0 B13R2.449 BrCCc1cc2CCCc2cc1 Amb18048755 [0,0,0,0,0,0|3,0,1]=4 1 B13R2.449 BrCCc1cc2OCOc2cc1 Amb18548880 [0,0,0,0,0,0|1,0,1]=2 2 B13R2.449 BrCCc1ccc2c(c1)CCN2 Amb17205149 [0,0,0,0,0,0|3,0,1]=4 3 B13R2.449 C#CCc1ccc2OCOc2c1 Amb25800981 [0,0,0,0,0,0|0,0,2]=2 4 B13R2.449 C/N=C/c1ccc2OCOc2c1 Amb17778532 [0,0,0,0,0,0|1,0,2]=3 5 B13R2.449 C=CCc1cc2CCNc2cc1 Amb24456870 [0,0,0,0,0,0|2,0,0]=2 6 B13R2.449 C=CCc1cc2NCCc2cc1 Amb24687019 [0,0,0,0,0,0|2,0,0]=2 7 B13R2.449 C=CCc1cc2OCCc2cc1 Amb24502637 [0,0,0,0,0,0|1,0,0]=1 8 B13R2.449 C=CCc1cc2[nH]ccc2cc1 Amb25034611 [0,0,0,0,0,0|2,0,1]=3 9 B13R2.449 C=CCc1cc2[n]o[n]c2cc1 Amb24733892 [0,0,0,0,0,0|3,0,0]=3 10 B13R2.449 C=CCc1cc2cc[s]c2cc1 Amb24628287 [0,0,0,0,0,0|1,1,1]=3 11 B13R2.449 C=CCc1cc2ccoc2cc1 Amb24070980 [0,0,0,0,0,0|1,0,1]=2 12 B13R2.449 C=CCc1cc2occc2cc1 Amb25135164 [0,0,0,0,0,0|1,0,1]=2 13 B13R2.449 CCCc1cc2ccoc2cc1 Amb24071651 [0,0,0,0,0,0|1,0,3]=4 14 B13R2.449 CCCc1ccc2CCNc2c1 Amb24067523 [0,0,0,0,0,0|2,0,2]=4 15 B13R2.449 CCCc1ccc2c(c1)CCN2 Amb1124236 [0,0,0,0,0,0|2,0,2]=4 16 B13R2.449 CCCc1ccc2c(c1)nco2 Amb17570041 [0,0,0,0,0,0|1,0,3]=4 17 B13R2.449 CCSc1cc2OCOc2cc1 Amb22263730 [0,0,0,0,0,0|1,0,2]=3 18 B13R2.449 CNCc1cc2CCOc2cc1 Amb24271195 [0,0,0,0,0,0|2,0,1]=3 19 B13R2.449 CNCc1cc2NCCc2cc1 Amb25696714 [0,0,0,0,0,0|3,0,1]=4 20 B13R2.449 CNCc1cc2OCCc2cc1 Amb23586280 [0,0,0,0,0,0|2,0,1]=3 21 B13R2.449 CNCc1cc2OCOc2[n]c1 Amb24557412 [0,0,0,0,0,0|2,0,1]=3 22 B13R2.449 CNCc1cc2[n]coc2cc1 Amb18632807 [0,0,0,0,0,0|2,0,2]=4 23 B13R2.449 CNCc1cc2ccoc2cc1 Amb24089263 [0,0,0,0,0,0|2,0,2]=4 24 B13R2.449 CNCc1cc2oc[n]c2cc1 Amb18114594 [0,0,0,0,0,0|2,0,2]=4 25 B13R2.449 CNCc1cc2occc2cc1 Amb18829936 [0,0,0,0,0,0|2,0,2]=4 26 B13R2.449 CNCc1ccc2NCCc2c1 Amb18951424 [0,0,0,0,0,0|3,0,1]=4 27 B13R2.449 CNCc1ccc2c(c1)OCO2 Amb1106055 [0,0,0,0,0,0|1,0,1]=2 28 B13R2.449 COCc1cc2CCNc2cc1 Amb24419334 [0,0,0,0,0,0|3,0,1]=4 29 B13R2.449 COCc1ccc2OCCc2c1 Amb24401475 [0,0,0,0,0,0|2,0,1]=3 30 B13R2.449 CSCc1cc2CCCc2cc1 Amb24722250 [0,0,0,0,0,0|3,0,1]=4 31 B13R2.449 ClCCc1cc2CCCc2cc1 Amb18049739 [0,0,0,0,0,0|3,0,1]=4 32 B13R2.449 ClCCc1cc2CCOc2cc1 Amb20241524 [0,0,0,0,0,0|2,0,1]=3 33 B13R2.449 ClCCc1cc2ccoc2cc1 Amb22232561 [0,0,0,0,0,0|2,0,2]=4 34 B13R2.449 ClCCc1ccc2CCOc2c1 Amb24507087 [0,0,0,0,0,0|2,0,1]=3 35 B13R2.449 Cl[Mg]Cc1ccc2OCOc2c1 Amb22897330 [0,0,0,0,0,0|2,0,0]=2 36 B13R2.449 Cl[Zn]Cc1ccc2OCOc2c1 Amb22897832 [0,0,0,0,0,0|2,0,0]=2 37 B13R2.449 ICCc1cc2CCOc2cc1 Amb24696501 [0,0,0,0,0,0|2,0,1]=3 38 B13R2.449 I\C=C/c1ccc2c(c1)OCO2 Amb10067503 [0,0,0,0,0,0|1,0,1]=2 39 B13R2.449 N#CCc1cc2CCCc2cc1 Amb18862527 [0,0,0,0,0,0|3,0,1]=4 40 B13R2.449 N#CCc1cc2OCCc2cc1 Amb21964773 [0,0,0,0,0,0|2,0,1]=3 41 B13R2.449 N#CCc1cc2ccoc2cc1 Amb23454584 [0,0,0,0,0,0|2,0,2]=4 42 B13R2.449 N#CCc1cc2o[n]cc2cc1 Amb25132296 [0,0,0,0,0,0|3,0,1]=4 43 B13R2.449 N#CCc1cc2occc2cc1 Amb18126052 [0,0,0,0,0,0|2,0,2]=4 44 B13R2.449 N#CCc1ccc2c(c1)CCO2 Amb1139487 [0,0,0,0,0,0|2,0,1]=3 45 B13R2.449 N#CCc1ccc2c(c1)OCO2 Amb1161690 [0,0,0,0,0,0|1,0,1]=2 46 B13R2.449 N#CCc1ccc2c(c1)nco2 Amb17131034 [0,0,0,0,0,0|2,0,2]=4 47 B13R2.449 N#CCc1ccc2c(c1)ocn2 Amb17131032 [0,0,0,0,0,0|2,0,2]=4 48 B13R2.449 N#CNc1cc2OCOc2cc1 Amb18800606 [0,0,0,0,0,0|2,0,1]=3 49 B13R2.449 NCCc1c[n]c2OCOc2c1 Amb25299387 [0,0,0,0,0,0|2,0,1]=3 50 B13R2.449 NCCc1cc2CCOc2c[n]1 Amb25245915 [0,0,0,0,0,0|3,0,1]=4 51 B13R2.449 NCCc1cc2CCSc2cc1 Amb18194205 [0,0,0,0,0,0|2,1,1]=4 52 B13R2.449 NCCc1cc2OCOc2c[n]1 Amb18827783 [0,0,0,0,0,0|2,0,1]=3 53 B13R2.449 NCCc1cc2[n]coc2cc1 Amb18062283 [0,0,0,0,0,0|2,0,2]=4 54 B13R2.449 NCCc1cc2ccoc2cc1 Amb18141998 [0,0,0,0,0,0|2,0,2]=4 55 B13R2.449 NCCc1cc2oc[n]c2cc1 Amb18829746 [0,0,0,0,0,0|2,0,2]=4 56 B13R2.449 NCCc1cc2occc2cc1 Amb18829960 [0,0,0,0,0,0|2,0,2]=4 57 B13R2.449 NCCc1ccc2CCOc2c1 Amb18829261 [0,0,0,0,0,0|2,0,1]=3 58 B13R2.449 NCCc1ccc2CCSc2c1 Amb18824587 [0,0,0,0,0,0|2,1,1]=4 59 B13R2.449 NCCc1ccc2c(c1)CCC2 Amb17232385 [0,0,0,0,0,0|3,0,1]=4 60 B13R2.449 NCCc1ccc2c(c1)CCN2 Amb17570066 [0,0,0,0,0,0|3,0,1]=4 61 B13R2.449 NCCc1ccc2c(c1)CCO2 Amb1133437 [0,0,0,0,0,0|2,0,1]=3 62 B13R2.449 NCCc1ccc2c(c1)OCO2 Amb1154403 [0,0,0,0,0,0|1,0,1]=2 63 B13R2.449 NNCc1cc2OCCc2cc1 Amb24425583 [0,0,0,0,0,0|3,0,0]=3 64 B13R2.449 NNCc1ccc2c(c1)OCO2 Amb13949118 [0,0,0,0,0,0|2,0,0]=2 65 B13R2.449 NOCc1cc2CCCc2cc1 Amb24559109 [0,0,0,0,0,0|4,0,0]=4 66 B13R2.449 NOCc1cc2oc[n]c2cc1 Amb25128132 [0,0,0,0,0,0|3,0,1]=4 67 B13R2.449 NOCc1ccc2c(c1)OCO2 Amb17091446 [0,0,0,0,0,0|2,0,0]=2 68 B13R2.449 N\N=C\c1cc2CCOc2cc1 Amb25683275 [0,0,0,0,0,0|3,0,1]=4 69 B13R2.449 N\N=C\c1cc2OCOc2c[n]1 Amb25781483 [0,0,0,0,0,0|3,0,1]=4 70 B13R2.449 O=CCc1cc2CCCc2cc1 Amb25723552 [0,0,0,0,0,0|3,0,0]=3 71 B13R2.449 O=CCc1cc2COCc2cc1 Amb25712955 [0,0,0,0,0,0|4,0,0]=4 72 B13R2.449 O=CCc1cc2[n]c[nH]c2cc1 Amb24591225 [0,0,0,0,0,0|3,0,1]=4 73 B13R2.449 O=CCc1cc2[n]c[s]c2cc1 Amb24083216 [0,0,0,0,0,0|2,1,1]=4 74 B13R2.449 O=CCc1cc2cc[nH]c2cc1 Amb24725173 [0,0,0,0,0,0|3,0,1]=4 75 B13R2.449 O=CCc1cc2cc[s]c2cc1 Amb24094693 [0,0,0,0,0,0|2,1,1]=4 76 B13R2.449 O=CCc1cc2ccoc2cc1 Amb25200935 [0,0,0,0,0,0|2,0,1]=3 77 B13R2.449 O=CCc1cc2oc[n]c2cc1 Amb25250061 [0,0,0,0,0,0|2,0,1]=3 78 B13R2.449 O=CCc1ccc2c(c1)OCO2 Amb17089538 [0,0,0,0,0,0|1,0,0]=1 79 B13R2.449 O=CNc1cc2OCOc2cc1 Amb22059641 [0,0,0,0,0,0|2,0,0]=2 80 B13R2.449 O=COc1ccc2OCOc2c1 Amb24488547 [0,0,0,0,0,0|2,0,0]=2 81 B13R2.449 OCCc1cc2CCNc2cc1 Amb25071770 [0,0,0,0,0,0|3,0,1]=4 82 B13R2.449 OCCc1cc2CCSc2cc1 Amb24450184 [0,0,0,0,0,0|2,1,1]=4 83 B13R2.449 OCCc1cc2[n]coc2cc1 Amb18893472 [0,0,0,0,0,0|2,0,2]=4 84 B13R2.449 OCCc1cc2ccoc2cc1 Amb22886810 [0,0,0,0,0,0|2,0,2]=4 85 B13R2.449 OCCc1cc2oc[n]c2cc1 Amb18893471 [0,0,0,0,0,0|2,0,2]=4 86 B13R2.449 OCCc1ccc2CCOc2c1 Amb25362526 [0,0,0,0,0,0|2,0,1]=3 87 B13R2.449 OCCc1ccc2c(c1)CCC2 Amb17232413 [0,0,0,0,0,0|3,0,1]=4 88 B13R2.449 OCCc1ccc2c(c1)CCO2 Amb10069335 [0,0,0,0,0,0|2,0,1]=3 89 B13R2.449 ONCc1ccc2OCOc2c1 Amb24346554 [0,0,0,0,0,0|2,0,0]=2 90 B13R2.449 SCCc1ccc2c(c1)CCC2 Amb17470584 [0,0,0,0,0,0|3,0,1]=4 91 B13R2.449 SCCc1ccc2c(c1)OCO2 Amb17400924 [0,0,0,0,0,0|1,0,1]=2 92 B13R2.449 [C-]#[N+]Cc1ccc2c(c1)OCO2 Amb1981064 [0,0,0,0,0,0|1,0,1]=2 93 B13R2.449 [N-]=[N+]=Nc1cc2OCOc2cc1 Amb25686007 [0,0,0,0,0,0|3,0,0]=3 94 B13R2.449 [NH3+]CCc1cc2OCOc2cc1 Amb22461742 [0,0,0,0,0,0|1,0,1]=2 95 B13R2.449 [NH3+]CCc1ccc2c(c1)OCO2 