]=4 4106 B12R1.267 C\C=C\CSc1ccccc1Br Amb28398756 [0,2,0,0,0,0|1,0,1]=4 4107 B12R1.267 C\C=C\CSc1ccccc1C Amb4020367 [0,2,0,0,0,0|1,0,1]=4 4108 B12R1.267 Cc1ccccc1C=C=CCO Amb28435849 [0,2,0,0,0,0|0,0,2]=4 4109 B12R1.267 Cc1ccccc1CCCC=O Amb18645710 [0,2,0,0,0,0|0,0,2]=4 4110 B12R1.267 Cc1ccccc1CSCC=O Amb18184909 [0,2,0,0,0,0|0,0,2]=4 4111 B12R1.267 Cc1ccccc1NC\C=C/Cl Amb27407084 [0,2,0,0,0,0|1,0,1]=4 4112 B12R1.267 Cc1ccccc1NC\C=C\Cl Amb28045972 [0,2,0,0,0,0|1,0,1]=4 4113 B12R1.267 Cc1ccccc1OCCC=O Amb5731759 [0,2,0,0,0,0|0,0,2]=4 4114 B12R1.267 Cc1ccccc1OC\C=C/Cl Amb27658979 [0,2,0,0,0,0|1,0,1]=4 4115 B12R1.267 Cc1ccccc1OC\C=C\Cl Amb27215119 [0,2,0,0,0,0|1,0,1]=4 4116 B12R1.267 Cc1ccccc1SCCC=O Amb18178931 [0,2,0,0,0,0|0,0,2]=4 4117 B12R1.267 Cc1ccccc1\C=C\CC#N Amb24611737 [0,2,0,0,0,0|1,0,1]=4 4118 B12R1.267 Cc1ccccc1\C=C\CCBr Amb17246876 [0,2,0,0,0,0|1,0,1]=4 4119 B12R1.267 Cc1ccccc1\C=C\CCCl Amb17233777 [0,2,0,0,0,0|1,0,1]=4 4120 B12R1.267 Cc1ccccc1\C=C\CCN Amb17232386 [0,2,0,0,0,0|1,0,1]=4 4121 B12R1.267 Cc1ccccc1\C=C\CCO Amb27978430 [0,2,0,0,0,0|0,0,2]=4 4122 B12R1.267 Cc1cccnc1N\C=C\C=O Amb27256404 [0,2,0,0,0,0|1,0,0]=3 4123 B12R1.267 ClCC\C=C\c1ccccc1Cl Amb17237226 [0,2,0,0,0,0|1,0,1]=4 4124 B12R1.267 Cl\C=C\CNc1ccccc1I Amb28207679 [0,2,0,0,0,0|1,0,1]=4 4125 B12R1.267 Clc1ccccc1\C=C\CCBr Amb17258089 [0,2,0,0,0,0|1,0,1]=4 4126 B12R1.267 Fc1ccccc1SC\C=C\Cl Amb27609566 [0,2,0,0,0,0|1,0,1]=4 4127 B12R1.267 Fc1ccccc1\C=C\CCBr Amb17248420 [0,2,0,0,0,0|1,0,1]=4 4128 B12R1.267 Fc1ccccc1\C=C\CCCl Amb17234150 [0,2,0,0,0,0|1,0,1]=4 4129 B12R1.267 N#CC\C=C\c1ccccc1Br Amb26607196 [0,2,0,0,0,0|1,0,1]=4 4130 B12R1.267 N#CC\C=C\c1ccccc1Cl Amb27663574 [0,2,0,0,0,0|1,0,1]=4 4131 B12R1.267 N#CC\C=C\c1ccccc1F Amb25854230 [0,2,0,0,0,0|1,0,1]=4 4132 B12R1.267 NCC\C=C\c1ccccc1Cl Amb17233874 [0,2,0,0,0,0|1,0,1]=4 4133 B12R1.267 NCC\C=C\c1ccccc1F Amb17232531 [0,2,0,0,0,0|1,0,1]=4 4134 B12R1.267 NCC\C=C\c1ccccc1O Amb27965289 [0,2,0,0,0,0|1,0,1]=4 4135 B12R1.267 NNC\C=C\c1ccccc1Cl Amb18648720 [0,2,0,0,0,0|1,0,1]=4 4136 B12R1.267 Nc1ccccc1C\C=C\CO Amb28290910 [0,2,0,0,0,0|0,0,2]=4 4137 B12R1.267 Nc1ccccc1N\C=C/C=O Amb27876581 [0,2,0,0,0,0|0,0,0]=2 4138 B12R1.267 Nc1ccccc1N\C=C\CO Amb27866483 [0,2,0,0,0,0|0,0,2]=4 4139 B12R1.267 Nc1ccccc1OC\C=C\Cl Amb18971536 [0,2,0,0,0,0|1,0,1]=4 4140 B12R1.267 O=C=N\C=C\c1ccccc1Cl Amb25101906 [0,2,0,0,0,0|0,0,1]=3 4141 B12R1.267 O=CCCCc1ccccc1Br Amb33451106 [0,2,0,0,0,0|0,0,2]=4 4142 B12R1.267 O=CCCCc1ccccc1Cl Amb32750392 [0,2,0,0,0,0|0,0,2]=4 4143 B12R1.267 O=CCCCc1ccccc1F Amb33474216 [0,2,0,0,0,0|0,0,2]=4 4144 B12R1.267 O=CCCCc1ccccc1O Amb18646065 [0,2,0,0,0,0|0,0,2]=4 4145 B12R1.267 O=CCCOc1ccccc1Br Amb17099971 [0,2,0,0,0,0|0,0,2]=4 4146 B12R1.267 O=CCCOc1ccccc1Cl Amb5731775 [0,2,0,0,0,0|0,0,2]=4 4147 B12R1.267 O=CCCSc1ccccc1Br Amb32682705 [0,2,0,0,0,0|0,0,2]=4 4148 B12R1.267 O=CCCSc1ccccc1Cl Amb18317016 [0,2,0,0,0,0|0,0,2]=4 4149 B12R1.267 O=CCCSc1ccccc1F Amb19045412 [0,2,0,0,0,0|0,0,2]=4 4150 B12R1.267 O=CCSCc1ccccc1Cl Amb32683106 [0,2,0,0,0,0|0,0,2]=4 4151 B12R1.267 O=CNCCc1ccccc1Br Amb28410820 [0,2,0,0,0,0|0,0,2]=4 4152 B12R1.267 O=CN\N=C\c1ccccc1O Amb9802007 [0,2,0,0,0,0|1,0,0]=3 4153 B12R1.371 C=CC(=O)Cc1ccccc1Br Amb28143882 [0,2,0,0,0,0|1,0,1]=4 4154 B12R1.371 C=CC(=O)Cc1ccccc1F Amb2699672 [0,2,0,0,0,0|1,0,1]=4 4155 B12R1.371 C=CC(=O)Nc1ccccc1C Amb6843670 [0,2,0,0,0,0|2,0,0]=4 4156 B12R1.371 C=CC(=O)Nc1ccccc1Cl Amb6843675 [0,2,0,0,0,0|2,0,0]=4 4157 B12R1.371 C=CC(=O)Nc1ccccc1F Amb6843680 [0,2,0,0,0,0|2,0,0]=4 4158 B12R1.371 C=CC(=O)Nc1ccccc1I Amb9261228 [0,2,0,0,0,0|2,0,0]=4 4159 B12R1.371 C=CC(=O)Oc1ccccc1C Amb28204165 [0,2,0,0,0,0|2,0,0]=4 4160 B12R1.371 C=CC(=O)Oc1ccccc1Cl Amb28364728 [0,2,0,0,0,0|2,0,0]=4 4161 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [0,2,0,0,0,0|0,0,2]=4 4162 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [0,2,0,0,0,0|0,0,2]=4 4163 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [0,2,0,0,0,0|0,0,2]=4 4164 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [0,2,0,0,0,0|0,0,2]=4 4165 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [0,2,0,0,0,0|0,0,2]=4 4166 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [0,2,0,0,0,0|0,0,2]=4 4167 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [0,2,0,0,0,0|1,0,1]=4 4168 B12R1.371 CC(C=O)Oc1ccccc1F Amb35737124 [0,2,0,0,0,0|1,0,1]=4 4169 B12R1.371 CC(C=O)Oc1ccccc1I Amb30020615 [0,2,0,0,0,0|1,0,1]=4 4170 B12R1.371 CC(C=O)Sc1ccccc1Br Amb30020876 [0,2,0,0,0,0|1,0,1]=4 4171 B12R1.371 CC(C=O)Sc1ccccc1Cl Amb30020873 [0,2,0,0,0,0|1,0,1]=4 4172 B12R1.371 CC(C=O)Sc1ccccc1F Amb30020863 [0,2,0,0,0,0|1,0,1]=4 4173 B12R1.371 CC\C(C)=C/c1ccccc1O Amb28253700 [0,2,0,0,0,0|1,0,1]=4 4174 B12R1.371 CN(C=O)Cc1ccccc1Br Amb27228720 [0,2,0,0,0,0|1,0,1]=4 4175 B12R1.371 C\C(=C\c1ccccc1Br)CBr Amb27254538 [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.371 C\C(=C\c1ccccc1C)CBr Amb27656994 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.371 C\C(=C\c1ccccc1C)CN Amb28370194 [0,2,0,0,0,0|1,0,1]=4 4178 B12R1.371 C\C(=C\c1ccccc1F)CN Amb27837353 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.371 C\C(C=O)=C/c1ccccc1C Amb17334495 [0,2,0,0,0,0|0,0,0]=2 4180 B12R1.371 C\C(C=O)=C/c1ccccc1Cl Amb17335454 [0,2,0,0,0,0|0,0,0]=2 4181 B12R1.371 C\C(C=O)=C/c1ccccc1F Amb17334598 [0,2,0,0,0,0|0,0,0]=2 4182 B12R1.371 C\C(C=O)=C/c1nccnc1C Amb35600875 [0,2,0,0,0,0|2,0,0]=4 4183 B12R1.371 C\C(C=O)=C\c1ccccc1O Amb28457572 [0,2,0,0,0,0|0,0,0]=2 4184 B12R1.371 C\C=C(\C)Cc1ccccc1O Amb24380771 [0,2,0,0,0,0|1,0,1]=4 4185 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,2,0,0,0,0|0,0,2]=4 4186 B12R1.371 Cc1ccccc1CC(Cl)C=O Amb17204326 [0,2,0,0,0,0|0,0,2]=4 4187 B12R1.371 Cc1ccccc1CC(F)C=O Amb27251880 [0,2,0,0,0,0|0,0,2]=4 4188 B12R1.371 Cc1ccccc1OC(C)C=O Amb27841630 [0,2,0,0,0,0|1,0,1]=4 4189 B12R1.371 Cc1ccccc1SC(C)C=O Amb30020858 [0,2,0,0,0,0|1,0,1]=4 4190 B12R1.371 Cc1ccccc1\C=C(/F)C=O Amb27851468 [0,2,0,0,0,0|0,0,0]=2 4191 B12R1.371 O=CC(Cl)Cc1ccccc1Br Amb17204707 [0,2,0,0,0,0|0,0,2]=4 4192 B12R1.371 O=CC(Cl)Cc1ccccc1Cl Amb17204401 [0,2,0,0,0,0|0,0,2]=4 4193 B12R1.371 O=CC(Cl)Cc1ccccc1F Amb17204341 [0,2,0,0,0,0|0,0,2]=4 4194 B12R1.371 OC\C(Cl)=C/c1ccccc1O Amb27256379 [0,2,0,0,0,0|0,0,2]=4 4195 B12R1.374 C=C\C=C/c1cc(Cl)ccc1O Amb28243957 [0,2,0,0,0,0|1,0,0]=3 4196 B12R1.374 C\C=C\Cc1cc(C)ccc1O Amb26344517 [0,2,0,0,0,0|1,0,1]=4 4197 B12R1.374 C\C=C\Cc1cc(N)ccc1O Amb24341889 [0,2,0,0,0,0|1,0,1]=4 4198 B12R1.374 C\C=C\Cc1cc(O)ccc1O Amb26555817 [0,2,0,0,0,0|1,0,1]=4 4199 B12R1.374 Cc1ccc(Br)c(CCC=O)c1 Amb28187072 [0,2,0,0,0,0|0,0,2]=4 4200 B12R1.374 Cc1ccc(Br)c(OCC=O)c1 Amb35666597 [0,2,0,0,0,0|1,0,1]=4 4201 B12R1.374 Cc1ccc(Br)c(\C=C\C=O)c1 Amb33477881 [0,2,0,0,0,0|0,0,0]=2 4202 B12R1.374 Cc1ccc(Br)c(\C=C\CN)c1 Amb33477535 [0,2,0,0,0,0|1,0,1]=4 4203 B12R1.374 Cc1ccc(Br)c(\C=C\CO)c1 Amb33477530 [0,2,0,0,0,0|0,0,2]=4 4204 B12R1.374 Cc1ccc(Br)cc1CCC=O Amb27209546 [0,2,0,0,0,0|0,0,2]=4 4205 B12R1.374 Cc1ccc(Br)cc1\C=C\C=O Amb33450351 [0,2,0,0,0,0|0,0,0]=2 4206 B12R1.374 Cc1ccc(Br)cc1\C=C\CN Amb25699956 [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.374 Cc1ccc(Br)cc1\C=C\CO Amb33450354 [0,2,0,0,0,0|0,0,2]=4 4208 B12R1.374 Cc1ccc(C)c(CCC=O)c1 Amb18798123 [0,2,0,0,0,0|0,0,2]=4 4209 B12R1.374 Cc1ccc(C)c(OCC=O)c1 Amb5731826 [0,2,0,0,0,0|1,0,1]=4 4210 B12R1.374 Cc1ccc(C)c(SCC=O)c1 Amb17082911 [0,2,0,0,0,0|1,0,1]=4 4211 B12R1.374 Cc1ccc(C)c(\C=C\C#N)c1 Amb17232211 [0,2,0,0,0,0|1,0,1]=4 4212 B12R1.374 Cc1ccc(C)c(\C=C\C=O)c1 Amb17232317 [0,2,0,0,0,0|0,0,0]=2 4213 B12R1.374 Cc1ccc(C)c(\C=C\CBr)c1 Amb27459545 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.374 Cc1ccc(C)c(\C=C\CCl)c1 Amb25204789 [0,2,0,0,0,0|1,0,1]=4 4215 B12R1.374 Cc1ccc(C)c(\C=C\CN)c1 Amb18563536 [0,2,0,0,0,0|1,0,1]=4 4216 B12R1.374 Cc1ccc(C)c(\C=C\CO)c1 Amb27174811 [0,2,0,0,0,0|0,0,2]=4 4217 B12R1.374 Cc1ccc(Cl)c(CCC=O)c1 Amb27471041 [0,2,0,0,0,0|0,0,2]=4 4218 B12R1.374 Cc1ccc(Cl)c(\C=C\C=O)c1 Amb33260489 [0,2,0,0,0,0|0,0,0]=2 4219 B12R1.374 Cc1ccc(Cl)c(\C=C\CN)c1 Amb33260493 [0,2,0,0,0,0|1,0,1]=4 4220 B12R1.374 Cc1ccc(Cl)c(\C=C\CO)c1 Amb33260492 [0,2,0,0,0,0|0,0,2]=4 4221 B12R1.374 Cc1ccc(Cl)cc1CCC=O Amb18564227 [0,2,0,0,0,0|0,0,2]=4 4222 B12R1.374 Cc1ccc(Cl)cc1\C=C\C#N Amb17233378 [0,2,0,0,0,0|1,0,1]=4 4223 B12R1.374 Cc1ccc(Cl)cc1\C=C\C=O Amb17233765 [0,2,0,0,0,0|0,0,0]=2 4224 B12R1.374 Cc1ccc(Cl)cc1\C=C\CN Amb28369939 [0,2,0,0,0,0|1,0,1]=4 4225 B12R1.374 Cc1ccc(Cl)cc1\C=C\CO Amb25721181 [0,2,0,0,0,0|0,0,2]=4 4226 B12R1.374 Cc1ccc(F)c(CCC=O)c1 Amb25775656 [0,2,0,0,0,0|0,0,2]=4 4227 B12R1.374 Cc1ccc(F)c(OCC=O)c1 Amb28241692 [0,2,0,0,0,0|1,0,1]=4 4228 B12R1.374 Cc1ccc(F)c(\C=C\C=O)c1 Amb32954143 [0,2,0,0,0,0|0,0,0]=2 4229 B12R1.374 Cc1ccc(F)c(\C=C\CN)c1 Amb33079803 [0,2,0,0,0,0|1,0,1]=4 4230 B12R1.374 Cc1ccc(F)c(\C=C\CO)c1 Amb27834532 [0,2,0,0,0,0|0,0,2]=4 4231 B12R1.374 Cc1ccc(F)cc1CCC=O Amb26860965 [0,2,0,0,0,0|0,0,2]=4 4232 B12R1.374 Cc1ccc(F)cc1OCC=O Amb28430393 [0,2,0,0,0,0|1,0,1]=4 4233 B12R1.374 Cc1ccc(F)cc1\C=C\C#N Amb27438426 [0,2,0,0,0,0|1,0,1]=4 4234 B12R1.374 Cc1ccc(F)cc1\C=C\C=O Amb33429725 [0,2,0,0,0,0|0,0,0]=2 4235 B12R1.374 Cc1ccc(F)cc1\C=C\CN Amb33475365 [0,2,0,0,0,0|1,0,1]=4 4236 B12R1.374 Cc1ccc(F)cc1\C=C\CO Amb33358703 [0,2,0,0,0,0|0,0,2]=4 4237 B12R1.374 Cc1ccc(I)c(CCC=O)c1 Amb27851427 [0,2,0,0,0,0|0,0,2]=4 4238 B12R1.374 Cc1ccc(O)c(CCC=O)c1 Amb24527959 [0,2,0,0,0,0|0,0,2]=4 4239 B12R1.374 Cc1ccc(O)c(\C=C\C=O)c1 Amb33079853 [0,2,0,0,0,0|0,0,0]=2 4240 B12R1.374 Cc1ccc(O)c(\C=C\CN)c1 Amb33268329 [0,2,0,0,0,0|1,0,1]=4 4241 B12R1.374 Cc1ccc(O)c(\C=C\CO)c1 Amb18646066 [0,2,0,0,0,0|0,0,2]=4 4242 B12R1.374 ClC\C=C\c1cc(Br)ccc1Cl Amb27619079 [0,2,0,0,0,0|1,0,1]=4 4243 B12R1.374 ClC\C=C\c1cc(Cl)ccc1Br Amb27871928 [0,2,0,0,0,0|1,0,1]=4 4244 B12R1.374 Clc1ccc(Br)c(\C=C\CBr)c1 Amb27167381 [0,2,0,0,0,0|1,0,1]=4 4245 B12R1.374 Clc1ccc(Br)cc1\C=C\CBr Amb27796771 [0,2,0,0,0,0|1,0,1]=4 4246 B12R1.374 Fc1ccc(Br)c(\C=C\CCl)c1 Amb28350328 [0,2,0,0,0,0|1,0,1]=4 4247 B12R1.374 Fc1ccc(Cl)cc1\C=C\CBr Amb27656202 [0,2,0,0,0,0|1,0,1]=4 4248 B12R1.374 N#C\C=C\c1cc(Br)ccc1Cl Amb27438427 [0,2,0,0,0,0|1,0,1]=4 4249 B12R1.374 N#C\C=C\c1cc(Cl)ccc1Cl Amb17236712 [0,2,0,0,0,0|1,0,1]=4 4250 B12R1.374 NC\C=C\c1cc(Br)ccc1Cl Amb33450889 [0,2,0,0,0,0|1,0,1]=4 4251 B12R1.374 NC\C=C\c1cc(Br)ccc1F Amb25148430 [0,2,0,0,0,0|1,0,1]=4 4252 B12R1.374 NC\C=C\c1cc(Br)ccc1O Amb33333573 [0,2,0,0,0,0|1,0,1]=4 4253 B12R1.374 NC\C=C\c1cc(Cl)ccc1Br Amb33451385 [0,2,0,0,0,0|1,0,1]=4 4254 B12R1.374 NC\C=C\c1cc(Cl)ccc1Cl Amb23442826 [0,2,0,0,0,0|1,0,1]=4 4255 B12R1.374 NC\C=C\c1cc(Cl)ccc1F Amb25341754 [0,2,0,0,0,0|1,0,1]=4 4256 B12R1.374 NC\C=C\c1cc(Cl)ccc1O Amb33052675 [0,2,0,0,0,0|1,0,1]=4 4257 B12R1.374 NC\C=C\c1cc(F)ccc1Br Amb33450635 [0,2,0,0,0,0|1,0,1]=4 4258 B12R1.374 NC\C=C\c1cc(F)ccc1F Amb18563888 [0,2,0,0,0,0|1,0,1]=4 4259 B12R1.374 NC\C=C\c1cc(F)ccc1O Amb33379891 [0,2,0,0,0,0|1,0,1]=4 4260 B12R1.374 NC\C=C\c1cc(O)ccc1Br Amb33450386 [0,2,0,0,0,0|1,0,1]=4 4261 B12R1.374 NC\C=C\c1cc(O)ccc1O Amb33269470 [0,2,0,0,0,0|1,0,1]=4 4262 B12R1.374 Nc1ccc(F)c(CCC=O)c1 Amb27614027 [0,2,0,0,0,0|0,0,2]=4 4263 B12R1.374 Nc1ccc(F)cc1CCC=O Amb27614026 [0,2,0,0,0,0|0,0,2]=4 4264 B12R1.374 Nc1ccc(O)c(CCC=O)c1 Amb28129930 [0,2,0,0,0,0|0,0,2]=4 4265 B12R1.374 Nc1ccc(S)c(CCC=O)c1 Amb27777371 [0,2,0,0,0,0|0,0,2]=4 4266 B12R1.374 O=CC#Cc1cc(F)ccc1F Amb28319760 [0,2,0,0,0,0|0,0,2]=4 4267 B12R1.374 O=CCCc1cc(Br)ccc1Br Amb26904631 [0,2,0,0,0,0|0,0,2]=4 4268 B12R1.374 O=CCCc1cc(Br)ccc1Cl Amb24093048 [0,2,0,0,0,0|0,0,2]=4 4269 B12R1.374 O=CCCc1cc(Br)ccc1F Amb27460881 [0,2,0,0,0,0|0,0,2]=4 4270 B12R1.374 O=CCCc1cc(Br)ccc1O Amb26009876 [0,2,0,0,0,0|0,0,2]=4 4271 B12R1.374 O=CCCc1cc(Cl)ccc1Br Amb25669683 [0,2,0,0,0,0|0,0,2]=4 4272 B12R1.374 O=CCCc1cc(Cl)ccc1Cl Amb10606178 [0,2,0,0,0,0|0,0,2]=4 4273 B12R1.374 O=CCCc1cc(Cl)ccc1F Amb25336451 [0,2,0,0,0,0|0,0,2]=4 4274 B12R1.374 O=CCCc1cc(Cl)ccc1I Amb25941284 [0,2,0,0,0,0|0,0,2]=4 4275 B12R1.374 O=CCCc1cc(Cl)ccc1O Amb27148868 [0,2,0,0,0,0|0,0,2]=4 4276 B12R1.374 O=CCCc1cc(F)ccc1Br Amb20669022 [0,2,0,0,0,0|0,0,2]=4 4277 B12R1.374 O=CCCc1cc(F)ccc1Cl Amb25968941 [0,2,0,0,0,0|0,0,2]=4 4278 B12R1.374 O=CCCc1cc(F)ccc1F Amb18801724 [0,2,0,0,0,0|0,0,2]=4 4279 B12R1.374 O=CCCc1cc(F)ccc1I Amb25302517 [0,2,0,0,0,0|0,0,2]=4 4280 B12R1.374 O=CCCc1cc(F)ccc1O Amb24432683 [0,2,0,0,0,0|0,0,2]=4 4281 B12R1.374 O=CCCc1cc(F)ccc1S Amb27423576 [0,2,0,0,0,0|0,0,2]=4 4282 B12R1.374 O=CCCc1cc(I)ccc1Cl Amb27876661 [0,2,0,0,0,0|0,0,2]=4 4283 B12R1.374 O=CCCc1cc(I)ccc1F Amb27978680 [0,2,0,0,0,0|0,0,2]=4 4284 B12R1.374 O=CCCc1cc(I)ccc1O Amb27638722 [0,2,0,0,0,0|0,0,2]=4 4285 B12R1.374 O=CCCc1cc(I)ccc1S Amb27423735 [0,2,0,0,0,0|0,0,2]=4 4286 B12R1.374 O=CCCc1cc(O)ccc1Br Amb25311997 [0,2,0,0,0,0|0,0,2]=4 4287 B12R1.374 O=CCCc1cc(O)ccc1Cl Amb26846620 [0,2,0,0,0,0|0,0,2]=4 4288 B12R1.374 O=CCCc1cc(O)ccc1F Amb26879965 [0,2,0,0,0,0|0,0,2]=4 4289 B12R1.374 O=CCCc1cc(O)ccc1I Amb27604868 [0,2,0,0,0,0|0,0,2]=4 4290 B12R1.374 O=CCCc1cc(O)ccc1O Amb27962672 [0,2,0,0,0,0|0,0,2]=4 4291 B12R1.374 O=CCCc1cc(S)ccc1Cl Amb27428155 [0,2,0,0,0,0|0,0,2]=4 4292 B12R1.374 O=CCCc1cc(S)ccc1O Amb27423589 [0,2,0,0,0,0|0,0,2]=4 4293 B12R1.374 O=CCOc1cc(Cl)ccc1Cl Amb5731858 [0,2,0,0,0,0|1,0,1]=4 4294 B12R1.374 O=CCOc1cc(F)ccc1Br Amb27776004 [0,2,0,0,0,0|1,0,1]=4 4295 B12R1.374 O=CCOc1cc(F)ccc1Cl Amb27257466 [0,2,0,0,0,0|1,0,1]=4 4296 B12R1.374 O=CCOc1cc(F)ccc1F Amb28455954 [0,2,0,0,0,0|1,0,1]=4 4297 B12R1.374 O=CCSc1cc(Cl)ccc1Cl Amb25751305 [0,2,0,0,0,0|1,0,1]=4 4298 B12R1.374 O=CCSc1cc(F)ccc1F Amb19077118 [0,2,0,0,0,0|1,0,1]=4 4299 B12R1.374 O=CNCc1cc(Br)ccc1F Amb27756595 [0,2,0,0,0,0|1,0,1]=4 4300 B12R1.374 O=C\C=C\c1cc(Br)ccc1Br Amb33335172 [0,2,0,0,0,0|0,0,0]=2 4301 B12R1.374 O=C\C=C\c1cc(Br)ccc1Cl Amb27606261 [0,2,0,0,0,0|0,0,0]=2 4302 B12R1.374 O=C\C=C\c1cc(Br)ccc1F Amb33136424 [0,2,0,0,0,0|0,0,0]=2 4303 B12R1.374 O=C\C=C\c1cc(Br)ccc1O Amb33452163 [0,2,0,0,0,0|0,0,0]=2 4304 B12R1.374 O=C\C=C\c1cc(Br)cnc1Cl Amb33485669 [0,2,0,0,0,0|1,0,0]=3 4305 B12R1.374 O=C\C=C\c1cc(Br)cnc1F Amb33478517 [0,2,0,0,0,0|1,0,0]=3 4306 B12R1.374 O=C\C=C\c1cc(Cl)ccc1Br Amb28041802 [0,2,0,0,0,0|0,0,0]=2 4307 B12R1.374 O=C\C=C\c1cc(Cl)ccc1Cl Amb17237215 [0,2,0,0,0,0|0,0,0]=2 4308 B12R1.374 O=C\C=C\c1cc(Cl)ccc1F Amb33262431 [0,2,0,0,0,0|0,0,0]=2 4309 B12R1.374 O=C\C=C\c1cc(Cl)ccc1O Amb26443069 [0,2,0,0,0,0|0,0,0]=2 4310 B12R1.374 O=C\C=C\c1cc(Cl)cnc1F Amb33257548 [0,2,0,0,0,0|1,0,0]=3 4311 B12R1.374 O=C\C=C\c1cc(Cl)ncc1Br Amb33478146 [0,2,0,0,0,0|1,0,0]=3 4312 B12R1.374 O=C\C=C\c1cc(Cl)nnc1Cl Amb33259401 [0,2,0,0,0,0|2,0,0]=4 4313 B12R1.374 O=C\C=C\c1cc(F)ccc1Br Amb33452275 [0,2,0,0,0,0|0,0,0]=2 4314 B12R1.374 O=C\C=C\c1cc(F)ccc1F Amb33136426 [0,2,0,0,0,0|0,0,0]=2 4315 B12R1.374 O=C\C=C\c1cc(F)ccc1O Amb27781983 [0,2,0,0,0,0|0,0,0]=2 4316 B12R1.374 O=C\C=C\c1cc(O)ccc1Br Amb33451009 [0,2,0,0,0,0|0,0,0]=2 4317 B12R1.374 O=C\C=C\c1cc(O)ccc1O Amb33079006 [0,2,0,0,0,0|0,0,0]=2 4318 B12R1.374 OC\C=C\c1cc(Br)ccc1Cl Amb33451181 [0,2,0,0,0,0|0,0,2]=4 4319 B12R1.374 OC\C=C\c1cc(Br)ccc1F Amb25742275 [0,2,0,0,0,0|0,0,2]=4 4320 B12R1.374 OC\C=C\c1cc(Br)ccc1O Amb33333571 [0,2,0,0,0,0|0,0,2]=4 4321 B12R1.374 OC\C=C\c1cc(Cl)ccc1Br Amb33430058 [0,2,0,0,0,0|0,0,2]=4 4322 B12R1.374 OC\C=C\c1cc(Cl)ccc1Cl Amb23442825 [0,2,0,0,0,0|0,0,2]=4 4323 B12R1.374 OC\C=C\c1cc(Cl)ccc1F Amb28127857 [0,2,0,0,0,0|0,0,2]=4 4324 B12R1.374 OC\C=C\c1cc(Cl)ccc1O Amb18649021 [0,2,0,0,0,0|0,0,2]=4 4325 B12R1.374 OC\C=C\c1cc(F)ccc1Br Amb33430225 [0,2,0,0,0,0|0,0,2]=4 4326 B12R1.374 OC\C=C\c1cc(F)ccc1F Amb24082691 [0,2,0,0,0,0|0,0,2]=4 4327 B12R1.374 OC\C=C\c1cc(F)ccc1O Amb33379892 [0,2,0,0,0,0|0,0,2]=4 4328 B12R1.374 OC\C=C\c1cc(O)ccc1Br Amb33227874 [0,2,0,0,0,0|0,0,2]=4 4329 B12R1.374 OC\C=C\c1cc(O)ccc1O Amb33268530 [0,2,0,0,0,0|0,0,2]=4 4330 B12R1.374 Oc1ccc(O)c(C\C=C\Cl)c1 Amb24652640 [0,2,0,0,0,0|1,0,1]=4 4331 B12R1.1631 Cc1cccc(Br)c1CCC=O Amb24341814 [0,2,0,0,0,0|0,0,2]=4 4332 B12R1.1631 Cc1cccc(C)c1CCC=O Amb24092993 [0,2,0,0,0,0|0,0,2]=4 4333 B12R1.1631 Cc1cccc(C)c1OCC=O Amb5731825 [0,2,0,0,0,0|1,0,1]=4 4334 B12R1.1631 Cc1cccc(C)c1\C=C\C=O Amb33080455 [0,2,0,0,0,0|0,0,0]=2 4335 B12R1.1631 Cc1cccc(C)c1\C=C\CN Amb33171944 [0,2,0,0,0,0|1,0,1]=4 4336 B12R1.1631 Cc1cccc(C)c1\C=C\CO Amb33359467 [0,2,0,0,0,0|0,0,2]=4 4337 B12R1.1631 Cc1cccc(Cl)c1CCC=O Amb27211329 [0,2,0,0,0,0|0,0,2]=4 4338 B12R1.1631 Cc1cccc(Cl)c1\C=C\C=O Amb33259730 [0,2,0,0,0,0|0,0,0]=2 4339 B12R1.1631 Cc1cccc(Cl)c1\C=C\CN Amb33259738 [0,2,0,0,0,0|1,0,1]=4 4340 B12R1.1631 Cc1cccc(Cl)c1\C=C\CO Amb33259733 [0,2,0,0,0,0|0,0,2]=4 4341 B12R1.1631 Cc1cccc(F)c1CCC=O Amb24432818 [0,2,0,0,0,0|0,0,2]=4 4342 B12R1.1631 Cc1cccc(F)c1\C=C\C=O Amb33226245 [0,2,0,0,0,0|0,0,0]=2 4343 B12R1.1631 Cc1cccc(F)c1\C=C\CN Amb33143159 [0,2,0,0,0,0|1,0,1]=4 4344 B12R1.1631 Cc1cccc(F)c1\C=C\CO Amb33143160 [0,2,0,0,0,0|0,0,2]=4 4345 B12R1.1631 Cc1cccc(I)c1CCC=O Amb27962889 [0,2,0,0,0,0|0,0,2]=4 4346 B12R1.1631 Cc1cccc(S)c1CCC=O Amb27624765 [0,2,0,0,0,0|0,0,2]=4 4347 B12R1.1631 NC\C=C\c1c(Cl)cccc1Br Amb33336250 [0,2,0,0,0,0|1,0,1]=4 4348 B12R1.1631 NC\C=C\c1c(Cl)cccc1Cl Amb33136531 [0,2,0,0,0,0|1,0,1]=4 4349 B12R1.1631 NC\C=C\c1c(F)cccc1Br Amb33431040 [0,2,0,0,0,0|1,0,1]=4 4350 B12R1.1631 NC\C=C\c1c(F)cccc1Cl Amb18564351 [0,2,0,0,0,0|1,0,1]=4 4351 B12R1.1631 NC\C=C\c1c(F)cccc1F Amb33136517 [0,2,0,0,0,0|1,0,1]=4 4352 B12R1.1631 NC\C=C\c1c(O)cccc1Br Amb33336467 [0,2,0,0,0,0|1,0,1]=4 4353 B12R1.1631 NC\C=C\c1c(O)cccc1Cl Amb33261071 [0,2,0,0,0,0|1,0,1]=4 4354 B12R1.1631 Nc1cccc(S)c1CCC=O Amb28384695 [0,2,0,0,0,0|0,0,2]=4 4355 B12R1.1631 O=CCCc1c(Cl)cccc1Br Amb26494572 [0,2,0,0,0,0|0,0,2]=4 4356 B12R1.1631 O=CCCc1c(Cl)cccc1Cl Amb24092996 [0,2,0,0,0,0|0,0,2]=4 4357 B12R1.1631 O=CCCc1c(Cl)cccc1I Amb27759488 [0,2,0,0,0,0|0,0,2]=4 4358 B12R1.1631 O=CCCc1c(F)cccc1Br Amb25035166 [0,2,0,0,0,0|0,0,2]=4 4359 B12R1.1631 O=CCCc1c(F)cccc1Cl Amb17081684 [0,2,0,0,0,0|0,0,2]=4 4360 B12R1.1631 O=CCCc1c(F)cccc1F Amb25728226 [0,2,0,0,0,0|0,0,2]=4 4361 B12R1.1631 O=CCCc1c(F)cccc1I Amb25055675 [0,2,0,0,0,0|0,0,2]=4 4362 B12R1.1631 O=CCCc1c(F)cccc1S Amb27798716 [0,2,0,0,0,0|0,0,2]=4 4363 B12R1.1631 O=CCCc1c(O)cccc1Br Amb28046347 [0,2,0,0,0,0|0,0,2]=4 4364 B12R1.1631 O=CCCc1c(O)cccc1Cl Amb26845539 [0,2,0,0,0,0|0,0,2]=4 4365 B12R1.1631 O=CCCc1c(O)cccc1I Amb25784762 [0,2,0,0,0,0|0,0,2]=4 4366 B12R1.1631 O=CCCc1c(O)cccc1S Amb27259768 [0,2,0,0,0,0|0,0,2]=4 4367 B12R1.1631 O=CCCc1c(S)cccc1Br Amb28435487 [0,2,0,0,0,0|0,0,2]=4 4368 B12R1.1631 O=CCCc1c(S)cccc1Cl Amb27623464 [0,2,0,0,0,0|0,0,2]=4 4369 B12R1.1631 O=CCCc1c(S)cccc1S Amb28133073 [0,2,0,0,0,0|0,0,2]=4 4370 B12R1.1631 O=CCOc1c(Cl)cccc1Cl Amb5731860 [0,2,0,0,0,0|1,0,1]=4 4371 B12R1.1631 O=CNCc1c(Cl)cccc1Cl Amb35702735 [0,2,0,0,0,0|1,0,1]=4 4372 B12R1.1631 O=C\C=C/c1c(F)cccc1F Amb27423495 [0,2,0,0,0,0|0,0,0]=2 4373 B12R1.1631 O=C\C=C\c1c(Br)cccc1Br Amb33009386 [0,2,0,0,0,0|0,0,0]=2 4374 B12R1.1631 O=C\C=C\c1c(Cl)cccc1Br Amb33337613 [0,2,0,0,0,0|0,0,0]=2 4375 B12R1.1631 O=C\C=C\c1c(Cl)cccc1Cl Amb33136428 [0,2,0,0,0,0|0,0,0]=2 4376 B12R1.1631 O=C\C=C\c1c(Cl)cncc1Cl Amb33256603 [0,2,0,0,0,0|1,0,0]=3 4377 B12R1.1631 O=C\C=C\c1c(Cl)ncnc1Cl Amb33262346 [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.1631 O=C\C=C\c1c(F)cccc1Br Amb33431038 [0,2,0,0,0,0|0,0,0]=2 4379 B12R1.1631 O=C\C=C\c1c(F)cccc1Cl Amb17335722 [0,2,0,0,0,0|0,0,0]=2 4380 B12R1.1631 O=C\C=C\c1c(F)cccc1F Amb33136480 [0,2,0,0,0,0|0,0,0]=2 4381 B12R1.1631 O=C\C=C\c1c(F)cncc1F Amb32882297 [0,2,0,0,0,0|1,0,0]=3 4382 B12R1.1631 O=C\C=C\c1c(O)cccc1Br Amb33336190 [0,2,0,0,0,0|0,0,0]=2 4383 B12R1.1631 O=C\C=C\c1c(O)cccc1Cl Amb33261058 [0,2,0,0,0,0|0,0,0]=2 4384 B12R1.1631 OC\C=C\c1c(Cl)cccc1Br Amb33337614 [0,2,0,0,0,0|0,0,2]=4 4385 B12R1.1631 OC\C=C\c1c(Cl)cccc1Cl Amb33136403 [0,2,0,0,0,0|0,0,2]=4 4386 B12R1.1631 OC\C=C\c1c(F)cccc1Br Amb27666063 [0,2,0,0,0,0|0,0,2]=4 4387 B12R1.1631 OC\C=C\c1c(F)cccc1Cl Amb33136461 [0,2,0,0,0,0|0,0,2]=4 4388 B12R1.1631 OC\C=C\c1c(F)cccc1F Amb33136460 [0,2,0,0,0,0|0,0,2]=4 4389 B12R1.1631 OC\C=C\c1c(O)cccc1Br Amb33336191 [0,2,0,0,0,0|0,0,2]=4 4390 B12R1.1631 OC\C=C\c1c(O)cccc1Cl Amb33261069 [0,2,0,0,0,0|0,0,2]=4 4391 B12R1.28 BrCC\C=C\c1cccc(Br)c1 Amb29880592 [0,2,0,0,0,0|1,0,1]=4 4392 B12R1.28 C#C\C=C\Oc1cccc(N)c1 Amb27249552 [0,2,0,0,0,0|1,0,1]=4 4393 B12R1.28 CNC\C=C\c1cccc(Br)c1 Amb26547783 [0,2,0,0,0,0|1,0,1]=4 4394 B12R1.28 CNC\C=C\c1cccc(C)c1 Amb23442961 [0,2,0,0,0,0|1,0,1]=4 4395 B12R1.28 CNC\C=C\c1cccc(F)c1 Amb23442889 [0,2,0,0,0,0|1,0,1]=4 4396 B12R1.28 C\C=C/COc1cccc(O)c1 Amb27409570 [0,2,0,0,0,0|1,0,1]=4 4397 B12R1.28 C\C=C\CNc1cccc(Br)c1 Amb27232571 [0,2,0,0,0,0|1,0,1]=4 4398 B12R1.28 C\C=C\CNc1cccc(Cl)c1 Amb27866490 [0,2,0,0,0,0|1,0,1]=4 4399 B12R1.28 C\C=C\COc1cccc(C)c1 Amb27596496 [0,2,0,0,0,0|1,0,1]=4 4400 B12R1.28 C\C=C\COc1cccc(F)c1 Amb27794079 [0,2,0,0,0,0|1,0,1]=4 4401 B12R1.28 C\C=C\COc1cccc(I)c1 Amb28460870 [0,2,0,0,0,0|1,0,1]=4 4402 B12R1.28 C\C=C\CSc1cccc(O)c1 Amb27748496 [0,2,0,0,0,0|1,0,1]=4 4403 B12R1.28 Cc1cccc(C#C\C=C\Cl)c1 Amb27645392 [0,2,0,0,0,0|1,0,1]=4 4404 B12R1.28 Cc1cccc(CCCC=O)c1 Amb33474174 [0,2,0,0,0,0|0,0,2]=4 4405 B12R1.28 Cc1cccc(CSCC=O)c1 Amb18184910 [0,2,0,0,0,0|0,0,2]=4 4406 B12R1.28 Cc1cccc(OCCC=O)c1 Amb5731760 [0,2,0,0,0,0|0,0,2]=4 4407 B12R1.28 Cc1cccc(OC\C=C\Cl)c1 Amb28314535 [0,2,0,0,0,0|1,0,1]=4 4408 B12R1.28 Cc1cccc(SCCC=O)c1 Amb17082972 [0,2,0,0,0,0|0,0,2]=4 4409 B12R1.28 Cc1cccc(\C=C\CC#N)c1 Amb25335796 [0,2,0,0,0,0|1,0,1]=4 4410 B12R1.28 Cc1cccc(\C=C\CCBr)c1 Amb17246877 [0,2,0,0,0,0|1,0,1]=4 4411 B12R1.28 Cc1cccc(\C=C\CCCl)c1 Amb17233778 [0,2,0,0,0,0|1,0,1]=4 4412 B12R1.28 Cc1cccc(\C=C\CCN)c1 Amb17232387 [0,2,0,0,0,0|1,0,1]=4 4413 B12R1.28 Cc1ccnc(N\C=C\C=O)c1 Amb27794447 [0,2,0,0,0,0|1,0,0]=3 4414 B12R1.28 ClCC\C=C\c1cccc(Br)c1 Amb29880786 [0,2,0,0,0,0|1,0,1]=4 4415 B12R1.28 ClCC\C=C\c1cccc(Cl)c1 Amb17237227 [0,2,0,0,0,0|1,0,1]=4 4416 B12R1.28 Cl\C=C\CNc1cccc(Cl)c1 Amb27233264 [0,2,0,0,0,0|1,0,1]=4 4417 B12R1.28 Clc1cccc(\C=C\CCBr)c1 Amb17258090 [0,2,0,0,0,0|1,0,1]=4 4418 B12R1.28 Fc1cccc(SC\C=C\Cl)c1 Amb27836541 [0,2,0,0,0,0|1,0,1]=4 4419 B12R1.28 Fc1cccc(\C=C\CCBr)c1 Amb17248421 [0,2,0,0,0,0|1,0,1]=4 4420 B12R1.28 Fc1cccc(\C=C\CCCl)c1 Amb17234151 [0,2,0,0,0,0|1,0,1]=4 4421 B12R1.28 N#CC\C=C\c1cccc(Br)c1 Amb25159827 [0,2,0,0,0,0|1,0,1]=4 4422 B12R1.28 N#CC\C=C\c1cccc(Cl)c1 Amb25283064 [0,2,0,0,0,0|1,0,1]=4 4423 B12R1.28 N#CC\C=C\c1cccc(F)c1 Amb27663706 [0,2,0,0,0,0|1,0,1]=4 4424 B12R1.28 N#CC\C=C\c1cccc(O)c1 Amb25328524 [0,2,0,0,0,0|1,0,1]=4 4425 B12R1.28 NCC\C=C\c1cccc(Br)c1 Amb26564163 [0,2,0,0,0,0|1,0,1]=4 4426 B12R1.28 NCC\C=C\c1cccc(Cl)c1 Amb17233875 [0,2,0,0,0,0|1,0,1]=4 4427 B12R1.28 NCC\C=C\c1cccc(F)c1 Amb17232532 [0,2,0,0,0,0|1,0,1]=4 4428 B12R1.28 NNC\C=C\c1cccc(Cl)c1 Amb18648721 [0,2,0,0,0,0|1,0,1]=4 4429 B12R1.28 O=C=N\C=C\c1cccc(Cl)c1 Amb25246678 [0,2,0,0,0,0|0,0,1]=3 4430 B12R1.28 O=C=N\C=C\c1cccc(F)c1 Amb23569112 [0,2,0,0,0,0|0,0,1]=3 4431 B12R1.28 O=CCCCc1cccc(Br)c1 Amb18048776 [0,2,0,0,0,0|0,0,2]=4 4432 B12R1.28 O=CCCCc1cccc(Cl)c1 Amb33406790 [0,2,0,0,0,0|0,0,2]=4 4433 B12R1.28 O=CCCCc1cccc(F)c1 Amb33449550 [0,2,0,0,0,0|0,0,2]=4 4434 B12R1.28 O=CCCCc1cccc(O)c1 Amb33358761 [0,2,0,0,0,0|0,0,2]=4 4435 B12R1.28 O=CCCOc1cccc(I)c1 Amb33307154 [0,2,0,0,0,0|0,0,2]=4 4436 B12R1.28 O=CCCSc1cccc(Br)c1 Amb32682701 [0,2,0,0,0,0|0,0,2]=4 4437 B12R1.28 O=CCCSc1cccc(Cl)c1 Amb17082982 [0,2,0,0,0,0|0,0,2]=4 4438 B12R1.28 O=CCCSc1cccc(F)c1 Amb32682707 [0,2,0,0,0,0|0,0,2]=4 4439 B12R1.28 O=CN\N=C\c1cccc(Br)c1 Amb27595355 [0,2,0,0,0,0|1,0,0]=3 4440 B12R1.28 O=CN\N=C\c1cccc(F)c1 Amb28317605 [0,2,0,0,0,0|1,0,0]=3 4441 B12R1.50 C=CC(=O)Cc1cccc(F)c1 Amb2699673 [0,2,0,0,0,0|1,0,1]=4 4442 B12R1.50 C=CC(=O)Nc1cccc(Br)c1 Amb33534001 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.50 C=CC(=O)Nc1cccc(C)c1 Amb6843664 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.50 C=CC(=O)Nc1cccc(Cl)c1 Amb6843674 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.50 C=CC(=O)Nc1cccc(F)c1 Amb6843681 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.50 C=CC(=O)Nc1cccc(O)c1 Amb6738692 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.50 C=CC(=O)Oc1cccc(Br)c1 Amb27247979 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.50 CC(C=O)Cc1cccc(Br)c1 Amb26348210 [0,2,0,0,0,0|0,0,2]=4 4450 B12R1.50 CC(C=O)Cc1cccc(F)c1 Amb25885683 [0,2,0,0,0,0|0,0,2]=4 4451 B12R1.50 CC(C=O)Cc1cccc(I)c1 Amb25850018 [0,2,0,0,0,0|0,0,2]=4 4452 B12R1.50 CC(C=O)Cc1cccc(N)c1 Amb25251154 [0,2,0,0,0,0|0,0,2]=4 4453 B12R1.50 CC(C=O)Cc1cccc(O)c1 Amb27601007 [0,2,0,0,0,0|0,0,2]=4 4454 B12R1.50 CC(C=O)Oc1cccc(Br)c1 Amb30020611 [0,2,0,0,0,0|1,0,1]=4 4455 B12R1.50 CC(C=O)Oc1cccc(F)c1 Amb30020587 [0,2,0,0,0,0|1,0,1]=4 4456 B12R1.50 CC(C=O)Oc1cccc(I)c1 Amb30020616 [0,2,0,0,0,0|1,0,1]=4 4457 B12R1.50 CC(C=O)Sc1cccc(Br)c1 Amb30020878 [0,2,0,0,0,0|1,0,1]=4 4458 B12R1.50 CC(C=O)Sc1cccc(Cl)c1 Amb30020871 [0,2,0,0,0,0|1,0,1]=4 4459 B12R1.50 CC(C=O)Sc1cccc(F)c1 Amb30020861 [0,2,0,0,0,0|1,0,1]=4 4460 B12R1.50 CN(C=O)Cc1cccc(Cl)c1 Amb27878332 [0,2,0,0,0,0|1,0,1]=4 4461 B12R1.50 CN(C=O)Cc1cccc(F)c1 Amb27616765 [0,2,0,0,0,0|1,0,1]=4 4462 B12R1.50 C\C(=C\c1cccc(Br)c1)CN Amb28134551 [0,2,0,0,0,0|1,0,1]=4 4463 B12R1.50 C\C(=C\c1cccc(Br)c1)CO Amb27470680 [0,2,0,0,0,0|0,0,2]=4 4464 B12R1.50 C\C(=C\c1cccc(C)c1)CBr Amb28206734 [0,2,0,0,0,0|1,0,1]=4 4465 B12R1.50 C\C(=C\c1cccc(Cl)c1)CBr Amb27485239 [0,2,0,0,0,0|1,0,1]=4 4466 B12R1.50 C\C(=C\c1cccc(Cl)c1)CCl Amb28320105 [0,2,0,0,0,0|1,0,1]=4 4467 B12R1.50 C\C(=C\c1cccc(F)c1)CN Amb27195481 [0,2,0,0,0,0|1,0,1]=4 4468 B12R1.50 C\C(=C\c1cccc(I)c1)CO Amb27668599 [0,2,0,0,0,0|0,0,2]=4 4469 B12R1.50 C\C(C=O)=C/c1cccc(Br)c1 Amb17343200 [0,2,0,0,0,0|0,0,0]=2 4470 B12R1.50 C\C(C=O)=C/c1cccc(C)c1 Amb17334497 [0,2,0,0,0,0|0,0,0]=2 4471 B12R1.50 C\C(C=O)=C/c1cccc(Cl)c1 Amb17335456 [0,2,0,0,0,0|0,0,0]=2 4472 B12R1.50 C\C(C=O)=C/c1cccc(F)c1 Amb27614503 [0,2,0,0,0,0|0,0,0]=2 4473 B12R1.50 C\C(C=O)=C/c1cccc(O)c1 Amb17334558 [0,2,0,0,0,0|0,0,0]=2 4474 B12R1.50 C\C(C=O)=C\c1cccc(Br)c1 Amb27748579 [0,2,0,0,0,0|0,0,0]=2 4475 B12R1.50 C\C(C=O)=C\c1cccc(O)c1 Amb28046443 [0,2,0,0,0,0|0,0,0]=2 4476 B12R1.50 C\C(C=O)=C\c1cncc(Br)c1 Amb27591389 [0,2,0,0,0,0|1,0,0]=3 4477 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,2,0,0,0,0|0,0,2]=4 4478 B12R1.50 Cc1cccc(CC(Cl)C=O)c1 Amb17204327 [0,2,0,0,0,0|0,0,2]=4 4479 B12R1.50 Cc1cccc(CC(F)C=O)c1 Amb28423095 [0,2,0,0,0,0|0,0,2]=4 4480 B12R1.50 Cc1cccc(SC(C)C=O)c1 Amb30020857 [0,2,0,0,0,0|1,0,1]=4 4481 B12R1.50 Cc1cccc(\C=C(\F)C=O)c1 Amb27788393 [0,2,0,0,0,0|0,0,0]=2 4482 B12R1.50 N#C\C(F)=C\c1cccc(Cl)c1 Amb24053598 [0,2,0,0,0,0|1,0,1]=4 4483 B12R1.50 Nc1cccc(O\C(Cl)=C\Cl)c1 Amb28239468 [0,2,0,0,0,0|2,0,0]=4 4484 B12R1.50 O=CC(=O)Cc1cccc(Cl)c1 Amb27488179 [0,2,0,0,0,0|0,0,1]=3 4485 B12R1.50 O=CC(Cl)Cc1cccc(Br)c1 Amb17204708 [0,2,0,0,0,0|0,0,2]=4 4486 B12R1.50 O=CC(Cl)Cc1cccc(Cl)c1 Amb17204402 [0,2,0,0,0,0|0,0,2]=4 4487 B12R1.50 O=CC(Cl)Cc1cccc(F)c1 Amb17204343 [0,2,0,0,0,0|0,0,2]=4 4488 B12R1.50 O=CC(F)Cc1cccc(F)c1 Amb27595749 [0,2,0,0,0,0|0,0,2]=4 4489 B12R1.100 Cc1cc(Br)cc(CCC=O)c1 Amb25141592 [0,2,0,0,0,0|0,0,2]=4 4490 B12R1.100 Cc1cc(Br)cc(\C=C\C=O)c1 Amb33430334 [0,2,0,0,0,0|0,0,0]=2 4491 B12R1.100 Cc1cc(Br)cc(\C=C\CN)c1 Amb33430290 [0,2,0,0,0,0|1,0,1]=4 4492 B12R1.100 Cc1cc(Br)cc(\C=C\CO)c1 Amb33430335 [0,2,0,0,0,0|0,0,2]=4 4493 B12R1.100 Cc1cc(C)cc(CCC=O)c1 Amb18798122 [0,2,0,0,0,0|0,0,2]=4 4494 B12R1.100 Cc1cc(C)cc(CNC=O)c1 Amb35728120 [0,2,0,0,0,0|1,0,1]=4 4495 B12R1.100 Cc1cc(C)cc(OCC=O)c1 Amb5731824 [0,2,0,0,0,0|1,0,1]=4 4496 B12R1.100 Cc1cc(C)cc(\C=C\C#N)c1 Amb17232213 [0,2,0,0,0,0|1,0,1]=4 4497 B12R1.100 Cc1cc(C)cc(\C=C\C=O)c1 Amb17232319 [0,2,0,0,0,0|0,0,0]=2 4498 B12R1.100 Cc1cc(C)cc(\C=C\CN)c1 Amb23555573 [0,2,0,0,0,0|1,0,1]=4 4499 B12R1.100 Cc1cc(C)cc(\C=C\CO)c1 Amb23555572 [0,2,0,0,0,0|0,0,2]=4 4500 B12R1.100 Cc1cc(Cl)cc(CCC=O)c1 Amb26511468 [0,2,0,0,0,0|0,0,2]=4 4501 B12R1.100 Cc1cc(Cl)cc(\C=C\C#N)c1 Amb27984105 [0,2,0,0,0,0|1,0,1]=4 4502 B12R1.100 Cc1cc(Cl)cc(\C=C\CBr)c1 Amb27192135 [0,2,0,0,0,0|1,0,1]=4 4503 B12R1.100 Cc1cc(Cl)cc(\C=C\CCl)c1 Amb27192134 [0,2,0,0,0,0|1,0,1]=4 4504 B12R1.100 Cc1cc(F)cc(CCC=O)c1 Amb25839793 [0,2,0,0,0,0|0,0,2]=4 4505 B12R1.100 Cc1cc(F)cc(\C=C\C=O)c1 Amb33343441 [0,2,0,0,0,0|0,0,0]=2 4506 B12R1.100 Cc1cc(F)cc(\C=C\CN)c1 Amb33344717 [0,2,0,0,0,0|1,0,1]=4 4507 B12R1.100 Cc1cc(F)cc(\C=C\CO)c1 Amb33343440 [0,2,0,0,0,0|0,0,2]=4 4508 B12R1.100 Cc1cc(I)cc(CCC=O)c1 Amb27614585 [0,2,0,0,0,0|0,0,2]=4 4509 B12R1.100 Cc1cc(I)cc(\C=C\C#N)c1 Amb33997764 [0,2,0,0,0,0|1,0,1]=4 4510 B12R1.100 Cc1cc(N)cc(CCC=O)c1 Amb27616079 [0,2,0,0,0,0|0,0,2]=4 4511 B12R1.100 Cc1cc(O)cc(\C=C\C#N)c1 Amb25233722 [0,2,0,0,0,0|1,0,1]=4 4512 B12R1.100 Cc1cc(\C=C\C=O)cc(Cl)n1 Amb33221983 [0,2,0,0,0,0|1,0,0]=3 4513 B12R1.100 N#C\C=C/c1cc(O)cc(F)c1 Amb28243958 [0,2,0,0,0,0|1,0,1]=4 4514 B12R1.100 N#C\C=C\c1cc(Br)cc(Br)c1 Amb27191541 [0,2,0,0,0,0|1,0,1]=4 4515 B12R1.100 N#C\C=C\c1cc(Cl)cc(Cl)c1 Amb17236713 [0,2,0,0,0,0|1,0,1]=4 4516 B12R1.100 NC\C=C\c1cc(Br)cc(Br)c1 Amb27491315 [0,2,0,0,0,0|1,0,1]=4 4517 B12R1.100 NC\C=C\c1cc(Cl)cc(Br)c1 Amb33436127 [0,2,0,0,0,0|1,0,1]=4 4518 B12R1.100 NC\C=C\c1cc(Cl)cc(Cl)c1 Amb24378786 [0,2,0,0,0,0|1,0,1]=4 4519 B12R1.100 NC\C=C\c1cc(F)cc(Br)c1 Amb33335284 [0,2,0,0,0,0|1,0,1]=4 4520 B12R1.100 NC\C=C\c1cc(F)cc(Cl)c1 Amb27253420 [0,2,0,0,0,0|1,0,1]=4 4521 B12R1.100 NC\C=C\c1cc(F)cc(F)c1 Amb33429722 [0,2,0,0,0,0|1,0,1]=4 4522 B12R1.100 Nc1cc(F)cc(CCC=O)c1 Amb27798933 [0,2,0,0,0,0|0,0,2]=4 4523 B12R1.100 Nc1cc(N)cc(CCC=O)c1 Amb27665955 [0,2,0,0,0,0|0,0,2]=4 4524 B12R1.100 O=CCCc1cc(Br)cc(Br)c1 Amb26349656 [0,2,0,0,0,0|0,0,2]=4 4525 B12R1.100 O=CCCc1cc(Br)cc(I)c1 Amb27836304 [0,2,0,0,0,0|0,0,2]=4 4526 B12R1.100 O=CCCc1cc(Cl)cc(Br)c1 Amb26880746 [0,2,0,0,0,0|0,0,2]=4 4527 B12R1.100 O=CCCc1cc(Cl)cc(Cl)c1 Amb18066575 [0,2,0,0,0,0|0,0,2]=4 4528 B12R1.100 O=CCCc1cc(F)cc(Br)c1 Amb26850424 [0,2,0,0,0,0|0,0,2]=4 4529 B12R1.100 O=CCCc1cc(F)cc(Cl)c1 Amb6306224 [0,2,0,0,0,0|0,0,2]=4 4530 B12R1.100 O=CCCc1cc(F)cc(F)c1 Amb25149927 [0,2,0,0,0,0|0,0,2]=4 4531 B12R1.100 O=CCCc1cc(F)cc(I)c1 Amb25104319 [0,2,0,0,0,0|0,0,2]=4 4532 B12R1.100 O=CCCc1cc(I)cc(I)c1 Amb28199256 [0,2,0,0,0,0|0,0,2]=4 4533 B12R1.100 O=CCCc1cc(O)cc(Cl)c1 Amb27222112 [0,2,0,0,0,0|0,0,2]=4 4534 B12R1.100 O=CCCc1cc(O)cc(F)c1 Amb28057761 [0,2,0,0,0,0|0,0,2]=4 4535 B12R1.100 O=CCCc1cc(O)cc(I)c1 Amb27841377 [0,2,0,0,0,0|0,0,2]=4 4536 B12R1.100 O=CCCc1cc(O)cc(S)c1 Amb27423591 [0,2,0,0,0,0|0,0,2]=4 4537 B12R1.100 O=CCCc1cc(S)cc(Cl)c1 Amb27428156 [0,2,0,0,0,0|0,0,2]=4 4538 B12R1.100 O=CCOc1cc(Cl)cc(Br)c1 Amb35635452 [0,2,0,0,0,0|1,0,1]=4 4539 B12R1.100 O=CCOc1cc(Cl)cc(Cl)c1 Amb5731862 [0,2,0,0,0,0|1,0,1]=4 4540 B12R1.100 O=CCOc1cc(F)cc(Br)c1 Amb25827273 [0,2,0,0,0,0|1,0,1]=4 4541 B12R1.100 O=CCOc1cc(F)cc(F)c1 Amb18802837 [0,2,0,0,0,0|1,0,1]=4 4542 B12R1.100 O=CCSc1cc(Cl)cc(Cl)c1 Amb25817384 [0,2,0,0,0,0|1,0,1]=4 4543 B12R1.100 O=C\C=C\c1cc(Br)cc(Br)c1 Amb27850407 [0,2,0,0,0,0|0,0,0]=2 4544 B12R1.100 O=C\C=C\c1cc(Cl)cc(Br)c1 Amb33435587 [0,2,0,0,0,0|0,0,0]=2 4545 B12R1.100 O=C\C=C\c1cc(Cl)cc(Cl)c1 Amb17237216 [0,2,0,0,0,0|0,0,0]=2 4546 B12R1.100 O=C\C=C\c1cc(Cl)nc(Cl)c1 Amb33258170 [0,2,0,0,0,0|1,0,0]=3 4547 B12R1.100 O=C\C=C\c1cc(F)cc(Br)c1 Amb33334423 [0,2,0,0,0,0|0,0,0]=2 4548 B12R1.100 O=C\C=C\c1cc(F)cc(Cl)c1 Amb33406668 [0,2,0,0,0,0|0,0,0]=2 4549 B12R1.100 O=C\C=C\c1cc(F)cc(F)c1 Amb33429159 [0,2,0,0,0,0|0,0,0]=2 4550 B12R1.100 OC\C=C\c1cc(Br)cc(Br)c1 Amb27658308 [0,2,0,0,0,0|0,0,2]=4 4551 B12R1.100 OC\C=C\c1cc(Cl)cc(Br)c1 Amb33435590 [0,2,0,0,0,0|0,0,2]=4 4552 B12R1.100 OC\C=C\c1cc(Cl)cc(Cl)c1 Amb26597273 [0,2,0,0,0,0|0,0,2]=4 4553 B12R1.100 OC\C=C\c1cc(F)cc(Br)c1 Amb28385983 [0,2,0,0,0,0|0,0,2]=4 4554 B12R1.100 OC\C=C\c1cc(F)cc(Cl)c1 Amb33262259 [0,2,0,0,0,0|0,0,2]=4 4555 B12R1.100 OC\C=C\c1cc(F)cc(F)c1 Amb19889731 [0,2,0,0,0,0|0,0,2]=4 4556 B12R1.226 CC(=O)C#Cc1cccc(F)c1 Amb27177631 [0,2,0,0,0,0|0,0,2]=4 4557 B12R1.226 CC(=O)CCc1cccc(Br)c1 Amb9031557 [0,2,0,0,0,0|0,0,2]=4 4558 B12R1.226 CC(=O)CCc1cccc(C)c1 Amb8869632 [0,2,0,0,0,0|0,0,2]=4 4559 B12R1.226 CC(=O)CCc1cccc(Cl)c1 Amb9031572 [0,2,0,0,0,0|0,0,2]=4 4560 B12R1.226 CC(=O)CCc1cccc(F)c1 Amb9031555 [0,2,0,0,0,0|0,0,2]=4 4561 B12R1.226 CC(=O)CCc1cccc(N)c1 Amb26452029 [0,2,0,0,0,0|0,0,2]=4 4562 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [0,2,0,0,0,0|0,0,2]=4 4563 B12R1.226 CC(=O)COc1cccc(Br)c1 Amb17226706 [0,2,0,0,0,0|1,0,1]=4 4564 B12R1.226 CC(=O)COc1cccc(I)c1 Amb27829069 [0,2,0,0,0,0|1,0,1]=4 4565 B12R1.226 CC(=O)COc1cccc(N)c1 Amb17110084 [0,2,0,0,0,0|1,0,1]=4 4566 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [0,2,0,0,0,0|1,0,1]=4 4567 B12R1.226 CC(=O)CSc1cccc(C)c1 Amb18791171 [0,2,0,0,0,0|1,0,1]=4 4568 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [0,2,0,0,0,0|1,0,1]=4 4569 B12R1.226 CC(=O)CSc1cccc(F)c1 Amb28386048 [0,2,0,0,0,0|1,0,1]=4 4570 B12R1.226 CC(=O)NCc1cccc(Br)c1 Amb2085743 [0,2,0,0,0,0|1,0,1]=4 4571 B12R1.226 CC(=O)NCc1cccc(Cl)c1 Amb2023612 [0,2,0,0,0,0|1,0,1]=4 4572 B12R1.226 CC(=O)NCc1cccc(F)c1 Amb33546305 [0,2,0,0,0,0|1,0,1]=4 4573 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [0,2,0,0,0,0|1,0,1]=4 4574 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [0,2,0,0,0,0|1,0,1]=4 4575 B12R1.226 CC(=O)NNc1cccc(Br)c1 Amb27414445 [0,2,0,0,0,0|2,0,0]=4 4576 B12R1.226 CC(=O)NNc1cccc(Cl)c1 Amb4362483 [0,2,0,0,0,0|2,0,0]=4 4577 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [0,2,0,0,0,0|1,0,1]=4 4578 B12R1.226 CC(=O)OCc1cccc(O)c1 Amb26427066 [0,2,0,0,0,0|1,0,1]=4 4579 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [0,2,0,0,0,0|1,0,1]=4 4580 B12R1.226 CC(=O)SCc1cccc(I)c1 Amb27770074 [0,2,0,0,0,0|1,0,1]=4 4581 B12R1.226 CC(=O)\C=C\c1cc(C)ccn1 Amb33317813 [0,2,0,0,0,0|1,0,0]=3 4582 B12R1.226 CC(=O)\C=C\c1cc(F)ccn1 Amb33325518 [0,2,0,0,0,0|1,0,0]=3 4583 B12R1.226 CC(=O)\C=C\c1cccc(Br)c1 Amb10601440 [0,2,0,0,0,0|0,0,0]=2 4584 B12R1.226 CC(=O)\C=C\c1cccc(Br)n1 Amb25233145 [0,2,0,0,0,0|1,0,0]=3 4585 B12R1.226 CC(=O)\C=C\c1cccc(C)c1 Amb33079187 [0,2,0,0,0,0|0,0,0]=2 4586 B12R1.226 CC(=O)\C=C\c1cccc(C)n1 Amb33474924 [0,2,0,0,0,0|1,0,0]=3 4587 B12R1.226 CC(=O)\C=C\c1cccc(Cl)c1 Amb2724236 [0,2,0,0,0,0|0,0,0]=2 4588 B12R1.226 CC(=O)\C=C\c1cccc(Cl)n1 Amb33222648 [0,2,0,0,0,0|1,0,0]=3 4589 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [0,2,0,0,0,0|0,0,0]=2 4590 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [0,2,0,0,0,0|0,0,0]=2 4591 B12R1.226 CC(=O)\C=C\c1cccc(O)c1 Amb17615740 [0,2,0,0,0,0|0,0,0]=2 4592 B12R1.226 CC(=O)\C=C\c1ccnc(C)c1 Amb33172588 [0,2,0,0,0,0|1,0,0]=3 4593 B12R1.226 CC(=O)\C=C\c1cncc(Br)c1 Amb33430082 [0,2,0,0,0,0|1,0,0]=3 4594 B12R1.226 CC(=O)\C=C\c1cncc(C)c1 Amb33317647 [0,2,0,0,0,0|1,0,0]=3 4595 B12R1.226 CC(=O)\C=C\c1cncc(F)c1 Amb33195632 [0,2,0,0,0,0|1,0,0]=3 4596 B12R1.226 CC(Br)\C=C\c1cccc(Cl)c1 Amb27591061 [0,2,0,0,0,0|1,0,1]=4 4597 B12R1.226 CC(Br)\C=C\c1cccc(F)c1 Amb28207845 [0,2,0,0,0,0|1,0,1]=4 4598 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [0,2,0,0,0,0|1,0,1]=4 4599 B12R1.226 CC(N)\C=C\c1cccc(Br)c1 Amb33241203 [0,2,0,0,0,0|1,0,1]=4 4600 B12R1.226 CC(N)\C=C\c1cccc(Cl)c1 Amb33220774 [0,2,0,0,0,0|1,0,1]=4 4601 B12R1.226 CC(N)\C=C\c1cccc(F)c1 Amb33450002 [0,2,0,0,0,0|1,0,1]=4 4602 B12R1.226 CC(N)\C=C\c1cccc(I)c1 Amb27590388 [0,2,0,0,0,0|1,0,1]=4 4603 B12R1.226 CC(N)\C=C\c1cccc(O)c1 Amb27615369 [0,2,0,0,0,0|1,0,1]=4 4604 B12R1.226 CC(O)\C=C\c1cccc(Br)c1 Amb25098989 [0,2,0,0,0,0|0,0,2]=4 4605 B12R1.226 CC(O)\C=C\c1cccc(Cl)c1 Amb24590748 [0,2,0,0,0,0|0,0,2]=4 4606 B12R1.226 CC(O)\C=C\c1cccc(F)c1 Amb25730368 [0,2,0,0,0,0|0,0,2]=4 4607 B12R1.226 CC(O)\C=C\c1cccc(I)c1 Amb27644961 [0,2,0,0,0,0|0,0,2]=4 4608 B12R1.226 CS(=O)\N=C\c1cccc(Br)c1 Amb35681676 [0,2,0,0,0,0|2,0,0]=4 4609 B12R1.226 CS(=O)\N=C\c1cccc(Cl)c1 Amb35681711 [0,2,0,0,0,0|2,0,0]=4 4610 B12R1.226 CS(=O)\N=C\c1cccc(F)c1 Amb29858703 [0,2,0,0,0,0|2,0,0]=4 4611 B12R1.226 CS(=O)\N=C\c1cccc(I)c1 Amb35692840 [0,2,0,0,0,0|2,0,0]=4 4612 B12R1.226 CS(=O)\N=C\c1cccc(O)c1 Amb29858760 [0,2,0,0,0,0|2,0,0]=4 4613 B12R1.226 Cc1cc(\C=C\C(=O)O)ccn1 Amb32953957 [0,2,0,0,0,0|1,0,0]=3 4614 B12R1.226 Cc1cc(\C=C\C(=O)O)ncn1 Amb27224407 [0,2,0,0,0,0|2,0,0]=4 4615 B12R1.226 Cc1cc(\C=C\C(N)=O)ccn1 Amb27445433 [0,2,0,0,0,0|1,0,0]=3 4616 B12R1.226 Cc1cc(\C=C\[N+](=O)[O-])ccn1 Amb33340429 [0,2,0,0,0,0|2,0,0]=4 4617 B12R1.226 Cc1cccc(C#CC(=O)O)c1 Amb20673071 [0,2,0,0,0,0|0,0,2]=4 4618 B12R1.226 Cc1cccc(CCC(=O)Cl)c1 Amb18325287 [0,2,0,0,0,0|0,0,2]=4 4619 B12R1.226 Cc1cccc(CCC(=O)O)c1 Amb1106242 [0,2,0,0,0,0|0,0,2]=4 4620 B12R1.226 Cc1cccc(CCC(N)=O)c1 Amb17400135 [0,2,0,0,0,0|0,0,2]=4 4621 B12R1.226 Cc1cccc(CNC(=O)Cl)c1 Amb35625652 [0,2,0,0,0,0|1,0,1]=4 4622 B12R1.226 Cc1cccc(COC(N)=O)c1 Amb27165818 [0,2,0,0,0,0|1,0,1]=4 4623 B12R1.226 Cc1cccc(NCC(=O)O)c1 Amb840514 [0,2,0,0,0,0|1,0,1]=4 4624 B12R1.226 Cc1cccc(NCC(N)=O)c1 Amb6706700 [0,2,0,0,0,0|1,0,1]=4 4625 B12R1.226 Cc1cccc(NNC(N)=O)c1 Amb25061369 [0,2,0,0,0,0|2,0,0]=4 4626 B12R1.226 Cc1cccc(OCC(=O)Cl)c1 Amb10880010 [0,2,0,0,0,0|1,0,1]=4 4627 B12R1.226 Cc1cccc(OCC(=O)O)c1 Amb6336446 [0,2,0,0,0,0|1,0,1]=4 4628 B12R1.226 Cc1cccc(OCC(N)=O)c1 Amb6346003 [0,2,0,0,0,0|1,0,1]=4 4629 B12R1.226 Cc1cccc(SCC(=O)Cl)c1 Amb17143249 [0,2,0,0,0,0|1,0,1]=4 4630 B12R1.226 Cc1cccc(SCC(=O)O)c1 Amb5768509 [0,2,0,0,0,0|1,0,1]=4 4631 B12R1.226 Cc1cccc(SCC(N)=O)c1 Amb17142988 [0,2,0,0,0,0|1,0,1]=4 4632 B12R1.226 Cc1cccc(\C=C/C(N)=O)c1 Amb27490834 [0,2,0,0,0,0|0,0,0]=2 4633 B12R1.226 Cc1cccc(\C=C/[N+](=O)[O-])c1 Amb26891002 [0,2,0,0,0,0|1,0,0]=3 4634 B12R1.226 Cc1cccc(\C=C\C(=O)Cl)c1 Amb33513162 [0,2,0,0,0,0|0,0,0]=2 4635 B12R1.226 Cc1cccc(\C=C\C(=O)O)c1 Amb2720533 [0,2,0,0,0,0|0,0,0]=2 4636 B12R1.226 Cc1cccc(\C=C\C(=O)O)n1 Amb10669513 [0,2,0,0,0,0|1,0,0]=3 4637 B12R1.226 Cc1cccc(\C=C\C(=O)[O-])c1 Amb33513024 [0,2,0,0,0,0|0,0,0]=2 4638 B12R1.226 Cc1cccc(\C=C\C(C)N)c1 Amb33450114 [0,2,0,0,0,0|1,0,1]=4 4639 B12R1.226 Cc1cccc(\C=C\C(C)O)c1 Amb25683937 [0,2,0,0,0,0|0,0,2]=4 4640 B12R1.226 Cc1cccc(\C=C\[N+](=O)[O-])c1 Amb6296910 [0,2,0,0,0,0|1,0,0]=3 4641 B12R1.226 Cc1cccc(\C=C\[N+](=O)[O-])n1 Amb33079112 [0,2,0,0,0,0|2,0,0]=4 4642 B12R1.226 Cc1cccc(\C=N\S(C)=O)c1 Amb29858792 [0,2,0,0,0,0|2,0,0]=4 4643 B12R1.226 Cc1ccnc(\C=C\C(=O)O)c1 Amb33079454 [0,2,0,0,0,0|1,0,0]=3 4644 B12R1.226 Cc1ccnc(\C=C\C(N)=O)c1 Amb28421771 [0,2,0,0,0,0|1,0,0]=3 4645 B12R1.226 Cc1ccnc(\C=C\[N+](=O)[O-])c1 Amb33318088 [0,2,0,0,0,0|2,0,0]=4 4646 B12R1.226 Cc1cncc(\C=C\C(=O)O)c1 Amb22059615 [0,2,0,0,0,0|1,0,0]=3 4647 B12R1.226 Cc1cncc(\C=C\[N+](=O)[O-])c1 Amb33429279 [0,2,0,0,0,0|2,0,0]=4 4648 B12R1.226 Cc1nccc(\C=C\C(=O)O)n1 Amb23592256 [0,2,0,0,0,0|2,0,0]=4 4649 B12R1.226 NC(=O)CCc1cccc(Br)c1 Amb8997695 [0,2,0,0,0,0|0,0,2]=4 4650 B12R1.226 NC(=O)CCc1cccc(Cl)c1 Amb17400995 [0,2,0,0,0,0|0,0,2]=4 4651 B12R1.226 NC(=O)CNc1cccc(Br)c1 Amb143565 [0,2,0,0,0,0|1,0,1]=4 4652 B12R1.226 NC(=O)CNc1cccc(Cl)c1 Amb6711826 [0,2,0,0,0,0|1,0,1]=4 4653 B12R1.226 NC(=O)CNc1cccc(F)c1 Amb6711883 [0,2,0,0,0,0|1,0,1]=4 4654 B12R1.226 NC(=O)CNc1cccc(I)c1 Amb7758310 [0,2,0,0,0,0|1,0,1]=4 4655 B12R1.226 NC(=O)CNc1cccc(O)c1 Amb26868898 [0,2,0,0,0,0|1,0,1]=4 4656 B12R1.226 NC(=O)COc1cccc(Br)c1 Amb192032 [0,2,0,0,0,0|1,0,1]=4 4657 B12R1.226 NC(=O)COc1cccc(Cl)c1 Amb2726046 [0,2,0,0,0,0|1,0,1]=4 4658 B12R1.226 NC(=O)COc1cccc(I)c1 Amb181273 [0,2,0,0,0,0|1,0,1]=4 4659 B12R1.226 NC(=O)COc1cccc(N)c1 Amb1112358 [0,2,0,0,0,0|1,0,1]=4 4660 B12R1.226 NC(=O)COc1cccc(O)c1 Amb9210998 [0,2,0,0,0,0|1,0,1]=4 4661 B12R1.226 NC(=O)CSc1cccc(Cl)c1 Amb17143258 [0,2,0,0,0,0|1,0,1]=4 4662 B12R1.226 NC(=O)CSc1cccc(N)c1 Amb27770252 [0,2,0,0,0,0|1,0,1]=4 4663 B12R1.226 NC(=O)NCc1cccc(Br)c1 Amb26315359 [0,2,0,0,0,0|1,0,1]=4 4664 B12R1.226 NC(=O)NCc1cccc(F)c1 Amb7782143 [0,2,0,0,0,0|1,0,1]=4 4665 B12R1.226 NC(=O)NNc1cccc(Br)c1 Amb27980089 [0,2,0,0,0,0|2,0,0]=4 4666 B12R1.226 NC(=O)NNc1cccc(Cl)c1 Amb27858802 [0,2,0,0,0,0|2,0,0]=4 4667 B12R1.226 NC(=O)NNc1cccc(F)c1 Amb6298511 [0,2,0,0,0,0|2,0,0]=4 4668 B12R1.226 NC(=O)NOc1cccc(Cl)c1 Amb27250570 [0,2,0,0,0,0|2,0,0]=4 4669 B12R1.226 NC(=O)OCc1cccc(F)c1 Amb27392390 [0,2,0,0,0,0|1,0,1]=4 4670 B12R1.226 NC(=O)\C=C\c1cccc(Br)c1 Amb8997726 [0,2,0,0,0,0|0,0,0]=2 4671 B12R1.226 NC(=O)\C=C\c1cccc(F)c1 Amb8997747 [0,2,0,0,0,0|0,0,0]=2 4672 B12R1.226 NC(=O)\C=C\c1cccc(I)c1 Amb25338405 [0,2,0,0,0,0|0,0,0]=2 4673 B12R1.226 NC(=O)\C=C\c1cccc(O)c1 Amb27854413 [0,2,0,0,0,0|0,0,0]=2 4674 B12R1.226 NC(=O)\C=C\c1ccnc(Br)c1 Amb24451667 [0,2,0,0,0,0|1,0,0]=3 4675 B12R1.226 NC(=O)\C=C\c1ccnc(Cl)c1 Amb27598185 [0,2,0,0,0,0|1,0,0]=3 4676 B12R1.226 NC(=O)\C=C\c1cncc(O)c1 Amb27178630 [0,2,0,0,0,0|1,0,0]=3 4677 B12R1.226 NC(=O)\N=C\c1cccc(F)c1 Amb27848231 [0,2,0,0,0,0|1,0,0]=3 4678 B12R1.226 NC(=S)\C=C\c1cccc(Cl)c1 Amb27637700 [0,2,0,0,0,0|0,1,0]=3 4679 B12R1.226 Nc1cccc(C#CC(=O)O)c1 Amb24650985 [0,2,0,0,0,0|0,0,2]=4 4680 B12R1.226 Nc1cccc(CCC(=O)Cl)c1 Amb27453550 [0,2,0,0,0,0|0,0,2]=4 4681 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2684507 [0,2,0,0,0,0|0,0,2]=4 4682 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2692058 [0,2,0,0,0,0|0,0,2]=4 4683 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22408735 [0,2,0,0,0,0|0,0,2]=4 4684 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22757721 [0,2,0,0,0,0|0,0,2]=4 4685 B12R1.226 Nc1cccc(OCC(=O)O)c1 Amb839769 [0,2,0,0,0,0|1,0,1]=4 4686 B12R1.226 Nc1cccc(\C=C\C(=O)O)c1 Amb34916041 [0,2,0,0,0,0|0,0,0]=2 4687 B12R1.226 Nc1cncc(\C=C\C(=O)O)c1 Amb27840658 [0,2,0,0,0,0|1,0,0]=3 4688 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [0,2,0,0,0,0|0,0,2]=4 4689 B12R1.226 O=C(Cl)COc1cccc(Br)c1 Amb16230149 [0,2,0,0,0,0|1,0,1]=4 4690 B12R1.226 O=C(Cl)COc1cccc(F)c1 Amb27406717 [0,2,0,0,0,0|1,0,1]=4 4691 B12R1.226 O=C(Cl)CSc1cccc(Cl)c1 Amb17143820 [0,2,0,0,0,0|1,0,1]=4 4692 B12R1.226 O=C(Cl)NCc1cccc(Br)c1 Amb35625550 [0,2,0,0,0,0|1,0,1]=4 4693 B12R1.226 O=C(Cl)NCc1cccc(Cl)c1 Amb35637058 [0,2,0,0,0,0|1,0,1]=4 4694 B12R1.226 O=C(Cl)NCc1cccc(F)c1 Amb27238851 [0,2,0,0,0,0|1,0,1]=4 4695 B12R1.226 O=C(Cl)OCc1cccc(Cl)c1 Amb26597913 [0,2,0,0,0,0|1,0,1]=4 4696 B12R1.226 O=C(Cl)\C=C\c1cccc(Br)c1 Amb17145216 [0,2,0,0,0,0|0,0,0]=2 4697 B12R1.226 O=C(Cl)\C=C\c1cccc(Cl)c1 Amb16230245 [0,2,0,0,0,0|0,0,0]=2 4698 B12R1.226 O=C(Cl)\C=C\c1cccc(O)c1 Amb26344668 [0,2,0,0,0,0|0,0,0]=2 4699 B12R1.226 O=C(O)C#Cc1cccc(Br)c1 Amb23504362 [0,2,0,0,0,0|0,0,2]=4 4700 B12R1.226 O=C(O)C#Cc1cccc(Cl)c1 Amb20673086 [0,2,0,0,0,0|0,0,2]=4 4701 B12R1.226 O=C(O)C#Cc1cccc(F)c1 Amb20673102 [0,2,0,0,0,0|0,0,2]=4 4702 B12R1.226 O=C(O)C#Cc1cccc(O)c1 Amb23569602 [0,2,0,0,0,0|0,0,2]=4 4703 B12R1.226 O=C(O)CCc1cccc(Br)c1 Amb1209216 [0,2,0,0,0,0|0,0,2]=4 4704 B12R1.226 O=C(O)CCc1cccc(Cl)c1 Amb1672952 [0,2,0,0,0,0|0,0,2]=4 4705 B12R1.226 O=C(O)CCc1cccc(F)c1 Amb1091868 [0,2,0,0,0,0|0,0,2]=4 4706 B12R1.226 O=C(O)CCc1cccc(I)c1 Amb16232982 [0,2,0,0,0,0|0,0,2]=4 4707 B12R1.226 O=C(O)CCc1cccc(O)c1 Amb2688781 [0,2,0,0,0,0|0,0,2]=4 4708 B12R1.226 O=C(O)CNc1cccc(Br)c1 Amb840527 [0,2,0,0,0,0|1,0,1]=4 4709 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb10609174 [0,2,0,0,0,0|1,0,1]=4 4710 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb840525 [0,2,0,0,0,0|1,0,1]=4 4711 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb19341704 [0,2,0,0,0,0|1,0,1]=4 4712 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb840522 [0,2,0,0,0,0|1,0,1]=4 4713 B12R1.226 O=C(O)COc1cccc(Br)c1 Amb6336684 [0,2,0,0,0,0|1,0,1]=4 4714 B12R1.226 O=C(O)COc1cccc(Cl)c1 Amb1211231 [0,2,0,0,0,0|1,0,1]=4 4715 B12R1.226 O=C(O)COc1cccc(F)c1 Amb1102803 [0,2,0,0,0,0|1,0,1]=4 4716 B12R1.226 O=C(O)COc1cccc(I)c1 Amb4574102 [0,2,0,0,0,0|1,0,1]=4 4717 B12R1.226 O=C(O)COc1cccc(O)c1 Amb6360813 [0,2,0,0,0,0|1,0,1]=4 4718 B12R1.226 O=C(O)CSc1cccc(Br)c1 Amb2372547 [0,2,0,0,0,0|1,0,1]=4 4719 B12R1.226 O=C(O)CSc1cccc(Cl)c1 Amb2794096 [0,2,0,0,0,0|1,0,1]=4 4720 B12R1.226 O=C(O)CSc1cccc(F)c1 Amb19887452 [0,2,0,0,0,0|1,0,1]=4 4721 B12R1.226 O=C(O)CSc1cccc(O)c1 Amb28385688 [0,2,0,0,0,0|1,0,1]=4 4722 B12R1.226 O=C(O)\C=C\C1=CC=CC(=O)N1 Amb25705720 [0,2,0,0,0,0|1,0,0]=3 4723 B12R1.226 O=C(O)\C=C\c1cc(Cl)ccn1 Amb33469130 [0,2,0,0,0,0|1,0,0]=3 4724 B12R1.226 O=C(O)\C=C\c1cc(F)ccn1 Amb33414575 [0,2,0,0,0,0|1,0,0]=3 4725 B12R1.226 O=C(O)\C=C\c1cccc(Br)c1 Amb1207365 [0,2,0,0,0,0|0,0,0]=2 4726 B12R1.226 O=C(O)\C=C\c1cccc(Br)n1 Amb33240785 [0,2,0,0,0,0|1,0,0]=3 4727 B12R1.226 O=C(O)\C=C\c1cccc(Cl)c1 Amb33513177 [0,2,0,0,0,0|0,0,0]=2 4728 B12R1.226 O=C(O)\C=C\c1cccc(F)c1 Amb1210956 [0,2,0,0,0,0|0,0,0]=2 4729 B12R1.226 O=C(O)\C=C\c1cccc(I)c1 Amb2236388 [0,2,0,0,0,0|0,0,0]=2 4730 B12R1.226 O=C(O)\C=C\c1cccc(O)c1 Amb8513189 [0,2,0,0,0,0|0,0,0]=2 4731 B12R1.226 O=C(O)\C=C\c1ccnc(Br)c1 Amb19929893 [0,2,0,0,0,0|1,0,0]=3 4732 B12R1.226 O=C(O)\C=C\c1ccnc(Cl)c1 Amb20668239 [0,2,0,0,0,0|1,0,0]=3 4733 B12R1.226 O=C(O)\C=C\c1ccnc(O)c1 Amb24682988 [0,2,0,0,0,0|1,0,0]=3 4734 B12R1.226 O=C(O)\C=C\c1cncc(Br)c1 Amb33242916 [0,2,0,0,0,0|1,0,0]=3 4735 B12R1.226 O=C(O)\C=C\c1cncc(Cl)c1 Amb26004618 [0,2,0,0,0,0|1,0,0]=3 4736 B12R1.226 O=C(O)\C=C\c1cncc(F)c1 Amb18283058 [0,2,0,0,0,0|1,0,0]=3 4737 B12R1.226 O=C(O)\C=C\c1cncc(O)c1 Amb27868737 [0,2,0,0,0,0|1,0,0]=3 4738 B12R1.226 O=S([O-])\C=C\c1cccc(Br)c1 Amb32754056 [0,2,0,0,0,0|1,0,0]=3 4739 B12R1.226 O=S([O-])\C=C\c1cccc(Cl)c1 Amb32755654 [0,2,0,0,0,0|1,0,0]=3 4740 B12R1.226 O=[N+]([O-])\C=C\c1cc(F)ccn1 Amb33320261 [0,2,0,0,0,0|2,0,0]=4 4741 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Br)c1 Amb3905133 [0,2,0,0,0,0|1,0,0]=3 4742 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Br)n1 Amb33433135 [0,2,0,0,0,0|2,0,0]=4 4743 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Cl)c1 Amb2763380 [0,2,0,0,0,0|1,0,0]=3 4744 B12R1.226 O=[N+]([O-])\C=C\c1cccc(Cl)n1 Amb33222414 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.226 O=[N+]([O-])\C=C\c1cccc(F)c1 Amb2764632 [0,2,0,0,0,0|1,0,0]=3 4746 B12R1.226 O=[N+]([O-])\C=C\c1cccc(I)c1 Amb1144728 [0,2,0,0,0,0|1,0,0]=3 4747 B12R1.226 O=[N+]([O-])\C=C\c1cccc(O)c1 Amb6296329 [0,2,0,0,0,0|1,0,0]=3 4748 B12R1.226 O=[N+]([O-])\C=C\c1cncc(Br)c1 Amb27661971 [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.226 O=[N+]([O-])\C=C\c1cncc(F)c1 Amb33171923 [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.226 OB(O)\C=C\c1cccc(Br)c1 Amb25208384 [0,2,0,0,0,0|1,0,1]=4 4751 B12R1.226 OB(O)\C=C\c1cccc(Cl)c1 Amb10603469 [0,2,0,0,0,0|1,0,1]=4 4752 B12R1.382 C#Cc1cccc(CCC=O)c1 Amb33272129 [0,2,0,0,0,0|0,0,2]=4 4753 B12R1.382 C#Cc1cccc(\C=C\C=O)c1 Amb33272788 [0,2,0,0,0,0|0,0,0]=2 4754 B12R1.382 C#Cc1cccc(\C=C\CN)c1 Amb33272785 [0,2,0,0,0,0|1,0,1]=4 4755 B12R1.382 C#Cc1cccc(\C=C\CO)c1 Amb33272787 [0,2,0,0,0,0|0,0,2]=4 4756 B12R1.382 C=C\C=C/c1cccc(C=O)c1 Amb24085624 [0,2,0,0,0,0|1,0,0]=3 4757 B12R1.382 CC\C=C\c1cccc(OC)c1 Amb28139566 [0,2,0,0,0,0|1,0,1]=4 4758 B12R1.382 CCc1cccc(CCC=O)c1 Amb33474379 [0,2,0,0,0,0|0,0,2]=4 4759 B12R1.382 CCc1cccc(OCC=O)c1 Amb5731830 [0,2,0,0,0,0|1,0,1]=4 4760 B12R1.382 CCc1cccc(\C=C\C=O)c1 Amb32875440 [0,2,0,0,0,0|0,0,0]=2 4761 B12R1.382 CCc1cccc(\C=C\CN)c1 Amb32875438 [0,2,0,0,0,0|1,0,1]=4 4762 B12R1.382 CCc1cccc(\C=C\CO)c1 Amb32875439 [0,2,0,0,0,0|0,0,2]=4 4763 B12R1.382 CO\C=C\c1cccc(C#N)c1 Amb24184014 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.382 COc1cc(\C=C\C=O)ccn1 Amb32730059 [0,2,0,0,0,0|1,0,0]=3 4765 B12R1.382 COc1cccc(CCC=O)c1 Amb6306214 [0,2,0,0,0,0|0,0,2]=4 4766 B12R1.382 COc1cccc(CNC=O)c1 Amb25973686 [0,2,0,0,0,0|1,0,1]=4 4767 B12R1.382 COc1cccc(OCC=O)c1 Amb5731833 [0,2,0,0,0,0|1,0,1]=4 4768 B12R1.382 COc1cccc(SCC=O)c1 Amb18809762 [0,2,0,0,0,0|1,0,1]=4 4769 B12R1.382 COc1cccc(\C=C\C#N)c1 Amb17232287 [0,2,0,0,0,0|1,0,1]=4 4770 B12R1.382 COc1cccc(\C=C\C=O)c1 Amb17232402 [0,2,0,0,0,0|0,0,0]=2 4771 B12R1.382 COc1cccc(\C=C\C=O)n1 Amb33358721 [0,2,0,0,0,0|1,0,0]=3 4772 B12R1.382 COc1cccc(\C=C\CN)c1 Amb18563579 [0,2,0,0,0,0|1,0,1]=4 4773 B12R1.382 COc1cccc(\C=C\CO)c1 Amb23442965 [0,2,0,0,0,0|0,0,2]=4 4774 B12R1.382 COc1ccnc(\C=C\C=O)c1 Amb33418103 [0,2,0,0,0,0|1,0,0]=3 4775 B12R1.382 COc1cncc(\C=C\C=O)c1 Amb35667192 [0,2,0,0,0,0|1,0,0]=3 4776 B12R1.382 CSc1cccc(CCC=O)c1 Amb33079612 [0,2,0,0,0,0|0,0,2]=4 4777 B12R1.382 CSc1cccc(\C=C\C=O)c1 Amb33148825 [0,2,0,0,0,0|0,0,0]=2 4778 B12R1.382 CSc1cccc(\C=C\CN)c1 Amb33472880 [0,2,0,0,0,0|1,0,1]=4 4779 B12R1.382 CSc1cccc(\C=C\CO)c1 Amb33149408 [0,2,0,0,0,0|0,0,2]=4 4780 B12R1.382 N#Cc1cccc(CCC=O)c1 Amb18645176 [0,2,0,0,0,0|0,0,2]=4 4781 B12R1.382 N#Cc1cccc(CNC=O)c1 Amb27810652 [0,2,0,0,0,0|1,0,1]=4 4782 B12R1.382 N#Cc1cccc(C\C=C\O)c1 Amb27636684 [0,2,0,0,0,0|0,0,2]=4 4783 B12R1.382 N#Cc1cccc(OCC=O)c1 Amb18800496 [0,2,0,0,0,0|1,0,1]=4 4784 B12R1.382 N#Cc1cccc(\C=C\C=O)c1 Amb33136427 [0,2,0,0,0,0|0,0,0]=2 4785 B12R1.382 N#Cc1cccc(\C=C\CCl)c1 Amb25934113 [0,2,0,0,0,0|1,0,1]=4 4786 B12R1.382 N#Cc1cccc(\C=C\CN)c1 Amb33136442 [0,2,0,0,0,0|1,0,1]=4 4787 B12R1.382 N#Cc1cccc(\C=C\CO)c1 Amb18645175 [0,2,0,0,0,0|0,0,2]=4 4788 B12R1.382 O=Cc1cccc(\C=C\CO)c1 Amb27980713 [0,2,0,0,0,0|0,0,2]=4 4789 B12R1.8 BrCCC\C=C\c1ccccc1 Amb33081215 [0,2,0,0,0,0|1,0,1]=4 4790 B12R1.8 BrC\C=C\C=C\c1ccccc1 Amb8394285 [0,2,0,0,0,0|1,0,0]=3 4791 B12R1.8 C#CCC\C=C\c1ccccc1 Amb33081070 [0,2,0,0,0,0|1,0,1]=4 