Amb16209004 [0,0,0,0,0,0|1,0,1]=2 96 B12R2.44 BrCc1cc2CCCc2cc1 Amb22174141 [1,0,0,0,0,0|3,0,0]=4 97 B12R2.44 BrCc1cc2[n]coc2cc1 Amb23401986 [1,0,0,0,0,0|2,0,1]=4 98 B12R2.44 BrCc1cc2ccoc2cc1 Amb23401833 [1,0,0,0,0,0|2,0,1]=4 99 B12R2.44 BrCc1cc2oc[n]c2cc1 Amb23401987 [1,0,0,0,0,0|2,0,1]=4 100 B12R2.44 BrCc1cc2occc2cc1 Amb23401749 [1,0,0,0,0,0|2,0,1]=4 101 B12R2.44 Br[Mg]c1cc2CCOc2cc1 Amb22897288 [1,0,0,0,0,0|3,0,0]=4 102 B12R2.44 Br[Mg]c1ccc2OCOc2c1 Amb17689220 [1,0,0,0,0,0|2,0,0]=3 103 B12R2.44 Br[Zn]c1cc2CCOc2cc1 Amb22897750 [1,0,0,0,0,0|3,0,0]=4 104 B12R2.44 Br[Zn]c1cc2OCOc2cc1 Amb22897833 [1,0,0,0,0,0|2,0,0]=3 105 B12R2.44 C#Cc1cc2CCOc2cc1 Amb22490039 [1,0,0,0,0,0|1,0,2]=4 106 B12R2.44 C#Cc1cc2OCOc2cc1 Amb22170379 [1,0,0,0,0,0|0,0,2]=3 107 B12R2.44 C=Cc1cc2CCOc2cc1 Amb24056357 [1,0,0,0,0,0|1,0,0]=2 108 B12R2.44 C=Cc1cc2OCOc2cc1 Amb22263780 [1,0,0,0,0,0|0,0,0]=1 109 B12R2.44 C=Cc1cc2[nH]ccc2cc1 Amb22263005 [1,0,0,0,0,0|2,0,1]=4 110 B12R2.44 C=Cc1cc2[n][n][nH]c2cc1 Amb25191236 [1,0,0,0,0,0|3,0,0]=4 111 B12R2.44 C=Cc1cc2[n][s][n]c2cc1 Amb24511576 [1,0,0,0,0,0|3,0,0]=4 112 B12R2.44 C=Cc1cc2[n]c[nH]c2cc1 Amb25738265 [1,0,0,0,0,0|2,0,1]=4 113 B12R2.44 C=Cc1cc2[n]c[s]c2cc1 Amb24091052 [1,0,0,0,0,0|1,1,1]=4 114 B12R2.44 C=Cc1cc2[s]c[n]c2cc1 Amb22494077 [1,0,0,0,0,0|1,1,1]=4 115 B12R2.44 C=Cc1cc2cc[s]c2cc1 Amb24091094 [1,0,0,0,0,0|1,1,1]=4 116 B12R2.44 C=Cc1cc2ccoc2[n]c1 Amb24071682 [1,0,0,0,0,0|2,0,1]=4 117 B12R2.44 C=Cc1cc2occc2cc1 Amb25808151 [1,0,0,0,0,0|1,0,1]=3 118 B12R2.44 C=Nc1cc2OCOc2cc1 Amb25790668 [1,0,0,0,0,0|1,0,0]=2 119 B12R2.44 CCc1cc2CCOc2cc1 Amb24092860 [1,0,0,0,0,0|1,0,1]=3 120 B12R2.44 CCc1cc2ccoc2cc1 Amb25780435 [1,0,0,0,0,0|1,0,2]=4 121 B12R2.44 CCc1cc2occc2cc1 Amb24683803 [1,0,0,0,0,0|1,0,2]=4 122 B12R2.44 CCc1ccc2c(c1)CCC2 Amb17232014 [1,0,0,0,0,0|2,0,1]=4 123 B12R2.44 CCc1ccc2c(c1)CCN2 Amb1132682 [1,0,0,0,0,0|2,0,1]=4 124 B12R2.44 CCc1ccc2c(c1)nco2 Amb17304940 [1,0,0,0,0,0|1,0,2]=4 125 B12R2.44 CNc1cc2CCOc2cc1 Amb18949282 [1,0,0,0,0,0|2,0,1]=4 126 B12R2.44 CNc1ccc2OCOc2[n]1 Amb25095176 [1,0,0,0,0,0|2,0,1]=4 127 B12R2.44 COc1ccc2OCCc2c1 Amb22549565 [1,0,0,0,0,0|2,0,1]=4 128 B12R2.44 COc1ccc2OCOc2c1 Amb17673128 [1,0,0,0,0,0|1,0,1]=3 129 B12R2.44 CSc1cc2OCOc2cc1 Amb22263395 [1,0,0,0,0,0|1,0,1]=3 130 B12R2.44 ClCc1c[n]c2OCOc2c1 Amb24673346 [1,0,0,0,0,0|2,0,0]=3 131 B12R2.44 ClCc1cc2OCOc2c[n]1 Amb25331709 [1,0,0,0,0,0|2,0,0]=3 132 B12R2.44 ClCc1cc2[n]coc2cc1 Amb23401988 [1,0,0,0,0,0|2,0,1]=4 133 B12R2.44 ClCc1cc2ccoc2cc1 Amb23401834 [1,0,0,0,0,0|2,0,1]=4 134 B12R2.44 ClCc1cc2oc[n]c2cc1 Amb23401989 [1,0,0,0,0,0|2,0,1]=4 135 B12R2.44 ClCc1cc2occc2cc1 Amb23401823 [1,0,0,0,0,0|2,0,1]=4 136 B12R2.44 ClCc1ccc2CCOc2c1 Amb25340528 [1,0,0,0,0,0|2,0,0]=3 137 B12R2.44 ClCc1ccc2c(c1)OCO2 Amb1105052 [1,0,0,0,0,0|1,0,0]=2 138 B12R2.44 FCc1cc2CCNc2cc1 Amb25381126 [1,0,0,0,0,0|3,0,0]=4 139 B12R2.44 FCc1cc2OCOc2cc1 Amb25169462 [1,0,0,0,0,0|1,0,0]=2 140 B12R2.44 FCc1cc2o[n]cc2cc1 Amb25178913 [1,0,0,0,0,0|3,0,0]=4 141 B12R2.44 ICc1cc2CCCc2cc1 Amb25151278 [1,0,0,0,0,0|3,0,0]=4 142 B12R2.44 ICc1cc2OCOc2cc1 Amb25151267 [1,0,0,0,0,0|1,0,0]=2 143 B12R2.44 I[Zn]c1ccc2c(c1)OCO2 Amb13890850 [1,0,0,0,0,0|2,0,0]=3 144 B12R2.44 N#Cc1ccc2CCOc2c1 Amb23399918 [1,0,0,0,0,0|2,0,1]=4 145 B12R2.44 N#Cc1ccc2OCOc2[n]1 Amb24468842 [1,0,0,0,0,0|2,0,1]=4 146 B12R2.44 N#Cc1ccc2c(c1)OCO2 Amb1102181 [1,0,0,0,0,0|1,0,1]=3 147 B12R2.44 N#[N+]c1cc2CCOc2cc1 Amb24647486 [1,0,0,0,0,0|3,0,0]=4 148 B12R2.44 NCc1c[n]c2OCOc2c1 Amb25684684 [1,0,0,0,0,0|2,0,0]=3 149 B12R2.44 NCc1cc2CCNc2cc1 Amb19889133 [1,0,0,0,0,0|3,0,0]=4 150 B12R2.44 NCc1cc2CCOc2[n]c1 Amb25178659 [1,0,0,0,0,0|3,0,0]=4 151 B12R2.44 NCc1cc2OCOc2cc1 Amb22757193 [1,0,0,0,0,0|1,0,0]=2 152 B12R2.44 NCc1cc2OCOc2cc1 Amb23566988 [1,0,0,0,0,0|1,0,0]=2 153 B12R2.44 NCc1cc2SCOc2cc1 Amb24666841 [1,0,0,0,0,0|1,1,0]=3 154 B12R2.44 NCc1cc2[n]coc2cc1 Amb18114639 [1,0,0,0,0,0|2,0,1]=4 155 B12R2.44 NCc1cc2[n]coc2cc1 Amb23399634 [1,0,0,0,0,0|2,0,1]=4 156 B12R2.44 NCc1cc2ccoc2cc1 Amb22755776 [1,0,0,0,0,0|2,0,1]=4 157 B12R2.44 NCc1cc2oc[n]c2cc1 Amb18632723 [1,0,0,0,0,0|2,0,1]=4 158 B12R2.44 NCc1cc2oc[n]c2cc1 Amb22491217 [1,0,0,0,0,0|2,0,1]=4 159 B12R2.44 NCc1ccc2CCNc2c1 Amb24068186 [1,0,0,0,0,0|3,0,0]=4 160 B12R2.44 NCc1ccc2CCOc2c1 Amb23412186 [1,0,0,0,0,0|2,0,0]=3 161 B12R2.44 NCc1ccc2OCCc2[n]1 Amb23455413 [1,0,0,0,0,0|3,0,0]=4 162 B12R2.44 NCc1ccc2OCOc2[n]1 Amb25352267 [1,0,0,0,0,0|2,0,0]=3 163 B12R2.44 NCc1ccc2c(c1)CCN2 Amb16186700 [1,0,0,0,0,0|3,0,0]=4 164 B12R2.44 NCc1ccc2c(c1)OCO2 Amb1102008 [1,0,0,0,0,0|1,0,0]=2 165 B12R2.44 NCc1ccc2c(c1)occ2 Amb13951983 [1,0,0,0,0,0|2,0,1]=4 166 B12R2.44 NNc1cc2CCOc2cc1 Amb22011831 [1,0,0,0,0,0|3,0,0]=4 167 B12R2.44 NNc1ccc2CCOc2c1 Amb23571502 [1,0,0,0,0,0|3,0,0]=4 168 B12R2.44 NNc1ccc2c(c1)OCO2 Amb13948975 [1,0,0,0,0,0|2,0,0]=3 169 B12R2.44 NOc1cc2OCOc2cc1 Amb25254771 [1,0,0,0,0,0|2,0,0]=3 170 B12R2.44 O=Cc1c[n]c2CCOc2c1 Amb24101561 [1,0,0,0,0,0|3,0,0]=4 171 B12R2.44 O=Cc1cc2CCNc2cc1 Amb18202303 [1,0,0,0,0,0|3,0,0]=4 172 B12R2.44 O=Cc1cc2CCOc2c[n]1 Amb18202189 [1,0,0,0,0,0|3,0,0]=4 173 B12R2.44 O=Cc1cc2CCSc2cc1 Amb18199757 [1,0,0,0,0,0|2,1,0]=4 174 B12R2.44 O=Cc1cc2OCOc2[n]c1 Amb24060667 [1,0,0,0,0,0|2,0,0]=3 175 B12R2.44 O=Cc1cc2OCOc2c[n]1 Amb18831275 [1,0,0,0,0,0|2,0,0]=3 176 B12R2.44 O=Cc1cc2OCSc2c[n]1 Amb24645392 [1,0,0,0,0,0|2,1,0]=4 177 B12R2.44 O=Cc1cc2OCSc2cc1 Amb25325201 [1,0,0,0,0,0|1,1,0]=3 178 B12R2.44 O=Cc1cc2SCOc2c[n]1 Amb21864679 [1,0,0,0,0,0|2,1,0]=4 179 B12R2.44 O=Cc1cc2[n][n]oc2cc1 Amb18202281 [1,0,0,0,0,0|3,0,0]=4 180 B12R2.44 O=Cc1cc2[n]coc2cc1 Amb18831438 [1,0,0,0,0,0|2,0,1]=4 181 B12R2.44 O=Cc1cc2c[n]oc2cc1 Amb18831430 [1,0,0,0,0,0|3,0,0]=4 182 B12R2.44 O=Cc1cc2oc[n]c2cc1 Amb18831439 [1,0,0,0,0,0|2,0,1]=4 183 B12R2.44 O=Cc1cc2occc2cc1 Amb18831461 [1,0,0,0,0,0|2,0,1]=4 184 B12R2.44 O=Cc1ccc2CCNc2c1 Amb18202304 [1,0,0,0,0,0|3,0,0]=4 185 B12R2.44 O=Cc1ccc2CCNc2c1 Amb21857958 [1,0,0,0,0,0|3,0,0]=4 186 B12R2.44 O=Cc1ccc2CCOc2c1 Amb18202266 [1,0,0,0,0,0|2,0,0]=3 187 B12R2.44 O=Cc1ccc2c(c1)CCO2 Amb2408258 [1,0,0,0,0,0|2,0,0]=3 188 B12R2.44 O=Cc1ccc2c(c1)OCO2 Amb1873767 [1,0,0,0,0,0|1,0,0]=2 189 B12R2.44 O=Nc1cc2OCOc2cc1 Amb25719400 [1,0,0,0,0,0|2,0,0]=3 190 B12R2.44 OCc1c[n]c2OCOc2c1 Amb24060668 [1,0,0,0,0,0|2,0,0]=3 191 B12R2.44 OCc1cc2CCNc2cc1 Amb25169264 [1,0,0,0,0,0|3,0,0]=4 192 B12R2.44 