4792 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [0,2,0,0,0,0|1,0,1]=4 4793 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [0,2,0,0,0,0|1,0,1]=4 4794 B12R1.8 CCNC\C=C\c1ccccc1 Amb6864716 [0,2,0,0,0,0|1,0,1]=4 4795 B12R1.8 CCNC\C=C\c1ccccc1 Amb837817 [0,2,0,0,0,0|1,0,1]=4 4796 B12R1.8 CNCC\C=C\c1ccccc1 Amb32954379 [0,2,0,0,0,0|1,0,1]=4 4797 B12R1.8 CO\N=C\C=C\c1ccccc1 Amb27396673 [0,2,0,0,0,0|0,0,1]=3 4798 B12R1.8 CO\N=C\C=C\c1ccncc1 Amb27809416 [0,2,0,0,0,0|1,0,1]=4 4799 B12R1.8 C\C=C\CCNc1ccccc1 Amb28119164 [0,2,0,0,0,0|1,0,1]=4 4800 B12R1.8 ClC\C=C\C#Cc1ccccc1 Amb27859690 [0,2,0,0,0,0|1,0,1]=4 4801 B12R1.8 ClC\C=C\CNc1ccccc1 Amb27806651 [0,2,0,0,0,0|1,0,1]=4 4802 B12R1.8 N#CCC\C=C\c1ccccc1 Amb33081785 [0,2,0,0,0,0|1,0,1]=4 4803 B12R1.8 N#CSC\C=C\c1ccccc1 Amb6370377 [0,2,0,0,0,0|0,1,1]=4 4804 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [0,2,0,0,0,0|1,0,1]=4 4805 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [0,2,0,0,0,0|1,0,0]=3 4806 B12R1.8 NC\C=C\CCc1ccccc1 Amb32951855 [0,2,0,0,0,0|1,0,1]=4 4807 B12R1.8 NC\C=C\COc1ccccc1 Amb32428654 [0,2,0,0,0,0|1,0,1]=4 4808 B12R1.8 NOCC\C=C\c1ccccc1 Amb18563583 [0,2,0,0,0,0|0,0,2]=4 4809 B12R1.8 O=C=NC\C=C\c1ccccc1 Amb26439771 [0,2,0,0,0,0|0,0,1]=3 4810 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [0,2,0,0,0,0|0,0,2]=4 4811 B12R1.8 O=CCCCOc1ccccc1 Amb18798283 [0,2,0,0,0,0|0,0,2]=4 4812 B12R1.8 O=CCCOCc1ccccc1 Amb8394259 [0,2,0,0,0,0|0,0,2]=4 4813 B12R1.8 O=CCCSCc1ccccc1 Amb18791178 [0,2,0,0,0,0|0,0,2]=4 4814 B12R1.8 O=CCC\C=C\c1ccccc1 Amb18645368 [0,2,0,0,0,0|0,0,0]=2 4815 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [0,2,0,0,0,0|0,0,0]=2 4816 B12R1.8 O=C\C=C/NCc1ccccc1 Amb28054344 [0,2,0,0,0,0|0,0,0]=2 4817 B12R1.8 O=C\C=C\C=C\c1ccccc1 Amb17593956 [0,2,0,0,0,0|0,0,0]=2 4818 B12R1.8 O=C\C=C\C=C\c1ccccn1 Amb27646400 [0,2,0,0,0,0|1,0,0]=3 4819 B12R1.8 O=C\C=C\C=C\c1cccnc1 Amb28196713 [0,2,0,0,0,0|1,0,0]=3 4820 B12R1.8 O=C\C=C\C=C\c1ccncc1 Amb28457581 [0,2,0,0,0,0|1,0,0]=3 4821 B12R1.8 O=C\C=C\CCc1ccccc1 Amb32954855 [0,2,0,0,0,0|0,0,0]=2 4822 B12R1.8 O=C\C=C\NCc1ccccc1 Amb18645517 [0,2,0,0,0,0|0,0,0]=2 4823 B12R1.8 OCC#C\C=C\c1ccccc1 Amb27977863 [0,2,0,0,0,0|0,0,2]=4 4824 B12R1.8 OCCC=C=Cc1ccccc1 Amb27972290 [0,2,0,0,0,0|0,0,2]=4 4825 B12R1.8 OCCC\C=C\c1ccccc1 Amb33082089 [0,2,0,0,0,0|0,0,2]=4 4826 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [0,2,0,0,0,0|0,0,2]=4 4827 B12R1.8 OC\C=C\C#Cc1ccccc1 Amb17593957 [0,2,0,0,0,0|0,0,2]=4 4828 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [0,2,0,0,0,0|0,0,1]=3 4829 B12R1.8 OC\C=C\CCc1ccccc1 Amb33082995 [0,2,0,0,0,0|0,0,2]=4 4830 B12R1.8 O\C=C/NCCc1ccccc1 Amb27975397 [0,2,0,0,0,0|0,0,2]=4 4831 B12R1.8 S=CNC\C=C\c1ccccc1 Amb27232732 [0,2,0,0,0,0|0,1,0]=3 4832 B12R1.8 SCCC\C=C\c1ccccc1 Amb33081102 [0,2,0,0,0,0|0,1,1]=4 4833 B12R1.8 [C-]#[N+]CC\C=C\c1ccccc1 Amb33081344 [0,2,0,0,0,0|1,0,1]=4 4834 B12R1.8 [N-]=[N+]=NC\C=C\c1ccccc1 Amb32665531 [0,2,0,0,0,0|1,0,1]=4 4835 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,2,0,0,0,0|0,0,2]=4 4836 B12R1.27 C#CC(=O)CSc1ccccc1 Amb27961049 [0,2,0,0,0,0|1,0,1]=4 4837 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,2,0,0,0,0|1,0,1]=4 4838 B12R1.27 C#CC(=O)NNc1ccccc1 Amb28317629 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,2,0,0,0,0|1,0,1]=4 4840 B12R1.27 C#CC(C)\C=C\c1ccccc1 Amb33080777 [0,2,0,0,0,0|1,0,1]=4 4841 B12R1.27 C#CC(O)\C=C\c1ccccc1 Amb3354803 [0,2,0,0,0,0|0,0,2]=4 4842 B12R1.27 C#C[C@H](O)\C=C\c1ccccc1 Amb28127146 [0,2,0,0,0,0|0,0,2]=4 4843 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [0,2,0,0,0,0|1,0,0]=3 4844 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [0,2,0,0,0,0|1,0,0]=3 4845 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [0,2,0,0,0,0|1,0,0]=3 4846 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,2,0,0,0,0|0,0,2]=4 4847 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [0,2,0,0,0,0|1,0,1]=4 4848 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,2,0,0,0,0|1,0,1]=4 4849 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,2,0,0,0,0|1,0,1]=4 4850 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [0,2,0,0,0,0|0,0,0]=2 4851 B12R1.27 C=CC(O)\C=C\c1ccccc1 Amb27478521 [0,2,0,0,0,0|1,0,0]=3 4852 B12R1.27 CC(C#N)\C=C\c1ccccc1 Amb33081313 [0,2,0,0,0,0|1,0,1]=4 4853 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [0,2,0,0,0,0|0,0,2]=4 4854 B12R1.27 CC(C=O)CSc1ccccc1 Amb17594629 [0,2,0,0,0,0|0,0,2]=4 4855 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,2,0,0,0,0|0,0,2]=4 4856 B12R1.27 CC(C=O)SCc1ccccc1 Amb18648419 [0,2,0,0,0,0|0,0,2]=4 4857 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb33081219 [0,2,0,0,0,0|0,0,0]=2 4858 B12R1.27 CC(\C=C\c1ccccc1)=N/O Amb24101081 [0,2,0,0,0,0|0,0,1]=3 4859 B12R1.27 CC(\C=C\c1ccccc1)=N\O Amb27204245 [0,2,0,0,0,0|0,0,1]=3 4860 B12R1.27 CC(\C=C\c1ccccc1)CBr Amb33080770 [0,2,0,0,0,0|1,0,1]=4 4861 B12R1.27 CC(\C=C\c1ccccc1)CN Amb33081132 [0,2,0,0,0,0|1,0,1]=4 4862 B12R1.27 CC(\C=C\c1ccccc1)ON Amb33080788 [0,2,0,0,0,0|0,0,2]=4 4863 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,2,0,0,0,0|0,0,2]=4 4864 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [0,2,0,0,0,0|0,0,2]=4 4865 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [0,2,0,0,0,0|1,0,1]=4 4866 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [0,2,0,0,0,0|1,0,1]=4 4867 B12R1.27 CCC(=O)NCc1ccccc1 Amb3097295 [0,2,0,0,0,0|1,0,1]=4 4868 B12R1.27 CCC(=O)NNc1ccccc1 Amb2720825 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.27 CCC(=O)NOc1ccccc1 Amb27827163 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [0,2,0,0,0,0|1,0,1]=4 4871 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,2,0,0,0,0|0,0,0]=2 4872 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [0,2,0,0,0,0|1,0,0]=3 4873 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [0,2,0,0,0,0|0,0,2]=4 4874 B12R1.27 CCS(=O)\N=C\c1ccccc1 Amb35726562 [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.27 CC[C@H](O)\C=C\c1ccccc1 Amb27205385 [0,2,0,0,0,0|0,0,2]=4 4876 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [0,2,0,0,0,0|0,0,2]=4 4877 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [0,2,0,0,0,0|1,0,1]=4 4878 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [0,2,0,0,0,0|1,0,1]=4 4881 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [0,2,0,0,0,0|1,0,1]=4 4882 B12R1.27 CNC(=O)\C=C\c1ccncc1 Amb28454984 [0,2,0,0,0,0|1,0,0]=3 4883 B12R1.27 COC(=O)C#Cc1ccccc1 Amb4019367 [0,2,0,0,0,0|0,0,2]=4 4884 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [0,2,0,0,0,0|0,0,2]=4 4885 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [0,2,0,0,0,0|1,0,1]=4 4886 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [0,2,0,0,0,0|1,0,1]=4 4887 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [0,2,0,0,0,0|1,0,1]=4 4888 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [0,2,0,0,0,0|1,0,1]=4 4889 B12R1.27 COC(=O)NCc1ccccc1 Amb2746993 [0,2,0,0,0,0|1,0,1]=4 4890 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,2,0,0,0,0|1,0,1]=4 4891 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [0,2,0,0,0,0|0,0,0]=2 4892 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [0,2,0,0,0,0|0,0,0]=2 4893 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.27 COC(=O)\C=C\c1ccncn1 Amb28069217 [0,2,0,0,0,0|2,0,0]=4 4898 B12R1.27 COC(=O)\C=C\c1cnccn1 Amb22524637 [0,2,0,0,0,0|2,0,0]=4 4899 B12R1.27 COC(=O)\C=C\c1cncnc1 Amb2698637 [0,2,0,0,0,0|2,0,0]=4 4900 B12R1.27 COC(=O)\C=C\c1ncccn1 Amb25337205 [0,2,0,0,0,0|2,0,0]=4 4901 B12R1.27 COC(Cl)\C=C\c1ccccc1 Amb26371733 [0,2,0,0,0,0|0,0,2]=4 4902 B12R1.27 C[C@@H](C=O)OCc1ccccc1 Amb17609288 [0,2,0,0,0,0|0,0,2]=4 4903 B12R1.27 C[C@@H](\C=C\c1ccccc1)CO Amb27642008 [0,2,0,0,0,0|0,0,2]=4 4904 B12R1.27 C[C@H](C=O)ONc1ccccc1 Amb28239490 [0,2,0,0,0,0|1,0,1]=4 4905 B12R1.27 C\C(=C/Cc1ccccc1)CN Amb27402545 [0,2,0,0,0,0|1,0,1]=4 4906 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [0,2,0,0,0,0|0,0,2]=4 4907 B12R1.27 C\C(=C\Cl)CCc1ccccc1 Amb27658993 [0,2,0,0,0,0|1,0,1]=4 4908 B12R1.27 C\C(=C\Cl)CSc1ccccc1 Amb27760378 [0,2,0,0,0,0|1,0,1]=4 4909 B12R1.27 C\C(C#N)=C\Nc1ccccc1 Amb27420007 [0,2,0,0,0,0|1,0,1]=4 4910 B12R1.27 C\C(C=O)=C/Nc1ccccc1 Amb18645511 [0,2,0,0,0,0|0,0,0]=2 4911 B12R1.27 C\C=C(\C)C#Cc1ccccc1 Amb30621736 [0,2,0,0,0,0|1,0,1]=4 4912 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [0,2,0,0,0,0|1,0,1]=4 4913 B12R1.27 Cl\C=C(\Cl)COc1ccccc1 Amb27228628 [0,2,0,0,0,0|1,0,1]=4 4914 B12R1.27 N#CC(=O)OCc1ccccc1 Amb9786353 [0,2,0,0,0,0|1,0,1]=4 4915 B12R1.27 N#CC(O)\C=C\c1ccccc1 Amb28208386 [0,2,0,0,0,0|0,0,2]=4 4916 B12R1.27 NC(\C=C\c1ccccc1)=N/O Amb27816576 [0,2,0,0,0,0|0,0,1]=3 4917 B12R1.27 NC(\C=C\c1ccccc1)=N\O Amb25065269 [0,2,0,0,0,0|0,0,1]=3 4918 B12R1.27 NC(\C=C\c1ccccc1)CO Amb32954713 [0,2,0,0,0,0|0,0,2]=4 4919 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,2,0,0,0,0|0,0,2]=4 4920 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [0,2,0,0,0,0|0,0,2]=4 4921 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [0,2,0,0,0,0|1,0,1]=4 4922 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [0,2,0,0,0,0|1,0,1]=4 4923 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,2,0,0,0,0|1,0,1]=4 4924 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,2,0,0,0,0|1,0,1]=4 4925 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [0,2,0,0,0,0|0,0,0]=2 4926 B12R1.27 NCC(Cl)\C=C\c1ccccc1 Amb27447294 [0,2,0,0,0,0|1,0,1]=4 4927 B12R1.27 NCC(F)\C=C\c1ccccc1 Amb33081747 [0,2,0,0,0,0|1,0,1]=4 4928 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb32953205 [0,2,0,0,0,0|0,0,2]=4 4929 B12R1.27 NC[C@@H](O)\C=C\c1ccccc1 Amb33080765 [0,2,0,0,0,0|0,0,2]=4 4930 B12R1.27 NC[C@H](O)\C=C\c1ccccc1 Amb33080762 [0,2,0,0,0,0|0,0,2]=4 4931 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,2,0,0,0,0|0,0,2]=4 4932 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,2,0,0,0,0|1,0,1]=4 4933 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [0,2,0,0,0,0|1,0,1]=4 4934 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [0,2,0,0,0,0|1,0,1]=4 4935 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [0,2,0,0,0,0|1,0,1]=4 4936 B12R1.27 NNC(=O)NCc1ccccc1 Amb8853874 [0,2,0,0,0,0|1,0,1]=4 4937 B12R1.27 NNC(=O)NNc1ccccc1 Amb28045865 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.27 NNC(=O)OCc1ccccc1 Amb33422006 [0,2,0,0,0,0|1,0,1]=4 4939 B12R1.27 NNC(=O)OCc1ccccc1 Amb8516532 [0,2,0,0,0,0|1,0,1]=4 4940 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [0,2,0,0,0,0|0,0,0]=2 4941 B12R1.27 NNC(=O)\C=C\c1cccnc1 Amb2612884 [0,2,0,0,0,0|1,0,0]=3 4942 B12R1.27 NNC(=O)\C=C\c1ccncc1 Amb26611701 [0,2,0,0,0,0|1,0,0]=3 4943 B12R1.27 N[C@@H](\C=C\c1ccccc1)CO Amb33081817 [0,2,0,0,0,0|0,0,2]=4 4944 B12R1.27 N[C@H](\C=C\c1ccccc1)CO Amb32953226 [0,2,0,0,0,0|0,0,2]=4 4945 B12R1.27 O=C(C#Cc1ccccc1)CCl Amb26866804 [0,2,0,0,0,0|0,0,2]=4 4946 B12R1.27 O=C(C#Cc1ccccc1)NO Amb27755294 [0,2,0,0,0,0|0,0,2]=4 4947 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,2,0,0,0,0|0,0,2]=4 4948 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,2,0,0,0,0|1,0,1]=4 4949 B12R1.27 O=C(CBr)NCc1ccccc1 Amb2221074 [0,2,0,0,0,0|1,0,1]=4 4950 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [0,2,0,0,0,0|1,0,1]=4 4951 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [0,2,0,0,0,0|0,0,2]=4 4952 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [0,2,0,0,0,0|0,0,2]=4 4953 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [0,2,0,0,0,0|1,0,1]=4 4954 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [0,2,0,0,0,0|1,0,1]=4 4955 B12R1.27 O=C(CCl)NCc1ccccc1 Amb6324481 [0,2,0,0,0,0|1,0,1]=4 4956 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [0,2,0,0,0,0|1,0,1]=4 4958 B12R1.27 O=C(CF)NCc1ccccc1 Amb27237611 [0,2,0,0,0,0|1,0,1]=4 4959 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,2,0,0,0,0|1,0,1]=4 4960 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,2,0,0,0,0|1,0,1]=4 4961 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [0,2,0,0,0,0|0,0,2]=4 4962 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [0,2,0,0,0,0|1,0,1]=4 4963 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [0,2,0,0,0,0|1,0,1]=4 4964 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [0,2,0,0,0,0|1,0,1]=4 4966 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [0,2,0,0,0,0|1,0,1]=4 4967 B12R1.27 O=C(CS)NNc1ccccc1 Amb8459004 [0,2,0,0,0,0|2,0,0]=4 4968 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [0,2,0,0,0,0|1,0,1]=4 4969 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [0,2,0,0,0,0|1,0,1]=4 4970 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,2,0,0,0,0|1,0,1]=4 4971 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,2,0,0,0,0|1,0,1]=4 4972 B12R1.27 O=C(NO)NNc1ccccc1 Amb3427817 [0,2,0,0,0,0|2,0,0]=4 4973 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [0,2,0,0,0,0|1,0,1]=4 4974 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [0,2,0,0,0,0|0,0,0]=2 4975 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [0,2,0,0,0,0|0,0,0]=2 4976 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [0,2,0,0,0,0|0,0,0]=2 4977 B12R1.27 O=C(\C=C\c1ccccn1)NO Amb28370532 [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.27 O=C(\C=C\c1cccnc1)NO Amb28140433 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [0,2,0,0,0,0|0,0,1]=3 4980 B12R1.27 O=C\C(Cl)=C\Nc1ccccc1 Amb25797781 [0,2,0,0,0,0|0,0,0]=2 4981 B12R1.27 O=C\C(Cl)=N\Nc1ccccc1 Amb27797293 [0,2,0,0,0,0|1,0,0]=3 4982 B12R1.27 O=C\C(F)=C\Cc1ccccc1 Amb27166149 [0,2,0,0,0,0|0,0,0]=2 4983 B12R1.27 O=C\C(O)=C/Nc1ccccc1 Amb27476557 [0,2,0,0,0,0|0,0,0]=2 4984 B12R1.27 OC(\C=C\c1ccccc1)CBr Amb33080783 [0,2,0,0,0,0|0,0,2]=4 4985 B12R1.27 OC(\C=C\c1ccccc1)CCl Amb26527861 [0,2,0,0,0,0|0,0,2]=4 4986 B12R1.27 OC(\C=C\c1ccccc1)CF Amb32953290 [0,2,0,0,0,0|0,0,2]=4 4987 B12R1.27 OCC(F)\C=C\c1ccccc1 Amb27593937 [0,2,0,0,0,0|0,0,2]=4 4988 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb32953203 [0,2,0,0,0,0|0,0,2]=4 4989 B12R1.27 OC[C@H](O)\C=C\c1ccccc1 Amb28410835 [0,2,0,0,0,0|0,0,2]=4 4990 B12R1.27 [C-]#[N+]C(C)\C=C\c1ccccc1 Amb33081337 [0,2,0,0,0,0|1,0,1]=4 4991 B12R1.27 [C-]#[N+]\C(C)=C/Nc1ccccc1 Amb28398147 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [0,2,0,0,0,0|1,0,1]=4 4993 B12R1.32 C#CC\C(C)=C\c1ccccc1 Amb33476744 [0,2,0,0,0,0|1,0,1]=4 4994 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,2,0,0,0,0|1,0,1]=4 4995 B12R1.32 C=CNC(=O)Cc1ccccc1 Amb27455089 [0,2,0,0,0,0|1,0,1]=4 4996 B12R1.32 C=CNC(=S)Cc1ccccc1 Amb27239916 [0,2,0,0,0,0|1,0,1]=4 4997 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,2,0,0,0,0|1,0,1]=4 4998 B12R1.32 C=COC(=S)Nc1ccccc1 Amb27969249 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.32 CC(=C\c1ccccc1)\C=C\N Amb27788151 [0,2,0,0,0,0|1,0,0]=3 5000 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [0,2,0,0,0,0|0,0,2]=4 5001 B12R1.32 CC(\C=N\O)=C/c1ccccc1 Amb4036028 [0,2,0,0,0,0|0,0,1]=3 5002 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,2,0,0,0,0|1,0,1]=4 5003 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,2,0,0,0,0|0,0,2]=4 5004 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [0,2,0,0,0,0|1,0,1]=4 5005 B12R1.32 C\C(=C/c1ccccc1)CC#N Amb33476434 [0,2,0,0,0,0|1,0,1]=4 5006 B12R1.32 C\C(=C/c1ccccc1)CC=O Amb32952974 [0,2,0,0,0,0|0,0,0]=2 5007 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,2,0,0,0,0|1,0,1]=4 5008 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,2,0,0,0,0|1,0,1]=4 5009 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,2,0,0,0,0|0,0,2]=4 5010 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,2,0,0,0,0|0,1,1]=4 5011 B12R1.32 C\C(=C/c1ccccc1)CNN Amb27769440 [0,2,0,0,0,0|1,0,1]=4 5012 B12R1.32 C\C(=C/c1ccccc1)CNO Amb33506732 [0,2,0,0,0,0|0,0,2]=4 5013 B12R1.32 C\C(=C/c1ccccc1)CON Amb33476431 [0,2,0,0,0,0|0,0,2]=4 5014 B12R1.32 C\C(=C\C=O)Cc1ccccc1 Amb27435409 [0,2,0,0,0,0|0,0,0]=2 5015 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [0,2,0,0,0,0|0,0,2]=4 5016 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,2,0,0,0,0|1,0,1]=4 5017 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,2,0,0,0,0|1,0,1]=4 5018 B12R1.32 C\C(=C\c1ccccc1)N=[N+]=[N-] Amb27659480 [0,2,0,0,0,0|2,0,0]=4 5019 B12R1.32 C\C(=C\c1ccccc1)NC=O Amb27669841 [0,2,0,0,0,0|0,0,0]=2 5020 B12R1.32 C\C=C\C(=O)Cc1ccccn1 Amb27190935 [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.32 C\C=C\C(=O)Cc1ccncc1 Amb28063108 [0,2,0,0,0,0|2,0,0]=4 5022 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [0,2,0,0,0,0|1,0,0]=3 5023 B12R1.32 C\C=C\C(=O)Nc1cccnc1 Amb27766723 [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.32 C\C=C\C(=O)Nc1ccncc1 Amb27858099 [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [0,2,0,0,0,0|1,0,0]=3 5026 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [0,2,0,0,0,0|1,0,0]=3 5027 B12R1.32 C\C=C\C(C)Nc1ccccc1 Amb28245278 [0,2,0,0,0,0|1,0,1]=4 5028 B12R1.32 C\C=C\C(O)Cc1ccccc1 Amb27641998 [0,2,0,0,0,0|1,0,1]=4 5029 B12R1.32 N#C\C=C(/N)Cc1ccccc1 Amb28195853 [0,2,0,0,0,0|1,0,1]=4 5030 B12R1.32 N#C\C=C(\N)Nc1ccccc1 Amb27607188 [0,2,0,0,0,0|1,0,1]=4 5031 B12R1.32 NCC\C(Br)=C\c1ccccc1 Amb27770057 [0,2,0,0,0,0|1,0,1]=4 5032 B12R1.32 NCC\C(Cl)=C/c1ccccc1 Amb27881313 [0,2,0,0,0,0|1,0,1]=4 5033 B12R1.32 NCC\C(Cl)=C\c1ccccc1 Amb27843483 [0,2,0,0,0,0|1,0,1]=4 5034 B12R1.32 N\C=N\C(=S)Nc1ccccc1 Amb27441755 [0,2,0,0,0,0|2,0,0]=4 5035 B12R1.32 O=C(\C=C\Cl)Nc1ccccc1 Amb28342211 [0,2,0,0,0,0|1,0,0]=3 5036 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,2,0,0,0,0|1,0,0]=3 5037 B12R1.32 O=C(\C=N\O)Nc1ccccc1 Amb1205570 [0,2,0,0,0,0|1,0,1]=4 5038 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,2,0,0,0,0|0,0,2]=4 5039 B12R1.32 O=C=NC(=O)Oc1ccccc1 Amb22348017 [0,2,0,0,0,0|1,0,1]=4 5040 B12R1.32 O=C=NC(=S)Cc1ccccc1 Amb27178259 [0,2,0,0,0,0|0,0,2]=4 5041 B12R1.32 O=CCC(=S)Nc1ccccc1 Amb28073090 [0,2,0,0,0,0|0,0,1]=3 5042 B12R1.32 O=CNC(=O)Cc1ccccc1 Amb6360720 [0,2,0,0,0,0|0,0,1]=3 5043 B12R1.32 OC\C=C(\Cl)Cc1ccccc1 Amb27841976 [0,2,0,0,0,0|0,0,2]=4 5044 B12R1.32 [C-]#[N+]C\C(C)=C\c1ccccc1 Amb33476725 [0,2,0,0,0,0|1,0,1]=4 5045 B12R1.32 [N-]=[N+]=CC(=O)Cc1ccccc1 Amb749121 [0,2,0,0,0,0|1,0,1]=4 5046 B12R1.252 CC(=O)C#CCc1ccccc1 Amb27177980 [0,2,0,0,0,0|0,0,2]=4 5047 B12R1.252 CC(=O)CC#Cc1ccccc1 Amb28122481 [0,2,0,0,0,0|0,0,2]=4 5048 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [0,2,0,0,0,0|0,0,2]=4 5049 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [0,2,0,0,0,0|0,0,2]=4 5050 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [0,2,0,0,0,0|0,0,2]=4 5051 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [0,2,0,0,0,0|0,0,2]=4 5052 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [0,2,0,0,0,0|0,0,2]=4 5053 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [0,2,0,0,0,0|1,0,1]=4 5054 B12R1.252 CC(=O)CSCc1ccccc1 Amb4018341 [0,2,0,0,0,0|0,0,2]=4 5055 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [0,2,0,0,0,0|0,0,0]=2 5056 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [0,2,0,0,0,0|0,0,1]=3 5057 B12R1.252 CC(=O)NCCc1ccccc1 Amb2781514 [0,2,0,0,0,0|0,0,2]=4 5058 B12R1.252 CC(=O)NCSc1ccccc1 Amb27797274 [0,2,0,0,0,0|1,0,1]=4 5059 B12R1.252 CC(=O)N\N=C\c1ccccc1 Amb2732164 [0,2,0,0,0,0|1,0,0]=3 5060 B12R1.252 CC(=O)N\N=C\c1ccccn1 Amb6878917 [0,2,0,0,0,0|2,0,0]=4 5061 B12R1.252 CC(=O)OCCc1ccccc1 Amb6357159 [0,2,0,0,0,0|0,0,2]=4 5062 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [0,2,0,0,0,0|0,0,0]=2 5063 B12R1.252 CC(=O)\C=C/Nc1ccccc1 Amb28461253 [0,2,0,0,0,0|0,0,0]=2 5064 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [0,2,0,0,0,0|0,0,0]=2 5065 B12R1.252 CC(=O)\C=C\N=C1C=CNC=C1 Amb25351670 [0,2,0,0,0,0|1,0,0]=3 5066 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [0,2,0,0,0,0|0,0,0]=2 5067 B12R1.252 CC(=O)\C=C\Nc1ccccn1 Amb22490408 [0,2,0,0,0,0|1,0,0]=3 5068 B12R1.252 CC(=O)\C=C\Oc1ccccc1 Amb26528572 [0,2,0,0,0,0|0,0,0]=2 5069 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb35789855 [0,2,0,0,0,0|0,0,0]=2 5070 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [0,2,0,0,0,0|1,0,0]=3 5071 B12R1.252 CC(=O)\[C+]=N\[N-]c1ccccc1 Amb27614630 [0,2,0,0,0,0|1,0,1]=4 5072 B12R1.252 CC(Br)C\C=C\c1ccccc1 Amb33080969 [0,2,0,0,0,0|1,0,1]=4 5073 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [0,2,0,0,0,0|1,0,1]=4 5074 B12R1.252 CC(C)=CCNc1ccccc1 Amb27638094 [0,2,0,0,0,0|1,0,1]=4 5075 B12R1.252 CC(C)=CCSc1ccccc1 Amb8394723 [0,2,0,0,0,0|1,0,1]=4 5076 B12R1.252 CC(C)=C\C=C/c1ccccn1 Amb22546609 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.252 CC(C)=C\C=C\c1ccccc1 Amb28143072 [0,2,0,0,0,0|1,0,0]=3 5078 B12R1.252 CC(Cl)\C=C\Sc1ccccc1 Amb27401898 [0,2,0,0,0,0|1,0,1]=4 5079 B12R1.252 CC(N)C\C=C\c1ccccc1 Amb25970039 [0,2,0,0,0,0|1,0,1]=4 5080 B12R1.252 CC(N)\C=C\Cc1ccccc1 Amb32953143 [0,2,0,0,0,0|1,0,1]=4 5081 B12R1.252 CC(O)C\C=C\c1ccccc1 Amb32954303 [0,2,0,0,0,0|0,0,2]=4 5082 B12R1.252 CC(O)\C=C\Sc1ccccc1 Amb28294251 [0,2,0,0,0,0|0,0,2]=4 5083 B12R1.252 CN(O)C\C=C\c1ccccc1 Amb33081135 [0,2,0,0,0,0|0,0,2]=4 5084 B12R1.252 CS(=O)\N=C\Cc1ccccc1 Amb35681654 [0,2,0,0,0,0|1,0,1]=4 5085 B12R1.252 C[C@@H](N)C\C=C\c1ccccc1 Amb33080763 [0,2,0,0,0,0|1,0,1]=4 5086 B12R1.252 C[C@@H](O)C\C=C\c1ccccc1 Amb32954522 [0,2,0,0,0,0|0,0,2]=4 5087 B12R1.252 C[C@H](N)C\C=C\c1ccccc1 Amb33080767 [0,2,0,0,0,0|1,0,1]=4 5088 B12R1.252 C[C@H](O)C\C=C\c1ccccc1 Amb32954836 [0,2,0,0,0,0|0,0,2]=4 5089 B12R1.252 C\C(Cl)=C\CNc1ccccc1 Amb4303986 [0,2,0,0,0,0|1,0,1]=4 5090 B12R1.252 C\C(N)=N\C=C\c1ccccc1 Amb28457490 [0,2,0,0,0,0|1,0,0]=3 5091 B12R1.252 C\C(N)=N\N=C\c1ccccc1 Amb25362013 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.252 ClC(Cl)=CCCc1ccccc1 Amb27443084 [0,2,0,0,0,0|1,0,1]=4 5093 B12R1.252 ClC(Cl)=CCOc1ccccc1 Amb29866947 [0,2,0,0,0,0|1,0,1]=4 5094 B12R1.252 ClC(Cl)=CNCc1ccccc1 Amb2793552 [0,2,0,0,0,0|1,0,1]=4 5095 B12R1.252 ClP(Cl)\C=C\Oc1ccccc1 Amb4297323 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.252 N=C(N)C\C=C\c1ccccc1 Amb27652946 [0,2,0,0,0,0|1,0,0]=3 5097 B12R1.252 N=C(N)N\C=N\c1ccccc1 Amb24550657 [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.252 N=C(N)N\N=C/c1ccccc1 Amb598038 [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.252 N=C(N)N\N=C\c1ccccc1 Amb1147507 [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.252 NC(=O)CC#Cc1ccccc1 Amb28256571 [0,2,0,0,0,0|0,0,2]=4 5101 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [0,2,0,0,0,0|0,0,2]=4 5102 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [0,2,0,0,0,0|0,0,2]=4 5103 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [0,2,0,0,0,0|0,0,2]=4 5104 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [0,2,0,0,0,0|0,0,2]=4 5105 B12R1.252 NC(=O)CNCc1ccccc1 Amb2696395 [0,2,0,0,0,0|0,0,2]=4 5106 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [0,2,0,0,0,0|0,0,2]=4 5107 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [0,2,0,0,0,0|0,0,2]=4 5108 B12R1.252 NC(=O)NCSc1ccccc1 Amb28200898 [0,2,0,0,0,0|1,0,1]=4 5109 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [0,2,0,0,0,0|1,0,1]=4 5110 B12R1.252 NC(=O)N\N=C/c1ccccc1 Amb2610534 [0,2,0,0,0,0|1,0,0]=3 5111 B12R1.252 NC(=O)N\N=C\c1ccccc1 Amb4383215 [0,2,0,0,0,0|1,0,0]=3 5112 B12R1.252 NC(=O)N\N=C\c1cccnc1 Amb4390087 [0,2,0,0,0,0|2,0,0]=4 5113 B12R1.252 NC(=O)N\N=C\c1ccncc1 Amb8504449 [0,2,0,0,0,0|2,0,0]=4 5114 B12R1.252 NC(=S)C\C=C\c1ccccc1 Amb25112081 [0,2,0,0,0,0|0,1,0]=3 5115 B12R1.252 NC(=S)N\N=C\c1ccccc1 Amb6318869 [0,2,0,0,0,0|1,1,0]=4 5116 B12R1.252 NC(N)=N\N=C\c1ccccc1 Amb2755669 [0,2,0,0,0,0|2,0,0]=4 5117 B12R1.252 N\C(S)=N\N=C/c1ccccc1 Amb1264516 [0,2,0,0,0,0|1,1,0]=4 5118 B12R1.252 N\C(S)=N\N=C\c1ccccc1 Amb19987045 [0,2,0,0,0,0|1,1,0]=4 5119 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [0,2,0,0,0,0|0,0,2]=4 5120 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [0,2,0,0,0,0|0,0,2]=4 5121 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [0,2,0,0,0,0|0,0,2]=4 5122 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [0,2,0,0,0,0|0,0,2]=4 5123 B12R1.252 O=C(Cl)CSCc1ccccc1 Amb10880013 [0,2,0,0,0,0|0,0,2]=4 5124 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [0,2,0,0,0,0|0,0,0]=2 5125 B12R1.252 O=C(Cl)OCCc1ccccc1 Amb32661047 [0,2,0,0,0,0|0,0,2]=4 5126 B12R1.252 O=C(O)C#CSc1ccccc1 Amb27645390 [0,2,0,0,0,0|0,0,2]=4 5127 B12R1.252 O=C(O)C=C=Cc1ccccc1 Amb25102534 [0,2,0,0,0,0|0,0,0]=2 5128 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [0,2,0,0,0,0|0,0,2]=4 5129 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [0,2,0,0,0,0|0,0,2]=4 5130 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [0,2,0,0,0,0|0,0,2]=4 