OCc1cc2OCSc2cc1 Amb24536120 [1,0,0,0,0,0|1,1,0]=3 193 B12R2.44 OCc1cc2SCOc2c[n]1 Amb21864665 [1,0,0,0,0,0|2,1,0]=4 194 B12R2.44 OCc1cc2[n]coc2cc1 Amb18632905 [1,0,0,0,0,0|2,0,1]=4 195 B12R2.44 OCc1cc2c[n]oc2cc1 Amb24593237 [1,0,0,0,0,0|3,0,0]=4 196 B12R2.44 OCc1cc2o[n]cc2cc1 Amb25710191 [1,0,0,0,0,0|3,0,0]=4 197 B12R2.44 OCc1cc2oc[n]c2cc1 Amb18114711 [1,0,0,0,0,0|2,0,1]=4 198 B12R2.44 OCc1cc2occc2cc1 Amb23399611 [1,0,0,0,0,0|2,0,1]=4 199 B12R2.44 OCc1ccc2CCOc2c1 Amb19516191 [1,0,0,0,0,0|2,0,0]=3 200 B12R2.44 OCc1ccc2c(c1)CCO2 Amb2445141 [1,0,0,0,0,0|2,0,0]=3 201 B12R2.44 SCc1cc2CCOc2cc1 Amb24538204 [1,0,0,0,0,0|2,0,0]=3 202 B12R2.44 SCc1ccc2c(c1)OCO2 Amb17400252 [1,0,0,0,0,0|1,0,0]=2 203 B12R2.44 [C-]#[N+]c1ccc2c(c1)OCO2 Amb1981070 [1,0,0,0,0,0|1,0,1]=3 204 B14R2.475 C=CCc1cc2C(O)CCc2cc1 Amb25045720 [0,1,0,0,0,0|2,0,0]=3 205 B14R2.475 CCCc1cc2C(=O)COc2cc1 Amb18184052 [0,1,0,0,0,0|1,0,2]=4 206 B14R2.475 CCCc1cc2C(N)COc2cc1 Amb18962507 [0,1,0,0,0,0|1,0,2]=4 207 B14R2.475 CCCc1cc2C(O)COc2cc1 Amb25109666 [0,1,0,0,0,0|1,0,2]=4 208 B14R2.475 CCCc1cc2[C@H](N)COc2cc1 Amb25072698 [0,1,0,0,0,0|1,0,2]=4 209 B14R2.475 C\C=C\c1cc2C(=O)COc2cc1 Amb24678234 [0,1,0,0,0,0|1,0,2]=4 210 B14R2.583 Br[Zn]Cc1cc2OCOc2cc1Br Amb13890849 [0,1,0,0,0,0|2,0,0]=3 211 B14R2.583 C=CCc1cc2CCCc2cc1O Amb25282787 [0,1,0,0,0,0|2,0,0]=3 212 B14R2.583 C=CCc1cc2OCOc2cc1O Amb25839255 [0,1,0,0,0,0|0,0,0]=1 213 B14R2.583 C=CCc1cc2SCCc2cc1O Amb25318946 [0,1,0,0,0,0|1,1,0]=3 214 B14R2.583 CCCc1cc2OCCc2cc1O Amb25723817 [0,1,0,0,0,0|1,0,2]=4 215 B14R2.583 CCCc1cc2OCOc2cc1N Amb21955461 [0,1,0,0,0,0|0,0,2]=3 216 B14R2.583 CNCc1cc2OCOc2cc1O Amb18288247 [0,1,0,0,0,0|1,0,1]=3 217 B14R2.583 CSCc1cc2OCOc2cc1Br Amb24720644 [0,1,0,0,0,0|1,0,1]=3 218 B14R2.583 C\C=C/c1cc2OCOc2cc1O Amb24456721 [0,1,0,0,0,0|0,0,2]=3 219 B14R2.583 C\C=C\c1cc2OCOc2cc1N Amb24563440 [0,1,0,0,0,0|0,0,2]=3 220 B14R2.583 Cc1cc2OCCc2cc1CCN Amb18142878 [0,1,0,0,0,0|2,0,1]=4 221 B14R2.583 Cc1cc2OCOc2cc1CCO Amb25674806 [0,1,0,0,0,0|1,0,1]=3 222 B14R2.583 Cc1cc2OCOc2cc1NCC Amb24591861 [0,1,0,0,0,0|1,0,2]=4 223 B14R2.583 Clc1cc2OCOc2cc1C[Zn]Cl Amb22897732 [0,1,0,0,0,0|2,0,0]=3 224 B14R2.583 N#CCc1cc2OCOc2cc1Br Amb10658476 [0,1,0,0,0,0|1,0,1]=3 225 B14R2.583 N#CCc1cc2OCOc2cc1Cl Amb10754749 [0,1,0,0,0,0|1,0,1]=3 226 B14R2.583 N#CCc1cc2OCOc2cc1F Amb24463776 [0,1,0,0,0,0|1,0,1]=3 227 B14R2.583 NCCc1cc2CCOc2cc1Cl Amb18675876 [0,1,0,0,0,0|2,0,1]=4 228 B14R2.583 NCCc1cc2CCOc2cc1F Amb18675883 [0,1,0,0,0,0|2,0,1]=4 229 B14R2.583 NCCc1cc2OCOc2cc1Cl Amb17199962 [0,1,0,0,0,0|1,0,1]=3 230 B14R2.583 NCCc1cc2OCOc2cc1F Amb19929567 [0,1,0,0,0,0|1,0,1]=3 231 B14R2.583 NCCc1cc2OCOc2cc1O Amb24378746 [0,1,0,0,0,0|1,0,1]=3 232 B14R2.583 NNCc1cc2OCOc2cc1Br Amb1113963 [0,1,0,0,0,0|2,0,0]=3 233 B14R2.583 NOCc1cc2OCOc2cc1Cl Amb22483237 [0,1,0,0,0,0|2,0,0]=3 234 B14R2.583 N\N=C\c1cc2OCOc2cc1Br Amb25050951 [0,1,0,0,0,0|2,0,1]=4 235 B14R2.583 N\N=C\c1cc2OCOc2cc1O Amb24396844 [0,1,0,0,0,0|2,0,1]=4 236 B14R2.583 Nc1cc2OCOc2cc1CC#N Amb24489040 [0,1,0,0,0,0|1,0,1]=3 237 B14R2.583 Nc1cc2OCOc2cc1\C=N\O Amb24519131 [0,1,0,0,0,0|2,0,1]=4 238 B14R2.583 ONCc1cc2OCOc2cc1Br Amb25775410 [0,1,0,0,0,0|2,0,0]=3 239 B14R2.583 O\N=C\c1cc2OCOc2cc1Br Amb2407337 [0,1,0,0,0,0|2,0,1]=4 240 B14R2.587 Brc1cc(CCBr)cc2CCOc12 Amb25719041 [0,1,0,0,0,0|2,0,1]=4 241 B14R2.587 C=CCc1cc2OCOc2c(O)c1 Amb24686403 [0,1,0,0,0,0|0,0,0]=1 242 B14R2.587 CSCc1cc2OCOc2c(Cl)c1 Amb24676443 [0,1,0,0,0,0|1,0,1]=3 243 B14R2.587 N#CCc1cc(Br)c2OCCc2c1 Amb25187790 [0,1,0,0,0,0|2,0,1]=4 244 B14R2.587 N#CCc1cc2OCOc2c(Br)c1 Amb25751965 [0,1,0,0,0,0|1,0,1]=3 245 B14R2.587 N#CCc1cc2OCOc2c(F)c1 Amb25262821 [0,1,0,0,0,0|1,0,1]=3 246 B14R2.587 N\N=C\c1cc(Cl)c2OCOc2c1 Amb24429684 [0,1,0,0,0,0|2,0,1]=4 247 B14R2.808 C=CCc1ccc2OCOc2c1O Amb24357239 [0,1,0,0,0,0|0,0,0]=1 248 B14R2.808 C=CCc1ccc2[s]ccc2c1O Amb24646536 [0,1,0,0,0,0|1,1,1]=4 249 B14R2.808 C=CCc1ccc2cc[s]c2c1O Amb25358812 [0,1,0,0,0,0|1,1,1]=4 250 B14R2.808 Cc1c(CCN)ccc2OCCc21 Amb18675939 [0,1,0,0,0,0|2,0,1]=4 251 B14R2.808 N#CCc1ccc2OCOc2c1O Amb25045167 [0,1,0,0,0,0|1,0,1]=3 252 B14R2.808 NCCc1ccc2OCCc2c1Cl Amb18675888 [0,1,0,0,0,0|2,0,1]=4 253 B14R2.808 NCCc1ccc2OCCc2c1F Amb18675907 [0,1,0,0,0,0|2,0,1]=4 254 B14R2.808 Nc1c2OCOc2ccc1\C=N\O Amb24489030 [0,1,0,0,0,0|2,0,1]=4 255 B14R2.966 BrCC(=O)c1ccc2c(c1)OCO2 Amb1159304 [0,1,0,0,0,0|1,0,2]=4 256 B14R2.966 BrCC(c1ccc2c(c1)OCO2)C Amb17256414 [0,1,0,0,0,0|1,0,1]=3 257 B14R2.966 BrCC(c1ccc2c(c1)OCO2)O Amb17206131 [0,1,0,0,0,0|1,0,1]=3 258 B14R2.966 C#CC(=O)c1cc2OCOc2cc1 Amb25192577 [0,1,0,0,0,0|0,0,3]=4 259 B14R2.966 C#CC(N)c1cc2CCOc2cc1 Amb25158899 [0,1,0,0,0,0|1,0,2]=4 260 B14R2.966 C#CC(O)c1cc2CCOc2cc1 Amb24575130 [0,1,0,0,0,0|1,0,2]=4 261 B14R2.966 C#CC(O)c1cc2OCOc2cc1 Amb24533821 [0,1,0,0,0,0|0,0,2]=3 262 B14R2.966 C#C[C@H](O)c1cc2OCOc2cc1 Amb24354381 [0,1,0,0,0,0|0,0,2]=3 263 B14R2.966 C=CC(=O)c1cc2CCCc2cc1 Amb18563978 [0,1,0,0,0,0|2,0,1]=4 264 B14R2.966 C=CC(=O)c1cc2CCNc2cc1 Amb24761201 [0,1,0,0,0,0|2,0,1]=4 265 B14R2.966 C=CC(=O)c1cc2OCOc2cc1 Amb18564036 [0,1,0,0,0,0|0,0,1]=2 266 B14R2.966 C=CC(=O)c1cc2[n]coc2cc1 Amb24494947 [0,1,0,0,0,0|1,0,2]=4 267 B14R2.966 C=CC(N)c1cc2CCNc2cc1 Amb25287974 [0,1,0,0,0,0|2,0,0]=3 268 B14R2.966 C=CC(N)c1cc2N=CCc2cc1 Amb24490784 [0,1,0,0,0,0|2,0,1]=4 269 B14R2.966 C=CC(N)c1cc2[nH]ccc2cc1 Amb24533894 [0,1,0,0,0,0|2,0,1]=4 270 B14R2.966 C=CC(N)c1cc2[s]ccc2cc1 Amb25034126 [0,1,0,0,0,0|1,1,1]=4 271 B14R2.966 C=CC(N)c1cc2ccoc2cc1 Amb24356020 [0,1,0,0,0,0|1,0,1]=3 272 B14R2.966 C=CC(N)c1cc2occc2cc1 Amb25683385 [0,1,0,0,0,0|1,0,1]=3 273 B14R2.966 C=CC(N)c1ccc2CCCc2[n]1 Amb25841769 [0,1,0,0,0,0|3,0,0]=4 274 B14R2.966 C=CC(O)c1cc2CCOc2cc1 Amb24594398 [0,1,0,0,0,0|1,0,0]=2 275 B14R2.966 C=C[C@@H](N)c1cc2CCNc2cc1 Amb24744397 [0,1,0,0,0,0|2,0,0]=3 276 B14R2.966 C=C[C@@H](N)c1cc2c[n][nH]c2cc1 Amb24471431 [0,1,0,0,0,0|3,0,0]=4 277 B14R2.966 C=C[C@@H](N)c1cc2cc[s]c2cc1 Amb25116938 [0,1,0,0,0,0|1,1,1]=4 278 B14R2.966 C=C[C@@H](N)c1cc2occc2cc1 Amb25119350 [0,1,0,0,0,0|1,0,1]=3 279 B14R2.966 C=C[C@@H](O)c1cc2CCOc2cc1 Amb24577065 [0,1,0,0,0,0|1,0,0]=2 280 B14R2.966 C=C[C@@H](O)c1cc2OCOc2cc1 Amb25153944 [0,1,0,0,0,0|0,0,0]=1 281 B14R2.966 C=C[C@H](N)c1cc2CCNc2cc1 Amb24744540 [0,1,0,0,0,0|2,0,0]=3 282 B14R2.966 C=C[C@H](N)c1cc2CCOc2cc1 Amb25817489 [0,1,0,0,0,0|1,0,0]=2 283 B14R2.966 