5131 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [0,2,0,0,0,0|0,0,2]=4 5132 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [0,2,0,0,0,0|0,0,2]=4 5133 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [0,2,0,0,0,0|0,0,2]=4 5134 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [0,2,0,0,0,0|0,0,2]=4 5135 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [0,2,0,0,0,0|0,0,2]=4 5136 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [0,2,0,0,0,0|0,0,2]=4 5137 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [0,2,0,0,0,0|0,0,2]=4 5138 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [0,2,0,0,0,0|0,0,2]=4 5139 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [0,2,0,0,0,0|0,0,0]=2 5140 B12R1.252 O=C(O)C\C=C\c1ccccn1 Amb25073201 [0,2,0,0,0,0|1,0,0]=3 5141 B12R1.252 O=C(O)C\C=C\c1cccnc1 Amb26478515 [0,2,0,0,0,0|1,0,0]=3 5142 B12R1.252 O=C(O)C\C=C\c1ccncc1 Amb24571194 [0,2,0,0,0,0|1,0,0]=3 5143 B12R1.252 O=C(O)C\N=C/c1cccnc1 Amb27232669 [0,2,0,0,0,0|1,0,1]=4 5144 B12R1.252 O=C(O)C\N=C\c1cccnc1 Amb28077098 [0,2,0,0,0,0|1,0,1]=4 5145 B12R1.252 O=C(O)C\N=C\c1ccncc1 Amb27455443 [0,2,0,0,0,0|1,0,1]=4 5146 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [0,2,0,0,0,0|1,0,1]=4 5147 B12R1.252 O=C(O)\C=C/Sc1ccccc1 Amb3940780 [0,2,0,0,0,0|0,0,0]=2 5148 B12R1.252 O=C(O)\C=C\Cc1ccccc1 Amb8392409 [0,2,0,0,0,0|0,0,0]=2 5149 B12R1.252 O=C(O)\C=C\Cc1cccnc1 Amb25849857 [0,2,0,0,0,0|1,0,0]=3 5150 B12R1.252 O=C(O)\C=C\Cc1ccncc1 Amb26841073 [0,2,0,0,0,0|1,0,0]=3 5151 B12R1.252 O=C(O)\C=C\Sc1ccccc1 Amb1661597 [0,2,0,0,0,0|0,0,0]=2 5152 B12R1.252 O=C(O)\C=C\Sc1ccccn1 Amb27865585 [0,2,0,0,0,0|1,0,0]=3 5153 B12R1.252 O=C(O)\C=N/Nc1ccccc1 Amb24068313 [0,2,0,0,0,0|1,0,0]=3 5154 B12R1.252 O=C(O)\C=N\Nc1ccccc1 Amb17594064 [0,2,0,0,0,0|1,0,0]=3 5155 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [0,2,0,0,0,0|0,0,2]=4 5156 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [0,2,0,0,0,0|0,0,2]=4 5157 B12R1.252 O=C([O-])\C=C\Sc1ccccc1 Amb534252 [0,2,0,0,0,0|0,0,0]=2 5158 B12R1.252 O=[N+]([O-])\C=C\Cc1ccccc1 Amb32953157 [0,2,0,0,0,0|0,0,1]=3 5159 B12R1.252 OB(O)C\C=C\c1ccccc1 Amb26916741 [0,2,0,0,0,0|0,0,2]=4 5160 B12R1.252 OB(O)\C=C\Cc1ccccc1 Amb21856558 [0,2,0,0,0,0|0,0,2]=4 5161 B12R1.43 C=C(C)C(=O)Nc1ccccc1 Amb6384289 [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.43 C=C(C)C(=O)Oc1ccccc1 Amb8394675 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.43 C=C(C)C(=S)Nc1ccccc1 Amb28243811 [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.43 C=C(Cc1ccccc1)C(=O)Cl Amb27416413 [0,2,0,0,0,0|0,0,1]=3 5165 B12R1.43 C=C(Cc1ccccc1)C(=O)O Amb8393733 [0,2,0,0,0,0|0,0,1]=3 5166 B12R1.43 C=C(Cc1ccccc1)[N+](=O)[O-] Amb33295355 [0,2,0,0,0,0|1,0,1]=4 5167 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [0,2,0,0,0,0|1,0,1]=4 5168 B12R1.43 C=C(Cc1ccncc1)C(=O)O Amb27389258 [0,2,0,0,0,0|1,0,1]=4 5169 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 Amb27751263 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,2,0,0,0,0|0,0,1]=3 5171 B12R1.43 CC(=O)C(=O)Cc1ccccn1 Amb26923275 [0,2,0,0,0,0|1,0,1]=4 5172 B12R1.43 CC(=O)C(=O)Cc1cccnc1 Amb24556780 [0,2,0,0,0,0|1,0,1]=4 5173 B12R1.43 CC(=O)C(=O)Cc1ccncc1 Amb24555440 [0,2,0,0,0,0|1,0,1]=4 5174 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [0,2,0,0,0,0|1,0,0]=3 5175 B12R1.43 CC(=O)C(=O)Nc1cccnc1 Amb28319843 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [0,2,0,0,0,0|0,0,2]=4 5177 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [0,2,0,0,0,0|0,0,2]=4 5178 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [0,2,0,0,0,0|1,0,1]=4 5179 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [0,2,0,0,0,0|1,0,1]=4 5180 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [0,2,0,0,0,0|1,0,1]=4 5181 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [0,2,0,0,0,0|0,0,2]=4 5182 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [0,2,0,0,0,0|1,0,1]=4 5183 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [0,2,0,0,0,0|0,0,2]=4 5184 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [0,2,0,0,0,0|0,0,2]=4 5185 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [0,2,0,0,0,0|0,0,2]=4 5186 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,2,0,0,0,0|0,0,2]=4 5187 B12R1.43 CC(=O)N(C)Cc1ccccc1 Amb3886652 [0,2,0,0,0,0|1,0,1]=4 5188 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,2,0,0,0,0|2,0,0]=4 5189 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [0,2,0,0,0,0|0,0,2]=4 5190 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [0,2,0,0,0,0|0,0,2]=4 5191 B12R1.43 CC(=O)\C(Br)=C\c1ccccc1 Amb17596166 [0,2,0,0,0,0|0,0,0]=2 5192 B12R1.43 CC(=O)\C(C)=C\c1ccccc1 Amb17594004 [0,2,0,0,0,0|0,0,0]=2 5193 B12R1.43 CC(=O)\C(C)=C\c1cccnc1 Amb25373091 [0,2,0,0,0,0|1,0,0]=3 5194 B12R1.43 CC(=O)\C(C)=C\c1cnccn1 Amb35601037 [0,2,0,0,0,0|2,0,0]=4 5195 B12R1.43 CC(=O)\C(C)=N\c1ccccc1 Amb24537849 [0,2,0,0,0,0|1,0,0]=3 5196 B12R1.43 CC(C)=C(C)Sc1ccccc1 Amb28284519 [0,2,0,0,0,0|2,0,0]=4 5197 B12R1.43 CC(Cc1ccccc1)C(=O)Cl Amb5744098 [0,2,0,0,0,0|0,0,2]=4 5198 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,2,0,0,0,0|0,0,2]=4 5199 B12R1.43 CC(Cc1ccccc1)C(N)=O Amb2701804 [0,2,0,0,0,0|0,0,2]=4 5200 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [0,2,0,0,0,0|1,0,1]=4 5201 B12R1.43 CC(Oc1ccccc1)C(=O)Cl Amb3939464 [0,2,0,0,0,0|1,0,1]=4 5202 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [0,2,0,0,0,0|1,0,1]=4 5203 B12R1.43 CC(Oc1ccccc1)C(N)=O Amb3886659 [0,2,0,0,0,0|1,0,1]=4 5204 B12R1.43 CC(Sc1ccccc1)C(=O)Cl Amb17143250 [0,2,0,0,0,0|1,0,1]=4 5205 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [0,2,0,0,0,0|1,0,1]=4 5206 B12R1.43 CC(Sc1ccccc1)C(N)=O Amb10665761 [0,2,0,0,0,0|1,0,1]=4 5207 B12R1.43 CN(Cc1ccccc1)C(=O)Cl Amb17563090 [0,2,0,0,0,0|1,0,1]=4 5208 B12R1.43 CN(Cc1ccccc1)C(N)=O Amb6250028 [0,2,0,0,0,0|1,0,1]=4 5209 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,2,0,0,0,0|0,0,2]=4 5210 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [0,2,0,0,0,0|1,0,1]=4 5211 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [0,2,0,0,0,0|1,0,1]=4 5212 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [0,2,0,0,0,0|1,0,1]=4 5213 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,2,0,0,0,0|0,0,2]=4 5214 B12R1.43 C[C@H](Cc1ccccc1)C(N)=O Amb28319376 [0,2,0,0,0,0|0,0,2]=4 5215 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [0,2,0,0,0,0|1,0,1]=4 5216 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [0,2,0,0,0,0|1,0,1]=4 5217 B12R1.43 C[C@H](Oc1ccccc1)C(N)=O Amb27431501 [0,2,0,0,0,0|1,0,1]=4 5218 B12R1.43 C\C(=C/c1ccccc1)B(O)O Amb26348065 [0,2,0,0,0,0|1,0,1]=4 5219 B12R1.43 C\C(=C/c1ccccc1)C(=N)N Amb32952072 [0,2,0,0,0,0|1,0,0]=3 5220 B12R1.43 C\C(=C/c1ccccc1)C(=O)Cl Amb24061289 [0,2,0,0,0,0|0,0,0]=2 5221 B12R1.43 C\C(=C/c1ccccc1)C(=O)O Amb8513246 [0,2,0,0,0,0|0,0,0]=2 5222 B12R1.43 C\C(=C/c1ccccc1)C(C)Br Amb27654847 [0,2,0,0,0,0|1,0,1]=4 5223 B12R1.43 C\C(=C/c1ccccc1)C(C)Cl Amb27779593 [0,2,0,0,0,0|1,0,1]=4 5224 B12R1.43 C\C(=C/c1ccccc1)C(C)N Amb33329380 [0,2,0,0,0,0|1,0,1]=4 5225 B12R1.43 C\C(=C/c1ccccc1)C(C)O Amb27762014 [0,2,0,0,0,0|0,0,2]=4 5226 B12R1.43 C\C(=C/c1ccccc1)C(N)=S Amb33082670 [0,2,0,0,0,0|0,1,0]=3 5227 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)N Amb33476129 [0,2,0,0,0,0|1,0,1]=4 5228 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)O Amb32952077 [0,2,0,0,0,0|0,0,2]=4 5229 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)N Amb27261769 [0,2,0,0,0,0|1,0,1]=4 5230 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)O Amb27589732 [0,2,0,0,0,0|0,0,2]=4 5231 B12R1.43 C\C(=C/c1ccccc1)[N+](=O)[O-] Amb6320973 [0,2,0,0,0,0|1,0,0]=3 5232 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb30584914 [0,2,0,0,0,0|1,0,0]=3 5233 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb33995393 [0,2,0,0,0,0|1,0,0]=3 5234 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb30584915 [0,2,0,0,0,0|1,0,0]=3 5235 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb5743927 [0,2,0,0,0,0|1,0,0]=3 5236 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb30584913 [0,2,0,0,0,0|1,0,0]=3 5237 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb5743928 [0,2,0,0,0,0|1,0,0]=3 5238 B12R1.43 C\C(=C/c1cncnc1)C(=O)O Amb27755121 [0,2,0,0,0,0|2,0,0]=4 5239 B12R1.43 C\C(=C\c1ccccc1)C(=O)O Amb24603461 [0,2,0,0,0,0|0,0,0]=2 5240 B12R1.43 C\C(=C\c1ccccc1)C(N)=S Amb27466528 [0,2,0,0,0,0|0,1,0]=3 5241 B12R1.43 C\C(=C\c1ccccc1)[N+](=O)[O-] Amb21520351 [0,2,0,0,0,0|1,0,0]=3 5242 B12R1.43 C\C(=C\c1cccnc1)C(=O)O Amb27837141 [0,2,0,0,0,0|1,0,0]=3 5243 B12R1.43 C\C(=C\c1cccnc1)[N+](=O)[O-] Amb25294704 [0,2,0,0,0,0|2,0,0]=4 5244 B12R1.43 C\C(=C\c1ccncc1)C(=O)O Amb27882270 [0,2,0,0,0,0|1,0,0]=3 5245 B12R1.43 C\C(=C\c1cnccn1)C(=O)O Amb27622051 [0,2,0,0,0,0|2,0,0]=4 5246 B12R1.43 Cl\C(=C/c1ccccc1)P(Cl)Cl Amb4297325 [0,2,0,0,0,0|2,0,0]=4 5247 B12R1.43 FC(F)=C(F)Oc1ccccc1 Amb10841028 [0,2,0,0,0,0|2,0,0]=4 5248 B12R1.43 N=C(N)C(=O)Cc1ccccc1 Amb27257229 [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [0,2,0,0,0,0|1,0,0]=3 5250 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [0,2,0,0,0,0|0,0,1]=3 5251 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,2,0,0,0,0|1,0,0]=3 5252 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [0,2,0,0,0,0|1,0,0]=3 5253 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [0,2,0,0,0,0|1,0,0]=3 5254 B12R1.43 NC(=O)C(=S)Nc1ccccn1 Amb6870743 [0,2,0,0,0,0|2,0,0]=4 5255 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,2,0,0,0,0|0,0,2]=4 5256 B12R1.43 NC(=O)C(Cl)Cc1ccccc1 Amb17204334 [0,2,0,0,0,0|0,0,2]=4 5257 B12R1.43 NC(=O)C(F)Sc1ccccc1 Amb27865643 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,2,0,0,0,0|0,0,2]=4 5259 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb9727200 [0,2,0,0,0,0|0,0,2]=4 5260 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,2,0,0,0,0|1,0,1]=4 5261 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,2,0,0,0,0|0,0,2]=4 5262 B12R1.43 NC(=O)C(S)Cc1ccccc1 Amb27663190 [0,2,0,0,0,0|0,0,2]=4 5263 B12R1.43 NC(=O)N(O)Cc1ccccc1 Amb27966850 [0,2,0,0,0,0|1,0,1]=4 5264 B12R1.43 NC(=O)[C@@H](Br)Cc1ccccc1 Amb27240179 [0,2,0,0,0,0|0,0,2]=4 5265 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb6295777 [0,2,0,0,0,0|0,0,2]=4 5266 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb9825510 [0,2,0,0,0,0|0,0,2]=4 5267 B12R1.43 NC(=O)[C@@H](O)Cc1ccccc1 Amb26371653 [0,2,0,0,0,0|0,0,2]=4 5268 B12R1.43 NC(=O)[C@H](Cl)Cc1ccccc1 Amb28385619 [0,2,0,0,0,0|0,0,2]=4 5269 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb16183950 [0,2,0,0,0,0|0,0,2]=4 5270 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb33800758 [0,2,0,0,0,0|0,0,2]=4 5271 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,2,0,0,0,0|0,0,2]=4 5272 B12R1.43 NC(=O)\C(Cl)=C\c1ccccc1 Amb3724521 [0,2,0,0,0,0|0,0,0]=2 5273 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,2,0,0,0,0|0,0,2]=4 5274 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,2,0,0,0,0|0,0,2]=4 5275 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)Cl Amb27955901 [0,2,0,0,0,0|0,0,2]=4 5276 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,2,0,0,0,0|0,0,2]=4 5277 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,2,0,0,0,0|0,0,2]=4 5278 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)S Amb27407796 [0,2,0,0,0,0|0,0,2]=4 5279 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,2,0,0,0,0|0,0,2]=4 5280 B12R1.43 N\C(=C/c1ccccc1)C(=O)O Amb24081025 [0,2,0,0,0,0|0,0,0]=2 5281 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.43 N\C(=C\c1ccccc1)C(=O)O Amb27148014 [0,2,0,0,0,0|0,0,0]=2 5283 B12R1.43 N\C(=C\c1ccccn1)C(=O)O Amb27770994 [0,2,0,0,0,0|1,0,0]=3 5284 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.43 O=C(Br)C(Br)Cc1ccccc1 Amb27840480 [0,2,0,0,0,0|0,0,2]=4 5286 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,2,0,0,0,0|0,0,2]=4 5287 B12R1.43 O=C(Cl)C(F)Cc1ccccc1 Amb27615534 [0,2,0,0,0,0|0,0,2]=4 5288 B12R1.43 O=C(Cl)C(O)Cc1ccccc1 Amb27632817 [0,2,0,0,0,0|0,0,2]=4 5289 B12R1.43 O=C(Cl)\C(F)=C/c1ccccc1 Amb27416385 [0,2,0,0,0,0|0,0,0]=2 5290 B12R1.43 O=C(O)C(=O)C[n+]1ccccc1 Amb28287668 [0,2,0,0,0,0|1,0,1]=4 5291 B12R1.43 O=C(O)C(=O)Cc1ccccc1 Amb2718694 [0,2,0,0,0,0|0,0,1]=3 5292 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb17477815 [0,2,0,0,0,0|1,0,1]=4 5293 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb32952891 [0,2,0,0,0,0|1,0,1]=4 5294 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [0,2,0,0,0,0|1,0,1]=4 5295 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [0,2,0,0,0,0|1,0,1]=4 5296 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [0,2,0,0,0,0|1,0,0]=3 5297 B12R1.43 O=C(O)C(=O)Nc1ccccn1 Amb9303802 [0,2,0,0,0,0|2,0,0]=4 5298 B12R1.43 O=C(O)C(=O)Nc1cccnc1 Amb9303807 [0,2,0,0,0,0|2,0,0]=4 5299 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [0,2,0,0,0,0|2,0,0]=4 5300 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [0,2,0,0,0,0|1,0,0]=3 5301 B12R1.43 O=C(O)C(=S)Oc1ccccc1 Amb27484078 [0,2,0,0,0,0|1,0,0]=3 5302 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,2,0,0,0,0|0,0,2]=4 5303 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,2,0,0,0,0|0,0,2]=4 5304 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [0,2,0,0,0,0|1,0,1]=4 5305 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,2,0,0,0,0|0,0,2]=4 5306 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,2,0,0,0,0|0,0,2]=4 5307 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [0,2,0,0,0,0|1,0,1]=4 5308 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,2,0,0,0,0|0,0,2]=4 5309 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,2,0,0,0,0|0,0,2]=4 5310 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,2,0,0,0,0|0,0,2]=4 5311 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,2,0,0,0,0|0,0,2]=4 5312 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,2,0,0,0,0|0,0,2]=4 5313 B12R1.43 O=C(O)\C(Br)=C\c1ccccc1 Amb2794045 [0,2,0,0,0,0|0,0,0]=2 5314 B12R1.43 O=C(O)\C(Cl)=C/c1ccccc1 Amb18648695 [0,2,0,0,0,0|0,0,0]=2 5315 B12R1.43 O=C(O)\C(Cl)=C\c1ccccc1 Amb19651416 [0,2,0,0,0,0|0,0,0]=2 5316 B12R1.43 O=C(O)\C(Cl)=C\c1cccnc1 Amb26448364 [0,2,0,0,0,0|1,0,0]=3 5317 B12R1.43 O=C(O)\C(F)=C\c1ccccc1 Amb24093652 [0,2,0,0,0,0|0,0,0]=2 5318 B12R1.43 O=C(O)\C(F)=C\c1ccccn1 Amb27977069 [0,2,0,0,0,0|1,0,0]=3 5319 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb17614474 [0,2,0,0,0,0|1,0,0]=3 5320 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb31339126 [0,2,0,0,0,0|1,0,0]=3 5321 B12R1.43 O=C(O)\C(F)=C\c1cnccn1 Amb35600945 [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.43 O=C(O)\C(S)=C/c1ccccc1 Amb2550972 [0,2,0,0,0,0|0,0,0]=2 5323 B12R1.43 O=C(O)\C(S)=C\c1ccccc1 Amb1250109 [0,2,0,0,0,0|0,0,0]=2 5324 B12R1.43 O=C(O)\C(S)=C\c1ccccn1 Amb1761004 [0,2,0,0,0,0|1,0,0]=3 5325 B12R1.43 O=C(O)\C(S)=C\c1ccncc1 Amb1761003 [0,2,0,0,0,0|1,0,0]=3 5326 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb19884048 [0,2,0,0,0,0|0,0,1]=3 5327 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb6365780 [0,2,0,0,0,0|0,0,1]=3 5328 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb8393076 [0,2,0,0,0,0|0,0,1]=3 5329 B12R1.43 O=C([O-])C(O)Cc1ccccc1 Amb33513053 [0,2,0,0,0,0|0,0,2]=4 5330 B12R1.43 O=[N+]([O-])\C(F)=C\c1ccccc1 Amb27843539 [0,2,0,0,0,0|1,0,0]=3 5331 B12R1.43 OB(O)\C(F)=C\c1ccccc1 Amb25667549 [0,2,0,0,0,0|1,0,1]=4 5332 B12R1.118 C=C\C(=C/c1ccccc1)CO Amb27981982 [0,2,0,0,0,0|1,0,0]=3 5333 B12R1.118 CCC(=Cc1ccccc1)CC Amb27807779 [0,2,0,0,0,0|1,0,1]=4 5334 B12R1.118 CC\C(=C\Cl)Oc1ccccc1 Amb27425338 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.118 CC\C(=C\c1ccccc1)CO Amb27860945 [0,2,0,0,0,0|0,0,2]=4 5336 B12R1.118 CC\C(C=O)=C/c1ccccc1 Amb615951 [0,2,0,0,0,0|0,0,0]=2 5337 B12R1.118 CC\C(C=O)=C/c1ccccn1 Amb17334523 [0,2,0,0,0,0|1,0,0]=3 5338 B12R1.118 CC\C(C=O)=C/c1cccnc1 Amb17334524 [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.118 CC\C(C=O)=C/c1ccncc1 Amb17334525 [0,2,0,0,0,0|1,0,0]=3 5340 B12R1.118 CC\C(C=O)=C\c1cccnc1 Amb28321082 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.118 CC\C(C=O)=C\c1ccncn1 Amb27869140 [0,2,0,0,0,0|2,0,0]=4 5342 B12R1.118 CC\C(C=O)=C\c1cnccn1 Amb35600871 [0,2,0,0,0,0|2,0,0]=4 5343 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [0,2,0,0,0,0|0,0,2]=4 5344 B12R1.118 CO\C(=C\c1ccccc1)CO Amb27457627 [0,2,0,0,0,0|0,0,2]=4 5345 B12R1.118 CO\C(C=O)=C\c1ccccc1 Amb17594035 [0,2,0,0,0,0|0,0,0]=2 5346 B12R1.118 CS\C(C#N)=C\c1ccccc1 Amb17594452 [0,2,0,0,0,0|1,0,1]=4 5347 B12R1.118 CS\C(C=O)=C/c1ccccc1 Amb27614686 [0,2,0,0,0,0|0,0,0]=2 5348 B12R1.118 C\C=C(/C=O)Cc1ccccc1 Amb25743406 [0,2,0,0,0,0|0,0,1]=3 5349 B12R1.118 C\C=C(\CC)Nc1ccccc1 Amb26457549 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.118 C\C=C(\CCl)Sc1ccccc1 Amb26439798 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.118 C\C=C(\CO)Cc1ccccc1 Amb28242441 [0,2,0,0,0,0|1,0,1]=4 5352 B12R1.118 Cl\C=C(\CCl)Sc1ccccc1 Amb28057449 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.118 N#CC(C#N)=Cc1ccccc1 Amb1199354 [0,2,0,0,0,0|1,0,1]=4 5354 B12R1.118 N#C\C(=C/Cl)Sc1ccccc1 Amb27425339 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.118 N#C\C(=C/c1ccccc1)CCl Amb28290359 [0,2,0,0,0,0|1,0,1]=4 5356 B12R1.118 N#C\C(=C/c1ccccc1)CO Amb28322086 [0,2,0,0,0,0|0,0,2]=4 5357 B12R1.118 NC\C(=C\F)Cc1ccccc1 Amb26531075 [0,2,0,0,0,0|1,0,1]=4 5358 B12R1.118 O=CC(C=O)=Cc1ccccc1 Amb18645276 [0,2,0,0,0,0|0,0,0]=2 5359 B12R1.118 O=CC(Cc1ccccc1)=S=O Amb27972982 [0,2,0,0,0,0|0,0,1]=3 5360 B12R1.118 O=C\C(=C/O)Cc1ccccc1 Amb27630435 [0,2,0,0,0,0|0,0,1]=3 5361 B12R1.118 O=C\C(=C/O)Oc1ccccc1 Amb24625847 [0,2,0,0,0,0|1,0,0]=3 5362 B12R1.118 O=C\C(=C/c1ccccc1)CCl Amb27640646 [0,2,0,0,0,0|0,0,0]=2 5363 B12R1.118 O=C\C(=C\Cl)Cc1ccccc1 Amb27984848 [0,2,0,0,0,0|0,0,1]=3 5364 B12R1.118 O=C\C(=C\c1ccccc1)CO Amb27769967 [0,2,0,0,0,0|0,0,0]=2 5365 B12R1.194 CC(C)(C=O)Cc1ccccc1 Amb4358578 [0,2,0,0,0,0|0,0,2]=4 5366 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,2,0,0,0,0|1,0,1]=4 5367 B12R1.194 CC(C)(C=O)Sc1ccccc1 Amb2412521 [0,2,0,0,0,0|1,0,1]=4 5368 B12R1.194 CC(O)(C=O)Cc1ccccc1 Amb27399998 [0,2,0,0,0,0|0,0,2]=4 5369 B12R1.194 C[C@@](O)(C=O)Cc1ccccc1 Amb27748618 [0,2,0,0,0,0|0,0,2]=4 5370 B12R1.194 O=CC(Cl)(Cl)Cc1ccccc1 Amb28129587 [0,2,0,0,0,0|0,0,2]=4 5371 B12R1.891 CC(C)(C)\C=C/c1ccccc1 Amb22546614 [0,2,0,0,0,0|1,0,1]=4 5372 B12R1.891 CC(C)(N)\C=C\c1ccccc1 Amb32951520 [0,2,0,0,0,0|1,0,1]=4 5373 B12R1.891 CC(C)(O)\C=C\c1ccccc1 Amb32954377 [0,2,0,0,0,0|0,0,2]=4 5374 B12R1.891 CS(=O)(=O)\C=C\c1ccccc1 Amb4006709 [0,2,0,0,0,0|1,0,0]=3 5375 B12R1.891 C[Si](C)(C)\C=C\c1ccccc1 Amb26530802 [0,2,0,0,0,0|1,1,0]=4 5376 B12R1.891 F[B-](F)(F)\C=C\c1ccccc1 Amb6366028 [0,2,0,0,0,0|2,0,0]=4 5377 B12R1.891 NS(=O)(=O)\C=C\c1ccccc1 Amb34104901 [0,2,0,0,0,0|1,0,0]=3 5378 B12R1.891 O=P(Cl)(Cl)\C=C\c1ccccc1 Amb4297294 [0,2,0,0,0,0|1,0,0]=3 5379 B12R1.891 O=S(=O)(Cl)\C=C\c1ccccc1 Amb1149990 [0,2,0,0,0,0|1,0,0]=3 5380 B12R1.891 O=S(=O)(F)\C=C\c1ccccc1 Amb32661076 [0,2,0,0,0,0|1,0,0]=3 5381 B12R1.891 O=S(=O)(O)\C=C\c1ccccc1 Amb32664784 [0,2,0,0,0,0|1,0,0]=3 5382 B12R1.891 O=S(=O)([O-])\C=C\c1ccccc1 Amb8512119 [0,2,0,0,0,0|1,0,0]=3 5383 B10R1.30 C=C1C=CC(=O)C(OC)=C1 Amb27948733 [0,0,1,1,0,0|1,0,1]=4 5384 B10R1.30 C=Cc1cc(Br)ccc1Br Amb33335170 [0,0,1,1,0,0|2,0,0]=4 5385 B10R1.30 C=Cc1cc(Br)ccc1C Amb33450308 [0,0,1,1,0,0|2,0,0]=4 5386 B10R1.30 C=Cc1cc(Br)ccc1Cl Amb25689275 [0,0,1,1,0,0|2,0,0]=4 5387 B10R1.30 C=Cc1cc(Br)ccc1F Amb20669236 [0,0,1,1,0,0|2,0,0]=4 5388 B10R1.30 C=Cc1cc(Br)ccc1O Amb26598865 [0,0,1,1,0,0|1,0,1]=4 5389 B10R1.30 C=Cc1cc(C)ccc1Br Amb33477544 [0,0,1,1,0,0|1,0,1]=4 5390 B10R1.30 C=Cc1cc(C)ccc1C Amb3940472 [0,0,1,1,0,0|1,0,1]=4 5391 B10R1.30 C=Cc1cc(C)ccc1Cl Amb33260785 [0,0,1,1,0,0|1,0,1]=4 5392 B10R1.30 C=Cc1cc(C)ccc1F Amb26507719 [0,0,1,1,0,0|1,0,1]=4 5393 B10R1.30 C=Cc1cc(C)ccc1N Amb27473325 [0,0,1,1,0,0|1,0,1]=4 5394 B10R1.30 C=Cc1cc(C)ccc1O Amb24714553 [0,0,1,1,0,0|0,0,2]=4 5395 B10R1.30 C=Cc1cc(Cl)ccc1Br Amb28349036 [0,0,1,1,0,0|2,0,0]=4 5396 B10R1.30 C=Cc1cc(Cl)ccc1C Amb27489699 [0,0,1,1,0,0|2,0,0]=4 5397 B10R1.30 C=Cc1cc(Cl)ccc1Cl Amb6297861 [0,0,1,1,0,0|2,0,0]=4 5398 B10R1.30 C=Cc1cc(Cl)ccc1F Amb28315816 [0,0,1,1,0,0|2,0,0]=4 5399 B10R1.30 C=Cc1cc(Cl)ccc1N Amb26481404 [0,0,1,1,0,0|2,0,0]=4 5400 B10R1.30 C=Cc1cc(Cl)ccc1O Amb27855512 [0,0,1,1,0,0|1,0,1]=4 5401 B10R1.30 C=Cc1cc(F)ccc1Br Amb10841229 [0,0,1,1,0,0|2,0,0]=4 5402 B10R1.30 C=Cc1cc(F)ccc1C Amb26899477 [0,0,1,1,0,0|2,0,0]=4 5403 B10R1.30 C=Cc1cc(F)ccc1Cl Amb25836283 [0,0,1,1,0,0|2,0,0]=4 5404 B10R1.30 C=Cc1cc(F)ccc1F Amb8397097 [0,0,1,1,0,0|2,0,0]=4 5405 B10R1.30 C=Cc1cc(F)ccc1O Amb22899615 [0,0,1,1,0,0|1,0,1]=4 5406 B10R1.30 C=Cc1cc(N)ccc1F Amb24665426 [0,0,1,1,0,0|2,0,0]=4 5407 B10R1.30 C=Cc1cc(O)ccc1Br Amb33450342 [0,0,1,1,0,0|2,0,0]=4 5408 B10R1.30 C=Cc1cc(O)ccc1F Amb22229772 [0,0,1,1,0,0|2,0,0]=4 5409 B10R1.30 C=Cc1cc(O)ccc1O Amb17593445 [0,0,1,1,0,0|1,0,1]=4 5410 B10R1.30 Cc1ccc(Br)c(C=O)c1 Amb2447676 [0,0,1,1,0,0|1,0,1]=4 5411 B10R1.30 Cc1ccc(Br)cc1C=O Amb33542576 [0,0,1,1,0,0|1,0,1]=4 5412 B10R1.30 Cc1ccc(C)c(C=O)c1 Amb2721212 [0,0,1,1,0,0|0,0,2]=4 5413 B10R1.30 Cc1ccc(Cl)c(C=O)c1 Amb22043880 [0,0,1,1,0,0|1,0,1]=4 5414 B10R1.30 Cc1ccc(Cl)cc1C=O Amb17322835 [0,0,1,1,0,0|1,0,1]=4 5415 B10R1.30 Cc1ccc(F)c(C=O)c1 Amb6296961 [0,0,1,1,0,0|1,0,1]=4 5416 B10R1.30 Cc1ccc(F)cc1C=O Amb2688180 [0,0,1,1,0,0|1,0,1]=4 5417 B10R1.30 Cc1ccc(I)c(C=O)c1 Amb25995282 [0,0,1,1,0,0|1,0,1]=4 5418 B10R1.30 Cc1ccc(I)cc1C=O Amb21963461 [0,0,1,1,0,0|1,0,1]=4 5419 B10R1.30 Cc1ccc(N)c(C=O)c1 Amb22491232 [0,0,1,1,0,0|1,0,1]=4 5420 B10R1.30 Cc1ccc(N)cc1C=O Amb18203107 [0,0,1,1,0,0|1,0,1]=4 5421 B10R1.30 Cc1ccc(O)c(C=O)c1 Amb1814688 [0,0,1,1,0,0|1,0,1]=4 5422 B10R1.30 Cc1ccc(O)cc1C=O Amb22499667 [0,0,1,1,0,0|1,0,1]=4 5423 B10R1.30 Cc1ccc(S)c(C=O)c1 Amb25347956 [0,0,1,1,0,0|1,0,1]=4 5424 B10R1.30 Nc1ccc(Br)c(C=O)c1 Amb18810518 [0,0,1,1,0,0|2,0,0]=4 5425 B10R1.30 Nc1ccc(Br)cc1C=O Amb10975427 [0,0,1,1,0,0|2,0,0]=4 5426 B10R1.30 Nc1ccc(Cl)c(C=O)c1 Amb18830816 [0,0,1,1,0,0|2,0,0]=4 5427 B10R1.30 Nc1ccc(Cl)cc1C=O Amb6298149 [0,0,1,1,0,0|2,0,0]=4 5428 B10R1.30 Nc1ccc(F)c(C=O)c1 Amb18202976 [0,0,1,1,0,0|2,0,0]=4 5429 B10R1.30 Nc1ccc(F)cc1C=O Amb18202975 [0,0,1,1,0,0|2,0,0]=4 5430 B10R1.30 Nc1ccc(I)cc1C=O Amb22500198 [0,0,1,1,0,0|2,0,0]=4 5431 B10R1.30 Nc1ccc(O)c(C=O)c1 Amb16231918 [0,0,1,1,0,0|2,0,0]=4 5432 B10R1.30 Nc1ccc(O)cc1C=O Amb22235860 [0,0,1,1,0,0|2,0,0]=4 5433 B10R1.30 O=Cc1cc(Br)ccc1Br Amb6298484 [0,0,1,1,0,0|2,0,0]=4 5434 B10R1.30 O=Cc1cc(Br)ccc1Cl Amb10071566 [0,0,1,1,0,0|2,0,0]=4 5435 B10R1.30 O=Cc1cc(Br)ccc1F Amb1946279 [0,0,1,1,0,0|2,0,0]=4 5436 B10R1.30 O=Cc1cc(Br)ccc1I Amb10602852 [0,0,1,1,0,0|2,0,0]=4 5437 B10R1.30 O=Cc1cc(Br)ccc1O Amb1395837 [0,0,1,1,0,0|2,0,0]=4 5438 B10R1.30 O=Cc1cc(Br)ccc1S Amb27796229 [0,0,1,1,0,0|2,0,0]=4 5439 B10R1.30 O=Cc1cc(Cl)ccc1Br Amb8397117 [0,0,1,1,0,0|2,0,0]=4 5440 B10R1.30 O=Cc1cc(Cl)ccc1Cl Amb2404867 [0,0,1,1,0,0|2,0,0]=4 5441 B10R1.30 O=Cc1cc(Cl)ccc1F Amb535693 [0,0,1,1,0,0|2,0,0]=4 5442 B10R1.30 O=Cc1cc(Cl)ccc1I Amb20241824 [0,0,1,1,0,0|2,0,0]=4 5443 B10R1.30 O=Cc1cc(Cl)ccc1O Amb1880867 [0,0,1,1,0,0|2,0,0]=4 5444 B10R1.30 O=Cc1cc(F)ccc1Br Amb2685180 [0,0,1,1,0,0|2,0,0]=4 5445 B10R1.30 O=Cc1cc(F)ccc1Cl Amb6297073 [0,0,1,1,0,0|2,0,0]=4 5446 B10R1.30 O=Cc1cc(F)ccc1F Amb534980 [0,0,1,1,0,0|2,0,0]=4 5447 B10R1.30 O=Cc1cc(F)ccc1I Amb8628760 [0,0,1,1,0,0|2,0,0]=4 5448 B10R1.30 O=Cc1cc(F)ccc1O Amb2688106 [0,0,1,1,0,0|2,0,0]=4 5449 B10R1.30 O=Cc1cc(F)ccc1S Amb27599807 [0,0,1,1,0,0|2,0,0]=4 5450 B10R1.30 O=Cc1cc(I)ccc1Br Amb19958913 [0,0,1,1,0,0|2,0,0]=4 5451 B10R1.30 O=Cc1cc(I)ccc1Cl Amb22737644 [0,0,1,1,0,0|2,0,0]=4 5452 B10R1.30 O=Cc1cc(I)ccc1F Amb16231578 [0,0,1,1,0,0|2,0,0]=4 5453 B10R1.30 O=Cc1cc(I)ccc1O Amb4322888 [0,0,1,1,0,0|2,0,0]=4 5454 B10R1.30 O=Cc1cc(O)ccc1Br Amb1776700 [0,0,1,1,0,0|2,0,0]=4 5455 B10R1.30 O=Cc1cc(O)ccc1Cl Amb18830687 [0,0,1,1,0,0|2,0,0]=4 5456 B10R1.30 O=Cc1cc(O)ccc1F Amb5722299 [0,0,1,1,0,0|2,0,0]=4 5457 B10R1.30 O=Cc1cc(O)ccc1I Amb2725047 [0,0,1,1,0,0|2,0,0]=4 5458 B10R1.30 O=Cc1cc(O)ccc1O Amb3939949 [0,0,1,1,0,0|2,0,0]=4 5459 B10R1.30 O=Cc1cc(S)ccc1Br Amb32688046 [0,0,1,1,0,0|2,0,0]=4 5460 B10R1.187 C=CCN1C(=C)C=CC1=O Amb27463700 [0,0,1,1,0,0|1,0,1]=4 5461 B10R1.332 CC1=CC=C(N)C(=O)C=C1 Amb28050144 [0,0,1,1,0,0|1,0,1]=4 5462 B10R1.332 NC1=CC=C(Cl)C(=O)C=C1 Amb26556523 [0,0,1,1,0,0|2,0,0]=4 5463 B10R1.332 NC1=CC=C(O)C(=O)C=C1 Amb27839056 [0,0,1,1,0,0|2,0,0]=4 5464 B10R1.332 O=C1C=CC(=O)C(=O)C=C1 Amb17593438 [0,0,1,1,0,0|2,0,0]=4 5465 B10R1.332 