C=C[C@H](N)c1cc2[nH]ccc2cc1 Amb25064273 [0,1,0,0,0,0|2,0,1]=4 284 B14R2.966 C=C[C@H](N)c1cc2cc[s]c2cc1 Amb24494144 [0,1,0,0,0,0|1,1,1]=4 285 B14R2.966 C=C[C@H](N)c1cc2occc2cc1 Amb25294483 [0,1,0,0,0,0|1,0,1]=3 286 B14R2.966 C=C[C@H](O)c1cc2CCOc2cc1 Amb25792344 [0,1,0,0,0,0|1,0,0]=2 287 B14R2.966 C=C[C@H](O)c1cc2OCOc2cc1 Amb25676393 [0,1,0,0,0,0|0,0,0]=1 288 B14R2.966 CC(C#N)c1cc2CCOc2cc1 Amb25339963 [0,1,0,0,0,0|2,0,1]=4 289 B14R2.966 CC(C=C)c1cc2cc[nH]c2cc1 Amb25311106 [0,1,0,0,0,0|2,0,1]=4 290 B14R2.966 CC(CN)c1cc2CCOc2cc1 Amb24533675 [0,1,0,0,0,0|2,0,1]=4 291 B14R2.966 CC(NN)c1ccc2CCOc2c1 Amb24434054 [0,1,0,0,0,0|3,0,0]=4 292 B14R2.966 CC(NO)c1cc2CCOc2cc1 Amb25352884 [0,1,0,0,0,0|3,0,0]=4 293 B14R2.966 CCC(Br)c1cc2CCOc2cc1 Amb24526460 [0,1,0,0,0,0|1,0,2]=4 294 B14R2.966 CCC(Cl)c1cc2CCOc2cc1 Amb18321600 [0,1,0,0,0,0|1,0,2]=4 295 B14R2.966 CCC(Cl)c1ccc2CCOc2c1 Amb25114880 [0,1,0,0,0,0|1,0,2]=4 296 B14R2.966 CCC(c1ccc2c(c1)CCO2)N Amb1108788 [0,1,0,0,0,0|1,0,2]=4 297 B14R2.966 CCC(c1ccc2c(c1)OCO2)N Amb1108947 [0,1,0,0,0,0|0,0,2]=3 298 B14R2.966 CCC(c1ccc2c(c1)OCO2)O Amb17194540 [0,1,0,0,0,0|0,0,2]=3 299 B14R2.966 CC[C@@H](N)c1ccc2CCOc2c1 Amb25837375 [0,1,0,0,0,0|1,0,2]=4 300 B14R2.966 CC[C@@H](O)c1cc2CCOc2cc1 Amb25340434 [0,1,0,0,0,0|1,0,2]=4 301 B14R2.966 CC[C@H](N)c1cc2OCOc2cc1 Amb25789503 [0,1,0,0,0,0|0,0,2]=3 302 B14R2.966 CC[C@H](O)c1cc2OCOc2cc1 Amb25126753 [0,1,0,0,0,0|0,0,2]=3 303 B14R2.966 CC[C@H](c1ccc2c(c1)OCO2)O Amb10845322 [0,1,0,0,0,0|0,0,2]=3 304 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 Amb2408120 [0,1,0,0,0,0|1,0,2]=4 305 B14R2.966 CNC(=S)c1cc2OCOc2cc1 Amb25246257 [0,1,0,0,0,0|1,0,2]=4 306 B14R2.966 CNC(C)c1ccc2CCOc2c1 Amb24433502 [0,1,0,0,0,0|2,0,1]=4 307 B14R2.966 CNC(c1ccc2c(c1)OCO2)C Amb1118739 [0,1,0,0,0,0|1,0,1]=3 308 B14R2.966 CN[C@@H](C)c1cc2CCOc2cc1 Amb24540544 [0,1,0,0,0,0|2,0,1]=4 309 B14R2.966 COC(=N)c1cc2OCOc2cc1 Amb18180899 [0,1,0,0,0,0|1,0,2]=4 310 B14R2.966 C[C@@H](C=C)c1cc2[nH]ccc2cc1 Amb25258456 [0,1,0,0,0,0|2,0,1]=4 311 B14R2.966 C[C@@H](NC)c1cc2OCOc2cc1 Amb24752643 [0,1,0,0,0,0|1,0,1]=3 312 B14R2.966 ClCC(=O)c1ccc2c(c1)OCO2 Amb17039760 [0,1,0,0,0,0|1,0,2]=4 313 B14R2.966 ClCC(Cl)c1cc2OCOc2cc1 Amb25068318 [0,1,0,0,0,0|1,0,1]=3 314 B14R2.966 ClCC(c1ccc2c(c1)OCO2)C Amb17236831 [0,1,0,0,0,0|1,0,1]=3 315 B14R2.966 ClCC(c1ccc2c(c1)OCO2)O Amb17194814 [0,1,0,0,0,0|1,0,1]=3 316 B14R2.966 FCC(c1ccc2c(c1)OCO2)N Amb2372615 [0,1,0,0,0,0|1,0,1]=3 317 B14R2.966 N#CC(=C)c1ccc2c(c1)OCO2 Amb17232928 [0,1,0,0,0,0|1,0,2]=4 318 B14R2.966 N#CC(=O)c1cc2OCOc2cc1 Amb24378979 [0,1,0,0,0,0|1,0,2]=4 319 B14R2.966 N#CC(Br)c1cc2CCOc2cc1 Amb24636505 [0,1,0,0,0,0|2,0,1]=4 320 B14R2.966 N#CC(Cl)c1cc2CCOc2cc1 Amb18317784 [0,1,0,0,0,0|2,0,1]=4 321 B14R2.966 N#CC(Cl)c1cc2OCOc2cc1 Amb23539609 [0,1,0,0,0,0|1,0,1]=3 322 B14R2.966 N#C[C@H](O)c1cc2OCOc2cc1 Amb24591768 [0,1,0,0,0,0|1,0,1]=3 323 B14R2.966 NC(CO)c1cc2CCOc2cc1 Amb18281707 [0,1,0,0,0,0|2,0,1]=4 324 B14R2.966 NC(CO)c1ccc2CCOc2c1 Amb25311252 [0,1,0,0,0,0|2,0,1]=4 325 B14R2.966 NCC(=O)c1ccc2c(c1)OCO2 Amb17194533 [0,1,0,0,0,0|1,0,2]=4 326 B14R2.966 NCC(F)c1cc2CCOc2cc1 Amb25156223 [0,1,0,0,0,0|2,0,1]=4 327 B14R2.966 NCC(F)c1cc2OCOc2cc1 Amb24589009 [0,1,0,0,0,0|1,0,1]=3 328 B14R2.966 NCC(F)c1ccc2CCOc2c1 Amb24738824 [0,1,0,0,0,0|2,0,1]=4 329 B14R2.966 NCC(N)c1ccc2CCOc2c1 Amb25737997 [0,1,0,0,0,0|2,0,1]=4 330 B14R2.966 NCC(O)c1cc2OCOc2cc1 Amb19889359 [0,1,0,0,0,0|1,0,1]=3 331 B14R2.966 NCC(O)c1ccc2CCOc2c1 Amb23586300 [0,1,0,0,0,0|2,0,1]=4 332 B14R2.966 NCC(c1ccc2c(c1)OCO2)O Amb1107906 [0,1,0,0,0,0|1,0,1]=3 333 B14R2.966 NC[C@@H](N)c1cc2CCOc2cc1 Amb25322375 [0,1,0,0,0,0|2,0,1]=4 334 B14R2.966 NC[C@@H](N)c1cc2OCOc2cc1 Amb25324348 [0,1,0,0,0,0|1,0,1]=3 335 B14R2.966 NC[C@H](N)c1cc2CCOc2cc1 Amb24346919 [0,1,0,0,0,0|2,0,1]=4 336 B14R2.966 NC[C@H](N)c1cc2OCOc2cc1 Amb25292172 [0,1,0,0,0,0|1,0,1]=3 337 B14R2.966 NC[C@H](N)c1ccc2CCOc2c1 Amb25839866 [0,1,0,0,0,0|2,0,1]=4 338 B14R2.966 NNC(=N)c1ccc2c(c1)OCO2 Amb10576607 [0,1,0,0,0,0|2,0,1]=4 339 B14R2.966 N[C@@H](C#N)c1cc2CCOc2cc1 Amb24534659 [0,1,0,0,0,0|2,0,1]=4 340 B14R2.966 N[C@@H](C#N)c1cc2OCOc2cc1 Amb25123400 [0,1,0,0,0,0|1,0,1]=3 341 B14R2.966 N[C@@H](CO)c1cc2CCOc2cc1 Amb25843750 [0,1,0,0,0,0|2,0,1]=4 342 B14R2.966 N[C@@H](CO)c1cc2OCOc2cc1 Amb24493913 [0,1,0,0,0,0|1,0,1]=3 343 B14R2.966 N[C@H](C#N)c1cc2OCOc2cc1 Amb24424636 [0,1,0,0,0,0|1,0,1]=3 344 B14R2.966 N[C@H](CF)c1cc2CCOc2cc1 Amb24597745 [0,1,0,0,0,0|2,0,1]=4 345 B14R2.966 N[C@H](CF)c1cc2OCOc2cc1 Amb25214250 [0,1,0,0,0,0|1,0,1]=3 346 B14R2.966 N[C@H](CO)c1cc2CCOc2cc1 Amb24493919 [0,1,0,0,0,0|2,0,1]=4 347 B14R2.966 N[C@H](CO)c1ccc2CCOc2c1 Amb24726217 [0,1,0,0,0,0|2,0,1]=4 348 B14R2.966 N\C(=C\O)\c1cc2OCOc2cc1 Amb25346216 [0,1,0,0,0,0|1,0,1]=3 349 B14R2.966 N\C(=N\N)\c1cc2OCOc2cc1 Amb18178634 [0,1,0,0,0,0|2,0,1]=4 350 B14R2.966 O=CC(=O)c1ccc2c(c1)OCO2 Amb10067938 [0,1,0,0,0,0|1,0,1]=3 351 B14R2.966 O=CC(c1ccc2c(c1)CCC2)C Amb17194490 [0,1,0,0,0,0|3,0,0]=4 352 B14R2.966 O=CC(c1ccc2c(c1)OCO2)C Amb17194520 [0,1,0,0,0,0|1,0,0]=2 353 B14R2.966 OC(C=O)c1cc2CCOc2cc1 Amb24756389 [0,1,0,0,0,0|2,0,0]=3 354 B14R2.966 OCC(=O)c1cc2OCOc2cc1 Amb18186524 [0,1,0,0,0,0|1,0,2]=4 355 B14R2.966 OCC(F)c1cc2OCOc2cc1 Amb25107709 [0,1,0,0,0,0|1,0,1]=3 356 B14R2.966 OCC(O)c1cc2CCOc2cc1 Amb25680005 [0,1,0,0,0,0|2,0,1]=4 357 B14R2.966 OCC(O)c1cc2OCOc2cc1 Amb18066054 [0,1,0,0,0,0|1,0,1]=3 358 B14R2.966 OCC(c1ccc2c(c1)OCO2)C Amb17233666 [0,1,0,0,0,0|1,0,1]=3 359 B14R2.966 OCC(c1ccc2c(c1)OCO2)N Amb2236326 [0,1,0,0,0,0|1,0,1]=3 360 B14R2.966 OC[C@@H](O)c1cc2OCOc2cc1 Amb24717105 [0,1,0,0,0,0|1,0,1]=3 361 B14R2.966 ON=C(Cl)c1cc2OCOc2cc1 Amb22445416 [0,1,0,0,0,0|2,0,1]=4 362 B14R2.966 ONC(=N)c1ccc2c(c1)OCO2 Amb17233653 [0,1,0,0,0,0|2,0,1]=4 363 B14R2.966 ONC(c1ccc2c(c1)OCO2)C Amb10606963 [0,1,0,0,0,0|2,0,0]=3 364 B14R2.966 O[C@@H](CCl)c1cc2OCOc2cc1 Amb25772965 [0,1,0,0,0,0|1,0,1]=3 365 B14R2.966 O[C@H](CCl)c1cc2OCOc2cc1 Amb20241556 [0,1,0,0,0,0|1,0,1]=3 366 B14R2.966 O\N=C(/c1ccc2c(c1)OCO2)\N Amb10075282 [0,1,0,0,0,0|2,0,1]=4 367 B14R2.966 O\N=C(\Cl)/c1cc2OCOc2cc1 Amb25797458 [0,1,0,0,0,0|2,0,1]=4 368 B14R2.966 SCC(=O)c1ccc2c(c1)OCO2 Amb16192493 [0,1,0,0,0,0|1,0,2]=4 369 B14R2.966 SCC(c1ccc2c(c1)OCO2)O Amb16192501 [0,1,0,0,0,0|1,0,1]=3 370 B14R2.966 [NH3+]CC(=O)c1cc2OCOc2cc1 Amb20669851 [0,1,0,0,0,0|1,0,2]=4 371 B14R2.991 BrCCCc1cc2CCOc2cc1 Amb25789276 [0,1,0,0,0,0|1,0,2]=4 372 B14R2.991 BrCCCc1ccc2c(c1)OCO2 Amb17104572 [0,1,0,0,0,0|0,0,2]=3 373 B14R2.991 BrC\C=C\c1cc2CCOc2cc1 Amb25337264 [0,1,0,0,0,0|1,0,2]=4 374 B14R2.991 BrC\C=C\c1cc2OCOc2cc1 Amb25785660 [0,1,0,0,0,0|0,0,2]=3 375 B14R2.991 C#CCCc1ccc2OCOc2c1 Amb18117987 [0,1,0,0,0,0|0,0,2]=3 376 B14R2.991 C#CCNc1cc2OCOc2cc1 Amb18284533 [0,1,0,0,0,0|0,0,2]=3 377 B14R2.991 C#CCOc1ccc2c(c1)OCO2 Amb2426770 [0,1,0,0,0,0|0,0,2]=3 378 B14R2.991 C=CCNc1cc2CCCc2cc1 Amb18795012 [0,1,0,0,0,0|2,0,0]=3 379 B14R2.991 C=CCNc1cc2COCc2cc1 Amb25721697 [0,1,0,0,0,0|3,0,0]=4 380 B14R2.991 C=CCNc1cc2[s]c[n]c2cc1 Amb25160814 [0,1,0,0,0,0|1,1,1]=4 381 B14R2.991 C=CCNc1cc2cc[s]c2cc1 Amb24489153 [0,1,0,0,0,0|1,1,1]=4 382 B14R2.991 C=CCNc1cc2occc2cc1 Amb24584034 [0,1,0,0,0,0|1,0,1]=3 383 B14R2.991 C=CCNc1ccc2c(c1)OCO2 Amb17306202 [0,1,0,0,0,0|0,0,0]=1 384 B14R2.991 C=CCOc1cc2CSCc2cc1 Amb25350978 [0,1,0,0,0,0|3,0,0]=4 385 B14R2.991 C=CCOc1cc2[nH]c[n]c2cc1 Amb24586604 [0,1,0,0,0,0|2,0,1]=4 386 B14R2.991 C=CCOc1cc2[s]ccc2cc1 Amb24091100 [0,1,0,0,0,0|1,1,1]=4 387 B14R2.991 C=CCOc1cc2cc[s]c2cc1 Amb24091088 [0,1,0,0,0,0|1,1,1]=4 388 B14R2.991 C=C\C=C\c1cc2OCOc2cc1 Amb25339292 [0,1,0,0,0,0|0,0,1]=2 389 B14R2.991 CC/C=C/c1ccc2OCOc2c1 Amb17939595 [0,1,0,0,0,0|0,0,2]=3 390 B14R2.991 CCNCc1cc2OCCc2cc1 Amb25760883 [0,1,0,0,0,0|1,0,2]=4 391 B14R2.991 CCNCc1ccc2OCOc2c1 Amb21962570 [0,1,0,0,0,0|0,0,2]=3 392 B14R2.991 CCNCc1ccc2c(c1)OCO2 Amb1214320 [0,1,0,0,0,0|0,0,2]=3 393 B14R2.991 CC\N=C\c1cc2OCOc2cc1 Amb25246008 [0,1,0,0,0,0|0,0,3]=4 394 B14R2.991 CN/N=C/c1ccc2OCOc2c1 Amb17705181 [0,1,0,0,0,0|1,0,2]=4 395 B14R2.991 CNCCc1cc2CCOc2cc1 Amb18675440 [0,1,0,0,0,0|1,0,2]=4 396 B14R2.991 CNCCc1cc2OCCc2cc1 Amb24337418 [0,1,0,0,0,0|1,0,2]=4 397 B14R2.991 CNCCc1ccc2c(c1)OCO2 Amb17400706 [0,1,0,0,0,0|0,0,2]=3 398 B14R2.991 CNNCc1cc2OCOc2cc1 Amb24741324 [0,1,0,0,0,0|1,0,1]=3 399 B14R2.991 COCCc1ccc2OCOc2c1 Amb25119789 [0,1,0,0,0,0|0,0,2]=3 400 B14R2.991 CONCc1ccc2OCOc2c1 Amb22897026 [0,1,0,0,0,0|1,0,1]=3 401 B14R2.991 C\C=N\Nc1cc2CCOc2cc1 Amb24573038 [0,1,0,0,0,0|2,0,1]=4 402 B14R2.991 ClCC#Cc1cc2OCOc2cc1 Amb25109228 [0,1,0,0,0,0|0,0,3]=4 403 B14R2.991 ClCCCc1cc2CCOc2cc1 Amb25791583 [0,1,0,0,0,0|1,0,2]=4 404 B14R2.991 ClCCCc1ccc2CCOc2c1 Amb25336939 [0,1,0,0,0,0|1,0,2]=4 405 B14R2.991 ClCCCc1ccc2c(c1)OCO2 Amb17104544 [0,1,0,0,0,0|0,0,2]=3 406 B14R2.991 ClCCNc1ccc2c(c1)OCO2 Amb17337473 [0,1,0,0,0,0|1,0,1]=3 407 B14R2.991 ClC\C=C\c1cc2CCOc2cc1 Amb25690080 [0,1,0,0,0,0|1,0,2]=4 408 B14R2.991 ClC\C=C\c1cc2OCOc2cc1 Amb25295530 [0,1,0,0,0,0|0,0,2]=3 409 B14R2.991 N#CC#Cc1cc2OCOc2cc1 Amb25157229 [0,1,0,0,0,0|0,0,3]=4 410 B14R2.991 N#CCCc1ccc2OCOc2c1 Amb18862910 [0,1,0,0,0,0|0,0,2]=3 411 B14R2.991 N#CCOc1ccc2c(c1)OCO2 Amb1089806 [0,1,0,0,0,0|1,0,1]=3 412 B14R2.991 N#CNCc1ccc2OCOc2c1 Amb18178233 [0,1,0,0,0,0|1,0,1]=3 413 B14R2.991 N#C\C=C\c1cc2CCOc2cc1 Amb24397490 [0,1,0,0,0,0|1,0,2]=4 414 B14R2.991 N#C\C=C\c1cc2OCOc2cc1 Amb24674466 [0,1,0,0,0,0|0,0,2]=3 415 B14R2.991 NCCCc1c[n]c2OCOc2c1 Amb25237163 [0,1,0,0,0,0|1,0,2]=4 416 B14R2.991 NCCCc1cc2CCOc2cc1 Amb18981392 [0,1,0,0,0,0|1,0,2]=4 417 B14R2.991 NCCCc1cc2OCOc2cc1 Amb24055795 [0,1,0,0,0,0|0,0,2]=3 418 B14R2.991 NCCCc1ccc2CCOc2c1 Amb18195905 [0,1,0,0,0,0|1,0,2]=4 419 B14R2.991 NCCNc1ccc2c(c1)OCO2 Amb17091078 [0,1,0,0,0,0|1,0,1]=3 420 B14R2.991 NCCSc1ccc2c(c1)OCO2 Amb17083037 [0,1,0,0,0,0|1,0,1]=3 421 B14R2.991 NC\C=C\c1cc2OCOc2cc1 Amb18065654 [0,1,0,0,0,0|0,0,2]=3 422 B14R2.991 NNCCc1ccc2c(c1)OCO2 Amb17400771 [0,1,0,0,0,0|1,0,1]=3 423 B14R2.991 O=C=NCc1cc2CCOc2cc1 Amb24464653 [0,1,0,0,0,0|2,0,1]=4 424 B14R2.991 O=CCCc1cc2CCOc2cc1 Amb25772414 [0,1,0,0,0,0|1,0,1]=3 425 B14R2.991 O=CCCc1cc2ccoc2cc1 Amb24606846 [0,1,0,0,0,0|1,0,2]=4 426 B14R2.991 O=CCCc1ccc2c(c1)OCO2 Amb17081687 [0,1,0,0,0,0|0,0,1]=2 427 B14R2.991 O=CCSc1cc2CCCc2cc1 Amb19079075 [0,1,0,0,0,0|3,0,0]=4 428 B14R2.991 O=CCSc1ccc2c(c1)OCO2 Amb17082925 [0,1,0,0,0,0|1,0,0]=2 429 B14R2.991 O=CNCc1ccc2c(c1)OCO2 Amb2093111 [0,1,0,0,0,0|1,0,0]=2 430 B14R2.991 O=C\C=C\c1cc2CCOc2cc1 Amb24489926 [0,1,0,0,0,0|1,0,1]=3 431 B14R2.991 O=C\C=C\c1ccc2c(c1)OCO2 Amb1784438 [0,1,0,0,0,0|0,0,1]=2 432 B14R2.991 OCCCc1ccc2CCOc2c1 Amb25060220 [0,1,0,0,0,0|1,0,2]=4 433 B14R2.991 OCCCc1ccc2c(c1)OCO2 Amb17089509 [0,1,0,0,0,0|0,0,2]=3 434 B14R2.991 OCCNc1cc2CCOc2cc1 Amb24556482 [0,1,0,0,0,0|2,0,1]=4 435 B14R2.991 OCCNc1cc2OCOc2cc1 Amb19959300 [0,1,0,0,0,0|1,0,1]=3 436 B14R2.991 OC\C=C\c1cc2CCOc2cc1 Amb25057901 [0,1,0,0,0,0|1,0,2]=4 437 B14R2.991 OC\C=C\c1cc2OCOc2cc1 Amb22173831 [0,1,0,0,0,0|0,0,2]=3 438 B14R2.991 OC\N=C\c1cc2OCOc2cc1 Amb19866565 [0,1,0,0,0,0|1,0,2]=4 439 B14R2.991 S=CNCc1ccc2OCOc2c1 Amb25690198 [0,1,0,0,0,0|1,0,0]=2 440 B14R2.991 SCCCc1cc2CCOc2cc1 Amb24473210 [0,1,0,0,0,0|1,0,2]=4 441 B14R2.991 SCCCc1ccc2c(c1)OCO2 Amb17402126 [0,1,0,0,0,0|0,0,2]=3 442 B14R2.991 SCCOc1ccc2c(c1)OCO2 Amb17236743 [0,1,0,0,0,0|1,0,1]=3 443 B14R2.991 [N-]=[N+]=NCc1ccc2OCOc2c1 Amb18790808 [0,1,0,0,0,0|2,0,0]=3 444 B14R2.1008 BrC(Br)=Cc1cc2OCOc2cc1 Amb24491662 [0,1,0,0,0,0|1,0,1]=3 445 B14R2.1008 CC(=O)Cc1cc2CCCc2cc1 Amb18243588 [0,1,0,0,0,0|2,0,1]=4 446 B14R2.1008 CC(=O)Cc1cc2CCOc2cc1 Amb24368926 [0,1,0,0,0,0|1,0,1]=3 447 B14R2.1008 CC(=O)Cc1cc2[n]coc2cc1 Amb18893602 [0,1,0,0,0,0|1,0,2]=4 448 B14R2.1008 CC(=O)Cc1cc2ccoc2cc1 Amb25767854 [0,1,0,0,0,0|1,0,2]=4 449 B14R2.1008 CC(=O)Cc1cc2oc[n]c2cc1 Amb18243605 [0,1,0,0,0,0|1,0,2]=4 450 B14R2.1008 CC(=O)Cc1cc2occc2cc1 Amb22054403 [0,1,0,0,0,0|1,0,2]=4 451 B14R2.1008 CC(=O)Nc1cc2CCOc2cc1 Amb25820839 [0,1,0,0,0,0|2,0,1]=4 452 B14R2.1008 CC(=O)Nc1ccc2CCOc2c1 Amb23399922 [0,1,0,0,0,0|2,0,1]=4 453 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 Amb1196404 [0,1,0,0,0,0|1,0,1]=3 454 B14R2.1008 CC(=O)Oc1ccc2c(c1)OCC2 Amb10564579 [0,1,0,0,0,0|2,0,1]=4 455 B14R2.1008 CC(=S)Nc1ccc2c(c1)OCO2 Amb1150918 [0,1,0,0,0,0|1,0,1]=3 456 B14R2.1008 CC(Br)Cc1ccc2OCOc2c1 Amb17940336 [0,1,0,0,0,0|0,0,2]=3 457 B14R2.1008 CC(Cl)Cc1ccc2OCOc2c1 Amb18049254 [0,1,0,0,0,0|0,0,2]=3 458 B14R2.1008 CC(N)Cc1cc2CCOc2cc1 Amb19373562 [0,1,0,0,0,0|1,0,2]=4 459 B14R2.1008 CC(N)Cc1cc2OCCc2cc1 Amb21927116 [0,1,0,0,0,0|1,0,2]=4 460 B14R2.1008 CC(N)Cc1cc2OCCc2cc1 Amb21963891 [0,1,0,0,0,0|1,0,2]=4 461 B14R2.1008 CC(N)Cc1ccc2OCOc2c1 Amb22362931 [0,1,0,0,0,0|0,0,2]=3 462 B14R2.1008 CC(O)Cc1cc2CCOc2cc1 Amb24531837 [0,1,0,0,0,0|1,0,2]=4 463 B14R2.1008 CC(O)Cc1ccc2OCOc2c1 Amb24496826 [0,1,0,0,0,0|0,0,2]=3 464 B14R2.1008 CC(O)Nc1cc2OCOc2cc1 Amb25241532 [0,1,0,0,0,0|1,0,2]=4 465 B14R2.1008 CN(C)Cc1ccc2OCOc2c1 Amb21962584 [0,1,0,0,0,0|1,0,1]=3 466 B14R2.1008 CN(N)Cc1ccc2OCOc2c1 Amb18564124 [0,1,0,0,0,0|1,0,1]=3 467 B14R2.1008 CS(=O)Cc1ccc2OCOc2c1 Amb25086228 [0,1,0,0,0,0|1,0,1]=3 468 B14R2.1008 C[C@@H](N)Cc1cc2CCOc2cc1 Amb25192698 [0,1,0,0,0,0|1,0,2]=4 469 B14R2.1008 C[C@@H](O)Cc1cc2CCOc2cc1 Amb22896910 [0,1,0,0,0,0|1,0,2]=4 470 B14R2.1008 C[C@@H](O)Cc1ccc2OCOc2c1 Amb20241606 [0,1,0,0,0,0|0,0,2]=3 471 B14R2.1008 C[C@H](N)Cc1cc2CCOc2cc1 Amb24579494 [0,1,0,0,0,0|1,0,2]=4 472 B14R2.1008 C[C@H](O)Cc1ccc2OCOc2c1 Amb24432879 [0,1,0,0,0,0|0,0,2]=3 473 B14R2.1008 FC(Oc1ccc2c(c1)OCO2)F Amb17234483 [0,1,0,0,0,0|2,0,1]=4 474 B14R2.1008 FC(Sc1ccc2c(c1)OCO2)F Amb17237955 [0,1,0,0,0,0|2,0,1]=4 475 B14R2.1008 NC(=N)Cc1cc2CCCc2cc1 Amb25289812 [0,1,0,0,0,0|3,0,0]=4 476 B14R2.1008 NC(=N)Cc1cc2ccoc2cc1 Amb23560653 [0,1,0,0,0,0|2,0,1]=4 477 B14R2.1008 NC(=N)Nc1cc2OCOc2cc1 Amb21961675 [0,1,0,0,0,0|2,0,0]=3 478 B14R2.1008 NC(=O)Cc1cc2CCOc2cc1 Amb24182080 [0,1,0,0,0,0|2,0,0]=3 479 B14R2.1008 NC(=O)Cc1cc2[n]coc2cc1 Amb18243641 [0,1,0,0,0,0|2,0,1]=4 480 B14R2.1008 NC(=O)Cc1cc2oc[n]c2cc1 Amb18243640 [0,1,0,0,0,0|2,0,1]=4 481 B14R2.1008 NC(=O)Cc1ccc2c(c1)OCO2 Amb17400688 [0,1,0,0,0,0|1,0,0]=2 482 B14R2.1008 NC(=O)Nc1cc2CCOc2cc1 Amb25180302 [0,1,0,0,0,0|3,0,0]=4 483 B14R2.1008 NC(=O)Nc1ccc2c(c1)OCO2 Amb1155414 [0,1,0,0,0,0|2,0,0]=3 484 B14R2.1008 NC(=S)Cc1ccc2c(c1)OCO2 Amb17402019 [0,1,0,0,0,0|1,0,0]=2 485 B14R2.1008 NC(=S)Nc1cc2CCOc2cc1 Amb25702536 [0,1,0,0,0,0|3,0,0]=4 486 B14R2.1008 NC(=S)Nc1ccc2c(c1)OCO2 Amb2418873 [0,1,0,0,0,0|2,0,0]=3 487 B14R2.1008 O=C(Cl)Cc1cc2CCOc2cc1 Amb25674657 [0,1,0,0,0,0|2,0,0]=3 488 B14R2.1008 O=C(F)Cc1ccc2OCOc2c1 Amb25266077 [0,1,0,0,0,0|1,0,0]=2 489 B14R2.1008 OC(=O)Cc1cc2CCSc2cc1 Amb18130095 [0,1,0,0,0,0|2,1,0]=4 490 B14R2.1008 OC(=O)Cc1cc2OCOc2c[n]1 Amb18193411 [0,1,0,0,0,0|2,0,0]=3 491 B14R2.1008 OC(=O)Cc1cc2SCCc2cc1 Amb18814743 [0,1,0,0,0,0|2,1,0]=4 492 B14R2.1008 OC(=O)Cc1cc2ccoc2cc1 Amb18197066 [0,1,0,0,0,0|2,0,1]=4 493 B14R2.1008 OC(=O)Cc1cc2occc2cc1 Amb18197053 [0,1,0,0,0,0|2,0,1]=4 494 B14R2.1008 OC(=O)Cc1ccc2c(c1)CCO2 Amb1106297 [0,1,0,0,0,0|2,0,0]=3 495 B14R2.1008 OC(=O)Cc1ccc2c(c1)OCC2 Amb19134335 [0,1,0,0,0,0|2,0,0]=3 496 B14R2.1008 OC(=O)Cc1ccc2c(c1)nco2 Amb2420231 [0,1,0,0,0,0|2,0,1]=4 497 B14R2.1008 OC(=O)Cc1ccc2c(c1)ocn2 Amb17131033 [0,1,0,0,0,0|2,0,1]=4 498 B14R2.6400 CC1Cc2cc(CCN)ccc2O1 Amb18195929 [0,1,0,0,0,0|2,0,1]=4 499 B14R2.6400 CC1Cc2ccc(CCN)cc2O1 Amb18824973 [0,1,0,0,0,0|2,0,1]=4 500 B14R2.6400 CNCc1cc2OC(C)Cc2cc1 Amb25820075 [0,1,0,0,0,0|2,0,1]=4 501 B14R2.6400 NC1Oc2cc(CCO)ccc2O1 Amb22756326 [0,1,0,0,0,0|1,0,1]=3 502 B14R2.6400 NC1Oc2cc(CCO)ccc2O1 Amb24543998 [0,1,0,0,0,0|1,0,1]=3 503 B14R2.6412 C=CCc1cc2CCC(=O)c2cc1 Amb25192347 [0,1,0,0,0,0|2,0,0]=3 504 B14R2.6412 C=CCc1cc2CCC(O)c2cc1 Amb25332095 [0,1,0,0,0,0|2,0,0]=3 505 B12R1.116 CCCc1ccc(cc1)CCO Amb17232496 [0,0,1,0,0,0|1,0,2]=4 506 B12R1.116 CCOc1ccc(CCN)cc1 Amb22265796 [0,0,1,0,0,0|2,0,1]=4 507 B12R1.116 CCOc1ccc(C[Mg]Cl)cc1 Amb22000560 [0,0,1,0,0,0|3,0,0]=4 508 B12R1.116 CCOc1ccc(C[Zn]Cl)cc1 Amb22000460 [0,0,1,0,0,0|3,0,0]=4 509 B12R1.116 CCOc1ccc(cc1)CC=O Amb17089534 [0,0,1,0,0,0|2,0,0]=3 510 B12R1.116 N#CCc1ccc(cc1)OCCl Amb24713288 [0,0,1,0,0,0|2,0,1]=4 511 B12R1.116 NCCc1ccc(cc1)OCC Amb1131086 [0,0,1,0,0,0|2,0,1]=4 512 B12R1.116 OCCc1ccc(cc1)NC=O Amb18792636 [0,0,1,0,0,0|3,0,0]=4 513 B12R1.116 SCCc1ccc(cc1)OCC Amb17400952 [0,0,1,0,0,0|2,0,1]=4 514 B12R1.278 C=CCc1cc(ccc1)N=C=O Amb25039226 [0,0,1,0,0,0|1,0,2]=4 515 B12R1.278 C=CCc1cc(ccc1)N=C=S Amb25208558 [0,0,1,0,0,0|1,1,1]=4 516 B12R1.278 CCOc1cccc(c1)CC=O Amb17089533 [0,0,1,0,0,0|2,0,0]=3 517 B12R1.278 NCCc1cccc(CCO)c1 Amb17777550 [0,0,1,0,0,0|2,0,1]=4 518 B12R1.278 OCCc1cc(ccc1)NC=O Amb25115347 [0,0,1,0,0,0|3,0,0]=4 519 B12R1.278 OCCc1cccc(c1)OCC Amb17089520 [0,0,1,0,0,0|2,0,1]=4 520 B12R1.286 C=CCc1ccc(O)c(CO)c1 Amb25158127 [0,0,1,0,0,0|2,0,0]=3 521 B12R1.286 C=CCc1ccc(c(c1)OC)O Amb1211895 [0,0,1,0,0,0|0,0,0]=1 522 B12R1.286 CCCc1cc(CC)c(O)cc1 Amb24625381 [0,0,1,0,0,0|1,0,2]=4 523 B12R1.286 CCc1cc(CC=C)ccc1Cl Amb24426839 [0,0,1,0,0,0|2,0,0]=3 524 B12R1.286 CCc1cc(CC=C)ccc1O Amb25035032 [0,0,1,0,0,0|1,0,0]=2 525 B12R1.286 CCc1cc(ccc1O)NC=O Amb25159268 [0,0,1,0,0,0|3,0,0]=4 526 B12R1.286 CN=Cc1cc(OC)c(O)cc1 Amb24065707 [0,0,1,0,0,0|1,0,2]=4 527 B12R1.286 CNCc1cc(OC)c(Cl)cc1 Amb25246003 [0,0,1,0,0,0|2,0,1]=4 528 B12R1.286 CNCc1cc(OC)c(F)cc1 Amb25798292 [0,0,1,0,0,0|2,0,1]=4 529 B12R1.286 CNCc1ccc(c(c1)OC)O Amb1115180 [0,0,1,0,0,0|1,0,1]=3 530 B12R1.286 COCc1cc(OC)c(N)cc1 Amb24084547 [0,0,1,0,0,0|2,0,1]=4 531 B12R1.286 COCc1cc(OC)c(O)cc1 Amb18646892 [0,0,1,0,0,0|1,0,1]=3 532 B12R1.286 COc1cc(CC#N)ccc1Br Amb23401420 [0,0,1,0,0,0|2,0,1]=4 533 B12R1.286 COc1cc(CC#N)ccc1I Amb22456297 [0,0,1,0,0,0|2,0,1]=4 534 B12R1.286 COc1cc(CC#N)ccc1N Amb25347369 [0,0,1,0,0,0|2,0,1]=4 535 B12R1.286 COc1cc(CC=C)c[n]c1Cl Amb25299388 [0,0,1,0,0,0|2,0,0]=3 536 B12R1.286 COc1cc(CC=C)ccc1Cl Amb25751292 [0,0,1,0,0,0|1,0,0]=2 537 B12R1.286 COc1cc(CC=C)ccc1F Amb24341763 [0,0,1,0,0,0|1,0,0]=2 538 B12R1.286 COc1cc(CCBr)ccc1Cl Amb24700727 [0,0,1,0,0,0|2,0,1]=4 539 B12R1.286 COc1cc(CCN)ccc1Br Amb20621486 [0,0,1,0,0,0|2,0,1]=4 540 B12R1.286 COc1cc(CCN)ccc1Br Amb22284372 [0,0,1,0,0,0|2,0,1]=4 541 B12R1.286 COc1cc(CCN)ccc1Cl Amb18909513 [0,0,1,0,0,0|2,0,1]=4 542 B12R1.286 COc1cc(CCN)ccc1F Amb18826047 [0,0,1,0,0,0|2,0,1]=4 543 B12R1.286 COc1cc(CCN)ccc1F Amb22395139 [0,0,1,0,0,0|2,0,1]=4 544 B12R1.286 COc1cc(CCN)ccc1N Amb24756651 [0,0,1,0,0,0|2,0,1]=4 545 B12R1.286 COc1cc(CCO)ccc1Br Amb25280180 [0,0,1,0,0,0|2,0,1]=4 546 B12R1.286 COc1cc(CCO)ccc1F Amb24713679 [0,0,1,0,0,0|2,0,1]=4 547 B12R1.286 COc1cc(CCO)ccc1N Amb25093156 [0,0,1,0,0,0|2,0,1]=4 548 B12R1.286 COc1cc(CNN)ccc1Br Amb24063609 [0,0,1,0,0,0|3,0,0]=4 549 B12R1.286 COc1cc(CNN)ccc1F Amb21954053 [0,0,1,0,0,0|3,0,0]=4 550 B12R1.286 COc1cc(CNN)ccc1F Amb22009048 [0,0,1,0,0,0|3,0,0]=4 551 B12R1.286 COc1cc(CON)ccc1Br Amb24368625 [0,0,1,0,0,0|3,0,0]=4 552 B12R1.286 COc1cc(CON)ccc1I Amb25156630 [0,0,1,0,0,0|3,0,0]=4 553 B12R1.286 COc1cc(ccc1O)OC=O Amb18646844 [0,0,1,0,0,0|2,0,0]=3 554 B12R1.286 C\C=C\c1ccc(c(c1)OC)O