O=C1C=CC(Br)=CC=C1O Amb17933263 [0,0,1,1,0,0|2,0,0]=4 5466 B10R1.332 O=C1C=CC(O)=CC=C1Cl Amb24417082 [0,0,1,1,0,0|2,0,0]=4 5467 B10R1.332 O=C1C=CC(O)=CC=C1O Amb28126808 [0,0,1,1,0,0|2,0,0]=4 5468 B10R1.20 C=Cc1ccccc1C=C Amb17689476 [0,0,1,1,0,0|1,0,0]=3 5469 B10R1.20 C=Cc1ccccc1C=O Amb18124354 [0,0,1,1,0,0|2,0,0]=4 5470 B10R1.20 C=Cc1cccnc1C=O Amb27755829 [0,0,1,1,0,0|2,0,0]=4 5471 B10R1.35 C=Cc1cc(C=O)n(C)c1 Amb18643003 [0,0,1,1,0,0|1,0,1]=4 5472 B10R1.96 C=C=Cc1ccc(C=O)o1 Amb28051603 [0,0,1,1,0,0|1,0,1]=4 5473 B10R1.96 C=C=Cn1ccc(C=O)c1 Amb24502318 [0,0,1,1,0,0|1,0,1]=4 5474 B10R1.96 C=CCc1ccc(C=O)o1 Amb27983533 [0,0,1,1,0,0|1,0,1]=4 5475 B10R1.96 C=CCn1ccc(C=O)c1 Amb28188944 [0,0,1,1,0,0|1,0,1]=4 5476 B10R1.96 C\C=C/c1coc(C=O)c1 Amb27973562 [0,0,1,1,0,0|1,0,1]=4 5477 B10R1.172 C#Cc1cccc(C=C)c1 Amb25707760 [0,0,1,1,0,0|1,0,1]=4 5478 B10R1.172 C#Cc1cccc(C=O)c1 Amb10070110 [0,0,1,1,0,0|0,0,2]=4 5479 B10R1.172 C=Cc1cc(C=O)ccn1 Amb27156255 [0,0,1,1,0,0|1,0,0]=3 5480 B10R1.172 C=Cc1cccc(C#N)c1 Amb17593362 [0,0,1,1,0,0|1,0,1]=4 5481 B10R1.172 C=Cc1cccc(C=C)c1 Amb22045893 [0,0,1,1,0,0|1,0,0]=3 5482 B10R1.172 C=Cc1cccc(C=O)c1 Amb17593386 [0,0,1,1,0,0|0,0,0]=2 5483 B10R1.172 C=Cc1cccc(C=O)n1 Amb27607066 [0,0,1,1,0,0|1,0,0]=3 5484 B10R1.172 C=Cc1cccc(CBr)c1 Amb28239786 [0,0,1,1,0,0|1,0,1]=4 5485 B10R1.172 C=Cc1cccc(CC)c1 Amb24529283 [0,0,1,1,0,0|1,0,1]=4 5486 B10R1.172 C=Cc1cccc(CO)c1 Amb24405968 [0,0,1,1,0,0|0,0,2]=4 5487 B10R1.172 C=Cc1cccc(OC)c1 Amb21962858 [0,0,1,1,0,0|2,0,0]=4 5488 B10R1.172 C=Cc1cccc(SC)c1 Amb33148833 [0,0,1,1,0,0|2,0,0]=4 5489 B10R1.172 C=Cc1ccnc(C=O)c1 Amb27171487 [0,0,1,1,0,0|1,0,0]=3 5490 B10R1.172 C=Cc1cncc(C=C)c1 Amb27471813 [0,0,1,1,0,0|2,0,0]=4 5491 B10R1.172 C=Cc1cncc(C=O)c1 Amb25826055 [0,0,1,1,0,0|1,0,0]=3 5492 B10R1.172 C=Cc1cncc(C=O)n1 Amb27462008 [0,0,1,1,0,0|2,0,0]=4 5493 B10R1.172 CCc1cccc(C=O)c1 Amb16231764 [0,0,1,1,0,0|0,0,2]=4 5494 B10R1.172 CNc1cccc(C=O)c1 Amb10571863 [0,0,1,1,0,0|1,0,1]=4 5495 B10R1.172 COc1cccc(C=O)c1 Amb2792765 [0,0,1,1,0,0|1,0,1]=4 5496 B10R1.172 CSc1cccc(C=O)c1 Amb10607360 [0,0,1,1,0,0|1,0,1]=4 5497 B10R1.172 N#Cc1cccc(C=O)c1 Amb2686567 [0,0,1,1,0,0|1,0,1]=4 5498 B10R1.172 NCc1cccc(C=O)c1 Amb25255250 [0,0,1,1,0,0|1,0,1]=4 5499 B10R1.172 NCc1cccc(C=O)c1 Amb33734629 [0,0,1,1,0,0|1,0,1]=4 5500 B10R1.172 NNc1cccc(C=O)c1 Amb25952039 [0,0,1,1,0,0|2,0,0]=4 5501 B10R1.172 O=Cc1cccc(C=O)c1 Amb6891969 [0,0,1,1,0,0|1,0,0]=3 5502 B10R1.172 O=Cc1cccc(C=O)n1 Amb2696651 [0,0,1,1,0,0|2,0,0]=4 5503 B10R1.172 O=Cc1cccc(CBr)c1 Amb2724987 [0,0,1,1,0,0|1,0,1]=4 5504 B10R1.172 O=Cc1cccc(CCl)c1 Amb26555106 [0,0,1,1,0,0|1,0,1]=4 5505 B10R1.172 O=Cc1cccc(CF)c1 Amb26010625 [0,0,1,1,0,0|1,0,1]=4 5506 B10R1.172 O=Cc1cccc(CO)c1 Amb6298249 [0,0,1,1,0,0|1,0,1]=4 5507 B10R1.172 O=Cc1cccc(N=O)c1 Amb17593427 [0,0,1,1,0,0|2,0,0]=4 5508 B10R1.172 O=Cc1cccc(NO)c1 Amb28047724 [0,0,1,1,0,0|2,0,0]=4 5509 B10R1.172 O=Cc1ccnc(C=O)c1 Amb22728601 [0,0,1,1,0,0|2,0,0]=4 5510 B10R1.172 O=Cc1cncc(C=O)c1 Amb16231979 [0,0,1,1,0,0|2,0,0]=4 5511 B10R1.176 C=C1C=C(OC)C=CC1=O Amb28324324 [0,0,1,1,0,0|1,0,1]=4 5512 B10R1.176 C=CC1=CNC(=O)C(C)=C1 Amb23446846 [0,0,1,1,0,0|1,0,1]=4 5513 B10R1.176 C=Cc1ccc(Br)c(Br)c1 Amb26980053 [0,0,1,1,0,0|2,0,0]=4 5514 B10R1.176 C=Cc1ccc(Br)c(C)c1 Amb26556463 [0,0,1,1,0,0|1,0,1]=4 5515 B10R1.176 C=Cc1ccc(Br)c(Cl)c1 Amb27615173 [0,0,1,1,0,0|2,0,0]=4 5516 B10R1.176 C=Cc1ccc(Br)c(F)c1 Amb25974466 [0,0,1,1,0,0|2,0,0]=4 5517 B10R1.176 C=Cc1ccc(C)c(Br)c1 Amb25084200 [0,0,1,1,0,0|2,0,0]=4 5518 B10R1.176 C=Cc1ccc(C)c(C)c1 Amb24749575 [0,0,1,1,0,0|1,0,1]=4 5519 B10R1.176 C=Cc1ccc(C)c(Cl)c1 Amb27874857 [0,0,1,1,0,0|2,0,0]=4 5520 B10R1.176 C=Cc1ccc(C)c(F)c1 Amb26499644 [0,0,1,1,0,0|2,0,0]=4 5521 B10R1.176 C=Cc1ccc(C)c(I)c1 Amb25381005 [0,0,1,1,0,0|2,0,0]=4 5522 B10R1.176 C=Cc1ccc(C)c(O)c1 Amb28401574 [0,0,1,1,0,0|2,0,0]=4 5523 B10R1.176 C=Cc1ccc(Cl)c(Br)c1 Amb25776762 [0,0,1,1,0,0|2,0,0]=4 5524 B10R1.176 C=Cc1ccc(Cl)c(C)c1 Amb25857536 [0,0,1,1,0,0|1,0,1]=4 5525 B10R1.176 C=Cc1ccc(Cl)c(Cl)c1 Amb16193239 [0,0,1,1,0,0|2,0,0]=4 5526 B10R1.176 C=Cc1ccc(Cl)c(F)c1 Amb24372486 [0,0,1,1,0,0|2,0,0]=4 5527 B10R1.176 C=Cc1ccc(F)c(Br)c1 Amb27838950 [0,0,1,1,0,0|2,0,0]=4 5528 B10R1.176 C=Cc1ccc(F)c(C)c1 Amb24408128 [0,0,1,1,0,0|1,0,1]=4 5529 B10R1.176 C=Cc1ccc(F)c(Cl)c1 Amb27946351 [0,0,1,1,0,0|2,0,0]=4 5530 B10R1.176 C=Cc1ccc(F)c(F)c1 Amb8397096 [0,0,1,1,0,0|2,0,0]=4 5531 B10R1.176 C=Cc1ccc(N)c(F)c1 Amb26587932 [0,0,1,1,0,0|2,0,0]=4 5532 B10R1.176 C=Cc1ccc(N)c(N)c1 Amb28326069 [0,0,1,1,0,0|2,0,0]=4 5533 B10R1.176 C=Cc1ccc(O)c(Br)c1 Amb33388574 [0,0,1,1,0,0|1,0,1]=4 5534 B10R1.176 C=Cc1ccc(O)c(Cl)c1 Amb24104203 [0,0,1,1,0,0|1,0,1]=4 5535 B10R1.176 C=Cc1ccc(O)c(F)c1 Amb26653938 [0,0,1,1,0,0|1,0,1]=4 5536 B10R1.197 COC1=CC=CC(=O)C=C1 Amb27802670 [0,0,1,1,0,0|1,0,1]=4 5537 B10R1.7 O=C1C=CC=CC=CC1Cl Amb27949125 [0,0,1,1,0,0|1,0,1]=4 5538 B10R1.19 CNC1=CC=CC=CC1=O Amb21913201 [0,0,1,1,0,0|1,0,1]=4 5539 B10R1.19 COC1=CC=CC=CC1=O Amb22170123 [0,0,1,1,0,0|1,0,1]=4 5540 B10R1.19 CSC1=CC=CC=CC1=O Amb26336713 [0,0,1,1,0,0|1,0,1]=4 5541 B10R1.19 NNc1cccccc1=O Amb3715473 [0,0,1,1,0,0|2,0,0]=4 5542 B10R1.19 O=CC1=CC=CC=CC1=O Amb28049982 [0,0,1,1,0,0|1,0,0]=3 5543 B10R2.7 C1=CC2=NC=CCC2=C1 Amb28123850 [1,0,0,1,0,0|1,0,1]=4 5544 B10R2.7 C1=CC2C=CC=C2N=C1 Amb27862361 [1,0,0,1,0,0|1,0,1]=4 5545 B10R2.7 C1=Cc2ccccc2C1 Amb2383760 [1,0,0,1,0,0|0,0,1]=3 5546 B10R2.7 C1=Cc2cnccc2C1 Amb27945600 [1,0,0,1,0,0|1,0,1]=4 5547 B10R2.7 c1cc2ccoc2cn1 Amb10067356 [1,0,0,1,0,0|1,0,1]=4 5548 B10R2.7 c1cc2ccsc2cn1 Amb10067355 [1,0,0,1,0,0|1,1,0]=4 5549 B10R2.7 c1cc2ccsc2cn1 Amb24066968 [1,0,0,1,0,0|1,1,0]=4 5550 B10R2.7 c1cc2cnccn2c1 Amb8630012 [1,0,0,1,0,0|2,0,0]=4 5551 B10R2.7 c1cc2occc2cn1 Amb19895064 [1,0,0,1,0,0|1,0,1]=4 5552 B10R2.7 c1cc2sccc2cn1 Amb32664779 [1,0,0,1,0,0|1,1,0]=4 5553 B10R2.7 c1cc2sccc2cn1 Amb8383970 [1,0,0,1,0,0|1,1,0]=4 5554 B10R2.7 c1ccc2[se]ccc2c1 Amb8515166 [1,0,0,1,0,0|0,1,0]=3 5555 B10R2.7 c1ccc2cscc2c1 Amb24066379 [1,0,0,1,0,0|1,0,0]=3 5556 B10R2.7 c1ccc2nscc2c1 Amb25336989 [1,0,0,1,0,0|2,0,0]=4 5557 B10R2.7 c1ccc2occc2c1 Amb2725466 [1,0,0,1,0,0|0,0,1]=3 5558 B10R2.7 c1ccc2ocnc2c1 Amb6608831 [1,0,0,1,0,0|1,0,1]=4 5559 B10R2.7 c1ccc2oncc2c1 Amb1233398 [1,0,0,1,0,0|1,0,1]=4 5560 B10R2.7 c1ccc2sccc2c1 Amb2782006 [1,0,0,1,0,0|0,1,0]=3 5561 B10R2.7 c1ccc2scnc2c1 Amb2609954 [1,0,0,1,0,0|1,1,0]=4 5562 B10R2.7 c1ccn2cccc2c1 Amb10605601 [1,0,0,1,0,0|1,0,0]=3 5563 B10R2.7 c1ccn2ccnc2c1 Amb2235938 [1,0,0,1,0,0|2,0,0]=4 5564 B10R2.7 c1ccn2ccnc2c1 Amb8629968 [1,0,0,1,0,0|2,0,0]=4 5565 B10R2.7 c1ccn2cncc2c1 Amb10070943 [1,0,0,1,0,0|2,0,0]=4 5566 B10R2.7 c1ccn2nccc2c1 Amb10604230 [1,0,0,1,0,0|2,0,0]=4 5567 B10R2.7 c1cnc2cc[se]c2c1 Amb2611539 [1,0,0,1,0,0|1,1,0]=4 5568 B10R2.7 c1cnc2cccn2c1 Amb22490786 [1,0,0,1,0,0|2,0,0]=4 5569 B10R2.7 c1cnc2ccoc2c1 Amb16185654 [1,0,0,1,0,0|1,0,1]=4 5570 B10R2.7 c1cnc2ccoc2c1 Amb30585174 [1,0,0,1,0,0|1,0,1]=4 5571 B10R2.7 c1cnc2ccsc2c1 Amb10070404 [1,0,0,1,0,0|1,1,0]=4 5572 B10R2.7 c1cnc2cscc2c1 Amb27955126 [1,0,0,1,0,0|2,0,0]=4 5573 B10R2.7 c1cnc2occc2c1 Amb21963452 [1,0,0,1,0,0|1,0,1]=4 5574 B10R2.7 c1cnc2sccc2c1 Amb10070403 [1,0,0,1,0,0|1,1,0]=4 5575 B10R2.320 CC1=Cc2ccccc21 Amb27838637 [1,0,0,1,0,0|0,0,1]=3 5576 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,0]=3 5577 B10R2.320 FC1=Cc2ccccc21 Amb28053263 [1,0,0,1,0,0|1,0,0]=3 5578 B10R2.320 IC1=Cc2ccccc21 Amb28041016 [1,0,0,1,0,0|1,0,0]=3 5579 B10R2.320 NC1=Cc2ccccc21 Amb26390616 [1,0,0,1,0,0|1,0,0]=3 5580 B10R2.320 O=C1Cc2ccccc21 Amb8395940 [1,0,0,1,0,0|0,0,1]=3 5581 B10R2.320 O=C1Nc2ccccc21 Amb28436763 [1,0,0,1,0,0|1,0,0]=3 5582 B10R2.320 O=C1Sc2ncccc21 Amb28342602 [1,0,0,1,0,0|2,0,0]=4 5583 B10R2.32 O=C1C=Cc2cccn21 Amb27409386 [0,0,0,1,1,0|1,0,0]=3 5584 B12R2.41 C1=CC2=CN=CNC2=CC=N1 Amb25087784 [0,0,0,1,0,1|2,0,0]=4 5585 B12R2.41 C1=CC2=CN=CNC2=CN=C1 Amb27470310 [0,0,0,1,0,1|2,0,0]=4 5586 B12R2.41 C1=CC2=COC=CN=C2N=C1 Amb25731027 [0,0,0,1,0,1|2,0,0]=4 5587 B12R2.41 C1=CC=C2C=CNC=C2C=C1 Amb27633372 [0,0,0,1,0,1|2,0,0]=4 5588 B12R2.41 C1=CC=C2NC=CC=C2C=C1 Amb27488707 [0,0,0,1,0,1|1,0,0]=3 5589 B12R2.41 C1=CC=C2NC=NC=C2C=C1 Amb27486276 [0,0,0,1,0,1|2,0,0]=4 5590 B12R2.41 C1=CC=C2NC=NC=C2N=C1 Amb25736260 [0,0,0,1,0,1|2,0,0]=4 5591 B12R2.41 C1=CCc2ccccc2C=C1 Amb28288749 [0,0,0,1,0,1|1,0,0]=3 5592 B12R2.41 C1=CCc2ncncc2C=C1 Amb27480960 [0,0,0,1,0,1|2,0,0]=4 5593 B12R2.41 C1=CN=C2NC=NC=C2C=C1 Amb26846990 [0,0,0,1,0,1|2,0,0]=4 5594 B12R2.41 C1=CN=CC2=CN=CNC2=C1 Amb27617259 [0,0,0,1,0,1|2,0,0]=4 5595 B12R2.41 C1=CNc2ccccc2C=C1 Amb25340361 [0,0,0,1,0,1|1,0,0]=3 5596 B12R2.41 C1=CNc2ccccc2N=C1 Amb24581119 [0,0,0,1,0,1|2,0,0]=4 5597 B12R2.41 C1=COc2ccccc2N=C1 Amb27166777 [0,0,0,1,0,1|2,0,0]=4 5598 B12R2.41 C1=COc2ccncc2C=C1 Amb25148311 [0,0,0,1,0,1|2,0,0]=4 5599 B12R2.41 C1=COc2cnccc2C=C1 Amb27212583 [0,0,0,1,0,1|2,0,0]=4 5600 B12R2.41 C1=COc2ncccc2C=C1 Amb27160763 [0,0,0,1,0,1|1,0,0]=3 5601 B12R2.41 C1=COc2ncccc2N=C1 Amb27477436 [0,0,0,1,0,1|2,0,0]=4 5602 B12R2.41 C1=COc2ncncc2C=C1 Amb26574865 [0,0,0,1,0,1|2,0,0]=4 5603 B12R2.41 C1=Cc2ccccc2C=CN1 Amb27267215 [0,0,0,1,0,1|1,0,0]=3 5604 B12R2.41 C1=Cc2ccccc2C=NO1 Amb28280205 [0,0,0,1,0,1|2,0,0]=4 5605 B12R2.41 C1=Cc2ccccc2N=CO1 Amb25808170 [0,0,0,1,0,1|2,0,0]=4 5606 B12R2.586 Fc1ccc2cccccc12 Amb25111096 [0,0,0,1,0,1|1,0,0]=3 5607 B12R2.586 O=C1CCC2=C1CC=CC=C2 Amb27599449 [0,0,0,1,0,1|0,0,2]=4 5608 B12R2.586 O=C1CCC2=CC=CCC=C12 Amb28074670 [0,0,0,1,0,1|0,0,2]=4 5609 B12R2.586 O=C1CCC2=CCC=CC=C12 Amb28386613 [0,0,0,1,0,1|0,0,2]=4 5610 B12R2.2017 C1=CC=C2C=CC=CC(=C1)C2 Amb17778329 [0,0,0,1,0,1|1,0,0]=3 5611 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,1,0,1,0,0|1,0,1]=4 5612 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,1,0,1,0,0|0,0,2]=4 5613 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [0,1,0,1,0,0|2,0,0]=4 5614 B12R2.24 Brc1cc2cccnc2cn1 Amb35745025 [0,1,0,1,0,0|2,0,0]=4 5615 B12R2.24 Brc1cc[n+]2ccccc2c1 Amb2613514 [0,1,0,1,0,0|2,0,0]=4 5616 B12R2.24 Brc1ccc2c(c1)C=CCC2 Amb2383772 [0,1,0,1,0,0|1,0,1]=4 5617 B12R2.24 Brc1ccc2c(c1)C=CCO2 Amb22231978 [0,1,0,1,0,0|0,0,2]=4 5618 B12R2.24 Brc1ccc2c(c1)CNC=C2 Amb27632763 [0,1,0,1,0,0|2,0,0]=4 5619 B12R2.24 Brc1ccc2c(c1)NCC=C2 Amb27635282 [0,1,0,1,0,0|1,0,1]=4 5620 B12R2.24 Brc1ccc2cccc[n+]2c1 Amb24392821 [0,1,0,1,0,0|2,0,0]=4 5621 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [0,1,0,1,0,0|1,0,0]=3 5622 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [0,1,0,1,0,0|1,0,0]=3 5623 B12R2.24 Brc1ccc2cccnc2c1 Amb8397712 [0,1,0,1,0,0|1,0,0]=3 5624 B12R2.24 Brc1ccc2cccnc2n1 Amb2795056 [0,1,0,1,0,0|2,0,0]=4 5625 B12R2.24 Brc1ccc2ccncc2c1 Amb22276934 [0,1,0,1,0,0|2,0,0]=4 5626 B12R2.24 Brc1ccc2ccncc2c1 Amb7101503 [0,1,0,1,0,0|2,0,0]=4 5627 B12R2.24 Brc1ccc2ccncc2n1 Amb21962043 [0,1,0,1,0,0|2,0,0]=4 5628 B12R2.24 Brc1ccc2ccnnc2c1 Amb22276042 [0,1,0,1,0,0|2,0,0]=4 5629 B12R2.24 Brc1ccc2cnccc2c1 Amb33140904 [0,1,0,1,0,0|2,0,0]=4 5630 B12R2.24 Brc1ccc2cnccc2c1 Amb7101488 [0,1,0,1,0,0|2,0,0]=4 5631 B12R2.24 Brc1ccc2cnccc2n1 Amb10070412 [0,1,0,1,0,0|2,0,0]=4 5632 B12R2.24 Brc1ccc2cncnc2c1 Amb10975967 [0,1,0,1,0,0|2,0,0]=4 5633 B12R2.24 Brc1ccc2ncccc2c1 Amb1033034 [0,1,0,1,0,0|1,0,0]=3 5634 B12R2.24 Brc1ccc2ncccc2c1 Amb19516224 [0,1,0,1,0,0|1,0,0]=3 5635 B12R2.24 Brc1ccc2ncccc2n1 Amb8438939 [0,1,0,1,0,0|2,0,0]=4 5636 B12R2.24 Brc1ccc2nccnc2c1 Amb2723164 [0,1,0,1,0,0|2,0,0]=4 5637 B12R2.24 Brc1ccc2ncncc2c1 Amb10975973 [0,1,0,1,0,0|2,0,0]=4 5638 B12R2.24 Brc1ccc2nnccc2c1 Amb20241324 [0,1,0,1,0,0|2,0,0]=4 5639 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [0,1,0,1,0,0|1,0,0]=3 5640 B12R2.24 Brc1cnc2ccccc2n1 Amb33538649 [0,1,0,1,0,0|2,0,0]=4 5641 B12R2.24 Brc1cnc2cccnc2c1 Amb19958317 [0,1,0,1,0,0|2,0,0]=4 5642 B12R2.24 Brc1cnc2ccncc2c1 Amb18176152 [0,1,0,1,0,0|2,0,0]=4 5643 B12R2.24 Brc1cnc2cnccc2c1 Amb22500442 [0,1,0,1,0,0|2,0,0]=4 5644 B12R2.24 Brc1cnc2ncccc2c1 Amb2541644 [0,1,0,1,0,0|2,0,0]=4 5645 B12R2.24 Brc1ncc2ccccc2n1 Amb23399840 [0,1,0,1,0,0|2,0,0]=4 5646 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,1,0,1,0,0|1,0,1]=4 5647 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,1,0,1,0,0|2,0,0]=4 5648 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,1,0,1,0,0|1,0,1]=4 5649 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [0,1,0,1,0,0|1,0,1]=4 5650 B12R2.24 C[n+]1ccc2ccccc2c1 Amb1147460 [0,1,0,1,0,0|2,0,0]=4 5651 B12R2.24 C[n+]1ccc2ccccc2c1 Amb2609709 [0,1,0,1,0,0|2,0,0]=4 5652 B12R2.24 C[n+]1ccc2ncccc2c1 Amb2610099 [0,1,0,1,0,0|2,0,0]=4 5653 B12R2.24 C[n+]1ccc2ncccc2c1 Amb32454864 [0,1,0,1,0,0|2,0,0]=4 5654 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [0,1,0,1,0,0|2,0,0]=4 5655 B12R2.24 Cc1ccc2c(c1)C=CCN2 Amb18062199 [0,1,0,1,0,0|1,0,1]=4 5656 B12R2.24 Cc1ccc2c(c1)C=CCO2 Amb23441455 [0,1,0,1,0,0|0,0,2]=4 5657 B12R2.24 Cc1ccc2c(c1)NCC=C2 Amb18062194 [0,1,0,1,0,0|1,0,1]=4 5658 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [0,1,0,1,0,0|1,0,0]=3 5659 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [0,1,0,1,0,0|1,0,0]=3 5660 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [0,1,0,1,0,0|1,0,0]=3 5661 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [0,1,0,1,0,0|1,0,0]=3 5662 B12R2.24 Cc1ccc2cccnc2n1 Amb2793429 [0,1,0,1,0,0|2,0,0]=4 5663 B12R2.24 Cc1ccc2ccncc2c1 Amb33544176 [0,1,0,1,0,0|2,0,0]=4 5664 B12R2.24 Cc1ccc2ccncc2n1 Amb25305156 [0,1,0,1,0,0|2,0,0]=4 5665 B12R2.24 Cc1ccc2cnccc2c1 Amb10071945 [0,1,0,1,0,0|2,0,0]=4 5666 B12R2.24 Cc1ccc2cnccc2n1 Amb23441223 [0,1,0,1,0,0|2,0,0]=4 5667 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [0,1,0,1,0,0|1,0,0]=3 5668 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [0,1,0,1,0,0|1,0,0]=3 5669 B12R2.24 Cc1ccc2ncccc2n1 Amb15692772 [0,1,0,1,0,0|2,0,0]=4 5670 B12R2.24 Cc1ccc2nccnc2c1 Amb2689687 [0,1,0,1,0,0|2,0,0]=4 5671 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [0,1,0,1,0,0|1,0,0]=3 5672 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [0,1,0,1,0,0|2,0,0]=4 5673 B12R2.24 Cc1cnc2cccnc2c1 Amb26979817 [0,1,0,1,0,0|2,0,0]=4 5674 B12R2.24 Cc1cnc2ncccc2c1 Amb26074359 [0,1,0,1,0,0|2,0,0]=4 5675 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [0,1,0,1,0,0|2,0,0]=4 5676 B12R2.24 Clc1cc2cccnc2cn1 Amb25284449 [0,1,0,1,0,0|2,0,0]=4 5677 B12R2.24 Clc1ccc2c(c1)C=CCC2 Amb2383770 [0,1,0,1,0,0|1,0,1]=4 5678 B12R2.24 Clc1ccc2c(c1)C=CCN2 Amb18062201 [0,1,0,1,0,0|1,0,1]=4 5679 B12R2.24 Clc1ccc2c(c1)C=CCO2 Amb22586260 [0,1,0,1,0,0|0,0,2]=4 5680 B12R2.24 Clc1ccc2c(c1)CCC=C2 Amb28044105 [0,1,0,1,0,0|1,0,1]=4 5681 B12R2.24 Clc1ccc2c(c1)NCC=C2 Amb18062146 [0,1,0,1,0,0|1,0,1]=4 5682 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [0,1,0,1,0,0|1,0,0]=3 5683 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [0,1,0,1,0,0|1,0,0]=3 5684 B12R2.24 Clc1ccc2cccnc2c1 Amb10069239 [0,1,0,1,0,0|1,0,0]=3 5685 B12R2.24 Clc1ccc2cccnc2n1 Amb9806399 [0,1,0,1,0,0|2,0,0]=4 5686 B12R2.24 Clc1ccc2ccncc2c1 Amb32663641 [0,1,0,1,0,0|2,0,0]=4 5687 B12R2.24 Clc1ccc2ccncc2c1 Amb4007488 [0,1,0,1,0,0|2,0,0]=4 5688 B12R2.24 Clc1ccc2ccncc2n1 Amb4560931 [0,1,0,1,0,0|2,0,0]=4 5689 B12R2.24 Clc1ccc2ccnnc2c1 Amb22752658 [0,1,0,1,0,0|2,0,0]=4 5690 B12R2.24 Clc1ccc2cnccc2c1 Amb10603859 [0,1,0,1,0,0|2,0,0]=4 5691 B12R2.24 Clc1ccc2cnccc2n1 Amb10602045 [0,1,0,1,0,0|2,0,0]=4 5692 B12R2.24 Clc1ccc2cncnc2c1 Amb4011495 [0,1,0,1,0,0|2,0,0]=4 5693 B12R2.24 Clc1ccc2ncccc2c1 Amb749944 [0,1,0,1,0,0|1,0,0]=3 5694 B12R2.24 Clc1ccc2ncccc2n1 Amb21856967 [0,1,0,1,0,0|2,0,0]=4 5695 B12R2.24 Clc1ccc2nccnc2c1 Amb10068707 [0,1,0,1,0,0|2,0,0]=4 5696 B12R2.24 Clc1ccc2ncncc2c1 Amb17943286 [0,1,0,1,0,0|2,0,0]=4 5697 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [0,1,0,1,0,0|1,0,0]=3 5698 B12R2.24 Clc1cnc2ccccc2n1 Amb2371875 [0,1,0,1,0,0|2,0,0]=4 5699 B12R2.24 Clc1cnc2ccncc2c1 Amb2609880 [0,1,0,1,0,0|2,0,0]=4 5700 B12R2.24 Clc1cnc2ncccc2c1 Amb21864631 [0,1,0,1,0,0|2,0,0]=4 5701 B12R2.24 Clc1ncc2ccccc2n1 Amb6316147 [0,1,0,1,0,0|2,0,0]=4 5702 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,1,0,1,0,0|1,0,1]=4 5703 B12R2.24 Fc1ccc2c(c1)C=CCC2 Amb2383771 [0,1,0,1,0,0|1,0,1]=4 5704 B12R2.24 Fc1ccc2c(c1)C=CCN2 Amb18062200 [0,1,0,1,0,0|1,0,1]=4 5705 B12R2.24 Fc1ccc2c(c1)C=CCO2 Amb25770785 [0,1,0,1,0,0|0,0,2]=4 5706 B12R2.24 Fc1ccc2c(c1)OCC=C2 Amb24485991 [0,1,0,1,0,0|0,0,2]=4 5707 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [0,1,0,1,0,0|1,0,0]=3 5708 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [0,1,0,1,0,0|1,0,0]=3 5709 B12R2.24 Fc1ccc2cccnc2c1 Amb2622129 [0,1,0,1,0,0|1,0,0]=3 5710 B12R2.24 Fc1ccc2cccnc2n1 Amb24511773 [0,1,0,1,0,0|2,0,0]=4 5711 B12R2.24 Fc1ccc2ccncc2c1 Amb19100617 [0,1,0,1,0,0|2,0,0]=4 5712 B12R2.24 Fc1ccc2cnccc2c1 Amb19958275 [0,1,0,1,0,0|2,0,0]=4 5713 B12R2.24 Fc1ccc2cnccc2n1 Amb27798977 [0,1,0,1,0,0|2,0,0]=4 5714 B12R2.24 Fc1ccc2cncnc2c1 Amb4007611 [0,1,0,1,0,0|2,0,0]=4 5715 B12R2.24 Fc1ccc2ncccc2c1 Amb22831215 [0,1,0,1,0,0|1,0,0]=3 5716 B12R2.24 Fc1ccc2ncccc2c1 Amb6892892 [0,1,0,1,0,0|1,0,0]=3 5717 B12R2.24 Fc1ccc2nccnc2c1 Amb10840038 [0,1,0,1,0,0|2,0,0]=4 5718 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [0,1,0,1,0,0|1,0,0]=3 5719 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [0,1,0,1,0,0|2,0,0]=4 5720 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [0,1,0,1,0,0|1,0,0]=3 5721 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [0,1,0,1,0,0|1,0,0]=3 5722 B12R2.24 Ic1ccc2cccnc2c1 Amb21858708 [0,1,0,1,0,0|1,0,0]=3 5723 B12R2.24 Ic1ccc2ccncc2c1 Amb22170101 [0,1,0,1,0,0|2,0,0]=4 5724 B12R2.24 Ic1ccc2cnccc2c1 Amb10070847 [0,1,0,1,0,0|2,0,0]=4 5725 B12R2.24 Ic1ccc2cncnc2c1 Amb23402211 [0,1,0,1,0,0|2,0,0]=4 5726 B12R2.24 Ic1ccc2ncccc2c1 Amb10066910 [0,1,0,1,0,0|1,0,0]=3 5727 B12R2.24 Ic1ccc2nccnc2c1 Amb5751221 [0,1,0,1,0,0|2,0,0]=4 5728 B12R2.24 Ic1ccc2ncncc2c1 Amb19957516 [0,1,0,1,0,0|2,0,0]=4 5729 B12R2.24 Ic1ccc2nnccc2c1 Amb22751176 [0,1,0,1,0,0|2,0,0]=4 5730 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [0,1,0,1,0,0|1,0,0]=3 5731 B12R2.24 Ic1cnc2ccccc2n1 Amb24084425 [0,1,0,1,0,0|2,0,0]=4 5732 B12R2.24 Ic1cnc2cccnc2c1 Amb13890060 [0,1,0,1,0,0|2,0,0]=4 5733 B12R2.24 Ic1ncc2ccccc2n1 Amb27229523 [0,1,0,1,0,0|2,0,0]=4 5734 B12R2.24 N=C1C=c2ccccc2=NC1 Amb24061571 [0,1,0,1,0,0|1,0,1]=4 5735 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [0,1,0,1,0,0|1,0,1]=4 5736 B12R2.24 NC1C=Cc2ccccc2C1 Amb17470378 [0,1,0,1,0,0|1,0,1]=4 5737 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,1,0,1,0,0|0,0,2]=4 5738 B12R2.24 N[C@H]1C=Cc2ccccc2C1 Amb27779859 [0,1,0,1,0,0|1,0,1]=4 5739 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [0,1,0,1,0,0|2,0,0]=4 5740 B12R2.24 Nc1cc2ccccc2nn1 Amb8438995 [0,1,0,1,0,0|2,0,0]=4 5741 B12R2.24 Nc1cc2cccnc2cn1 Amb22495695 [0,1,0,1,0,0|2,0,0]=4 5742 B12R2.24 Nc1cc2cccnc2cn1 Amb32668902 [0,1,0,1,0,0|2,0,0]=4 5743 B12R2.24 Nc1ccc2c(c1)C=CCO2 Amb23441460 [0,1,0,1,0,0|0,0,2]=4 5744 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [0,1,0,1,0,0|1,0,0]=3 5745 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [0,1,0,1,0,0|1,0,0]=3 5746 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [0,1,0,1,0,0|1,0,0]=3 5747 B12R2.24 Nc1ccc2cccnc2c1 Amb24183307 [0,1,0,1,0,0|1,0,0]=3 5748 B12R2.24 Nc1ccc2cccnc2c1 Amb31217512 [0,1,0,1,0,0|1,0,0]=3 5749 B12R2.24 Nc1ccc2cccnc2c1 Amb5717605 [0,1,0,1,0,0|1,0,0]=3 5750 B12R2.24 Nc1ccc2cccnc2n1 Amb2795032 [0,1,0,1,0,0|2,0,0]=4 5751 B12R2.24 Nc1ccc2ccncc2c1 Amb33456346 [0,1,0,1,0,0|2,0,0]=4 5752 B12R2.24 Nc1ccc2ccncc2c1 Amb8011457 [0,1,0,1,0,0|2,0,0]=4 5753 B12R2.24 Nc1ccc2ccncc2n1 Amb18124738 [0,1,0,1,0,0|2,0,0]=4 5754 B12R2.24 Nc1ccc2cnccc2c1 Amb33527576 [0,1,0,1,0,0|2,0,0]=4 5755 B12R2.24 Nc1ccc2cnccc2c1 Amb8010910 [0,1,0,1,0,0|2,0,0]=4 5756 B12R2.24 Nc1ccc2cnccc2n1 Amb2796045 [0,1,0,1,0,0|2,0,0]=4 5757 B12R2.24 Nc1ccc2cnccc2n1 Amb33329948 [0,1,0,1,0,0|2,0,0]=4 5758 B12R2.24 Nc1ccc2cncnc2c1 Amb22001709 [0,1,0,1,0,0|2,0,0]=4 5759 B12R2.24 Nc1ccc2ncccc2c1 Amb2721017 [0,1,0,1,0,0|1,0,0]=3 5760 B12R2.24 Nc1ccc2ncccc2c1 Amb33536629 [0,1,0,1,0,0|1,0,0]=3 5761 B12R2.24 Nc1ccc2ncccc2n1 Amb2696937 [0,1,0,1,0,0|2,0,0]=4 5762 B12R2.24 Nc1ccc2nccnc2c1 Amb6315763 [0,1,0,1,0,0|2,0,0]=4 5763 B12R2.24 Nc1ccc2ncncc2c1 Amb17935799 [0,1,0,1,0,0|2,0,0]=4 5764 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [0,1,0,1,0,0|1,0,0]=3 5765 B12R2.24 Nc1cnc2ccccc2n1 Amb4135072 [0,1,0,1,0,0|2,0,0]=4 5766 B12R2.24 Nc1cnc2cccnc2c1 Amb13881251 [0,1,0,1,0,0|2,0,0]=4 5767 B12R2.24 Nc1cnc2ccncc2c1 Amb18831471 [0,1,0,1,0,0|2,0,0]=4 5768 B12R2.24 Nc1cnc2cnccc2c1 Amb24060730 [0,1,0,1,0,0|2,0,0]=4 5769 B12R2.24 Nc1cnc2ncccc2c1 Amb8827554 [0,1,0,1,0,0|2,0,0]=4 5770 B12R2.24 Nc1ncc2ccccc2n1 Amb8631314 [0,1,0,1,0,0|2,0,0]=4 5771 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,1,0,1,0,0|1,0,0]=3 5772 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,1,0,1,0,0|2,0,0]=4 5773 B12R2.24 O=C1C=C2C=CC=NC2=CN1 Amb27239109 [0,1,0,1,0,0|2,0,0]=4 5774 B12R2.24 O=C1C=C2N=CC=CC2=CN1 Amb27642614 [0,1,0,1,0,0|2,0,0]=4 5775 B12R2.24 O=C1C=CN2N=CC=CC2=N1 Amb22497885 [0,1,0,1,0,0|2,0,0]=4 5776 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,1,0,1,0,0|0,0,0]=2 5777 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,1,0,1,0,0|0,0,0]=2 5778 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,1,0,1,0,0|0,0,0]=2 5779 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [0,1,0,1,0,0|0,0,0]=2 5780 B12R2.24 O=C1C=Cc2cccnc2N1 Amb22001403 [0,1,0,1,0,0|1,0,0]=3 5781 B12R2.24 O=C1C=Cc2ccncc2N1 Amb22493786 [0,1,0,1,0,0|1,0,0]=3 5782 B12R2.24 O=C1C=Cc2ccncc2O1 Amb24395883 [0,1,0,1,0,0|1,0,0]=3 5783 B12R2.24 O=C1C=Cc2cnccc2N1 Amb21618693 [0,1,0,1,0,0|1,0,0]=3 5784 B12R2.24 O=C1C=Cc2ncccc2N1 Amb21856966 [0,1,0,1,0,0|1,0,0]=3 5785 B12R2.24 O=C1C=Cc2nccnc2N1 Amb19957771 [0,1,0,1,0,0|2,0,0]=4 5786 B12R2.24 O=C1C=Cc2ncncc2N1 Amb21811941 [0,1,0,1,0,0|2,0,0]=4 5787 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,1,0,1,0,0|1,0,0]=3 5788 B12R2.24 O=C1C=Nc2cccnc2N1 Amb20461570 [0,1,0,1,0,0|2,0,0]=4 5789 B12R2.24 O=C1C=Nc2ccncc2N1 Amb18016830 [0,1,0,1,0,0|2,0,0]=4 5790 B12R2.24 O=C1CCc2ccccc2C1 Amb2383557 [0,1,0,1,0,0|0,0,2]=4 5791 B12R2.24 O=C1CCc2ccccc2N1 Amb6358187 [0,1,0,1,0,0|0,0,2]=4 5792 B12R2.24 O=C1CCc2ccccc2O1 Amb533490 [0,1,0,1,0,0|0,0,2]=4 5793 B12R2.24 O=C1CNc2ccccc2C1 Amb18202302 [0,1,0,1,0,0|1,0,1]=4 5794 B12R2.24 O=C1CNc2ccccc2N1 Amb6355388 [0,1,0,1,0,0|1,0,1]=4 5795 B12R2.24 O=C1CNc2ccccc2O1 Amb22166855 [0,1,0,1,0,0|1,0,1]=4 5796 B12R2.24 O=C1COc2ccccc2C1 Amb15692703 [0,1,0,1,0,0|1,0,1]=4 5797 B12R2.24 O=C1COc2ccccc2N1 Amb1011836 [0,1,0,1,0,0|1,0,1]=4 5798 B12R2.24 O=C1COc2ccccc2O1 Amb2759474 [0,1,0,1,0,0|1,0,1]=4 5799 B12R2.24 O=C1CSc2ccccc2C1 Amb22231635 [0,1,0,1,0,0|1,0,1]=4 5800 B12R2.24 O=C1CSc2ccccc2N1 Amb1007458 [0,1,0,1,0,0|1,0,1]=4 5801 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [0,1,0,1,0,0|1,0,1]=4 5802 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [0,1,0,1,0,0|1,0,1]=4 5803 B12R2.24 O=C1N=Cc2ccccc2N1 Amb20653982 [0,1,0,1,0,0|1,0,0]=3 5804 B12R2.24 O=C1N=Cc2ccccc2O1 Amb22054765 [0,1,0,1,0,0|1,0,0]=3 5805 B12R2.24 O=C1NCc2ccccc2O1 Amb27468708 [0,1,0,1,0,0|1,0,1]=4 5806 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [0,1,0,1,0,0|1,0,1]=4 5807 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [0,1,0,1,0,0|1,0,0]=3 5808 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [0,1,0,1,0,0|1,0,0]=3 5809 B12R2.24 OC1=CC=C2C=CC=CN2C1 Amb17835334 [0,1,0,1,0,0|1,0,1]=4 5810 B12R2.24 OC1C=Cc2ccccc2S1 Amb27394776 [0,1,0,1,0,0|0,0,2]=4 5811 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [0,1,0,1,0,0|1,0,1]=4 5812 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [0,1,0,1,0,0|1,0,1]=4 5813 B12R2.24 Oc1ccc2c(c1)C=CCC2 Amb28075248 [0,1,0,1,0,0|1,0,1]=4 5814 B12R2.24 Oc1ccc2c(c1)C=CCN2 Amb25998025 [0,1,0,1,0,0|1,0,1]=4 5815 B12R2.24 Oc1ccc2c(c1)OCC=C2 Amb27804492 [0,1,0,1,0,0|0,0,2]=4 5816 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [0,1,0,1,0,0|0,0,1]=3 5817 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [0,1,0,1,0,0|1,0,0]=3 5818 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [0,1,0,1,0,0|1,0,0]=3 5819 B12R2.24 Oc1ccc2cccnc2n1 Amb9806398 [0,1,0,1,0,0|1,0,1]=4 5820 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [0,1,0,1,0,0|1,0,1]=4 5821 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [0,1,0,1,0,0|1,0,1]=4 5822 B12R2.24 Oc1ccc2ccnnc2c1 Amb25319976 [0,1,0,1,0,0|2,0,0]=4 5823 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [0,1,0,1,0,0|1,0,1]=4 5824 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [0,1,0,1,0,0|1,0,1]=4 5825 B12R2.24 Oc1ccc2cncnc2c1 Amb24066333 [0,1,0,1,0,0|2,0,0]=4 5826 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [0,1,0,1,0,0|1,0,0]=3 5827 B12R2.24 Oc1ccc2nccnc2c1 Amb2548376 [0,1,0,1,0,0|2,0,0]=4 5828 B12R2.24 Oc1ccc2ncncc2c1 Amb8484685 [0,1,0,1,0,0|2,0,0]=4 5829 B12R2.24 Oc1ccc2nnccc2c1 Amb26871668 [0,1,0,1,0,0|2,0,0]=4 5830 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [0,1,0,1,0,0|1,0,0]=3 5831 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [0,1,0,1,0,0|1,0,1]=4 5832 B12R2.24 Oc1cnc2cccnc2c1 Amb13890072 [0,1,0,1,0,0|2,0,0]=4 5833 B12R2.24 Oc1cnc2ccncc2c1 Amb27265400 [0,1,0,1,0,0|2,0,0]=4 5834 B12R2.24 Oc1cnc2ncccc2c1 Amb26616876 [0,1,0,1,0,0|2,0,0]=4 5835 B12R2.24 Oc1cnc2ncccc2c1 Amb32653317 [0,1,0,1,0,0|2,0,0]=4 5836 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,1,0,1,0,0|0,1,0]=3 5837 B12R2.24 S=C1C=Cc2cccnc2N1 Amb27233738 [0,1,0,1,0,0|1,1,0]=4 5838 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,1,0,1,0,0|1,1,0]=4 5839 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [0,1,0,1,0,0|1,0,1]=4 5840 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [0,1,0,1,0,0|0,1,0]=3 5841 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [0,1,0,1,0,0|0,1,0]=3 5842 B12R2.24 Sc1ccc2cccnc2c1 Amb25885524 [0,1,0,1,0,0|1,0,0]=3 5843 B12R2.24 Sc1ccc2ncccc2c1 Amb25076144 [0,1,0,1,0,0|1,0,0]=3 5844 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [0,1,0,1,0,0|1,0,0]=3 5845 B12R2.24 Sc1cnc2ccccc2n1 Amb837074 [0,1,0,1,0,0|1,1,0]=4 5846 B12R2.24 Sc1ncc2ccccc2n1 Amb27229522 [0,1,0,1,0,0|1,1,0]=4 5847 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [0,1,0,1,0,0|1,0,0]=3 5848 B12R2.24 [O-][n+]1ccc2ccccc2c1 Amb2609972 [0,1,0,1,0,0|1,0,1]=4 5849 B12R2.132 Brc1ccc2occ(Br)c2c1 Amb2723640 [0,1,0,1,0,0|2,0,0]=4 5850 B12R2.132 CC1=CCc2ccc(C)cc21 Amb27949310 [0,1,0,1,0,0|1,0,1]=4 5851 B12R2.132 Cc1ccc2c(c1)C(=O)CC2 Amb2781670 [0,1,0,1,0,0|0,0,2]=4 5852 B12R2.132 Cc1ccc2c(c1)C(=O)CN2 Amb18202305 [0,1,0,1,0,0|1,0,1]=4 5853 B12R2.132 Cc1ccc2c(c1)C(=O)CO2 Amb6683471 [0,1,0,1,0,0|1,0,1]=4 5854 B12R2.132 Cc1ccc2c(c1)C(=O)CS2 Amb18199752 [0,1,0,1,0,0|1,0,1]=4 5855 B12R2.132 Cc1ccc2c(c1)C(=O)NC2 Amb19517084 [0,1,0,1,0,0|1,0,1]=4 5856 B12R2.132 Cc1ccc2c(c1)C(=O)NN2 Amb19748512 [0,1,0,1,0,0|2,0,0]=4 5857 B12R2.132 Cc1ccc2c(c1)C(=O)OC2 Amb24060123 [0,1,0,1,0,0|1,0,1]=4 5858 B12R2.132 Cc1ccc2c(c1)C(=O)SN2 Amb32673864 [0,1,0,1,0,0|2,0,0]=4 5859 B12R2.132 Cc1ccc2ccn(C)c2c1 Amb9768368 [0,1,0,1,0,0|2,0,0]=4 5860 B12R2.132 Cc1ccc2occ(Br)c2c1 Amb26345721 [0,1,0,1,0,0|2,0,0]=4 5861 B12R2.132 Cc1ccc2occ(C)c2c1 Amb23440813 [0,1,0,1,0,0|2,0,0]=4 5862 B12R2.132 Cc1ccc2occ(O)c2c1 Amb33299851 [0,1,0,1,0,0|1,0,1]=4 5863 B12R2.132 Cc1ccc2scc(N)c2c1 Amb23402527 [0,1,0,1,0,0|2,0,0]=4 5864 B12R2.132 Cc1coc2ccc(Br)cc12 Amb5722044 [0,1,0,1,0,0|2,0,0]=4 5865 B12R2.132 Cc1coc2ccc(Cl)cc12 Amb20622396 [0,1,0,1,0,0|2,0,0]=4 5866 B12R2.132 Cc1coc2ccc(F)cc12 Amb20622399 [0,1,0,1,0,0|2,0,0]=4 5867 B12R2.132 Cc1coc2ccc(N)cc12 Amb28383907 [0,1,0,1,0,0|2,0,0]=4 5868 B12R2.132 Cc1coc2ccc(O)cc12 Amb18124872 [0,1,0,1,0,0|2,0,0]=4 5869 B12R2.132 Cc1csc2ccc(Br)cc12 Amb10068740 [0,1,0,1,0,0|2,0,0]=4 5870 B12R2.132 Cc1csc2ccc(Cl)cc12 Amb2686206 [0,1,0,1,0,0|2,0,0]=4 5871 B12R2.132 Cc1csc2ccc(F)cc12 Amb2688192 [0,1,0,1,0,0|2,0,0]=4 5872 B12R2.132 Cc1csc2ccc(I)cc12 Amb27612912 [0,1,0,1,0,0|2,0,0]=4 5873 B12R2.132 Cc1csc2ccc(N)cc12 Amb25151209 [0,1,0,1,0,0|2,0,0]=4 5874 B12R2.132 Cc1csc2ccc(O)cc12 Amb18126407 [0,1,0,1,0,0|2,0,0]=4 5875 B12R2.132 Clc1ccc2occ(Br)c2c1 Amb25742477 [0,1,0,1,0,0|2,0,0]=4 5876 B12R2.132 Clc1ccc2scc(Cl)c2c1 Amb28436176 [0,1,0,1,0,0|2,0,0]=4 5877 B12R2.132 Clc1coc2ccc(Br)cc12 Amb18159965 [0,1,0,1,0,0|2,0,0]=4 5878 B12R2.132 Clc1csc2ccc(Br)cc12 Amb28204991 [0,1,0,1,0,0|2,0,0]=4 5879 B12R2.132 Cn1ccc2ccc(Br)cc21 Amb2723771 [0,1,0,1,0,0|2,0,0]=4 5880 B12R2.132 Cn1ccc2ccc(Cl)cc21 Amb19895323 [0,1,0,1,0,0|2,0,0]=4 5881 B12R2.132 Cn1ccc2ccc(N)cc21 Amb30982191 [0,1,0,1,0,0|2,0,0]=4 5882 B12R2.132 Cn1ccc2ccc(N)cc21 Amb8941150 [0,1,0,1,0,0|2,0,0]=4 5883 B12R2.132 Cn1ccc2ccc(O)cc21 Amb18124818 [0,1,0,1,0,0|2,0,0]=4 5884 B12R2.132 Cn1ccc2ccc(S)cc21 Amb33200411 [0,1,0,1,0,0|2,0,0]=4 5885 B12R2.132 Fc1ccc2occ(Br)c2c1 Amb28044734 [0,1,0,1,0,0|2,0,0]=4 5886 B12R2.132 Fc1ccc2scc(Br)c2c1 Amb27754561 [0,1,0,1,0,0|2,0,0]=4 5887 B12R2.132 Fc1ccc2scc(Cl)c2c1 Amb27878551 [0,1,0,1,0,0|2,0,0]=4 5888 B12R2.132 NC1=CN2C(=O)NC=C2C=C1 Amb25290888 [0,1,0,1,0,0|2,0,0]=4 5889 B12R2.132 Nc1ccc2c(c1)C(=O)CC2 Amb10067747 [0,1,0,1,0,0|0,0,2]=4 5890 B12R2.132 Nc1ccc2c(c1)C(=O)CN2 Amb27963196 [0,1,0,1,0,0|1,0,1]=4 5891 B12R2.132 Nc1ccc2c(c1)C(=O)CO2 Amb15772360 [0,1,0,1,0,0|1,0,1]=4 5892 B12R2.132 Nc1ccc2c(c1)C(=O)CS2 Amb18199702 [0,1,0,1,0,0|1,0,1]=4 5893 B12R2.132 Nc1ccc2c(c1)C(=O)NC2 Amb9490509 [0,1,0,1,0,0|1,0,1]=4 5894 B12R2.132 Nc1ccc2c(c1)C(=O)NN2 Amb21959377 [0,1,0,1,0,0|2,0,0]=4 5895 B12R2.132 Nc1ccc2c(c1)C(=O)NO2 Amb21963754 [0,1,0,1,0,0|2,0,0]=4 5896 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb1042312 [0,1,0,1,0,0|1,0,1]=4 5897 B12R2.132 Nc1ccc2c(c1)C(=O)OC2 Amb32653314 [0,1,0,1,0,0|1,0,1]=4 5898 B12R2.132 Nc1ccc2scc(Br)c2c1 Amb27762421 [0,1,0,1,0,0|2,0,0]=4 5899 B12R2.132 Nc1ccc2scc(O)c2c1 Amb27965442 [0,1,0,1,0,0|1,0,1]=4 5900 B12R2.132 Nc1coc2ccc(O)cc12 Amb18831353 [0,1,0,1,0,0|2,0,0]=4 5901 B12R2.132 Nc1csc2ccc(Br)cc12 Amb23403633 [0,1,0,1,0,0|2,0,0]=4 5902 B12R2.132 Nc1csc2ccc(Cl)cc12 Amb23403647 [0,1,0,1,0,0|2,0,0]=4 5903 B12R2.132 Nc1csc2ccc(F)cc12 Amb23403639 [0,1,0,1,0,0|2,0,0]=4 5904 B12R2.132 Nc1csc2ccc(O)cc12 Amb32708792 [0,1,0,1,0,0|2,0,0]=4 5905 B12R2.132 Nn1ccc2ccc(Cl)cc21 Amb18199546 [0,1,0,1,0,0|2,0,0]=4 5906 B12R2.132 Nn1ccc2ccc(F)cc21 Amb18201961 [0,1,0,1,0,0|2,0,0]=4 5907 B12R2.132 Nn1ccc2ccc(O)cc21 Amb27877621 [0,1,0,1,0,0|2,0,0]=4 5908 B12R2.132 O=C1C=Cc2ccc(O)cc21 Amb25237100 [0,1,0,1,0,0|0,0,0]=2 5909 B12R2.132 O=C1CCc2ccc(Br)cc21 Amb2383532 [0,1,0,1,0,0|0,0,2]=4 5910 B12R2.132 O=C1CCc2ccc(Cl)cc21 Amb2383530 [0,1,0,1,0,0|0,0,2]=4 5911 B12R2.132 O=C1CCc2ccc(F)cc21 Amb2383531 [0,1,0,1,0,0|0,0,2]=4 5912 B12R2.132 O=C1CCc2ccc(I)cc21 Amb10603865 [0,1,0,1,0,0|0,0,2]=4 5913 B12R2.132 O=C1CCc2ccc(O)cc21 Amb2612891 [0,1,0,1,0,0|0,0,2]=4 5914 B12R2.132 O=C1CNc2ccc(Br)cc21 Amb18772113 [0,1,0,1,0,0|1,0,1]=4 5915 B12R2.132 O=C1CNc2ccc(F)cc21 Amb18831267 [0,1,0,1,0,0|1,0,1]=4 5916 B12R2.132 O=C1COc2ccc(Br)cc21 Amb33534386 [0,1,0,1,0,0|1,0,1]=4 5917 B12R2.132 O=C1COc2ccc(Cl)cc21 Amb2383540 [0,1,0,1,0,0|1,0,1]=4 5918 B12R2.132 O=C1COc2ccc(F)cc21 Amb33534384 [0,1,0,1,0,0|1,0,1]=4 5919 B12R2.132 O=C1COc2ccc(O)cc21 Amb24061522 [0,1,0,1,0,0|1,0,1]=4 5920 B12R2.132 O=C1CSc2ccc(Br)cc21 Amb18159426 [0,1,0,1,0,0|1,0,1]=4 5921 B12R2.132 O=C1CSc2ccc(Cl)cc21 Amb18822608 [0,1,0,1,0,0|1,0,1]=4 5922 B12R2.132 O=C1CSc2ccc(I)cc21 Amb27246724 [0,1,0,1,0,0|1,0,1]=4 5923 B12R2.132 O=C1N=Cc2ccc(I)cc21 Amb22015255 [0,1,0,1,0,0|1,0,0]=3 5924 B12R2.132 O=C1N=Cc2ccc(O)cc21 Amb22015254 [0,1,0,1,0,0|1,0,0]=3 5925 B12R2.132 O=C1NCc2ccc(Br)cc21 Amb19516102 [0,1,0,1,0,0|1,0,1]=4 5926 B12R2.132 O=C1NCc2ccc(Cl)cc21 Amb20241173 [0,1,0,1,0,0|1,0,1]=4 5927 B12R2.132 O=C1NCc2ccc(F)cc21 Amb20171614 [0,1,0,1,0,0|1,0,1]=4 5928 B12R2.132 O=C1NCc2ccc(I)cc21 Amb21963095 [0,1,0,1,0,0|1,0,1]=4 5929 B12R2.132 O=C1NCc2ccc(O)cc21 Amb15690702 [0,1,0,1,0,0|1,0,1]=4 5930 B12R2.132 O=C1NNc2ccc(Br)cc21 Amb22008691 [0,1,0,1,0,0|2,0,0]=4 5931 B12R2.132 O=C1NNc2ccc(Cl)cc21 Amb20460273 [0,1,0,1,0,0|2,0,0]=4 5932 B12R2.132 O=C1NOc2ccc(Br)cc21 Amb21858197 [0,1,0,1,0,0|2,0,0]=4 5933 B12R2.132 O=C1NOc2ccc(F)cc21 Amb21857209 [0,1,0,1,0,0|2,0,0]=4 5934 B12R2.132 O=C1NOc2ccc(O)cc21 Amb24440443 [0,1,0,1,0,0|2,0,0]=4 5935 B12R2.132 O=C1NSc2ccc(Br)cc21 Amb24628235 [0,1,0,1,0,0|2,0,0]=4 5936 B12R2.132 O=C1NSc2ccc(Cl)cc21 Amb19131194 [0,1,0,1,0,0|2,0,0]=4 5937 B12R2.132 O=C1NSc2ccc(F)cc21 Amb24372116 [0,1,0,1,0,0|2,0,0]=4 5938 B12R2.132 O=C1OCc2ccc(Br)cc21 Amb2692670 [0,1,0,1,0,0|1,0,1]=4 5939 B12R2.132 O=C1OCc2ccc(F)cc21 Amb16232663 [0,1,0,1,0,0|1,0,1]=4 5940 B12R2.132 O=C1OCc2ccc(I)cc21 Amb2692671 [0,1,0,1,0,0|1,0,1]=4 5941 B12R2.132 O=C1OCc2ccc(O)cc21 Amb5718516 [0,1,0,1,0,0|1,0,1]=4 5942 B12R2.132 O=C1ONc2ccc(Br)cc21 Amb28119155 [0,1,0,1,0,0|2,0,0]=4 5943 B12R2.132 O=C1ONc2ccc(Cl)cc21 Amb22263320 [0,1,0,1,0,0|2,0,0]=4 5944 B12R2.132 O=C1ONc2ccc(F)cc21 Amb26974015 [0,1,0,1,0,0|2,0,0]=4 5945 B12R2.132 O=C1SNc2ccc(F)cc21 Amb32673853 [0,1,0,1,0,0|2,0,0]=4 5946 B12R2.132 Oc1ccc2occ(Cl)c2c1 Amb27445869 [0,1,0,1,0,0|2,0,0]=4 5947 B12R2.132 Oc1ccc2occ(O)c2c1 Amb27974579 [0,1,0,1,0,0|1,0,1]=4 5948 B12R2.132 Oc1ccc2scc(Br)c2c1 Amb25114462 [0,1,0,1,0,0|2,0,0]=4 5949 B12R2.132 On1ccc2ccc(F)cc21 Amb27241747 [0,1,0,1,0,0|1,0,1]=4 5950 B12R2.132 Sc1csc2ccc(Br)cc12 Amb27795186 [0,1,0,1,0,0|1,1,0]=4 5951 B12R2.595 CC12C=CC(C=CC1=O)C=C2 Amb27762473 [0,1,0,1,0,0|0,0,2]=4 5952 B12R2.595 O=C1C=CC2C=CC1(Cl)C=C2 Amb25920839 [0,1,0,1,0,0|0,0,2]=4 5953 B12R2.2302 Fc1ccc(C2=CCO2)cc1 Amb2719092 [0,1,0,1,0,0|0,0,2]=4 5954 B12R2.2 C1=C(c2ccccc2)CCC1 Amb4317492 [0,1,0,1,0,0|1,0,1]=4 5955 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 5956 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [0,1,0,1,0,0|1,0,1]=4 5957 B12R2.2 C1=C(c2ccccc2)NCC1 Amb17938860 [0,1,0,1,0,0|1,0,1]=4 5958 B12R2.2 C1=CC(=C2N=CC=N2)C=CN1 Amb24102752 [0,1,0,1,0,0|2,0,0]=4 5959 B12R2.2 C1=CC(c2ccccc2)C=C1 Amb24351108 [0,1,0,1,0,0|1,0,0]=3 5960 B12R2.2 C1=CCC(c2ccccc2)=C1 Amb27484884 [0,1,0,1,0,0|1,0,0]=3 5961 B12R2.2 C1=CCP(c2ccccc2)C1 Amb25736369 [0,1,0,1,0,0|1,0,1]=4 5962 B12R2.2 C1=CNC(c2ccccc2)N1 Amb27617406 [0,1,0,1,0,0|1,0,1]=4 5963 B12R2.2 C1=CN\C(=C2/C=CN=N2)C=C1 Amb24100389 [0,1,0,1,0,0|2,0,0]=4 5964 B12R2.2 C1=CSC(c2ccccc2)N1 Amb27462150 [0,1,0,1,0,0|0,1,1]=4 5965 B12R2.2 c1cc(-c2ccoc2)ccn1 Amb25151842 [0,1,0,1,0,0|1,0,1]=4 5966 B12R2.2 c1cc(-c2ccsc2)ccn1 Amb2611626 [0,1,0,1,0,0|1,1,0]=4 5967 B12R2.2 c1cc(-c2cnco2)ccn1 Amb591128 [0,1,0,1,0,0|1,0,1]=4 5968 B12R2.2 c1cc(-c2cncs2)ccn1 Amb28256811 [0,1,0,1,0,0|1,1,0]=4 5969 B12R2.2 c1cc(-c2cocn2)ccn1 Amb22235350 [0,1,0,1,0,0|2,0,0]=4 5970 B12R2.2 c1cc(-c2cscn2)ccn1 Amb13884097 [0,1,0,1,0,0|2,0,0]=4 5971 B12R2.2 c1cc(-c2ncco2)ccn1 Amb10552928 [0,1,0,1,0,0|1,0,1]=4 5972 B12R2.2 c1cc(-c2nccs2)ccn1 Amb10601031 [0,1,0,1,0,0|1,1,0]=4 5973 B12R2.2 c1ccc(-c2ccco2)cc1 Amb8390025 [0,1,0,1,0,0|0,0,1]=3 5974 B12R2.2 c1ccc(-c2ccco2)nc1 Amb25865493 [0,1,0,1,0,0|1,0,1]=4 5975 B12R2.2 c1ccc(-c2cccs2)cc1 Amb1215646 [0,1,0,1,0,0|0,1,0]=3 5976 B12R2.2 c1ccc(-c2cccs2)nc1 Amb2765037 [0,1,0,1,0,0|1,1,0]=4 5977 B12R2.2 c1ccc(-c2ccno2)cc1 Amb2191136 [0,1,0,1,0,0|0,0,1]=3 5978 B12R2.2 c1ccc(-c2ccno2)nc1 Amb26363359 [0,1,0,1,0,0|1,0,1]=4 5979 B12R2.2 c1ccc(-c2ccoc2)cc1 Amb27155517 [0,1,0,1,0,0|0,0,1]=3 5980 B12R2.2 c1ccc(-c2ccoc2)nc1 Amb27632684 [0,1,0,1,0,0|1,0,1]=4 5981 B12R2.2 c1ccc(-c2ccsc2)cc1 Amb2611643 [0,1,0,1,0,0|0,1,0]=3 5982 B12R2.2 c1ccc(-c2ccsn2)cc1 Amb24376714 [0,1,0,1,0,0|0,1,0]=3 5983 B12R2.2 c1ccc(-c2cnco2)cc1 Amb2725800 [0,1,0,1,0,0|0,0,1]=3 5984 B12R2.2 c1ccc(-c2cnco2)nc1 Amb590581 [0,1,0,1,0,0|1,0,1]=4 5985 B12R2.2 c1ccc(-c2cncs2)cc1 Amb15691616 [0,1,0,1,0,0|0,1,0]=3 5986 B12R2.2 c1ccc(-c2cnns2)cc1 Amb2754725 [0,1,0,1,0,0|1,1,0]=4 5987 B12R2.2 c1ccc(-c2cnoc2)cc1 Amb33542838 [0,1,0,1,0,0|1,0,1]=4 5988 B12R2.2 c1ccc(-c2cnon2)cc1 Amb9791661 [0,1,0,1,0,0|1,0,1]=4 5989 B12R2.2 c1ccc(-c2cocn2)cc1 Amb17399894 [0,1,0,1,0,0|1,0,0]=3 5990 B12R2.2 c1ccc(-c2cscn2)cc1 Amb2234625 [0,1,0,1,0,0|1,0,0]=3 5991 B12R2.2 c1ccc(-c2cscn2)nc1 Amb13884095 [0,1,0,1,0,0|2,0,0]=4 5992 B12R2.2 c1ccc(-c2csnn2)cc1 Amb2765982 [0,1,0,1,0,0|2,0,0]=4 5993 B12R2.2 c1ccc(-c2ncco2)cc1 Amb5494173 [0,1,0,1,0,0|0,0,1]=3 5994 B12R2.2 c1ccc(-c2ncco2)nc1 Amb17399897 [0,1,0,1,0,0|1,0,1]=4 5995 B12R2.2 c1ccc(-c2nccs2)cc1 Amb13884049 [0,1,0,1,0,0|0,1,0]=3 5996 B12R2.2 c1ccc(-c2nccs2)nc1 Amb10601029 [0,1,0,1,0,0|1,1,0]=4 5997 B12R2.2 c1ccc(-c2ncno2)cc1 Amb10552927 [0,1,0,1,0,0|1,0,1]=4 5998 B12R2.2 c1ccc(-c2ncon2)cc1 Amb28457268 [0,1,0,1,0,0|1,0,1]=4 5999 B12R2.2 c1ccc(-c2ncsn2)cc1 Amb27169637 [0,1,0,1,0,0|1,1,0]=4 6000 B12R2.2 c1ccc(-c2nnco2)cc1 Amb669572 [0,1,0,1,0,0|1,0,1]=4 6001 B12R2.2 c1ccc(-n2cccc2)cc1 Amb1879309 [0,1,0,1,0,0|1,0,0]=3 6002 B12R2.2 c1ccc(-n2cccc2)nc1 Amb2235020 [0,1,0,1,0,0|2,0,0]=4 6003 B12R2.2 c1ccc(-n2cccn2)cc1 Amb1157548 [0,1,0,1,0,0|1,0,0]=3 6004 B12R2.2 c1ccc(-n2cccn2)nc1 Amb8394255 [0,1,0,1,0,0|2,0,0]=4 6005 B12R2.2 c1ccc(-n2ccnc2)cc1 Amb2413300 [0,1,0,1,0,0|2,0,0]=4 6006 B12R2.2 c1ccc(-n2ccnn2)cc1 Amb5720633 [0,1,0,1,0,0|2,0,0]=4 6007 B12R2.2 c1ccc(-n2cncn2)cc1 Amb2237267 [0,1,0,1,0,0|2,0,0]=4 6008 B12R2.2 c1ccc(-n2nccn2)cc1 Amb9804907 [0,1,0,1,0,0|2,0,0]=4 6009 B12R2.2 c1ccn(-c2ccncc2)c1 Amb8439681 [0,1,0,1,0,0|2,0,0]=4 6010 B12R2.2 c1cncc(-c2cccs2)c1 Amb2611628 [0,1,0,1,0,0|1,1,0]=4 6011 B12R2.2 c1cncc(-c2ccsc2)c1 Amb9769832 [0,1,0,1,0,0|1,1,0]=4 6012 B12R2.2 c1cncc(-c2cnco2)c1 Amb593000 [0,1,0,1,0,0|1,0,1]=4 6013 B12R2.2 c1cncc(-c2cocn2)c1 Amb22235345 [0,1,0,1,0,0|2,0,0]=4 6014 B12R2.2 c1cncc(-c2cscn2)c1 Amb13884096 [0,1,0,1,0,0|2,0,0]=4 6015 B12R2.2 c1cncc(-c2ncco2)c1 Amb17399898 [0,1,0,1,0,0|1,0,1]=4 6016 B12R2.2 c1cncc(-c2nccs2)c1 Amb10601030 [0,1,0,1,0,0|1,1,0]=4 6017 B12R2.2 c1cncc(-n2cccc2)c1 Amb2236511 [0,1,0,1,0,0|2,0,0]=4 6018 B12R2.2 c1cncc(-n2cccn2)c1 Amb19515135 [0,1,0,1,0,0|2,0,0]=4 6019 B12R2.2 c1cnn(-c2ccncc2)c1 Amb33531805 [0,1,0,1,0,0|2,0,0]=4 6020 B12R2.2 c1coc(-c2ccncc2)c1 Amb25092136 [0,1,0,1,0,0|1,0,1]=4 6021 B12R2.2 c1csc(-c2ccncc2)c1 Amb2611627 [0,1,0,1,0,0|1,1,0]=4 6022 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [0,1,0,1,0,0|0,0,2]=4 6023 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [0,1,0,1,0,0|0,0,2]=4 6024 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,1,0,1,0,0|0,0,2]=4 6025 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,1,0,1,0,0|0,0,1]=3 6026 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,1,0,1,0,0|0,0,2]=4 6027 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,1,0,1,0,0|0,0,2]=4 6028 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,1,0,1,0,0|0,0,2]=4 6029 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,1,0,1,0,0|0,0,2]=4 6030 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,1,0,1,0,0|0,0,2]=4 6031 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,1,0,1,0,0|0,0,2]=4 6032 B12R2.27 OCC1=C(c2ccccc2)N1 Amb28197190 [0,1,0,1,0,0|0,0,2]=4 6033 B12R2.931 N#CCC1=Cc2ccccc21 Amb26423043 [0,1,0,1,0,0|1,0,1]=4 6034 B12R2.931 NCCC1=Cc2ccccc21 Amb27866978 [0,1,0,1,0,0|1,0,1]=4 6035 B12R2.931 OCCC1=Cc2ccccc21 Amb24414369 [0,1,0,1,0,0|0,0,2]=4 6036 B12R2.1081 BrC1=C2C=CC=CN2CC=C1 Amb17835330 [0,1,0,1,0,0|2,0,0]=4 6037 B12R2.1081 BrC1=CCOc2ccccc21 Amb28385954 [0,1,0,1,0,0|0,0,2]=4 6038 B12R2.1081 Brc1cccc2c1CCC=C2 Amb22500941 [0,1,0,1,0,0|1,0,1]=4 6039 B12R2.1081 Brc1cccc2cccc[n+]12 Amb24309285 [0,1,0,1,0,0|2,0,0]=4 6040 B12R2.1081 Brc1cccc2ccccc12 Amb2795757 [0,1,0,1,0,0|1,0,0]=3 6041 B12R2.1081 Brc1cccc2cccnc12 Amb2234896 [0,1,0,1,0,0|1,0,0]=3 6042 B12R2.1081 Brc1cccc2ccncc12 Amb24184018 [0,1,0,1,0,0|2,0,0]=4 6043 B12R2.1081 Brc1cccc2ccncc12 Amb5638109 [0,1,0,1,0,0|2,0,0]=4 6044 B12R2.1081 Brc1cccc2cnccc12 Amb6364737 [0,1,0,1,0,0|2,0,0]=4 6045 B12R2.1081 Brc1cccc2cncnc12 Amb21858228 [0,1,0,1,0,0|2,0,0]=4 6046 B12R2.1081 Brc1cccc2ncccc12 Amb22276929 [0,1,0,1,0,0|1,0,0]=3 6047 B12R2.1081 Brc1cccc2ncccc12 Amb2447603 [0,1,0,1,0,0|1,0,0]=3 6048 B12R2.1081 Brc1cccc2nccnc12 Amb2622320 [0,1,0,1,0,0|2,0,0]=4 6049 B12R2.1081 Brc1cccc2ncncc12 Amb10602884 [0,1,0,1,0,0|2,0,0]=4 6050 B12R2.1081 Brc1ccnc2ccccc12 Amb2447564 [0,1,0,1,0,0|1,0,0]=3 6051 B12R2.1081 Brc1ccnc2cccnc12 Amb21857962 [0,1,0,1,0,0|2,0,0]=4 6052 B12R2.1081 Brc1ccnc2ccncc12 Amb22490503 [0,1,0,1,0,0|2,0,0]=4 6053 B12R2.1081 Brc1ccnc2cnccc12 Amb25890540 [0,1,0,1,0,0|2,0,0]=4 6054 B12R2.1081 Brc1ccnc2ncccc12 Amb10070413 [0,1,0,1,0,0|2,0,0]=4 6055 B12R2.1081 Brc1cncc2ccccc12 Amb6364997 [0,1,0,1,0,0|1,0,0]=3 6056 B12R2.1081 Brc1cncc2cccnc12 Amb2609625 [0,1,0,1,0,0|2,0,0]=4 6057 B12R2.1081 Brc1cncc2ncccc12 Amb7101479 [0,1,0,1,0,0|2,0,0]=4 6058 B12R2.1081 Brc1cnnc2ccccc12 Amb33548752 [0,1,0,1,0,0|2,0,0]=4 6059 B12R2.1081 Brc1nccc2ccccc12 Amb2609661 [0,1,0,1,0,0|1,0,0]=3 6060 B12R2.1081 Brc1nccc2cccnc12 Amb21857688 [0,1,0,1,0,0|2,0,0]=4 6061 B12R2.1081 Brc1nccc2ccncc12 Amb21856965 [0,1,0,1,0,0|2,0,0]=4 6062 B12R2.1081 Brc1nccc2cnccc12 Amb21857687 [0,1,0,1,0,0|2,0,0]=4 6063 B12R2.1081 Brc1nccc2ncccc12 Amb21857110 [0,1,0,1,0,0|2,0,0]=4 6064 B12R2.1081 Brc1ncnc2ccccc12 Amb10602647 [0,1,0,1,0,0|2,0,0]=4 6065 B12R2.1081 Brc1nncc2ccccc12 Amb33531650 [0,1,0,1,0,0|2,0,0]=4 6066 B12R2.1081 C=C1C=CNc2ccccc21 Amb24070554 [0,1,0,1,0,0|1,0,0]=3 6067 B12R2.1081 C=C1NC=Cc2ccccc21 Amb27186378 [0,1,0,1,0,0|1,0,0]=3 6068 B12R2.1081 CC1=CCCc2ccccc21 Amb2439915 [0,1,0,1,0,0|1,0,1]=4 6069 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|0,0,2]=4 6070 B12R2.1081 CC1NC=Cc2ccccc21 Amb28424328 [0,1,0,1,0,0|1,0,1]=4 6071 B12R2.1081 CN1CC=Cc2ccccc21 Amb26960927 [0,1,0,1,0,0|1,0,1]=4 6072 B12R2.1081 C[n+]1cccc2ccccc21 Amb2602430 [0,1,0,1,0,0|1,0,0]=3 6073 B12R2.1081 C[n+]1cccc2ncccc21 Amb2610098 [0,1,0,1,0,0|2,0,0]=4 6074 B12R2.1081 Cc1ccc[n+]2cccnc12 Amb26339009 [0,1,0,1,0,0|2,0,0]=4 6075 B12R2.1081 Cc1cccc2c1NCC=C2 Amb18062161 [0,1,0,1,0,0|1,0,1]=4 6076 B12R2.1081 Cc1cccc2ccccc12 Amb6608819 [0,1,0,1,0,0|1,0,0]=3 6077 B12R2.1081 Cc1cccc2cccnc12 Amb1229978 [0,1,0,1,0,0|1,0,0]=3 6078 B12R2.1081 Cc1cccc2ccncc12 Amb10070397 [0,1,0,1,0,0|2,0,0]=4 6079 B12R2.1081 Cc1cccc2cnccc12 Amb2447327 [0,1,0,1,0,0|2,0,0]=4 6080 B12R2.1081 Cc1cccc2ncccc12 Amb2447286 [0,1,0,1,0,0|1,0,0]=3 6081 B12R2.1081 Cc1cccc2nccnc12 Amb8515905 [0,1,0,1,0,0|2,0,0]=4 6082 B12R2.1081 Cc1ccnc2ccccc12 Amb6608646 [0,1,0,1,0,0|1,0,0]=3 6083 B12R2.1081 Cc1ccnc2cccnc12 Amb23437164 [0,1,0,1,0,0|2,0,0]=4 6084 B12R2.1081 Cc1ccnc2ncccc12 Amb21964571 [0,1,0,1,0,0|2,0,0]=4 6085 B12R2.1081 Cc1cncc2ccccc12 Amb15691609 [0,1,0,1,0,0|1,0,0]=3 6086 B12R2.1081 Cc1cnnc2ccccc12 Amb21964128 [0,1,0,1,0,0|2,0,0]=4 6087 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,1,0,1,0,0|1,0,0]=3 6088 B12R2.1081 Cc1nccc2cccnc12 Amb27849252 [0,1,0,1,0,0|2,0,0]=4 6089 B12R2.1081 Cc1ncnc2ccccc12 Amb10573340 [0,1,0,1,0,0|2,0,0]=4 6090 B12R2.1081 Cc1nncc2ccccc12 Amb22499677 [0,1,0,1,0,0|2,0,0]=4 6091 B12R2.1081 ClC1=CCOc2ccccc21 Amb27194523 [0,1,0,1,0,0|0,0,2]=4 6092 B12R2.1081 ClN1C=CNc2ccccc21 Amb27823291 [0,1,0,1,0,0|2,0,0]=4 6093 B12R2.1081 Clc1cccc2c1CCC=C2 Amb2383775 [0,1,0,1,0,0|1,0,1]=4 6094 B12R2.1081 Clc1cccc2c1NCC=C2 Amb18062185 [0,1,0,1,0,0|1,0,1]=4 6095 B12R2.1081 Clc1cccc2c1OCC=C2 Amb22586336 [0,1,0,1,0,0|0,0,2]=4 6096 B12R2.1081 Clc1cccc2cccc[n+]12 Amb2613073 [0,1,0,1,0,0|2,0,0]=4 6097 B12R2.1081 Clc1cccc2cccnc12 Amb6365653 [0,1,0,1,0,0|1,0,0]=3 6098 B12R2.1081 Clc1cccc2ccncc12 Amb10067628 [0,1,0,1,0,0|2,0,0]=4 6099 B12R2.1081 Clc1cccc2ccncc12 Amb32663564 [0,1,0,1,0,0|2,0,0]=4 6100 B12R2.1081 Clc1cccc2cnccc12 Amb10067233 [0,1,0,1,0,0|2,0,0]=4 6101 B12R2.1081 Clc1cccc2cnccc12 Amb33421960 [0,1,0,1,0,0|2,0,0]=4 6102 B12R2.1081 Clc1cccc2ncccc12 Amb2369016 [0,1,0,1,0,0|1,0,0]=3 6103 B12R2.1081 Clc1cccc2nccnc12 Amb10552908 [0,1,0,1,0,0|2,0,0]=4 6104 B12R2.1081 Clc1cccc2ncncc12 Amb22641427 [0,1,0,1,0,0|2,0,0]=4 6105 B12R2.1081 Clc1ccnc2ccccc12 Amb1033000 [0,1,0,1,0,0|1,0,0]=3 6106 B12R2.1081 Clc1ccnc2cccnc12 Amb8387813 [0,1,0,1,0,0|2,0,0]=4 6107 B12R2.1081 Clc1ccnc2ccncc12 Amb20623102 [0,1,0,1,0,0|2,0,0]=4 6108 B12R2.1081 Clc1ccnc2cnccc12 Amb21964715 [0,1,0,1,0,0|2,0,0]=4 6109 B12R2.1081 Clc1ccnc2ncccc12 Amb2700582 [0,1,0,1,0,0|2,0,0]=4 6110 B12R2.1081 Clc1cncc2ccccc12 Amb8438946 [0,1,0,1,0,0|1,0,0]=3 6111 B12R2.1081 Clc1cncc2ncccc12 Amb21963428 [0,1,0,1,0,0|2,0,0]=4 6112 B12R2.1081 Clc1cnnc2ccccc12 Amb28990887 [0,1,0,1,0,0|2,0,0]=4 6113 B12R2.1081 Clc1cnnc2ccccc12 Amb8394534 [0,1,0,1,0,0|2,0,0]=4 6114 B12R2.1081 Clc1nccc2ccccc12 Amb2196515 [0,1,0,1,0,0|1,0,0]=3 6115 B12R2.1081 Clc1nccc2cccnc12 Amb2700583 [0,1,0,1,0,0|2,0,0]=4 6116 B12R2.1081 Clc1nccc2ccncc12 Amb19958084 [0,1,0,1,0,0|2,0,0]=4 6117 B12R2.1081 Clc1nccc2cnccc12 Amb10603407 [0,1,0,1,0,0|2,0,0]=4 6118 B12R2.1081 Clc1nccc2ncccc12 Amb8467898 [0,1,0,1,0,0|2,0,0]=4 6119 B12R2.1081 Clc1ncnc2ccccc12 Amb1107717 [0,1,0,1,0,0|2,0,0]=4 6120 B12R2.1081 Clc1nncc2ccccc12 Amb22723369 [0,1,0,1,0,0|2,0,0]=4 6121 B12R2.1081 Clc1nncc2ccccc12 Amb415171 [0,1,0,1,0,0|2,0,0]=4 6122 B12R2.1081 FC1=CCCc2ccccc21 Amb27482090 [0,1,0,1,0,0|1,0,1]=4 6123 B12R2.1081 Fc1cccc2c1CC=CO2 Amb25243428 [0,1,0,1,0,0|0,0,2]=4 6124 B12R2.1081 Fc1cccc2c1CCC=C2 Amb2383776 [0,1,0,1,0,0|1,0,1]=4 6125 B12R2.1081 Fc1cccc2c1NCC=C2 Amb18062053 [0,1,0,1,0,0|1,0,1]=4 6126 B12R2.1081 Fc1cccc2c1OCC=C2 Amb22586337 [0,1,0,1,0,0|0,0,2]=4 6127 B12R2.1081 Fc1cccc2ccccc12 Amb2688247 [0,1,0,1,0,0|1,0,0]=3 6128 B12R2.1081 Fc1cccc2cccnc12 Amb22235972 [0,1,0,1,0,0|1,0,0]=3 6129 B12R2.1081 Fc1cccc2cccnc12 Amb532235 [0,1,0,1,0,0|1,0,0]=3 6130 B12R2.1081 Fc1cccc2ccncc12 Amb10839616 [0,1,0,1,0,0|2,0,0]=4 6131 B12R2.1081 Fc1cccc2cnccc12 Amb10573349 [0,1,0,1,0,0|2,0,0]=4 6132 B12R2.1081 Fc1cccc2cncnc12 Amb22498029 [0,1,0,1,0,0|2,0,0]=4 6133 B12R2.1081 Fc1cccc2ncccc12 Amb5494023 [0,1,0,1,0,0|1,0,0]=3 6134 B12R2.1081 Fc1cccc2nccnc12 Amb16192015 [0,1,0,1,0,0|2,0,0]=4 6135 B12R2.1081 Fc1cccc2ncncc12 Amb24071402 [0,1,0,1,0,0|2,0,0]=4 6136 B12R2.1081 Fc1ccnc2ccccc12 Amb10067580 [0,1,0,1,0,0|1,0,0]=3 6137 B12R2.1081 Fc1cncc2ccccc12 Amb22396493 [0,1,0,1,0,0|1,0,0]=3 6138 B12R2.1081 Fc1cncc2ccccc12 Amb6296546 [0,1,0,1,0,0|1,0,0]=3 6139 B12R2.1081 Fc1cncc2cccnc12 Amb27225198 [0,1,0,1,0,0|2,0,0]=4 6140 B12R2.1081 Fc1cncc2ncccc12 Amb27877615 [0,1,0,1,0,0|2,0,0]=4 6141 B12R2.1081 Fc1nccc2ccccc12 Amb24673352 [0,1,0,1,0,0|1,0,0]=3 6142 B12R2.1081 Fc1ncnc2ccccc12 Amb20669977 [0,1,0,1,0,0|2,0,0]=4 6143 B12R2.1081 Ic1cccc2ccccc12 Amb4605973 [0,1,0,1,0,0|1,0,0]=3 6144 B12R2.1081 Ic1cccc2cccnc12 Amb8839225 [0,1,0,1,0,0|1,0,0]=3 6145 B12R2.1081 Ic1cccc2ccncc12 Amb22495459 [0,1,0,1,0,0|2,0,0]=4 6146 B12R2.1081 Ic1cccc2cnccc12 Amb9675239 [0,1,0,1,0,0|2,0,0]=4 6147 B12R2.1081 Ic1cccc2ncccc12 Amb33528870 [0,1,0,1,0,0|1,0,0]=3 6148 B12R2.1081 Ic1ccnc2ccccc12 Amb5492738 [0,1,0,1,0,0|1,0,0]=3 6149 B12R2.1081 Ic1ccnc2cccnc12 Amb22754095 [0,1,0,1,0,0|2,0,0]=4 6150 B12R2.1081 Ic1cncc2ccccc12 Amb2609665 [0,1,0,1,0,0|1,0,0]=3 6151 B12R2.1081 Ic1nccc2ccccc12 Amb2609664 [0,1,0,1,0,0|1,0,0]=3 6152 B12R2.1081 Ic1ncnc2ccccc12 Amb2795821 [0,1,0,1,0,0|2,0,0]=4 6153 B12R2.1081 N[n+]1cccc2ccccc21 Amb2613573 [0,1,0,1,0,0|1,0,0]=3 6154 B12R2.1081 Nc1cccc2c1C=CCO2 Amb17569992 [0,1,0,1,0,0|0,0,2]=4 6155 B12R2.1081 Nc1cccc2c1C=CNN2 Amb27212993 [0,1,0,1,0,0|2,0,0]=4 6156 B12R2.1081 Nc1cccc2c1CC=CC2 Amb17593645 [0,1,0,1,0,0|1,0,1]=4 6157 B12R2.1081 Nc1cccc2c1NCC=C2 Amb28340933 [0,1,0,1,0,0|1,0,1]=4 6158 B12R2.1081 Nc1cccc2c1OCC=C2 Amb17569990 [0,1,0,1,0,0|0,0,2]=4 6159 B12R2.1081 Nc1cccc2ccccc12 Amb1935098 [0,1,0,1,0,0|1,0,0]=3 6160 B12R2.1081 Nc1cccc2cccnc12 Amb1056132 [0,1,0,1,0,0|1,0,0]=3 6161 B12R2.1081 Nc1cccc2ccncc12 Amb8009841 [0,1,0,1,0,0|2,0,0]=4 6162 B12R2.1081 Nc1cccc2cnccc12 Amb1157144 [0,1,0,1,0,0|2,0,0]=4 6163 B12R2.1081 Nc1cccc2cnccc12 Amb6383220 [0,1,0,1,0,0|2,0,0]=4 6164 B12R2.1081 Nc1cccc2cncnc12 Amb8388202 [0,1,0,1,0,0|2,0,0]=4 6165 B12R2.1081 Nc1cccc2ncccc12 Amb1151787 [0,1,0,1,0,0|1,0,0]=3 6166 B12R2.1081 Nc1cccc2nccnc12 Amb8388204 [0,1,0,1,0,0|2,0,0]=4 6167 B12R2.1081 Nc1cccc2ncncc12 Amb24071664 [0,1,0,1,0,0|2,0,0]=4 6168 B12R2.1081 Nc1ccnc2ccccc12 Amb1102727 [0,1,0,1,0,0|1,0,0]=3 6169 B12R2.1081 Nc1ccnc2ccccc12 Amb7969523 [0,1,0,1,0,0|1,0,0]=3 6170 B12R2.1081 Nc1ccnc2cccnc12 Amb8387794 [0,1,0,1,0,0|2,0,0]=4 6171 B12R2.1081 Nc1ccnc2ccncc12 Amb20623714 [0,1,0,1,0,0|2,0,0]=4 6172 B12R2.1081 Nc1ccnc2ccncc12 Amb8438996 [0,1,0,1,0,0|2,0,0]=4 6173 B12R2.1081 Nc1ccnc2ncccc12 Amb10879378 [0,1,0,1,0,0|2,0,0]=4 6174 B12R2.1081 Nc1cncc2ccccc12 Amb22276925 [0,1,0,1,0,0|1,0,0]=3 6175 B12R2.1081 Nc1cncc2ccccc12 Amb2610662 [0,1,0,1,0,0|1,0,0]=3 6176 B12R2.1081 Nc1cncc2cccnc12 Amb22642050 [0,1,0,1,0,0|2,0,0]=4 6177 B12R2.1081 Nc1cncc2ccncc12 Amb28132921 [0,1,0,1,0,0|2,0,0]=4 6178 B12R2.1081 Nc1cnnc2ccccc12 Amb4408462 [0,1,0,1,0,0|2,0,0]=4 6179 B12R2.1081 Nc1nccc2ccccc12 Amb2609973 [0,1,0,1,0,0|1,0,0]=3 6180 B12R2.1081 Nc1nccc2ccccc12 Amb32663180 [0,1,0,1,0,0|1,0,0]=3 6181 B12R2.1081 Nc1nccc2cccnc12 Amb2691520 [0,1,0,1,0,0|2,0,0]=4 6182 B12R2.1081 Nc1nccc2ccncc12 Amb18124737 [0,1,0,1,0,0|2,0,0]=4 6183 B12R2.1081 Nc1nccc2ncccc12 Amb21857689 [0,1,0,1,0,0|2,0,0]=4 6184 B12R2.1081 Nc1ncnc2ccccc12 Amb1154616 [0,1,0,1,0,0|2,0,0]=4 6185 B12R2.1081 Nc1nncc2ccccc12 Amb9378095 [0,1,0,1,0,0|2,0,0]=4 6186 B12R2.1081 O=C1C=CC=C2SC=CC=C12 Amb28253344 [0,1,0,1,0,0|0,1,0]=3 6187 B12R2.1081 O=C1C=CCC2=CNCC=C12 Amb28055909 [0,1,0,1,0,0|1,0,1]=4 6188 B12R2.1081 O=C1C=CCc2ccccc21 Amb2388336 [0,1,0,1,0,0|0,0,0]=2 6189 B12R2.1081 O=C1C=CN=C2C=CC=CN12 Amb18035151 [0,1,0,1,0,0|1,0,0]=3 6190 B12R2.1081 O=C1C=CNc2ccccc21 Amb18369085 [0,1,0,1,0,0|0,0,0]=2 6191 B12R2.1081 O=C1C=CNc2cccnc21 Amb22489921 [0,1,0,1,0,0|1,0,0]=3 6192 B12R2.1081 O=C1C=CNc2ccncc21 Amb20623103 [0,1,0,1,0,0|1,0,0]=3 6193 B12R2.1081 O=C1C=CNc2cnccc21 Amb22055906 [0,1,0,1,0,0|1,0,0]=3 6194 B12R2.1081 O=C1C=CNc2ncccc21 Amb22490480 [0,1,0,1,0,0|1,0,0]=3 6195 B12R2.1081 O=C1C=COc2ccccc21 Amb19894749 [0,1,0,1,0,0|0,0,0]=2 6196 B12R2.1081 O=C1C=COc2cccnc21 Amb32671309 [0,1,0,1,0,0|1,0,0]=3 6197 B12R2.1081 O=C1C=COc2cnccc21 Amb33484174 [0,1,0,1,0,0|1,0,0]=3 6198 B12R2.1081 O=C1C=CSc2ccccc21 Amb22347337 [0,1,0,1,0,0|0,0,0]=2 6199 B12R2.1081 O=C1C=CSc2ncccc21 Amb27490810 [0,1,0,1,0,0|1,0,0]=3 6200 B12R2.1081 O=C1C=NNc2ccccc21 Amb18528334 [0,1,0,1,0,0|1,0,0]=3 6201 B12R2.1081 O=C1CC=Nc2ccccc21 Amb24062843 [0,1,0,1,0,0|0,0,1]=3 6202 B12R2.1081 O=C1CCCc2ccccc21 Amb534638 [0,1,0,1,0,0|0,0,2]=4 6203 B12R2.1081 O=C1CCNc2ccccc21 Amb2699611 [0,1,0,1,0,0|0,0,2]=4 6204 B12R2.1081 O=C1CCNc2ccccc21 Amb33542509 [0,1,0,1,0,0|0,0,2]=4 6205 B12R2.1081 O=C1CCOc2ccccc21 Amb1153759 [0,1,0,1,0,0|0,0,2]=4 6206 B12R2.1081 O=C1CCSc2ccccc21 Amb1151631 [0,1,0,1,0,0|0,0,2]=4 6207 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,1,0,1,0,0|0,0,2]=4 6208 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [0,1,0,1,0,0|0,0,2]=4 6209 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,1,0,1,0,0|1,0,1]=4 6210 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,1,0,1,0,0|1,0,1]=4 6211 B12R2.1081 O=C1COCc2ccccc21 Amb10067824 [0,1,0,1,0,0|0,0,2]=4 6212 B12R2.1081 O=C1CSCc2ccccc21 Amb2733969 [0,1,0,1,0,0|0,0,2]=4 6213 B12R2.1081 O=C1N=CC=C2N=CC=CC12 Amb27479100 [0,1,0,1,0,0|1,0,1]=4 6214 B12R2.1081 O=C1N=CN=C2C=CC=CN12 Amb27843723 [0,1,0,1,0,0|2,0,0]=4 6215 B12R2.1081 O=C1N=CNc2ncccc21 Amb19957598 [0,1,0,1,0,0|2,0,0]=4 6216 B12R2.1081 O=C1N=NC=C2NC=CC=C12 Amb19515546 [0,1,0,1,0,0|2,0,0]=4 6217 B12R2.1081 O=C1N=NNc2ccccc21 Amb19653630 [0,1,0,1,0,0|2,0,0]=4 6218 B12R2.1081 O=C1NC=Cc2ccccc21 Amb18364338 [0,1,0,1,0,0|0,0,0]=2 6219 B12R2.1081 O=C1NC=Cc2cccnc21 Amb19958600 [0,1,0,1,0,0|1,0,0]=3 6220 B12R2.1081 O=C1NC=Cc2ccncc21 Amb21960470 [0,1,0,1,0,0|1,0,0]=3 6221 B12R2.1081 O=C1NC=Cc2ccncc21 Amb22496100 [0,1,0,1,0,0|1,0,0]=3 6222 B12R2.1081 O=C1NC=Cc2ccncc21 Amb33421959 [0,1,0,1,0,0|1,0,0]=3 6223 B12R2.1081 O=C1NC=Cc2cnccc21 Amb20241097 [0,1,0,1,0,0|1,0,0]=3 6224 B12R2.1081 O=C1NC=Cc2cnncc21 Amb27170657 [0,1,0,1,0,0|2,0,0]=4 6225 B12R2.1081 O=C1NC=Cc2ncccc21 Amb19882327 [0,1,0,1,0,0|1,0,0]=3 6226 B12R2.1081 O=C1NC=Cc2nccnc21 Amb22489852 [0,1,0,1,0,0|2,0,0]=4 6227 B12R2.1081 O=C1NC=Cc2ncncc21 Amb24119509 [0,1,0,1,0,0|2,0,0]=4 6228 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [0,1,0,1,0,0|1,0,0]=3 6229 B12R2.1081 O=C1NC=Nc2ccncc21 Amb22001741 [0,1,0,1,0,0|2,0,0]=4 6230 B12R2.1081 O=C1NC=Nc2cnccc21 Amb19957554 [0,1,0,1,0,0|2,0,0]=4 6231 B12R2.1081 O=C1NC=Nc2ncccc21 Amb18026152 [0,1,0,1,0,0|2,0,0]=4 6232 B12R2.1081 O=C1NCCc2ccccc21 Amb2502473 [0,1,0,1,0,0|0,0,2]=4 6233 B12R2.1081 O=C1NCSc2ccccc21 Amb27646438 [0,1,0,1,0,0|1,0,1]=4 6234 B12R2.1081 O=C1NN=Cc2ccccc21 Amb19338634 [0,1,0,1,0,0|1,0,0]=3 6235 B12R2.1081 O=C1NN=Cc2cccnc21 Amb19336036 [0,1,0,1,0,0|2,0,0]=4 6236 B12R2.1081 O=C1NN=Cc2cnccc21 Amb23557709 [0,1,0,1,0,0|2,0,0]=4 6237 B12R2.1081 O=C1NN=Cc2ncccc21 Amb19278034 [0,1,0,1,0,0|2,0,0]=4 6238 B12R2.1081 O=C1NN=Nc2ccccc21 Amb17933278 [0,1,0,1,0,0|2,0,0]=4 6239 B12R2.1081 O=C1NNCc2ccccc21 Amb27215032 [0,1,0,1,0,0|1,0,1]=4 6240 B12R2.1081 O=C1NNCc2ccccc21 Amb33482996 [0,1,0,1,0,0|1,0,1]=4 6241 B12R2.1081 O=C1NOCc2ccccc21 Amb26878656 [0,1,0,1,0,0|1,0,1]=4 6242 B12R2.1081 O=C1OC=Cc2ccccc21 Amb25189261 [0,1,0,1,0,0|0,0,0]=2 6243 B12R2.1081 O=C1OC=Cc2cccnc21 Amb19323216 [0,1,0,1,0,0|1,0,0]=3 6244 B12R2.1081 O=C1OC=Cc2ncncc21 Amb24119967 [0,1,0,1,0,0|2,0,0]=4 6245 B12R2.1081 O=C1OC=Nc2ccccc21 Amb26019177 [0,1,0,1,0,0|1,0,0]=3 6246 B12R2.1081 O=C1OCCc2ccccc21 Amb16232507 [0,1,0,1,0,0|0,0,2]=4 6247 B12R2.1081 O=C1ON=Cc2ccccc21 Amb27628760 [0,1,0,1,0,0|1,0,0]=3 6248 B12R2.1081 O=C1SCCc2ccccc21 Amb24484481 [0,1,0,1,0,0|0,0,2]=4 6249 B12R2.1081 OC1=C2C=CC=CN2CC=C1 Amb17835332 [0,1,0,1,0,0|1,0,1]=4 6250 B12R2.1081 OC1=CNNc2ccccc21 Amb22057612 [0,1,0,1,0,0|1,0,1]=4 6251 B12R2.1081 OC1=COCc2ccccc21 Amb10603427 [0,1,0,1,0,0|0,0,2]=4 6252 B12R2.1081 OC1C=CSc2ccccc21 Amb27980705 [0,1,0,1,0,0|0,0,2]=4 6253 B12R2.1081 ON1CC=Cc2ccccc21 Amb26600953 [0,1,0,1,0,0|0,0,2]=4 6254 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|0,0,2]=4 6255 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [0,1,0,1,0,0|0,0,2]=4 6256 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [0,1,0,1,0,0|0,0,2]=4 6257 B12R2.1081 O[C@H]1C=COc2ccccc21 Amb27589685 [0,1,0,1,0,0|0,0,2]=4 6258 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [0,1,0,1,0,0|0,0,2]=4 6259 B12R2.1081 Oc1cccc2c1C=CCC2 Amb18644265 [0,1,0,1,0,0|1,0,1]=4 6260 B12R2.1081 Oc1cccc2c1CC=CC2 Amb8386792 [0,1,0,1,0,0|1,0,1]=4 6261 B12R2.1081 Oc1cccc2c1OCC=C2 Amb27786332 [0,1,0,1,0,0|0,0,2]=4 6262 B12R2.1081 Oc1cccc2ccccc12 Amb2609031 [0,1,0,1,0,0|0,0,1]=3 6263 B12R2.1081 Oc1cccc2cccnc12 Amb10843705 [0,1,0,1,0,0|1,0,0]=3 6264 B12R2.1081 Oc1cccc2cccnc12 Amb1151957 [0,1,0,1,0,0|1,0,0]=3 6265 B12R2.1081 Oc1cccc2cccnc12 Amb22167517 [0,1,0,1,0,0|1,0,0]=3 6266 B12R2.1081 Oc1cccc2cccnc12 Amb8386462 [0,1,0,1,0,0|1,0,0]=3 6267 B12R2.1081 Oc1cccc2ccncc12 Amb8439357 [0,1,0,1,0,0|1,0,1]=4 6268 B12R2.1081 Oc1cccc2ccnnc12 Amb24601328 [0,1,0,1,0,0|2,0,0]=4 6269 B12R2.1081 Oc1cccc2cnccc12 Amb534916 [0,1,0,1,0,0|1,0,1]=4 6270 B12R2.1081 Oc1cccc2cncnc12 Amb10552925 [0,1,0,1,0,0|2,0,0]=4 6271 B12R2.1081 Oc1cccc2ncccc12 Amb2613004 [0,1,0,1,0,0|1,0,0]=3 6272 B12R2.1081 Oc1cccc2nccnc12 Amb2591928 [0,1,0,1,0,0|2,0,0]=4 6273 B12R2.1081 Oc1ccnc2ccccc12 Amb2719646 [0,1,0,1,0,0|0,0,1]=3 6274 B12R2.1081 Oc1ccnc2cccnc12 Amb2610875 [0,1,0,1,0,0|1,0,1]=4 6275 B12R2.1081 Oc1cncc2ccccc12 Amb10553148 [0,1,0,1,0,0|0,0,1]=3 6276 B12R2.1081 Oc1cncc2ccccc12 Amb21964404 [0,1,0,1,0,0|0,0,1]=3 6277 B12R2.1081 Oc1cncc2cccnc12 Amb28282595 [0,1,0,1,0,0|1,0,1]=4 6278 B12R2.1081 Oc1cncc2ccncc12 Amb27438150 [0,1,0,1,0,0|1,0,1]=4 6279 B12R2.1081 Oc1cnnc2ccccc12 Amb2371264 [0,1,0,1,0,0|1,0,1]=4 6280 B12R2.1081 Oc1cnnc2ccccc12 Amb482495 [0,1,0,1,0,0|1,0,1]=4 6281 B12R2.1081 Oc1nccc2ccccc12 Amb2610663 [0,1,0,1,0,0|0,0,1]=3 6282 B12R2.1081 Oc1ncnc2ccccc12 Amb6335374 [0,1,0,1,0,0|1,0,1]=4 6283 B12R2.1081 Oc1nncc2ccccc12 Amb4138464 [0,1,0,1,0,0|1,0,1]=4 6284 B12R2.1081 S=C1C=CC=C2C=CC=CN12 Amb27240298 [0,1,0,1,0,0|1,1,0]=4 6285 B12R2.1081 S=C1C=CNc2ccccc21 Amb19414493 [0,1,0,1,0,0|0,1,0]=3 6286 B12R2.1081 S=C1C=NNc2ccccc21 Amb18043628 [0,1,0,1,0,0|1,1,0]=4 6287 B12R2.1081 S=C1NC=Nc2ccccc21 Amb18015575 [0,1,0,1,0,0|1,1,0]=4 6288 B12R2.1081 S=C1NN=Cc2ccccc21 Amb18043134 [0,1,0,1,0,0|1,1,0]=4 6289 B12R2.1081 Sc1cccc2ccccc12 Amb8516722 [0,1,0,1,0,0|0,1,0]=3 6290 B12R2.1081 Sc1cccc2cccnc12 Amb8629206 [0,1,0,1,0,0|1,0,0]=3 6291 B12R2.1081 Sc1cccc2cnccc12 Amb25886341 [0,1,0,1,0,0|1,1,0]=4 6292 B12R2.1081 Sc1ccnc2ccccc12 Amb10603792 [0,1,0,1,0,0|0,1,0]=3 6293 B12R2.1081 Sc1cnnc2ccccc12 Amb2371342 [0,1,0,1,0,0|1,1,0]=4 6294 B12R2.1081 Sc1nccc2ccccc12 Amb5716285 [0,1,0,1,0,0|0,1,0]=3 6295 B12R2.1081 Sc1nccc2ncccc12 Amb24406587 [0,1,0,1,0,0|1,1,0]=4 6296 B12R2.1081 Sc1ncnc2ccccc12 Amb1104189 [0,1,0,1,0,0|1,1,0]=4 6297 B12R2.1081 Sc1nncc2ccccc12 Amb1149056 [0,1,0,1,0,0|1,1,0]=4 6298 B12R2.1081 [Mg+]c1cccc2ccccc12 Amb22044005 [0,1,0,1,0,0|1,0,0]=3 6299 B12R2.1081 [O-][n+]1cccc2ccccc21 Amb2609905 [0,1,0,1,0,0|0,0,1]=3 6300 B12R2.1081 [O-][n+]1cccc2ncccc21 Amb22739842 [0,1,0,1,0,0|1,0,1]=4 6301 B12R2.1081 [O-][n+]1ccnc2ccccc21 Amb2610937 [0,1,0,1,0,0|1,0,1]=4 6302 B12R2.1081 [O-][n+]1nccc2ccccc21 Amb28312887 [0,1,0,1,0,0|1,0,1]=4 6303 B12R2.1081 [O-]c1cccc2cccnc12 Amb22052464 [0,1,0,1,0,0|1,0,0]=3 6304 B12R2.1081 [O-]c1cccc2cccnc12 Amb22057291 [0,1,0,1,0,0|1,0,0]=3 6305 B12R2.1081 [S-]c1cccc2ccc[nH+]c12 Amb4014285 [0,1,0,1,0,0|1,0,0]=3 6306 B12R2.1081 [S-]c1cccc2ccccc12 Amb33513016 [0,1,0,1,0,0|0,1,0]=3 6307 B12R2.1081 [S-]c1cccc2cccnc12 Amb483273 [0,1,0,1,0,0|1,0,0]=3 6308 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb27487451 [0,1,0,1,0,0|1,0,0]=3 6309 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,1,0,0|1,0,0]=3 6310 B12R2.2028 CC1=CC(=O)c2ccccc21 Amb9783432 [0,1,0,1,0,0|0,0,0]=2 6311 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [0,1,0,1,0,0|0,0,2]=4 6312 B12R2.2028 CC1C=C(Cl)c2ccccc21 Amb17778911 [0,1,0,1,0,0|1,0,1]=4 6313 B12R2.2028 CC1CC(=O)c2ccccc21 Amb9747864 [0,1,0,1,0,0|0,0,2]=4 6314 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,1,0,1,0,0|1,0,1]=4 6315 B12R2.2028 CN1NC(=O)c2ccccc21 Amb22372319 [0,1,0,1,0,0|2,0,0]=4 6316 B12R2.2028 CN1SC(=O)c2ccccc21 Amb19664923 [0,1,0,1,0,0|2,0,0]=4 6317 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|0,0,2]=4 6318 B12R2.2028 C[C@@H]1OC(=O)c2ccccc21 Amb25892505 [0,1,0,1,0,0|1,0,1]=4 6319 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|0,0,2]=4 6320 B12R2.2028 Cc1cc(N)c2ccccn12 Amb27390603 [0,1,0,1,0,0|2,0,0]=4 6321 B12R2.2028 Cc1cn(Br)c2ccccc12 Amb28286948 [0,1,0,1,0,0|2,0,0]=4 6322 B12R2.2028 Cc1cn(C)c2ccccc12 Amb842585 [0,1,0,1,0,0|2,0,0]=4 6323 B12R2.2028 Clc1sc(Cl)c2ccccc12 Amb26355866 [0,1,0,1,0,0|2,0,0]=4 6324 B12R2.2028 Cn1cc(Br)c2ccccc21 Amb9210485 [0,1,0,1,0,0|2,0,0]=4 6325 B12R2.2028 Cn1cc(Cl)c2ccccc21 Amb28066534 [0,1,0,1,0,0|2,0,0]=4 6326 B12R2.2028 Cn1cc(N)c2ccccc21 Amb18064415 [0,1,0,1,0,0|2,0,0]=4 6327 B12R2.2028 Cn1cc(N)c2ccccc21 Amb33620933 [0,1,0,1,0,0|2,0,0]=4 6328 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [0,1,0,1,0,0|1,0,1]=4 6329 B12R2.2028 Cn1cc(S)c2ccccc21 Amb25721189 [0,1,0,1,0,0|1,1,0]=4 6330 B12R2.2028 N=C1NC(=N)c2ccccc21 Amb4410671 [0,1,0,1,0,0|2,0,0]=4 6331 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,1,0,1,0,0|1,0,0]=3 6332 B12R2.2028 N=C1NC(=S)c2ccccc21 Amb27268465 [0,1,0,1,0,0|1,1,0]=4 6333 B12R2.2028 NC1=NC(=O)c2ccccc21 Amb6252622 [0,1,0,1,0,0|1,0,0]=3 6334 B12R2.2028 NC1CC(=O)c2ccccc21 Amb17470381 [0,1,0,1,0,0|0,0,2]=4 6335 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|0,0,2]=4 6336 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,1,0,1,0,0|1,0,1]=4 6337 B12R2.2028 N[C@@H]1CC(=O)c2ccccc21 Amb27655630 [0,1,0,1,0,0|0,0,2]=4 6338 B12R2.2028 O=C1C=[N+]([O-])c2ccccc21 Amb17843025 [0,1,0,1,0,0|1,0,0]=3 6339 B12R2.2028 O=C1CC(=O)c2ccccc21 Amb1883008 [0,1,0,1,0,0|0,0,1]=3 6340 B12R2.2028 O=C1CC(=O)c2ncccc21 Amb28324367 [0,1,0,1,0,0|1,0,1]=4 6341 B12R2.2028 O=C1CC(Br)c2ccccc21 Amb10068269 [0,1,0,1,0,0|0,0,2]=4 6342 B12R2.2028 O=C1CC(Cl)c2ccccc21 Amb26945025 [0,1,0,1,0,0|0,0,2]=4 6343 B12R2.2028 O=C1CC(F)c2ccccc21 Amb26621970 [0,1,0,1,0,0|0,0,2]=4 6344 B12R2.2028 O=C1CC(I)c2ccccc21 Amb28289407 [0,1,0,1,0,0|0,0,2]=4 6345 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [0,1,0,1,0,0|0,0,2]=4 6346 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb1934252 [0,1,0,1,0,0|1,0,0]=3 6347 B12R2.2028 O=C1NC(=O)c2ccccc21 Amb33868500 [0,1,0,1,0,0|1,0,0]=3 6348 B12R2.2028 O=C1NC(=O)c2cnccc21 Amb2609991 [0,1,0,1,0,0|2,0,0]=4 6349 B12R2.2028 O=C1NC(=O)c2ncccc21 Amb2384085 [0,1,0,1,0,0|2,0,0]=4 6350 B12R2.2028 O=C1NC(Br)=C2C=CC=CN12 Amb27623626 [0,1,0,1,0,0|2,0,0]=4 6351 B12R2.2028 O=C1NC(F)c2ccccc21 Amb27165216 [0,1,0,1,0,0|1,0,1]=4 6352 B12R2.2028 O=C1NC(O)c2ccccc21 Amb17593710 [0,1,0,1,0,0|1,0,1]=4 6353 B12R2.2028 O=C1OC(=O)c2ccccc21 Amb17748796 [0,1,0,1,0,0|1,0,0]=3 6354 B12R2.2028 O=C1OC(=O)c2cnccc21 Amb2609992 [0,1,0,1,0,0|2,0,0]=4 6355 B12R2.2028 O=C1OC(=O)c2ncccc21 Amb1106402 [0,1,0,1,0,0|2,0,0]=4 6356 B12R2.2028 O=C1OC(Br)c2ccccc21 Amb2685476 [0,1,0,1,0,0|1,0,1]=4 6357 B12R2.2028 O=C1OC(Cl)c2ccccc21 Amb6297233 [0,1,0,1,0,0|1,0,1]=4 6358 B12R2.2028 O=C1OC(O)c2ccccc21 Amb10552913 [0,1,0,1,0,0|1,0,1]=4 6359 B12R2.2028 O=C1OC(O)c2ccccc21 Amb16226896 [0,1,0,1,0,0|1,0,1]=4 6360 B12R2.2028 O=C1OS(=O)c2ccccc21 Amb27755534 [0,1,0,1,0,0|2,0,0]=4 6361 B12R2.2028 O=C1O[IH2](Cl)c2ccccc21 Amb26012976 [0,1,0,1,0,0|2,0,0]=4 6362 B12R2.2028 O=C1O[IH2](O)c2ccccc21 Amb33548934 [0,1,0,1,0,0|2,0,0]=4 6363 B12R2.2028 O=C1SC(=O)c2ccccc21 Amb2610321 [0,1,0,1,0,0|1,0,0]=3 6364 B12R2.2028 O=C1SC(O)c2ccccc21 Amb28207229 [0,1,0,1,0,0|1,0,1]=4 6365 B12R2.2028 O=C1[CH-]C(=O)[n+]2ccccc21 Amb27823426 [0,1,0,1,0,0|1,0,1]=4 6366 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb28990952 [0,1,0,1,0,0|1,0,0]=3 6367 B12R2.2028 O=C1[N-]C(=O)c2ccccc21 Amb6365847 [0,1,0,1,0,0|1,0,0]=3 6368 B12R2.2028 O=c1ns(=O)c2ccccc12 Amb4138643 [0,1,0,1,0,0|2,0,0]=4 6369 B12R2.2028 S=C1NC(=S)c2ccccc21 Amb28241299 [0,1,0,1,0,0|1,1,0]=4 6370 B12R2.2075 O=C(c1ccccc1)C2C=N2 Amb28122438 [0,1,0,1,0,0|1,0,1]=4 6371 B12R2.32 BrCc1cc2ccccc2o1 Amb9175042 [0,1,0,1,0,0|1,0,1]=4 6372 B12R2.32 BrCc1cc2ccccc2s1 Amb25289923 [0,1,0,1,0,0|1,0,1]=4 6373 B12R2.32 C#Cc1cc2ccccc2s1 Amb25312447 [0,1,0,1,0,0|1,0,1]=4 6374 B12R2.32 C=Cc1cc2ccccc2s1 Amb28186077 [0,1,0,1,0,0|1,0,0]=3 6375 B12R2.32 C=Cc1cc2cccnc2s1 Amb28436507 [0,1,0,1,0,0|2,0,0]=4 6376 B12R2.32 C=Cc1nc2ccccc2o1 Amb24602813 [0,1,0,1,0,0|2,0,0]=4 6377 B12R2.32 C=Cc1nc2ccccc2s1 Amb24085073 [0,1,0,1,0,0|2,0,0]=4 6378 B12R2.32 CCC1=Cc2ccccc2C1 Amb6357923 [0,1,0,1,0,0|1,0,1]=4 6379 B12R2.32 CCc1cc2ccccc2o1 Amb6608886 [0,1,0,1,0,0|1,0,1]=4 6380 B12R2.32 CNc1cc2ccccc2s1 Amb27428924 [0,1,0,1,0,0|2,0,0]=4 6381 B12R2.32 COc1cc2ccccc2o1 Amb27962930 [0,1,0,1,0,0|2,0,0]=4 6382 B12R2.32 ClC=C1Cc2ccccc2C1 Amb8394322 [0,1,0,1,0,0|1,0,1]=4 6383 B12R2.32 ClCc1cc2ccccc2o1 Amb9004317 [0,1,0,1,0,0|1,0,1]=4 6384 B12R2.32 ClCc1cc2ccccc2s1 Amb16187137 [0,1,0,1,0,0|1,0,1]=4 6385 B12R2.32 N#CC1=Cc2ccccc2C1 Amb18643732 [0,1,0,1,0,0|1,0,1]=4 6386 B12R2.32 N#Cc1cc2ccccc2o1 Amb2704399 [0,1,0,1,0,0|1,0,1]=4 6387 B12R2.32 N#Cc1cc2ccccc2s1 Amb8396883 [0,1,0,1,0,0|1,0,1]=4 6388 B12R2.32 NCc1cc2ccccc2o1 Amb6271209 [0,1,0,1,0,0|1,0,1]=4 6389 B12R2.32 NCc1cc2ccccc2o1 Amb9176345 [0,1,0,1,0,0|1,0,1]=4 6390 B12R2.32 NCc1cc2ccccc2s1 Amb1801549 [0,1,0,1,0,0|1,0,1]=4 6391 B12R2.32 NCc1cc2ccccc2s1 Amb6344855 [0,1,0,1,0,0|1,0,1]=4 6392 B12R2.32 O=CC1=CC2C=CC=CC2=C1 Amb28145758 [0,1,0,1,0,0|0,0,1]=3 6393 B12R2.32 O=CC1=Cc2ccccc2C1 Amb18644150 [0,1,0,1,0,0|0,0,0]=2 6394 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [0,1,0,1,0,0|0,0,2]=4 6395 B12R2.32 O=CC1Cc2ccccc2N1 Amb27232668 [0,1,0,1,0,0|0,0,2]=4 6396 B12R2.32 O=CC1Oc2ccccc2O1 Amb27409489 [0,1,0,1,0,0|1,0,1]=4 6397 B12R2.32 O=CN1Cc2ccccc2C1 Amb26325036 [0,1,0,1,0,0|1,0,1]=4 6398 B12R2.32 O=Cc1cc2ccccc2o1 Amb1156936 [0,1,0,1,0,0|0,0,0]=2 6399 B12R2.32 O=Cc1cc2ccccc2s1 Amb2447439 [0,1,0,1,0,0|0,0,0]=2 6400 B12R2.32 O=Cc1cc2ccccn2c1 Amb26954646 [0,1,0,1,0,0|1,0,0]=3 6401 B12R2.32 O=Cc1cc2ccccn2n1 Amb10067626 [0,1,0,1,0,0|1,0,0]=3 6402 B12R2.32 O=Cc1cc2cccnc2o1 Amb18202346 [0,1,0,1,0,0|1,0,0]=3 6403 B12R2.32 O=Cc1cc2cccnc2s1 Amb2723081 [0,1,0,1,0,0|1,0,0]=3 6404 B12R2.32 O=Cc1cc2cccnn2c1 Amb27263695 [0,1,0,1,0,0|2,0,0]=4 6405 B12R2.32 O=Cc1cc2ccncc2s1 Amb13890511 [0,1,0,1,0,0|1,0,0]=3 6406 B12R2.32 O=Cc1cc2cnccc2o1 Amb18124811 [0,1,0,1,0,0|1,0,0]=3 6407 B12R2.32 O=Cc1cc2cnccc2s1 Amb18139393 [0,1,0,1,0,0|1,0,0]=3 6408 B12R2.32 O=Cc1cc2cnccn2c1 Amb18202369 [0,1,0,1,0,0|2,0,0]=4 6409 B12R2.32 O=Cc1cc2cncnc2s1 Amb18828876 [0,1,0,1,0,0|2,0,0]=4 6410 B12R2.32 O=Cc1cc2cnncc2o1 Amb18831405 [0,1,0,1,0,0|2,0,0]=4 6411 B12R2.32 O=Cc1cc2cnncc2s1 Amb18828877 [0,1,0,1,0,0|2,0,0]=4 6412 B12R2.32 O=Cc1cc2ncccc2o1 Amb18124810 [0,1,0,1,0,0|1,0,0]=3 6413 B12R2.32 O=Cc1cc2ncccc2s1 Amb18126370 [0,1,0,1,0,0|1,0,0]=3 6414 B12R2.32 O=Cc1cc2nccnc2o1 Amb18831410 [0,1,0,1,0,0|2,0,0]=4 6415 B12R2.32 O=Cc1cc2nccnc2s1 Amb2723506 [0,1,0,1,0,0|2,0,0]=4 6416 B12R2.32 O=Cc1cc2ncncc2o1 Amb18831403 [0,1,0,1,0,0|2,0,0]=4 6417 B12R2.32 O=Cc1cc2ncncc2s1 Amb18828881 [0,1,0,1,0,0|2,0,0]=4 6418 B12R2.32 O=Cc1cn2ccccc2n1 Amb2723503 [0,1,0,1,0,0|1,0,0]=3 6419 B12R2.32 O=Cc1cn2cccnc2n1 Amb8010289 [0,1,0,1,0,0|2,0,0]=4 6420 B12R2.32 O=Cc1cn2ccncc2n1 Amb8010290 [0,1,0,1,0,0|2,0,0]=4 6421 B12R2.32 O=Cc1cn2ncccc2n1 Amb18831428 [0,1,0,1,0,0|2,0,0]=4 6422 B12R2.32 O=Cc1nc2ccccc2o1 Amb2820047 [0,1,0,1,0,0|1,0,0]=3 6423 B12R2.32 O=Cc1nc2ccccc2s1 Amb2723094 [0,1,0,1,0,0|1,0,0]=3 6424 B12R2.32 O=Cc1nc2ccccn2n1 Amb22500855 [0,1,0,1,0,0|2,0,0]=4 6425 B12R2.32 O=Cc1nc2cccnc2o1 Amb18831406 [0,1,0,1,0,0|2,0,0]=4 6426 B12R2.32 O=Cc1nc2cccnc2s1 Amb18828883 [0,1,0,1,0,0|2,0,0]=4 6427 B12R2.32 O=Cc1nc2ccncc2o1 Amb18831409 [0,1,0,1,0,0|2,0,0]=4 6428 B12R2.32 O=Cc1nc2cnccc2s1 Amb18828882 [0,1,0,1,0,0|2,0,0]=4 6429 B12R2.32 O=Cc1nc2ncccc2s1 Amb18199777 [0,1,0,1,0,0|2,0,0]=4 6430 B12R2.32 OC=C1C=C2C=CC=CC2=C1 Amb27947827 [0,1,0,1,0,0|0,0,1]=3 6431 B12R2.32 OCc1cc2ccccc2o1 Amb1156663 [0,1,0,1,0,0|0,0,2]=4 6432 B12R2.32 OCc1cc2ccccc2s1 Amb2688765 [0,1,0,1,0,0|0,0,2]=4 6433 B12R2.32 O\C=C1\C=C2C=CC=CC2=N1 Amb26342374 [0,1,0,1,0,0|0,0,1]=3 6434 B12R2.32 SCc1cc2ccccc2o1 Amb32788142 [0,1,0,1,0,0|0,1,1]=4 6435 B12R2.32 SCc1cc2ccccc2s1 Amb26004107 [0,1,0,1,0,0|0,1,1]=4 6436 B12R2.196 Brc1csc2c(Br)cccc12 Amb28052826 [0,1,0,1,0,0|2,0,0]=4 6437 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,1,0,1,0,0|1,0,1]=4 6438 B12R2.196 Cc1cccc2c(Br)coc12 Amb27868647 [0,1,0,1,0,0|2,0,0]=4 6439 B12R2.196 Cc1cccc2c(Br)csc12 Amb26965893 [0,1,0,1,0,0|2,0,0]=4 6440 B12R2.196 Cc1cccc2c(N)csc12 Amb23402529 [0,1,0,1,0,0|2,0,0]=4 6441 B12R2.196 Cc1cccc2c1CCC2=O Amb4605923 [0,1,0,1,0,0|0,0,2]=4 6442 B12R2.196 Cc1cccc2c1CNC2=O Amb22229850 [0,1,0,1,0,0|1,0,1]=4 6443 B12R2.196 Cc1cccc2c1COC2=O Amb16231379 [0,1,0,1,0,0|1,0,1]=4 6444 B12R2.196 Cc1cccc2c1NCC2=O Amb18831418 [0,1,0,1,0,0|1,0,1]=4 6445 B12R2.196 Cc1cccc2c1NSC2=O Amb32673862 [0,1,0,1,0,0|2,0,0]=4 6446 B12R2.196 Cc1cccc2c1OCC2=O Amb33534388 [0,1,0,1,0,0|1,0,1]=4 6447 B12R2.196 Cc1cccc2c1ONC2=O Amb21857149 [0,1,0,1,0,0|2,0,0]=4 6448 B12R2.196 Cc1cccc2c1SCC2=O Amb18199753 [0,1,0,1,0,0|1,0,1]=4 6449 B12R2.196 Cc1cccc2c1SNC2=O Amb27966170 [0,1,0,1,0,0|2,0,0]=4 6450 B12R2.196 Cc1cccc2c1ccn2C Amb9768354 [0,1,0,1,0,0|2,0,0]=4 6451 B12R2.196 Cc1cccc2c1ccn2N Amb18202354 [0,1,0,1,0,0|2,0,0]=4 6452 B12R2.196 Cc1coc2c(Br)cccc12 Amb28245157 [0,1,0,1,0,0|2,0,0]=4 6453 B12R2.196 Cc1coc2c(I)cccc12 Amb27823712 [0,1,0,1,0,0|2,0,0]=4 6454 B12R2.196 Cc1coc2c(O)cccc12 Amb27948727 [0,1,0,1,0,0|2,0,0]=4 6455 B12R2.196 Cc1csc2c(Br)cccc12 Amb22500032 [0,1,0,1,0,0|2,0,0]=4 6456 B12R2.196 Cc1csc2c(N)cccc12 Amb18645930 [0,1,0,1,0,0|2,0,0]=4 6457 B12R2.196 Cc1csc2c(O)cccc12 Amb24097251 [0,1,0,1,0,0|2,0,0]=4 6458 B12R2.196 Clc1coc2c(Br)cccc12 Amb18745466 [0,1,0,1,0,0|2,0,0]=4 6459 B12R2.196 Cn1ccc2c(Br)cccc21 Amb2723832 [0,1,0,1,0,0|2,0,0]=4 6460 B12R2.196 Cn1ccc2c(Cl)cccc21 Amb22751213 [0,1,0,1,0,0|2,0,0]=4 6461 B12R2.196 Cn1ccc2c(F)cccc21 Amb25348450 [0,1,0,1,0,0|2,0,0]=4 6462 B12R2.196 Cn1ccc2c(I)cccc21 Amb22751214 [0,1,0,1,0,0|2,0,0]=4 6463 B12R2.196 Cn1ccc2c(N)cccc21 Amb22587189 [0,1,0,1,0,0|2,0,0]=4 6464 B12R2.196 Cn1ccc2c(N)cccc21 Amb22741110 [0,1,0,1,0,0|2,0,0]=4 6465 B12R2.196 Cn1ccc2c(N)cccc21 Amb8389568 [0,1,0,1,0,0|2,0,0]=4 6466 B12R2.196 Cn1ccc2c(O)cccc21 Amb13884900 [0,1,0,1,0,0|2,0,0]=4 6467 B12R2.196 Cn1ccc2c(S)cccc21 Amb26974874 [0,1,0,1,0,0|2,0,0]=4 6468 B12R2.196 Fc1cccc2c(Br)coc12 Amb28364458 [0,1,0,1,0,0|2,0,0]=4 6469 B12R2.196 Fc1cccc2c(Br)csc12 Amb25973316 [0,1,0,1,0,0|2,0,0]=4 6470 B12R2.196 Nc1cccc2c(=O)nnc12 Amb24082852 [0,1,0,1,0,0|2,0,0]=4 6471 B12R2.196 Nc1cccc2c(Br)coc12 Amb17571389 [0,1,0,1,0,0|2,0,0]=4 6472 B12R2.196 Nc1cccc2c(Br)csc12 Amb25893328 [0,1,0,1,0,0|2,0,0]=4 6473 B12R2.196 Nc1cccc2c1C=NC2=O Amb28456561 [0,1,0,1,0,0|1,0,0]=3 6474 B12R2.196 Nc1cccc2c1CCC2=O Amb10067615 [0,1,0,1,0,0|0,0,2]=4 6475 B12R2.196 Nc1cccc2c1CNC2=O Amb9677786 [0,1,0,1,0,0|1,0,1]=4 6476 B12R2.196 Nc1cccc2c1COC2=O Amb5718521 [0,1,0,1,0,0|1,0,1]=4 6477 B12R2.196 Nc1cccc2c1CSC2=O Amb28055839 [0,1,0,1,0,0|1,0,1]=4 6478 B12R2.196 Nc1cccc2c1OCC2=O Amb18202194 [0,1,0,1,0,0|1,0,1]=4 6479 B12R2.196 Nc1cccc2c1SCC2=O Amb18199701 [0,1,0,1,0,0|1,0,1]=4 6480 B12R2.196 Nc1csc2c(Br)cccc12 Amb23402524 [0,1,0,1,0,0|2,0,0]=4 6481 B12R2.196 Nc1csc2c(Cl)cccc12 Amb23403636 [0,1,0,1,0,0|2,0,0]=4 6482 B12R2.196 Nc1csc2c(F)cccc12 Amb23402525 [0,1,0,1,0,0|2,0,0]=4 6483 B12R2.196 Nc1csc2c(N)cccc12 Amb32708791 [0,1,0,1,0,0|2,0,0]=4 6484 B12R2.196 Nn1ccc2c(Cl)cccc21 Amb18827406 [0,1,0,1,0,0|2,0,0]=4 6485 B12R2.196 Nn1ccc2c(F)cccc21 Amb18201963 [0,1,0,1,0,0|2,0,0]=4 6486 B12R2.196 Nn1ccc2c(O)cccc21 Amb27782519 [0,1,0,1,0,0|2,0,0]=4 6487 B12R2.196 O=C1CCc2c(Br)cccc21 Amb6683468 [0,1,0,1,0,0|0,0,2]=4 6488 B12R2.196 O=C1CCc2c(Cl)cccc21 Amb2383535 [0,1,0,1,0,0|0,0,2]=4 6489 B12R2.196 O=C1CCc2c(F)cccc21 Amb2383536 [0,1,0,1,0,0|0,0,2]=4 6490 B12R2.196 O=C1CCc2c(O)cccc21 Amb1158068 [0,1,0,1,0,0|0,0,2]=4 6491 B12R2.196 O=C1CNc2c(F)cccc21 Amb18201774 [0,1,0,1,0,0|1,0,1]=4 6492 B12R2.196 O=C1COc2c(Br)cccc21 Amb33534390 [0,1,0,1,0,0|1,0,1]=4 6493 B12R2.196 O=C1COc2c(Cl)cccc21 Amb33534389 [0,1,0,1,0,0|1,0,1]=4 6494 B12R2.196 O=C1COc2c(F)cccc21 Amb2383546 [0,1,0,1,0,0|1,0,1]=4 6495 B12R2.196 O=C1COc2c(O)cccc21 Amb22490978 [0,1,0,1,0,0|1,0,1]=4 6496 B12R2.196 O=C1CSc2c(Br)cccc21 Amb18159421 [0,1,0,1,0,0|1,0,1]=4 6497 B12R2.196 O=C1CSc2c(Cl)cccc21 Amb18822582 [0,1,0,1,0,0|1,0,1]=4 6498 B12R2.196 O=C1CSc2c(F)cccc21 Amb23597480 [0,1,0,1,0,0|1,0,1]=4 6499 B12R2.196 O=C1NCc2c(Br)cccc21 Amb15693064 [0,1,0,1,0,0|1,0,1]=4 6500 B12R2.196 O=C1NCc2c(Cl)cccc21 Amb21858351 [0,1,0,1,0,0|1,0,1]=4 6501 B12R2.196 O=C1NCc2c(F)cccc21 Amb22008629 [0,1,0,1,0,0|1,0,1]=4 6502 B12R2.196 O=C1NCc2c(O)cccc21 Amb21858279 [0,1,0,1,0,0|1,0,1]=4 6503 B12R2.196 O=C1NNc2c(Br)cccc21 Amb22170435 [0,1,0,1,0,0|2,0,0]=4 6504 B12R2.196 O=C1NNc2c(F)cccc21 Amb22738649 [0,1,0,1,0,0|2,0,0]=4 6505 B12R2.196 O=C1NOc2c(Cl)cccc21 Amb22489850 [0,1,0,1,0,0|2,0,0]=4 6506 B12R2.196 O=C1NOc2c(F)cccc21 Amb21857207 [0,1,0,1,0,0|2,0,0]=4 6507 B12R2.196 O=C1NOc2c(I)cccc21 Amb27813751 [0,1,0,1,0,0|2,0,0]=4 6508 B12R2.196 O=C1NSc2c(Br)cccc21 Amb32710021 [0,1,0,1,0,0|2,0,0]=4 6509 B12R2.196 O=C1NSc2c(Cl)cccc21 Amb26570552 [0,1,0,1,0,0|2,0,0]=4 6510 B12R2.196 O=C1NSc2c(F)cccc21 Amb27670276 [0,1,0,1,0,0|2,0,0]=4 6511 B12R2.196 O=C1OCc2c(Br)cccc21 Amb6296519 [0,1,0,1,0,0|1,0,1]=4 6512 B12R2.196 O=C1OCc2c(Cl)cccc21 Amb16232645 [0,1,0,1,0,0|1,0,1]=4 6513 B12R2.196 O=C1OCc2c(F)cccc21 Amb22756851 [0,1,0,1,0,0|1,0,1]=4 6514 B12R2.196 O=C1SNc2c(F)cccc21 Amb32673867 [0,1,0,1,0,0|2,0,0]=4 6515 B12R2.196 Oc1cccc2c(Cl)coc12 Amb28368780 [0,1,0,1,0,0|2,0,0]=4 6516 B12R2.196 Oc1cccc2c1ccn2O Amb28051708 [0,1,0,1,0,0|1,0,1]=4 6517 B12R2.196 Sc1csc2c(Br)cccc12 Amb27174387 [0,1,0,1,0,0|1,1,0]=4 6518 B12R2.196 Sc1csc2c(Cl)cccc12 Amb27847193 [0,1,0,1,0,0|1,1,0]=4 6519 B12R2.225 Clc1ccccc1C=C2CC2 Amb19515482 [0,1,0,1,0,0|1,0,1]=4 6520 B12R2.225 Fc1ccccc1C=C2CC2 Amb25714200 [0,1,0,1,0,0|1,0,1]=4 6521 B12R2.203 Brc1cccc2occ(Br)c12 Amb27953022 [0,1,0,1,0,0|2,0,0]=4 6522 B12R2.203 Brc1cccc2scc(Br)c12 Amb28287812 [0,1,0,1,0,0|2,0,0]=4 6523 B12R2.203 Brc1cccc2scc(I)c12 Amb28255791 [0,1,0,1,0,0|2,0,0]=4 6524 B12R2.203 CC1=CCc2cccc(C)c21 Amb27951780 [0,1,0,1,0,0|1,0,1]=4 6525 B12R2.203 Cc1cccc2c1C(=O)CC2 Amb16232631 [0,1,0,1,0,0|0,0,2]=4 6526 B12R2.203 Cc1cccc2c1C(=O)CO2 Amb18202264 [0,1,0,1,0,0|1,0,1]=4 6527 B12R2.203 Cc1cccc2c1C(=O)CS2 Amb18199755 [0,1,0,1,0,0|1,0,1]=4 6528 B12R2.203 Cc1cccc2c1C(=O)NC2 Amb22230158 [0,1,0,1,0,0|1,0,1]=4 6529 B12R2.203 Cc1cccc2c1C(=O)OC2 Amb2608975 [0,1,0,1,0,0|1,0,1]=4 6530 B12R2.203 Cc1cccc2c1C(=O)SN2 Amb32673870 [0,1,0,1,0,0|2,0,0]=4 6531 B12R2.203 Cc1cccc2c1C(N)C=C2 Amb17470377 [0,1,0,1,0,0|1,0,1]=4 6532 B12R2.203 Cc1cccc2ccc(C)n12 Amb25180426 [0,1,0,1,0,0|2,0,0]=4 6533 B12R2.203 Cc1cccc2ccn(C)c12 Amb24729400 [0,1,0,1,0,0|2,0,0]=4 6534 B12R2.203 Cc1cccc2occ(Br)c12 Amb18176125 [0,1,0,1,0,0|2,0,0]=4 6535 B12R2.203 Cc1cccc2scc(Br)c12 Amb28368810 [0,1,0,1,0,0|2,0,0]=4 6536 B12R2.203 Cc1cccc2scc(Cl)c12 Amb22498045 [0,1,0,1,0,0|2,0,0]=4 6537 B12R2.203 Cc1cccc2scc(N)c12 Amb23402526 [0,1,0,1,0,0|2,0,0]=4 6538 B12R2.203 Cc1coc2cccc(Br)c12 Amb18773208 [0,1,0,1,0,0|2,0,0]=4 6539 B12R2.203 Cc1coc2cccc(N)c12 Amb18202307 [0,1,0,1,0,0|2,0,0]=4 6540 B12R2.203 Cc1csc2cccc(Br)c12 Amb28128399 [0,1,0,1,0,0|2,0,0]=4 6541 B12R2.203 Cc1csc2cccc(Cl)c12 Amb27273547 [0,1,0,1,0,0|2,0,0]=4 6542 B12R2.203 Cc1csc2cccc(O)c12 Amb18126406 [0,1,0,1,0,0|2,0,0]=4 6543 B12R2.203 Clc1cccc2occ(Br)c12 Amb18745540 [0,1,0,1,0,0|2,0,0]=4 6544 B12R2.203 Clc1coc2cccc(Br)c12 