Amb1215258 [0,0,1,0,0,0|0,0,2]=3 555 B12R1.286 Cc1ccc(CCN)cc1OC Amb18646388 [0,0,1,0,0,0|2,0,1]=4 556 B12R1.286 Cc1ccc(CON)cc1OC Amb24368624 [0,0,1,0,0,0|3,0,0]=4 557 B12R1.286 N#CCc1ccc(c(c1)OC)C Amb1672451 [0,0,1,0,0,0|2,0,1]=4 558 B12R1.286 N#CCc1ccc(c(c1)OC)Cl Amb16192003 [0,0,1,0,0,0|2,0,1]=4 559 B12R1.286 N#CCc1ccc(c(c1)OC)F Amb16186008 [0,0,1,0,0,0|2,0,1]=4 560 B12R1.286 N#CSc1ccc(c(c1)OC)O Amb2196497 [0,0,1,0,0,0|2,0,1]=4 561 B12R1.286 NNCc1ccc(c(c1)OC)F Amb10841874 [0,0,1,0,0,0|3,0,0]=4 562 B12R1.286 O=CCc1ccc(c(c1)OC)O Amb13883641 [0,0,1,0,0,0|1,0,0]=2 563 B12R1.286 OCCc1ccc(c(c1)OC)O Amb2099567 [0,0,1,0,0,0|1,0,1]=3 564 B12R1.288 C=CCc1ccc(c(c1)O)C=O Amb17607821 [0,0,1,0,0,0|2,0,0]=3 565 B12R1.288 CC=Cc1ccc(OC)c(O)c1 Amb24065712 [0,0,1,0,0,0|0,0,2]=3 566 B12R1.288 CCCc1ccc(SC)c(O)c1 Amb25825361 [0,0,1,0,0,0|0,1,2]=4 567 B12R1.288 CCCc1ccc(c(c1)N)OC Amb17138588 [0,0,1,0,0,0|1,0,2]=4 568 B12R1.288 CCCc1ccc(c(c1)O)CC Amb17594077 [0,0,1,0,0,0|1,0,2]=4 569 B12R1.288 CCSc1cc(O)c(cc1)OC Amb24471419 [0,0,1,0,0,0|1,0,2]=4 570 B12R1.288 CCc1ccc(COC)cc1O Amb18646546 [0,0,1,0,0,0|2,0,1]=4 571 B12R1.288 CNCc1ccc(OC)c(N)c1 Amb24663378 [0,0,1,0,0,0|2,0,1]=4 572 B12R1.288 CNCc1ccc(c(c1)C)OC Amb15705098 [0,0,1,0,0,0|2,0,1]=4 573 B12R1.288 CNCc1ccc(c(c1)Cl)OC Amb11014349 [0,0,1,0,0,0|2,0,1]=4 574 B12R1.288 CNCc1ccc(c(c1)F)OC Amb1106045 [0,0,1,0,0,0|2,0,1]=4 575 B12R1.288 CNCc1ccc(c(c1)O)OC Amb1076078 [0,0,1,0,0,0|1,0,1]=3 576 B12R1.288 COCc1ccc(OC)c(O)c1 Amb24497016 [0,0,1,0,0,0|1,0,1]=3 577 B12R1.288 COCc1ccc(SC)c(O)c1 Amb25693968 [0,0,1,0,0,0|1,1,1]=4 578 B12R1.288 COc1ccc(CC#N)cc1N Amb24068376 [0,0,1,0,0,0|2,0,1]=4 579 B12R1.288 COc1ccc(CC#N)cc1O Amb18645793 [0,0,1,0,0,0|1,0,1]=3 580 B12R1.288 COc1ccc(CC=C)cc1Br Amb25857978 [0,0,1,0,0,0|1,0,0]=2 581 B12R1.288 COc1ccc(CC=C)cc1N Amb24070981 [0,0,1,0,0,0|1,0,0]=2 582 B12R1.288 COc1ccc(CC=O)cc1Br Amb24665048 [0,0,1,0,0,0|2,0,0]=3 583 B12R1.288 COc1ccc(CC=O)cc1Cl Amb25265358 [0,0,1,0,0,0|2,0,0]=3 584 B12R1.288 COc1ccc(CC=O)cc1F Amb18793022 [0,0,1,0,0,0|2,0,0]=3 585 B12R1.288 COc1ccc(CCBr)cc1Br Amb18241382 [0,0,1,0,0,0|2,0,1]=4 586 B12R1.288 COc1ccc(CCBr)cc1Cl Amb18876253 [0,0,1,0,0,0|2,0,1]=4 587 B12R1.288 COc1ccc(CCBr)cc1F Amb24094299 [0,0,1,0,0,0|2,0,1]=4 588 B12R1.288 COc1ccc(CCCl)cc1Br Amb18228282 [0,0,1,0,0,0|2,0,1]=4 589 B12R1.288 COc1ccc(CCCl)cc1Cl Amb18225085 [0,0,1,0,0,0|2,0,1]=4 590 B12R1.288 COc1ccc(CCCl)cc1F Amb19060250 [0,0,1,0,0,0|2,0,1]=4 591 B12R1.288 COc1ccc(CCN)cc1Br Amb22395127 [0,0,1,0,0,0|2,0,1]=4 592 B12R1.288 COc1ccc(CCN)cc1Cl Amb22347969 [0,0,1,0,0,0|2,0,1]=4 593 B12R1.288 COc1ccc(CCN)cc1F Amb24089807 [0,0,1,0,0,0|2,0,1]=4 594 B12R1.288 COc1ccc(CCN)cc1N Amb18908686 [0,0,1,0,0,0|2,0,1]=4 595 B12R1.288 COc1ccc(CC[NH3+])cc1O Amb17778406 [0,0,1,0,0,0|1,0,1]=3 596 B12R1.288 COc1ccc(CNN)cc1O Amb24420632 [0,0,1,0,0,0|2,0,0]=3 597 B12R1.288 COc1ccc(CNO)cc1F Amb24601192 [0,0,1,0,0,0|3,0,0]=4 598 B12R1.288 COc1ccc(CON)cc1Cl Amb18649701 [0,0,1,0,0,0|3,0,0]=4 599 B12R1.288 COc1ccc(CON)cc1I Amb25352709 [0,0,1,0,0,0|3,0,0]=4 600 B12R1.288 COc1ccc(CSC)cc1Br Amb24633682 [0,0,1,0,0,0|2,0,1]=4 601 B12R1.288 COc1ccc(CSC)cc1N Amb18290077 [0,0,1,0,0,0|2,0,1]=4 602 B12R1.288 COc1ccc(C[Mg]Cl)cc1F Amb22000581 [0,0,1,0,0,0|3,0,0]=4 603 B12R1.288 COc1ccc(\C=N\N)cc1O Amb25343486 [0,0,1,0,0,0|2,0,1]=4 604 B12R1.288 COc1ccc(cc1Br)NC=O Amb25771918 [0,0,1,0,0,0|3,0,0]=4 605 B12R1.288 COc1ccc(cc1Cl)NC=O Amb25852018 [0,0,1,0,0,0|3,0,0]=4 606 B12R1.288 COc1ccc(cc1O)N=[N+]=[N-] Amb25122730 [0,0,1,0,0,0|3,0,0]=4 607 B12R1.288 COc1ccc(cc1O)OCC Amb18055999 [0,0,1,0,0,0|1,0,2]=4 608 B12R1.288 C\C=C/c1ccc(OC)c(O)c1 Amb24532743 [0,0,1,0,0,0|0,0,2]=3 609 B12R1.288 C\C=C/c1ccc(c(c1)N)OC Amb16205971 [0,0,1,0,0,0|1,0,2]=4 610 B12R1.288 Cc1cc(CC=C)ccc1NC Amb25109269 [0,0,1,0,0,0|2,0,0]=3 611 B12R1.288 Cc1cc(CCBr)ccc1OC Amb18049373 [0,0,1,0,0,0|2,0,1]=4 612 B12R1.288 Cc1cc(CCCl)ccc1OC Amb18049742 [0,0,1,0,0,0|2,0,1]=4 613 B12R1.288 Cc1cc(C[Mg]Cl)ccc1OC Amb22897315 [0,0,1,0,0,0|3,0,0]=4 614 B12R1.288 Cc1cc(C[Zn]Cl)ccc1OC Amb22897817 [0,0,1,0,0,0|3,0,0]=4 615 B12R1.288 Cc1cc(\C=C/Cl)ccc1OC Amb24650955 [0,0,1,0,0,0|2,0,1]=4 616 B12R1.288 Cc1cc(\C=C\Cl)ccc1OC Amb24652328 [0,0,1,0,0,0|2,0,1]=4 617 B12R1.288 Cl[Zn]Cc1ccc(c(c1)F)OC Amb13890837 [0,0,1,0,0,0|3,0,0]=4 618 B12R1.288 N#CCc1ccc(c(c1)F)OC Amb1659228 [0,0,1,0,0,0|2,0,1]=4 619 B12R1.288 NNCc1ccc(c(c1)Br)OC Amb1113416 [0,0,1,0,0,0|3,0,0]=4 620 B12R1.288 NNCc1ccc(c(c1)C)OC Amb17400210 [0,0,1,0,0,0|3,0,0]=4 621 B12R1.288 NNCc1ccc(c(c1)Cl)OC Amb17401090 [0,0,1,0,0,0|3,0,0]=4 622 B12R1.288 O=CCc1ccc(c(c1)O)OC Amb17089542 [0,0,1,0,0,0|1,0,0]=2 623 B12R1.288 OCCc1ccc(c(c1)Br)OC Amb17249275 [0,0,1,0,0,0|2,0,1]=4 624 B12R1.288 OCCc1ccc(c(c1)C)OC Amb17232591 [0,0,1,0,0,0|2,0,1]=4 625 B12R1.288 OCCc1ccc(c(c1)Cl)OC Amb17234354 [0,0,1,0,0,0|2,0,1]=4 626 B12R1.288 OCCc1ccc(c(c1)F)OC Amb17232737 [0,0,1,0,0,0|2,0,1]=4 627 B12R1.288 OCCc1ccc(c(c1)O)OC Amb17089525 [0,0,1,0,0,0|1,0,1]=3 628 B12R1.288 O\N=C\c1ccc(c(c1)O)OC Amb1101519 [0,0,1,0,0,0|2,0,1]=4 629 B12R1.288 SCCc1ccc(c(c1)Br)OC Amb17473036 [0,0,1,0,0,0|2,0,1]=4 630 B12R1.288 SCCc1ccc(c(c1)C)OC Amb17400953 [0,0,1,0,0,0|2,0,1]=4 631 B12R1.288 SCCc1ccc(c(c1)Cl)OC Amb17402624 [0,0,1,0,0,0|2,0,1]=4 632 B12R1.288 SCCc1ccc(c(c1)F)OC Amb17401080 [0,0,1,0,0,0|2,0,1]=4 633 B14R3.3015 C1OC1c2cc3CCOc3cc2 Amb18798095 [0,0,0,1,0,0|2,0,1]=4 634 B14R3.3015 C1OC1c2cc3OCCc3cc2 Amb23586296 [0,0,0,1,0,0|2,0,1]=4 635 B14R3.3015 C1Oc2c(O1)cc(cc2)C3CO3 Amb1127751 [0,0,0,1,0,0|1,0,1]=3 636 B14R3.3015 C1Oc2cc(ccc2O1)C3CN3 Amb18862568 [0,0,0,1,0,0|1,0,1]=3 637 B14R3.3015 C1Oc2cc(ccc2O1)[C@H]3CO3 Amb25822548 [0,0,0,1,0,0|1,0,1]=3 638 B14R3.3015 C1Oc2ccc(cc2O1)N3N=N3 Amb17777642 [0,0,0,1,0,0|3,0,0]=4 639 B14R3.3022 C1C=2OCOC2C=C3N=CN=C31 Amb24079207 [0,0,0,1,0,0|2,0,1]=4 640 B14R3.3022 C1C=Cc2cc3CCCc3cc21 Amb24535984 [0,0,0,1,0,0|2,0,0]=3 641 B14R3.3022 C1C=Cc2cc3ccoc3cc21 Amb24066298 [0,0,0,1,0,0|1,0,1]=3 642 B14R3.3022 C1C=Cc2cc3o[n]cc3cc21 Amb24090185 [0,0,0,1,0,0|2,0,0]=3 643 B14R3.3022 C1C=Cc2cc3oc[n]c3cc21 Amb24090186 [0,0,0,1,0,0|1,0,1]=3 644 B14R3.3022 C1C=Cc2cc3occc3cc21 Amb24090184 [0,0,0,1,0,0|1,0,1]=3 645 B14R3.3022 C1C=Nc2cc3ccoc3cc21 Amb24066294 [0,0,0,1,0,0|2,0,1]=4 646 B14R3.3022 C1C=c2cc3C=NC=c3cc2O1 Amb24100761 [0,0,0,1,0,0|2,0,1]=4 647 B14R3.3022 