Amb18745475 [0,1,0,1,0,0|2,0,0]=4 6545 B12R2.203 Cn1ccc2cccc(Br)c21 Amb6572377 [0,1,0,1,0,0|2,0,0]=4 6546 B12R2.203 Cn1ccc2cccc(Cl)c21 Amb24532946 [0,1,0,1,0,0|2,0,0]=4 6547 B12R2.203 Cn1ccc2cccc(F)c21 Amb24444091 [0,1,0,1,0,0|2,0,0]=4 6548 B12R2.203 Cn1ccc2cccc(I)c21 Amb28435608 [0,1,0,1,0,0|2,0,0]=4 6549 B12R2.203 Cn1ccc2cccc(N)c21 Amb24671296 [0,1,0,1,0,0|2,0,0]=4 6550 B12R2.203 Cn1ccc2cccc(O)c21 Amb25892483 [0,1,0,1,0,0|2,0,0]=4 6551 B12R2.203 Cn1ccc2cccc(S)c21 Amb26537527 [0,1,0,1,0,0|2,0,0]=4 6552 B12R2.203 Fc1cccc2scc(Br)c12 Amb24679290 [0,1,0,1,0,0|2,0,0]=4 6553 B12R2.203 NC1C=Cc2cccc(Cl)c21 Amb17470461 [0,1,0,1,0,0|1,0,1]=4 6554 B12R2.203 NC1C=Cc2cccc(F)c21 Amb17470386 [0,1,0,1,0,0|1,0,1]=4 6555 B12R2.203 Nc1cccc2c1C(=O)CC2 Amb10603890 [0,1,0,1,0,0|0,0,2]=4 6556 B12R2.203 Nc1cccc2c1C(=O)CO2 Amb27969163 [0,1,0,1,0,0|1,0,1]=4 6557 B12R2.203 Nc1cccc2c1C(=O)NC2 Amb2372743 [0,1,0,1,0,0|1,0,1]=4 6558 B12R2.203 Nc1cccc2c1C(=O)OC2 Amb16232974 [0,1,0,1,0,0|1,0,1]=4 6559 B12R2.203 Nc1cccc2scc(Br)c12 Amb26391250 [0,1,0,1,0,0|2,0,0]=4 6560 B12R2.203 Nc1csc2cccc(Cl)c12 Amb23403646 [0,1,0,1,0,0|2,0,0]=4 6561 B12R2.203 Nc1csc2cccc(F)c12 Amb23403637 [0,1,0,1,0,0|2,0,0]=4 6562 B12R2.203 Nc1csc2cccc(O)c12 Amb28321077 [0,1,0,1,0,0|2,0,0]=4 6563 B12R2.203 Nn1ccc2cccc(Br)c21 Amb18176113 [0,1,0,1,0,0|2,0,0]=4 6564 B12R2.203 Nn1ccc2cccc(Cl)c21 Amb18827405 [0,1,0,1,0,0|2,0,0]=4 6565 B12R2.203 O=C1C=Cc2cccc(O)c21 Amb25232216 [0,1,0,1,0,0|0,0,0]=2 6566 B12R2.203 O=C1CCc2cccc(Br)c21 Amb16232616 [0,1,0,1,0,0|0,0,2]=4 6567 B12R2.203 O=C1CCc2cccc(Cl)c21 Amb6296539 [0,1,0,1,0,0|0,0,2]=4 6568 B12R2.203 O=C1CCc2cccc(F)c21 Amb10603926 [0,1,0,1,0,0|0,0,2]=4 6569 B12R2.203 O=C1CCc2cccc(O)c21 Amb6296368 [0,1,0,1,0,0|0,0,2]=4 6570 B12R2.203 O=C1CCc2cccc(S)c21 Amb27949135 [0,1,0,1,0,0|0,0,2]=4 6571 B12R2.203 O=C1COc2cccc(Br)c21 Amb16233082 [0,1,0,1,0,0|1,0,1]=4 6572 B12R2.203 O=C1COc2cccc(Cl)c21 Amb18199151 [0,1,0,1,0,0|1,0,1]=4 6573 B12R2.203 O=C1COc2cccc(F)c21 Amb10840768 [0,1,0,1,0,0|1,0,1]=4 6574 B12R2.203 O=C1COc2cccc(O)c21 Amb18125055 [0,1,0,1,0,0|1,0,1]=4 6575 B12R2.203 O=C1CSc2cccc(Cl)c21 Amb18822610 [0,1,0,1,0,0|1,0,1]=4 6576 B12R2.203 O=C1CSc2cccc(I)c21 Amb27239169 [0,1,0,1,0,0|1,0,1]=4 6577 B12R2.203 O=C1CSc2cccc(O)c21 Amb28436434 [0,1,0,1,0,0|1,0,1]=4 6578 B12R2.203 O=C1N=Cc2cccc(Cl)c21 Amb22015253 [0,1,0,1,0,0|1,0,0]=3 6579 B12R2.203 O=C1N=Cc2cccc(I)c21 Amb22015271 [0,1,0,1,0,0|1,0,0]=3 6580 B12R2.203 O=C1NCc2cccc(Br)c21 Amb21858350 [0,1,0,1,0,0|1,0,1]=4 6581 B12R2.203 O=C1NCc2cccc(Cl)c21 Amb21963125 [0,1,0,1,0,0|1,0,1]=4 6582 B12R2.203 O=C1NCc2cccc(F)c21 Amb23401773 [0,1,0,1,0,0|1,0,1]=4 6583 B12R2.203 O=C1NCc2cccc(I)c21 Amb21963325 [0,1,0,1,0,0|1,0,1]=4 6584 B12R2.203 O=C1NCc2cccc(O)c21 Amb22008617 [0,1,0,1,0,0|1,0,1]=4 6585 B12R2.203 O=C1NNc2cccc(Br)c21 Amb22497381 [0,1,0,1,0,0|2,0,0]=4 6586 B12R2.203 O=C1NNc2cccc(Cl)c21 Amb19373186 [0,1,0,1,0,0|2,0,0]=4 6587 B12R2.203 O=C1NOc2cccc(Br)c21 Amb22494926 [0,1,0,1,0,0|2,0,0]=4 6588 B12R2.203 O=C1NOc2cccc(F)c21 Amb21857210 [0,1,0,1,0,0|2,0,0]=4 6589 B12R2.203 O=C1NSc2cccc(Br)c21 Amb32710018 [0,1,0,1,0,0|2,0,0]=4 6590 B12R2.203 O=C1NSc2cccc(Cl)c21 Amb27445101 [0,1,0,1,0,0|2,0,0]=4 6591 B12R2.203 O=C1NSc2cccc(F)c21 Amb24756929 [0,1,0,1,0,0|2,0,0]=4 6592 B12R2.203 O=C1OCc2cccc(F)c21 Amb4016876 [0,1,0,1,0,0|1,0,1]=4 6593 B12R2.203 O=C1OCc2cccc(I)c21 Amb28124350 [0,1,0,1,0,0|1,0,1]=4 6594 B12R2.203 O=C1OCc2cccc(O)c21 Amb25152698 [0,1,0,1,0,0|1,0,1]=4 6595 B12R2.203 O=C1ONc2cccc(F)c21 Amb27840267 [0,1,0,1,0,0|2,0,0]=4 6596 B12R2.203 Oc1cccc2scc(Br)c12 Amb25051256 [0,1,0,1,0,0|2,0,0]=4 6597 B12R2.203 Oc1cccc2scc(Cl)c12 Amb24606514 [0,1,0,1,0,0|2,0,0]=4 6598 B12R2.612 Brc1ccc2c(Br)csc2c1 Amb27162342 [0,1,0,1,0,0|2,0,0]=4 6599 B12R2.612 CC1=CCc2cc(Br)ccc21 Amb27231603 [0,1,0,1,0,0|1,0,1]=4 6600 B12R2.612 CC1=CCc2cc(Cl)ccc21 Amb27849462 [0,1,0,1,0,0|1,0,1]=4 6601 B12R2.612 CC1C=Cc2cc(F)ccc21 Amb28054860 [0,1,0,1,0,0|1,0,1]=4 6602 B12R2.612 C[C@@H]1C=Cc2cc(F)ccc21 Amb24533053 [0,1,0,1,0,0|1,0,1]=4 6603 B12R2.612 C[C@H]1C=Cc2cc(F)ccc21 Amb25106906 [0,1,0,1,0,0|1,0,1]=4 6604 B12R2.612 Cc1ccc2c(C)csc2c1 Amb26552219 [0,1,0,1,0,0|2,0,0]=4 6605 B12R2.612 Cc1ccc2c(N)csc2c1 Amb23402528 [0,1,0,1,0,0|2,0,0]=4 6606 B12R2.612 Cc1ccc2c(c1)C=CC2N Amb17470376 [0,1,0,1,0,0|1,0,1]=4 6607 B12R2.612 Cc1ccc2c(c1)CCC2=O Amb6667023 [0,1,0,1,0,0|0,0,2]=4 6608 B12R2.612 Cc1ccc2c(c1)CNC2=O Amb20248676 [0,1,0,1,0,0|1,0,1]=4 6609 B12R2.612 Cc1ccc2c(c1)COC2=O Amb16232630 [0,1,0,1,0,0|1,0,1]=4 6610 B12R2.612 Cc1ccc2c(c1)OCC2=O Amb18202265 [0,1,0,1,0,0|1,0,1]=4 6611 B12R2.612 Cc1ccc2c(c1)SCC2=O Amb18199754 [0,1,0,1,0,0|1,0,1]=4 6612 B12R2.612 Cc1ccc2c(c1)SNC2=O Amb26942754 [0,1,0,1,0,0|2,0,0]=4 6613 B12R2.612 Cc1ccc2c(ccn2C)c1 Amb9768430 [0,1,0,1,0,0|2,0,0]=4 6614 B12R2.612 Cc1ccc2c(ccn2N)c1 Amb18202355 [0,1,0,1,0,0|2,0,0]=4 6615 B12R2.612 Cc1ccn2c(C)ccc2c1 Amb27634061 [0,1,0,1,0,0|2,0,0]=4 6616 B12R2.612 Cc1coc2cc(Br)ccc12 Amb28074278 [0,1,0,1,0,0|2,0,0]=4 6617 B12R2.612 Cc1csc2cc(Br)ccc12 Amb25133721 [0,1,0,1,0,0|2,0,0]=4 6618 B12R2.612 Cc1csc2cc(Cl)ccc12 Amb20620743 [0,1,0,1,0,0|2,0,0]=4 6619 B12R2.612 Cc1csc2cc(F)ccc12 Amb27965848 [0,1,0,1,0,0|2,0,0]=4 6620 B12R2.612 Cc1csc2cc(O)ccc12 Amb28202170 [0,1,0,1,0,0|2,0,0]=4 6621 B12R2.612 Clc1ccc2c(Br)coc2c1 Amb18160080 [0,1,0,1,0,0|2,0,0]=4 6622 B12R2.612 Clc1ccc2c(Cl)csc2c1 Amb27751229 [0,1,0,1,0,0|2,0,0]=4 6623 B12R2.612 Clc1coc2cc(Br)ccc12 Amb18745541 [0,1,0,1,0,0|2,0,0]=4 6624 B12R2.612 Clc1csc2cc(Br)ccc12 Amb27815801 [0,1,0,1,0,0|2,0,0]=4 6625 B12R2.612 Clc1csc2cc(I)ccc12 Amb28048641 [0,1,0,1,0,0|2,0,0]=4 6626 B12R2.612 Cln1ccc2cc(Br)ccc21 Amb28252262 [0,1,0,1,0,0|2,0,0]=4 6627 B12R2.612 Cn1ccc2cc(Br)ccc21 Amb2092066 [0,1,0,1,0,0|2,0,0]=4 6628 B12R2.612 Cn1ccc2cc(Cl)ccc21 Amb20241507 [0,1,0,1,0,0|2,0,0]=4 6629 B12R2.612 Cn1ccc2cc(F)ccc21 Amb9768413 [0,1,0,1,0,0|2,0,0]=4 6630 B12R2.612 Cn1ccc2cc(N)ccc21 Amb2721823 [0,1,0,1,0,0|2,0,0]=4 6631 B12R2.612 Cn1ccc2cc(O)ccc21 Amb21864770 [0,1,0,1,0,0|2,0,0]=4 6632 B12R2.612 Cn1ccc2cc(S)ccc21 Amb25151402 [0,1,0,1,0,0|2,0,0]=4 6633 B12R2.612 NC1C=Cc2cc(Cl)ccc21 Amb17470460 [0,1,0,1,0,0|1,0,1]=4 6634 B12R2.612 NC1C=Cc2cc(F)ccc21 Amb17470385 [0,1,0,1,0,0|1,0,1]=4 6635 B12R2.612 Nc1ccc2c(Cl)coc2c1 Amb27446794 [0,1,0,1,0,0|2,0,0]=4 6636 B12R2.612 Nc1ccc2c(c1)CCC2=O Amb1348304 [0,1,0,1,0,0|0,0,2]=4 6637 B12R2.612 Nc1ccc2c(c1)CNC2=O Amb16233788 [0,1,0,1,0,0|1,0,1]=4 6638 B12R2.612 Nc1ccc2c(c1)COC2=O Amb1101070 [0,1,0,1,0,0|1,0,1]=4 6639 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb21964765 [0,1,0,1,0,0|2,0,0]=4 6640 B12R2.612 Nc1ccc2c(c1)NNC2=O Amb22008653 [0,1,0,1,0,0|2,0,0]=4 6641 B12R2.612 Nc1ccc2c(c1)NOC2=O Amb27404538 [0,1,0,1,0,0|2,0,0]=4 6642 B12R2.612 Nc1ccc2c(c1)OCC2=O Amb26332312 [0,1,0,1,0,0|1,0,1]=4 6643 B12R2.612 Nc1ccc2c(c1)ONC2=O Amb28399452 [0,1,0,1,0,0|2,0,0]=4 6644 B12R2.612 Nc1ccc2c(c1)SNC2=O Amb33548429 [0,1,0,1,0,0|2,0,0]=4 6645 B12R2.612 Nc1csc2cc(Cl)ccc12 Amb23403635 [0,1,0,1,0,0|2,0,0]=4 6646 B12R2.612 Nc1csc2cc(O)ccc12 Amb25825529 [0,1,0,1,0,0|2,0,0]=4 6647 B12R2.612 Nn1ccc2cc(Cl)ccc21 Amb18199547 [0,1,0,1,0,0|2,0,0]=4 6648 B12R2.612 Nn1ccc2cc(F)ccc21 Amb18201964 [0,1,0,1,0,0|2,0,0]=4 6649 B12R2.612 O=C1CCc2cc(Br)ccc21 Amb2685276 [0,1,0,1,0,0|0,0,2]=4 6650 B12R2.612 O=C1CCc2cc(Cl)ccc21 Amb2686124 [0,1,0,1,0,0|0,0,2]=4 6651 B12R2.612 O=C1CCc2cc(F)ccc21 Amb2688113 [0,1,0,1,0,0|0,0,2]=4 6652 B12R2.612 O=C1CCc2cc(I)ccc21 Amb10602519 [0,1,0,1,0,0|0,0,2]=4 6653 B12R2.612 O=C1CCc2cc(O)ccc21 Amb2610677 [0,1,0,1,0,0|0,0,2]=4 6654 B12R2.612 O=C1CCc2cc(S)ccc21 Amb24458838 [0,1,0,1,0,0|0,0,2]=4 6655 B12R2.612 O=C1CNc2cc(Br)ccc21 Amb27623314 [0,1,0,1,0,0|1,0,1]=4 6656 B12R2.612 O=C1COc2cc(Br)ccc21 Amb10070946 [0,1,0,1,0,0|1,0,1]=4 6657 B12R2.612 O=C1COc2cc(Cl)ccc21 Amb10070947 [0,1,0,1,0,0|1,0,1]=4 6658 B12R2.612 O=C1COc2cc(F)ccc21 Amb10840769 [0,1,0,1,0,0|1,0,1]=4 6659 B12R2.612 O=C1COc2cc(I)ccc21 Amb16233079 [0,1,0,1,0,0|1,0,1]=4 6660 B12R2.612 O=C1COc2cc(O)ccc21 Amb1155533 [0,1,0,1,0,0|1,0,1]=4 6661 B12R2.612 O=C1CSc2cc(Br)ccc21 Amb26632914 [0,1,0,1,0,0|1,0,1]=4 6662 B12R2.612 O=C1CSc2cc(Cl)ccc21 Amb4062420 [0,1,0,1,0,0|1,0,1]=4 6663 B12R2.612 O=C1CSc2cc(I)ccc21 Amb27441580 [0,1,0,1,0,0|1,0,1]=4 6664 B12R2.612 O=C1N=Cc2cc(F)ccc21 Amb22001920 [0,1,0,1,0,0|1,0,0]=3 6665 B12R2.612 O=C1N=Cc2cc(I)ccc21 Amb22015264 [0,1,0,1,0,0|1,0,0]=3 6666 B12R2.612 O=C1N=Cc2cc(O)ccc21 Amb22015151 [0,1,0,1,0,0|1,0,0]=3 6667 B12R2.612 O=C1NCc2cc(Br)ccc21 Amb10602848 [0,1,0,1,0,0|1,0,1]=4 6668 B12R2.612 O=C1NCc2cc(Cl)ccc21 Amb13883708 [0,1,0,1,0,0|1,0,1]=4 6669 B12R2.612 O=C1NCc2cc(F)ccc21 Amb22371476 [0,1,0,1,0,0|1,0,1]=4 6670 B12R2.612 O=C1NCc2cc(F)ccc21 Amb33716954 [0,1,0,1,0,0|1,0,1]=4 6671 B12R2.612 O=C1NCc2cc(I)ccc21 Amb21963157 [0,1,0,1,0,0|1,0,1]=4 6672 B12R2.612 O=C1NCc2cc(O)ccc21 Amb21857015 [0,1,0,1,0,0|1,0,1]=4 6673 B12R2.612 O=C1NNc2cc(Cl)ccc21 Amb22491677 [0,1,0,1,0,0|2,0,0]=4 6674 B12R2.612 O=C1NNc2cc(F)ccc21 Amb21864861 [0,1,0,1,0,0|2,0,0]=4 6675 B12R2.612 O=C1NOc2cc(Br)ccc21 Amb21856452 [0,1,0,1,0,0|2,0,0]=4 6676 B12R2.612 O=C1NOc2cc(Cl)ccc21 Amb22015207 [0,1,0,1,0,0|2,0,0]=4 6677 B12R2.612 O=C1NOc2cc(O)ccc21 Amb24427281 [0,1,0,1,0,0|2,0,0]=4 6678 B12R2.612 O=C1NSc2cc(Br)ccc21 Amb25863424 [0,1,0,1,0,0|2,0,0]=4 6679 B12R2.612 O=C1NSc2cc(Cl)ccc21 Amb19131195 [0,1,0,1,0,0|2,0,0]=4 6680 B12R2.612 O=C1NSc2cc(F)ccc21 Amb17933791 [0,1,0,1,0,0|2,0,0]=4 6681 B12R2.612 O=C1OCc2cc(Br)ccc21 Amb2617435 [0,1,0,1,0,0|1,0,1]=4 6682 B12R2.612 O=C1OCc2cc(Cl)ccc21 Amb16232644 [0,1,0,1,0,0|1,0,1]=4 6683 B12R2.612 O=C1OCc2cc(F)ccc21 Amb16232978 [0,1,0,1,0,0|1,0,1]=4 6684 B12R2.612 O=C1OCc2cc(I)ccc21 Amb16232979 [0,1,0,1,0,0|1,0,1]=4 6685 B12R2.612 O=C1OCc2cc(O)ccc21 Amb5718517 [0,1,0,1,0,0|1,0,1]=4 6686 B12R2.612 O=C1ONc2cc(Cl)ccc21 Amb26858350 [0,1,0,1,0,0|2,0,0]=4 6687 B12R2.612 O=C1ONc2cc(F)ccc21 Amb27488717 [0,1,0,1,0,0|2,0,0]=4 6688 B12R2.612 O=C1SNc2cc(F)ccc21 Amb32673866 [0,1,0,1,0,0|2,0,0]=4 6689 B12R2.612 O=s1cnc2cc(Cl)ccc21 Amb33513192 [0,1,0,1,0,0|2,0,0]=4 6690 B12R2.612 Oc1ccc2c(Br)csc2c1 Amb32708787 [0,1,0,1,0,0|2,0,0]=4 6691 B12R2.612 Oc1ccc2c(O)coc2c1 Amb24061705 [0,1,0,1,0,0|1,0,1]=4 6692 B12R2.612 Oc1csc2cc(Br)ccc12 Amb28199014 [0,1,0,1,0,0|1,0,1]=4 6693 B12R2.612 Oc1csc2cc(F)ccc12 Amb27799987 [0,1,0,1,0,0|1,0,1]=4 6694 B12R2.612 On1ccc2cc(F)ccc21 Amb28072848 [0,1,0,1,0,0|1,0,1]=4 6695 B12R2.1286 Fc1cccc(C=C2CC2)c1 Amb24432667 [0,1,0,1,0,0|1,0,1]=4 6696 B12R2.1 BrCc1coc2ccccc12 Amb23401826 [0,1,0,1,0,0|1,0,1]=4 6697 B12R2.1 BrCc1csc2ccccc12 Amb10609548 [0,1,0,1,0,0|1,0,1]=4 6698 B12R2.1 C#CC1=CCc2ccccc21 Amb25921455 [0,1,0,1,0,0|1,0,1]=4 6699 B12R2.1 C#Cc1coc2ccccc12 Amb27468515 [0,1,0,1,0,0|1,0,1]=4 6700 B12R2.1 C=CC1C=Nc2ccccc21 Amb28368575 [0,1,0,1,0,0|1,0,1]=4 6701 B12R2.1 C=Cc1cnc2ccccn12 Amb17601404 [0,1,0,1,0,0|2,0,0]=4 6702 B12R2.1 C=Cc1cnn2ccccc12 Amb23449230 [0,1,0,1,0,0|2,0,0]=4 6703 B12R2.1 C=Cc1csc2ccccc12 Amb27409855 [0,1,0,1,0,0|1,0,0]=3 6704 B12R2.1 C=Cc1onc2ccccc12 Amb27208307 [0,1,0,1,0,0|2,0,0]=4 6705 B12R2.1 C=Cn1cnc2ccccc21 Amb1035881 [0,1,0,1,0,0|2,0,0]=4 6706 B12R2.1 CCC1=CCc2ccccc21 Amb27227340 [0,1,0,1,0,0|1,0,1]=4 6707 B12R2.1 CCc1ccn2ccccc12 Amb27977884 [0,1,0,1,0,0|2,0,0]=4 6708 B12R2.1 CCc1coc2ccccc12 Amb27792683 [0,1,0,1,0,0|1,0,1]=4 6709 B12R2.1 CCn1ccc2ccccc21 Amb3708000 [0,1,0,1,0,0|1,0,1]=4 6710 B12R2.1 CNc1coc2ccccc12 Amb26039834 [0,1,0,1,0,0|2,0,0]=4 6711 B12R2.1 CNc1csc2ccccc12 Amb23403655 [0,1,0,1,0,0|2,0,0]=4 6712 B12R2.1 COC1=CCc2ccccc21 Amb17778910 [0,1,0,1,0,0|0,0,2]=4 6713 B12R2.1 COc1ccn2ccccc12 Amb28282776 [0,1,0,1,0,0|1,0,1]=4 6714 B12R2.1 COc1csc2ccccc12 Amb28320302 [0,1,0,1,0,0|1,0,1]=4 6715 B12R2.1 C\C=C1\C=Cc2ccccc21 Amb25322411 [0,1,0,1,0,0|1,0,0]=3 6716 B12R2.1 C\C=C1\CNc2ccccc21 Amb27967275 [0,1,0,1,0,0|1,0,1]=4 6717 B12R2.1 ClCc1coc2ccccc12 Amb5716310 [0,1,0,1,0,0|1,0,1]=4 6718 B12R2.1 ClCc1csc2ccccc12 Amb7808742 [0,1,0,1,0,0|1,0,1]=4 6719 B12R2.1 FCc1coc2ccccc12 Amb27186252 [0,1,0,1,0,0|1,0,1]=4 6720 B12R2.1 FCn1ccc2ccccc21 Amb27848541 [0,1,0,1,0,0|1,0,1]=4 6721 B12R2.1 N#CC1=CCc2ccccc21 Amb17231929 [0,1,0,1,0,0|1,0,1]=4 6722 B12R2.1 N#Cc1ccn2ccccc12 Amb10569184 [0,1,0,1,0,0|2,0,0]=4 6723 B12R2.1 N#Cc1coc2ccccc12 Amb10808759 [0,1,0,1,0,0|1,0,1]=4 6724 B12R2.1 N#Cc1csc2ccccc12 Amb18182421 [0,1,0,1,0,0|1,0,1]=4 6725 B12R2.1 NCC1=CCc2ccccc21 Amb18560208 [0,1,0,1,0,0|1,0,1]=4 6726 B12R2.1 NCC1C=Cc2ccccc21 Amb17470375 [0,1,0,1,0,0|1,0,1]=4 6727 B12R2.1 NCc1coc2ccccc12 Amb19373967 [0,1,0,1,0,0|1,0,1]=4 6728 B12R2.1 NCc1coc2ccccc12 Amb19649824 [0,1,0,1,0,0|1,0,1]=4 6729 B12R2.1 NCc1csc2ccccc12 Amb2723184 [0,1,0,1,0,0|1,0,1]=4 6730 B12R2.1 NCc1csc2ccccc12 Amb3941423 [0,1,0,1,0,0|1,0,1]=4 6731 B12R2.1 NNc1coc2ccccc12 Amb35704215 [0,1,0,1,0,0|2,0,0]=4 6732 B12R2.1 O=CC1=CNN2C=CC=CC12 Amb18202252 [0,1,0,1,0,0|1,0,1]=4 6733 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,1,0,1,0,0|0,0,1]=3 6734 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|0,0,2]=4 6735 B12R2.1 O=CC1CSc2ccccc21 Amb27456947 [0,1,0,1,0,0|0,0,2]=4 6736 B12R2.1 O=CC1OCc2ccccc21 Amb27225913 [0,1,0,1,0,0|0,0,2]=4 6737 B12R2.1 O=C[C@@H]1CCc2ccccc21 Amb28319720 [0,1,0,1,0,0|0,0,2]=4 6738 B12R2.1 O=C[C@H]1CCc2ccccc21 Amb27164668 [0,1,0,1,0,0|0,0,2]=4 6739 B12R2.1 O=Cc1ccc2ccccn12 Amb18559296 [0,1,0,1,0,0|1,0,0]=3 6740 B12R2.1 O=Cc1ccc2cnccn12 Amb18202370 [0,1,0,1,0,0|2,0,0]=4 6741 B12R2.1 O=Cc1ccn2ccccc12 Amb24089168 [0,1,0,1,0,0|1,0,0]=3 6742 B12R2.1 O=Cc1cnc2ccccn12 Amb9901908 [0,1,0,1,0,0|1,0,0]=3 6743 B12R2.1 O=Cc1cnc2cccnn12 Amb18202313 [0,1,0,1,0,0|2,0,0]=4 6744 B12R2.1 O=Cc1cnc2ccncn12 Amb18202320 [0,1,0,1,0,0|2,0,0]=4 6745 B12R2.1 O=Cc1cnc2cnccn12 Amb8011550 [0,1,0,1,0,0|2,0,0]=4 6746 B12R2.1 O=Cc1cnc2ncccn12 Amb8010295 [0,1,0,1,0,0|2,0,0]=4 6747 B12R2.1 O=Cc1cnn2ccccc12 Amb18124776 [0,1,0,1,0,0|1,0,0]=3 6748 B12R2.1 O=Cc1cnn2cccnc12 Amb2721824 [0,1,0,1,0,0|2,0,0]=4 6749 B12R2.1 O=Cc1cnn2ncccc12 Amb18202319 [0,1,0,1,0,0|2,0,0]=4 6750 B12R2.1 O=Cc1coc2ccccc12 Amb10844786 [0,1,0,1,0,0|0,0,0]=2 6751 B12R2.1 O=Cc1coc2cccnc12 Amb22495093 [0,1,0,1,0,0|1,0,0]=3 6752 B12R2.1 O=Cc1coc2ccncc12 Amb18202345 [0,1,0,1,0,0|1,0,0]=3 6753 B12R2.1 O=Cc1coc2cnccc12 Amb22495092 [0,1,0,1,0,0|1,0,0]=3 6754 B12R2.1 O=Cc1coc2ncccc12 Amb18202347 [0,1,0,1,0,0|1,0,0]=3 6755 B12R2.1 O=Cc1csc2ccccc12 Amb1157901 [0,1,0,1,0,0|0,0,0]=2 6756 B12R2.1 O=Cc1csc2cccnc12 Amb18662694 [0,1,0,1,0,0|1,0,0]=3 6757 B12R2.1 O=Cc1csc2ccncc12 Amb18139569 [0,1,0,1,0,0|1,0,0]=3 6758 B12R2.1 O=Cc1csc2cnccc12 Amb18135843 [0,1,0,1,0,0|1,0,0]=3 6759 B12R2.1 O=Cc1csc2cncnc12 Amb24484527 [0,1,0,1,0,0|2,0,0]=4 6760 B12R2.1 O=Cc1csc2cnncc12 Amb18828878 [0,1,0,1,0,0|2,0,0]=4 6761 B12R2.1 O=Cc1csc2ncccc12 Amb18139558 [0,1,0,1,0,0|1,0,0]=3 6762 B12R2.1 O=Cc1ncc2ccccn12 Amb18124774 [0,1,0,1,0,0|1,0,0]=3 6763 B12R2.1 O=Cc1ncc2cnccn12 Amb27481427 [0,1,0,1,0,0|2,0,0]=4 6764 B12R2.1 O=Cc1ncn2ccccc12 Amb18559503 [0,1,0,1,0,0|1,0,0]=3 6765 B12R2.1 O=Cc1ncn2ccncc12 Amb18831424 [0,1,0,1,0,0|2,0,0]=4 6766 B12R2.1 O=Cc1ncn2ncccc12 Amb18831429 [0,1,0,1,0,0|2,0,0]=4 6767 B12R2.1 O=Cc1nnc2ccccn12 Amb23450391 [0,1,0,1,0,0|2,0,0]=4 6768 B12R2.1 O=Cc1nnn2ccccc12 Amb18202317 [0,1,0,1,0,0|2,0,0]=4 6769 B12R2.1 O=Cc1noc2cccnc12 Amb27633323 [0,1,0,1,0,0|2,0,0]=4 6770 B12R2.1 O=Cc1noc2ccncc12 Amb27963151 [0,1,0,1,0,0|2,0,0]=4 6771 B12R2.1 O=Cc1noc2ncccc12 Amb18202280 [0,1,0,1,0,0|2,0,0]=4 6772 B12R2.1 O=Cc1nsc2ccncc12 Amb18199776 [0,1,0,1,0,0|2,0,0]=4 6773 B12R2.1 O=Cc1nsc2ncccc12 Amb18199775 [0,1,0,1,0,0|2,0,0]=4 6774 B12R2.1 O=Cc1occ2ccccc12 Amb27793276 [0,1,0,1,0,0|0,0,0]=2 6775 B12R2.1 O=Cc1onc2ccccc12 Amb18831437 [0,1,0,1,0,0|1,0,0]=3 6776 B12R2.1 O=Cc1snc2ccccc12 Amb26948515 [0,1,0,1,0,0|1,0,0]=3 6777 B12R2.1 O=Cn1nnc2ccccc21 Amb3374289 [0,1,0,1,0,0|2,0,0]=4 6778 B12R2.1 O=Nc1ccc2ccccn12 Amb28203842 [0,1,0,1,0,0|1,0,0]=3 6779 B12R2.1 O=Nn1cnc2ccccc21 Amb26451421 [0,1,0,1,0,0|2,0,0]=4 6780 B12R2.1 OCc1coc2ccccc12 Amb10572402 [0,1,0,1,0,0|0,0,2]=4 6781 B12R2.1 OCc1csc2ccccc12 Amb2723182 [0,1,0,1,0,0|0,0,2]=4 6782 B12R2.1 OCc1occ2ccccc12 Amb28345290 [0,1,0,1,0,0|0,0,2]=4 6783 B12R2.1 ONc1csc2ccccc12 Amb27638522 [0,1,0,1,0,0|1,0,1]=4 6784 B12R2.1 SCc1coc2ccccc12 Amb24405838 [0,1,0,1,0,0|0,1,1]=4 6785 B12R2.1 SCc1csc2ccccc12 Amb3429654 [0,1,0,1,0,0|0,1,1]=4 6786 B12R2.1 [C-]#[N+]c1csc2ccccc12 Amb33313010 [0,1,0,1,0,0|2,0,0]=4 6787 B12R2.11 OC1O\C1=C/c2ccccc2 Amb27589709 [0,1,0,1,0,0|0,0,2]=4 6788 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,1,0,1,0,0|0,0,2]=4 6789 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,1,0,1,0,0|0,0,2]=4 6790 B12R2.23 O=C1CC[C@H]1c2ccccc2 Amb28253765 [0,1,0,1,0,0|0,0,2]=4 6791 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,1,0,1,0,0|0,0,2]=4 6792 B12R2.23 O=C1NCC1c2ccccc2 Amb614326 [0,1,0,1,0,0|0,0,2]=4 6793 B12R2.2057 C(=C\C1CO1)/c2ccccc2 Amb32954418 [0,1,0,1,0,0|0,0,2]=4 6794 B12R2.2057 C(=C\[C@@H]1CO1)/c2ccccc2 Amb33081122 [0,1,0,1,0,0|0,0,2]=4 6795 B12R2.2057 C(=C\[C@H]1CO1)/c2ccccc2 Amb33081121 [0,1,0,1,0,0|0,0,2]=4 6796 B12R2.18 Brc1sc2ccccc2c1Br Amb21858144 [0,1,0,1,0,0|2,0,0]=4 6797 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,1,0,1,0,0|2,0,0]=4 6798 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,1,0,1,0,0|0,0,1]=3 6799 B12R2.18 CC1=C(C)c2ccccc2C1 Amb21948330 [0,1,0,1,0,0|1,0,1]=4 6800 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,1,0,1,0,0|0,0,2]=4 6801 B12R2.18 CC1=Cc2ccccc2[C@H]1O Amb28319957 [0,1,0,1,0,0|0,0,2]=4 6802 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [0,1,0,1,0,0|0,0,2]=4 6803 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [0,1,0,1,0,0|1,0,1]=4 6804 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,1,0,1,0,0|1,0,1]=4 6805 B12R2.18 CN1Cc2ccccc2C1=O Amb4006345 [0,1,0,1,0,0|1,0,1]=4 6806 B12R2.18 CN1Oc2ccccc2C1=O Amb27760365 [0,1,0,1,0,0|2,0,0]=4 6807 B12R2.18 CN1Sc2ccccc2C1=O Amb27218159 [0,1,0,1,0,0|2,0,0]=4 6808 B12R2.18 Cc1c(Br)oc2ccccc12 Amb24451202 [0,1,0,1,0,0|2,0,0]=4 6809 B12R2.18 Cc1c(I)sc2ccccc12 Amb26042872 [0,1,0,1,0,0|2,0,0]=4 6810 B12R2.18 Cc1c(N)oc2ccccc12 Amb18202306 [0,1,0,1,0,0|2,0,0]=4 6811 B12R2.18 Cc1c(O)oc2ccccc12 Amb33310521 [0,1,0,1,0,0|2,0,0]=4 6812 B12R2.18 Cc1cc2ccccc2n1C Amb1934988 [0,1,0,1,0,0|2,0,0]=4 6813 B12R2.18 Cc1cc2ccccc2n1N Amb28457281 [0,1,0,1,0,0|2,0,0]=4 6814 B12R2.18 Cc1cc2ccccn2c1Br Amb18559299 [0,1,0,1,0,0|2,0,0]=4 6815 B12R2.18 Cc1cc2ccccn2c1C Amb26481258 [0,1,0,1,0,0|2,0,0]=4 6816 B12R2.18 Cc1cc2ccccn2c1N Amb18559300 [0,1,0,1,0,0|2,0,0]=4 6817 B12R2.18 Cc1cn2ccccc2c1C Amb27492933 [0,1,0,1,0,0|2,0,0]=4 6818 B12R2.18 Cc1cn2ccccc2c1N Amb18149646 [0,1,0,1,0,0|2,0,0]=4 6819 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,1,0,1,0,0|2,0,0]=4 6820 B12R2.18 Cc1oc2ccccc2c1C Amb8516959 [0,1,0,1,0,0|2,0,0]=4 6821 B12R2.18 Cc1sc2ccccc2c1Br Amb10975969 [0,1,0,1,0,0|2,0,0]=4 6822 B12R2.18 Cc1sc2ccccc2c1I Amb25247275 [0,1,0,1,0,0|2,0,0]=4 6823 B12R2.18 Clc1c(Br)oc2ccccc12 Amb28284723 [0,1,0,1,0,0|2,0,0]=4 6824 B12R2.18 Clc1oc2ccccc2c1Br Amb33433284 [0,1,0,1,0,0|2,0,0]=4 6825 B12R2.18 Clc1sc2ccccc2c1Br Amb27792393 [0,1,0,1,0,0|2,0,0]=4 6826 B12R2.18 Clc1sc2ccccc2c1Cl Amb20669291 [0,1,0,1,0,0|2,0,0]=4 6827 B12R2.18 Cn1c(Br)cc2ccccc21 Amb22232574 [0,1,0,1,0,0|2,0,0]=4 6828 B12R2.18 Cn1c(Cl)cc2ccccc21 Amb26587274 [0,1,0,1,0,0|2,0,0]=4 6829 B12R2.18 Cn1c(F)cc2ccccc21 Amb27882722 [0,1,0,1,0,0|2,0,0]=4 6830 B12R2.18 Cn1c(I)cc2ccccc21 Amb24067548 [0,1,0,1,0,0|2,0,0]=4 6831 B12R2.18 Cn1c(N)cc2ccccc21 Amb18644284 [0,1,0,1,0,0|2,0,0]=4 6832 B12R2.18 Cn1c(N)cc2ccccc21 Amb19944548 [0,1,0,1,0,0|2,0,0]=4 6833 B12R2.18 Cn1c(O)cc2ccccc21 Amb3427957 [0,1,0,1,0,0|2,0,0]=4 6834 B12R2.18 Cn1c(S)cc2ccccc21 Amb26845572 [0,1,0,1,0,0|2,0,0]=4 6835 B12R2.18 Fc1sc2ccccc2c1Br Amb28323565 [0,1,0,1,0,0|2,0,0]=4 6836 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,1,0,1,0,0|2,0,0]=4 6837 B12R2.18 NC1=Nc2ccccc2S1=O Amb27875514 [0,1,0,1,0,0|2,0,0]=4 6838 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [0,1,0,1,0,0|0,0,2]=4 6839 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [0,1,0,1,0,0|0,0,2]=4 6840 B12R2.18 NN1Cc2ccccc2C1=O Amb28652918 [0,1,0,1,0,0|1,0,1]=4 6841 B12R2.18 Nc1c(Br)sc2ccccc12 Amb18135010 [0,1,0,1,0,0|2,0,0]=4 6842 B12R2.18 Nc1sc2ccccc2c1Br Amb18135037 [0,1,0,1,0,0|2,0,0]=4 6843 B12R2.18 Nc1sc2ccccc2c1N Amb27823311 [0,1,0,1,0,0|2,0,0]=4 6844 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,1,0,1,0,0|1,0,0]=3 6845 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,1,0,1,0,0|0,0,0]=2 6846 B12R2.18 O=C1C(Cl)=Nc2ccccc21 Amb17594117 [0,1,0,1,0,0|1,0,0]=3 6847 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [0,1,0,1,0,0|0,0,1]=3 6848 B12R2.18 O=C1N=C2C=CC=CN2C1=O Amb18528339 [0,1,0,1,0,0|2,0,0]=4 6849 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,1,0,1,0,0|1,0,0]=3 6850 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,1,0,1,0,0|1,1,0]=4 6851 B12R2.18 O=C1Nc2ncccc2C1=O Amb10976067 [0,1,0,1,0,0|2,0,0]=4 6852 B12R2.18 O=C1Oc2ccccc2C1=O Amb9783305 [0,1,0,1,0,0|1,0,0]=3 6853 B12R2.18 O=C1Sc2ccccc2C1=O Amb2608884 [0,1,0,1,0,0|1,0,0]=3 6854 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [0,1,0,1,0,0|0,0,2]=4 6855 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [0,1,0,1,0,0|0,0,2]=4 6856 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [0,1,0,1,0,0|0,0,2]=4 6857 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,1,0,1,0,0|0,0,2]=4 6858 B12R2.18 Oc1sc2ccccc2c1O Amb27966224 [0,1,0,1,0,0|1,0,1]=4 6859 B12R2.37 CC1=C(c2ccccc2)N1C Amb27602376 [0,1,0,1,0,0|2,0,0]=4 6860 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [0,1,0,1,0,0|0,0,2]=4 6861 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,1,0,1,0,0|0,0,0]=2 6862 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,1,0,1,0,0|0,0,0]=2 6863 B12R2.2403 CC1(C)C=Cc2ccccc21 Amb17844051 [0,1,0,1,0,0|1,0,1]=4 6864 B12R2.2403 O=S1(=O)C=Cc2ccccc21 Amb6356379 [0,1,0,1,0,0|1,0,0]=3 6865 B12R2.2403 O=S1(=O)C=Cc2cccnc21 Amb24635508 [0,1,0,1,0,0|2,0,0]=4 6866 B12R2.2403 O=S1(=O)C=Cc2ncccc21 Amb28365435 [0,1,0,1,0,0|2,0,0]=4 6867 B12R2.3190 CC(=O)C1Cc2ccccc21 Amb28066759 [0,1,0,1,0,0|0,0,2]=4 6868 B12R2.3190 CC(=O)N1Cc2ccccc21 Amb25148191 [0,1,0,1,0,0|1,0,1]=4 6869 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|0,0,2]=4 6870 B12R2.3190 O=C(Cl)C1=C2C=CC=CC2=C1 Amb25779648 [0,1,0,1,0,0|0,0,0]=2 6871 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|0,0,2]=4 6872 B12R2.3190 O=C(O)C1=Cc2ccccc21 Amb17593654 [0,1,0,1,0,0|0,0,0]=2 6873 B12R2.3190 O=C(O)C1Cc2ccccc21 Amb4017188 [0,1,0,1,0,0|0,0,2]=4 6874 B12R3.12 C1=CNN2C=C3C=C3C2=C1 Amb28143444 [0,0,0,2,0,0|2,0,0]=4 6875 B12R3.12 c1cc2c(cn1)cc3cc32 Amb28246047 [0,0,0,2,0,0|2,0,0]=4 6876 B12R3.12 c1ccc2c(c1)nc3nc32 Amb27774849 [0,0,0,2,0,0|2,0,0]=4 6877 B12R3.12 c1ccc2c3n(cc2c1)C3 Amb27781391 [0,0,0,2,0,0|2,0,0]=4 6878 B12R3.12 c1ccc2c3n(cc2c1)N3 Amb28282754 [0,0,0,2,0,0|2,0,0]=4 6879 B12R3.12 c1ccn2cc3c(c2c1)N3 Amb28239421 [0,0,0,2,0,0|2,0,0]=4 6880 B12R3.12 c1cnc2c(c1)cc3cc32 Amb27482098 [0,0,0,2,0,0|1,0,0]=3 6881 B12R3.12 c1cnc2cc3cc3c2c1 Amb26034642 [0,0,0,2,0,0|1,0,0]=3 6882 B8R1.8 Br\C=C\c1ccco1 Amb33134803 [1,0,0,0,1,0|2,0,0]=4 6883 B8R1.8 Br\C=C\c1cccs1 Amb33134763 [1,0,0,0,1,0|2,0,0]=4 6884 B8R1.8 Br\C=C\c1ccoc1 Amb27849530 [1,0,0,0,1,0|2,0,0]=4 6885 B8R1.8 Br\C=C\c1ccsc1 Amb27612884 [1,0,0,0,1,0|2,0,0]=4 6886 B8R1.8 C=C=Cc1ccco1 Amb27638814 [1,0,0,0,1,0|1,0,1]=4 6887 B8R1.8 C=CCc1ccco1 Amb26612842 [1,0,0,0,1,0|1,0,1]=4 6888 B8R1.8 C=CCc1cccs1 Amb27882648 [1,0,0,0,1,0|1,0,1]=4 6889 B8R1.8 C=CCc1ccsc1 Amb27799958 [1,0,0,0,1,0|1,0,1]=4 6890 B8R1.8 C=CCn1cccc1 Amb9371428 [1,0,0,0,1,0|1,0,1]=4 6891 B8R1.8 I\C=C\c1ccco1 Amb24697510 [1,0,0,0,1,0|2,0,0]=4 6892 B8R1.8 N\C=C\c1ccco1 Amb28367758 [1,0,0,0,1,0|2,0,0]=4 6893 B8R1.8 O=C=Cc1cccs1 Amb27632892 [1,0,0,0,1,0|1,0,1]=4 6894 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|1,0,1]=4 6895 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|1,0,1]=4 6896 B8R1.8 O=CCc1ccoc1 Amb18641576 [1,0,0,0,1,0|1,0,1]=4 6897 B8R1.8 O=CCc1ccsc1 Amb26603755 [1,0,0,0,1,0|1,0,1]=4 6898 B8R1.8 O=CCn1cccc1 Amb18203408 [1,0,0,0,1,0|1,0,1]=4 6899 B8R1.8 O=CNc1ccco1 Amb28135036 [1,0,0,0,1,0|2,0,0]=4 6900 B8R1.8 O=CNc1cccs1 Amb28282647 [1,0,0,0,1,0|2,0,0]=4 6901 B8R1.8 O=COc1ccco1 Amb27591421 [1,0,0,0,1,0|2,0,0]=4 6902 B8R1.8 O=COc1cccs1 Amb27798954 [1,0,0,0,1,0|2,0,0]=4 6903 B8R1.8 O=C\C=C1/C=COC1 Amb27461596 [1,0,0,0,1,0|1,0,1]=4 6904 B8R1.8 OCC=C1C=CC=C1 Amb27662404 [1,0,0,0,1,0|0,0,2]=4 6905 B12R1.329 O=C\C=C\C1=CC=CC=CC=C1 Amb25917089 [0,0,0,0,0,2|0,0,0]=2 6906 B12R1.329 OC\C=C\C1=CC=CC=CC=C1 Amb27980523 [0,0,0,0,0,2|0,0,2]=4