C1C=c2cc3N=CC=c3cc2O1 Amb24100760 [0,0,0,1,0,0|2,0,0]=3 648 B14R3.3022 C1CCc2cc3occc3cc21 Amb24071781 [0,0,0,1,0,0|3,0,0]=4 649 B14R3.3022 C1CNc2cc3cc[s]c3cc21 Amb24468885 [0,0,0,1,0,0|3,0,0]=4 650 B14R3.3022 C1COc2cc3occc3cc21 Amb24101566 [0,0,0,1,0,0|2,0,0]=3 651 B14R3.3022 C1Cc2c(C1)cc3c(c2)OCO3 Amb17232403 [0,0,0,1,0,0|0,0,2]=3 652 B14R3.3022 C1Cc2c(O1)cc3c(c2)OCC3 Amb17620444 [0,0,0,1,0,0|2,0,1]=4 653 B14R3.3022 C1Cc2cc3OCCc3cc2N1 Amb25233905 [0,0,0,1,0,0|2,0,1]=4 654 B14R3.3022 C1N=Cc2cc3oc[n]c3cc21 Amb24090209 [0,0,0,1,0,0|2,0,1]=4 655 B14R3.3022 C1N=c2cc3C=CC=c3cc2O1 Amb24100784 [0,0,0,1,0,0|1,0,1]=3 656 B14R3.3022 C1N=c2cc3C=CC=c3cc2S1 Amb24100785 [0,0,0,1,0,0|1,1,1]=4 657 B14R3.3022 C1N=c2cc3C=CN=c3cc2O1 Amb24061222 [0,0,0,1,0,0|2,0,0]=3 658 B14R3.3022 C1N=c2cc3C=CN=c3cc2S1 Amb24061221 [0,0,0,1,0,0|2,1,0]=4 659 B14R3.3022 C1N=c2cc3C=NC=c3cc2O1 Amb24061226 [0,0,0,1,0,0|2,0,1]=4 660 B14R3.3022 C1N=c2cc3N=CC=c3cc2O1 Amb24061217 [0,0,0,1,0,0|2,0,0]=3 661 B14R3.3022 C1N=c2cc3N=CC=c3cc2S1 Amb24061216 [0,0,0,1,0,0|2,1,0]=4 662 B14R3.3022 C1N=c2cc3N=CN=c3cc2O1 Amb24100772 [0,0,0,1,0,0|3,0,0]=4 663 B14R3.3022 C1NCc2cc3OCCc3cc21 Amb18829941 [0,0,0,1,0,0|2,0,1]=4 664 B14R3.3022 C1NCc2cc3OCOc3cc21 Amb23399687 [0,0,0,1,0,0|1,0,1]=3 665 B14R3.3022 C1NOc2cc3[nH]ccc3cc21 Amb24593811 [0,0,0,1,0,0|3,0,0]=4 666 B14R3.3022 C1Nc2cc3[nH]ccc3cc2S1 Amb24439557 [0,0,0,1,0,0|2,1,0]=4 667 B14R3.3022 C1Oc2c(O1)cc3c(c2)[nH]nn3 Amb10244532 [0,0,0,1,0,0|3,0,0]=4 668 B14R3.3022 C1Oc2c[n]3c[n]cc3cc2O1 Amb24060673 [0,0,0,1,0,0|2,0,1]=4 669 B14R3.3022 C1Oc2cc3=NCN=c3cc2O1 Amb24091709 [0,0,0,1,0,0|2,0,1]=4 670 B14R3.3022 C1Oc2cc3CCNc3cc2O1 Amb18829467 [0,0,0,1,0,0|1,0,1]=3 671 B14R3.3022 C1Oc2cc3c[n][nH]c3cc2O1 Amb24330437 [0,0,0,1,0,0|2,0,0]=3 672 B14R3.3022 C1Oc2cc3cc[s]c3cc2O1 Amb25034958 [0,0,0,1,0,0|1,0,0]=2 673 B14R3.3022 c1[nH]oc2cc3cccc3cc21 Amb24100783 [0,0,0,1,0,0|2,0,1]=4 674 B14R3.3022 c1c2[nH]ccc2cc3ccoc31 Amb24066295 [0,0,0,1,0,0|2,0,1]=4 675 B14R3.3022 c1c2ccoc2cc3occc31 Amb24095689 [0,0,0,1,0,0|2,0,1]=4 676 B14R3.3022 c1c2o[n]cc2cc3[nH]ccc31 Amb25712164 [0,0,0,1,0,0|3,0,0]=4 677 B14R3.3022 c1c2o[n]cc2cc3occc31 Amb25071715 [0,0,0,1,0,0|3,0,0]=4 678 B14R3.3022 c1c2occc2cc3[nH]ccc31 Amb24090177 [0,0,0,1,0,0|2,0,1]=4 679 B14R3.3022 c1c2occc2cc3c[n]oc31 Amb25072389 [0,0,0,1,0,0|3,0,0]=4 680 B14R3.3022 c1c2occc2cc3occc31 Amb24095683 [0,0,0,1,0,0|2,0,1]=4 681 B14R3.3046 C1C=C2N=CN=C2C=3OCOC31 Amb24079206 [0,0,0,1,0,0|2,0,1]=4 682 B14R3.3046 C1C=Cc2c1ccc3ccoc32 Amb24081694 [0,0,0,1,0,0|1,0,1]=3 683 B14R3.3046 C1C=c2c(ccc3N=CC=c32)O1 Amb24100762 [0,0,0,1,0,0|2,0,0]=3 684 B14R3.3046 C1C=c2ccc3=CC=Nc3c2O1 Amb24100763 [0,0,0,1,0,0|2,0,1]=4 685 B14R3.3046 C1C=c2ccc3=CN=Cc3c2O1 Amb24100755 [0,0,0,1,0,0|2,0,1]=4 686 B14R3.3046 C1C=c2ccc3=NC=Cc3c2O1 Amb24100759 [0,0,0,1,0,0|2,0,0]=3 687 B14R3.3046 C1C=c2ccc3=NN=Cc3c2O1 Amb24100758 [0,0,0,1,0,0|3,0,0]=4 688 B14R3.3046 C1CNc2c3cc[nH]c3ccc21 Amb18830476 [0,0,0,1,0,0|3,0,0]=4 689 B14R3.3046 C1CNc2c3cc[s]c3ccc21 Amb18197100 [0,0,0,1,0,0|3,0,0]=4 690 B14R3.3046 C1CNc2c3ccoc3ccc21 Amb18830385 [0,0,0,1,0,0|3,0,0]=4 691 B14R3.3046 C1CNc2ccc3[nH]ccc3c21 Amb18830467 [0,0,0,1,0,0|3,0,0]=4 692 B14R3.3046 C1COc2ccc3cc[nH]c3c21 Amb24074006 [0,0,0,1,0,0|2,0,1]=4 693 B14R3.3046 C1N=Cc2c1ccc3[n]coc23 Amb24081699 [0,0,0,1,0,0|2,0,1]=4 694 B14R3.3046 C1N=Cc2c1ccc3oc[n]c23 Amb24081698 [0,0,0,1,0,0|2,0,1]=4 695 B14R3.3046 C1N=c2c(ccc3C=CC=c32)O1 Amb24100781 [0,0,0,1,0,0|1,0,1]=3 696 B14R3.3046 C1N=c2c(ccc3N=CC=c23)O1 Amb24061220 [0,0,0,1,0,0|2,0,0]=3 697 B14R3.3046 C1N=c2c3=CN=Cc3ccc2O1 Amb24061224 [0,0,0,1,0,0|2,0,1]=4 698 B14R3.3046 C1N=c2c3=NC=Cc3ccc2O1 Amb24061215 [0,0,0,1,0,0|2,0,1]=4 699 B14R3.3046 C1N=c2c3=NC=Nc3ccc2O1 Amb24100770 [0,0,0,1,0,0|3,0,0]=4 700 B14R3.3046 C1N=c2ccc3=CN=Cc3c2O1 Amb24061227 [0,0,0,1,0,0|2,0,1]=4 701 B14R3.3046 C1N=c2ccc3=NC=Cc3c2O1 Amb24061219 [0,0,0,1,0,0|2,0,0]=3 702 B14R3.3046 C1N=c2ccc3=NC=Cc3c2S1 Amb24061218 [0,0,0,1,0,0|2,1,0]=4 703 B14R3.3046 C1N=c2ccc3=NC=Nc3c2O1 Amb24100774 [0,0,0,1,0,0|3,0,0]=4 704 B14R3.3046 C1N=c2ccc3=NN=Cc3c2O1 Amb24100797 [0,0,0,1,0,0|3,0,0]=4 705 B14R3.3046 C1NCc2c3OCOc3ccc21 Amb18829456 [0,0,0,1,0,0|1,0,1]=3 706 B14R3.3046 C1Nc2c(ccc3[nH]ccc23)O1 Amb25079064 [0,0,0,1,0,0|2,0,0]=3 707 B14R3.3046 C1Nc2c3[nH]ccc3ccc2O1 Amb25225563 [0,0,0,1,0,0|2,0,1]=4 708 B14R3.3046 C1Nc2ccc3[nH]ccc3c2O1 Amb25083396 [0,0,0,1,0,0|2,0,0]=3 709 B14R3.3046 C1Nc2ccc3[nH]ccc3c2S1 Amb24704251 [0,0,0,1,0,0|2,1,0]=4 710 B14R3.3046 C1OC=2C=CC3N=NC=C3C2O1 Amb24083203 [0,0,0,1,0,0|2,0,1]=4 711 B14R3.3046 C1Oc2c[n]c3ccc[n]3c2O1 Amb24060663 [0,0,0,1,0,0|2,0,1]=4 712 B14R3.3046 C1Oc2ccc3[n]occ3c2O1 Amb24060677 [0,0,0,1,0,0|2,0,0]=3 713 B14R3.3046 C1Oc2ccc3o[n]cc3c2O1 Amb24060675 [0,0,0,1,0,0|2,0,0]=3 714 B14R3.3046 c1[nH]oc2c3cc[n]c3ccc21 Amb24694635 [0,0,0,1,0,0|3,0,0]=4 715 B14R3.3046 c1[nH]oc2c3cccc3ccc21 Amb24100782 [0,0,0,1,0,0|2,0,1]=4 716 B14R3.3046 c1[n]c2c3cc[nH]c3ccc2o1 Amb25700808 [0,0,0,1,0,0|2,0,1]=4 717 B14R3.3046 c1[n]c2ccc3occc3c2o1 Amb25048468 [0,0,0,1,0,0|2,0,1]=4 718 B14R3.3046 c1[n]oc2c3cc[s]c3ccc21 Amb24367901 [0,0,0,1,0,0|3,0,0]=4 719 B14R3.3046 c1[n]oc2c3ccoc3ccc21 Amb25206208 [0,0,0,1,0,0|3,0,0]=4 720 B14R3.3046 c1cc2c(ccc3occc32)[nH]1 Amb24081691 [0,0,0,1,0,0|2,0,1]=4 721 B14R3.3046 c1cc2occc2c3ccoc31 Amb24092823 [0,0,0,1,0,0|2,0,1]=4 722 B14R3.3046 c1coc2c3ccoc3ccc21 Amb24095682 [0,0,0,1,0,0|2,0,1]=4 723 B14R3.7848 O=C1Cc2ccc3CCCc3c21 Amb25320109 [0,0,0,1,0,0|3,0,0]=4 724 B14R3.8268 ClC1Cc2cc3OCOc3cc21 Amb21948326 [0,0,0,1,0,0|1,0,1]=3 725 B14R3.8268 O=C1Cc2cc3OCOc3cc12 Amb17850797 [0,0,0,1,0,0|1,0,0]=2 726 B12R2.39 NCCc1cc2OCOc2[s]1 Amb25722048 [0,0,0,0,1,0|2,0,1]=4 727 B14R2.112 BrCCc1cc2CCCOc2cc1 Amb18228832 [0,0,0,0,0,1|2,0,1]=4 728 B14R2.112 BrCCc1cc2OCCOc2cc1 Amb25827311 [0,0,0,0,0,1|1,0,1]=3 729 B14R2.112 C=CCc1cc2CCCNc2cc1 Amb25804738 [0,0,0,0,0,1|2,0,0]=3 730 B14R2.112 C=CCc1cc2cc[n]cc2cc1 Amb24655452 [0,0,0,0,0,1|2,0,1]=4 731 B14R2.112 CCCc1ccc2c(c1)NCCO2 Amb17570253 [0,0,0,0,0,1|1,0,2]=4 732 B14R2.112 CCOc1cc2OCCOc2cc1 Amb25818420 [0,0,0,0,0,1|1,0,2]=4 733 B14R2.112 CCSc1cc2OCCOc2cc1 Amb24335121 [0,0,0,0,0,1|1,0,2]=4 734 B14R2.112 CNCc1cc2CCOCc2cc1 Amb24461139 [0,0,0,0,0,1|2,0,1]=4 735 B14R2.112 CNCc1cc2OCCOc2c[n]1 Amb23455869 [0,0,0,0,0,1|2,0,1]=4 736 B14R2.112 CNCc1ccc2c(c1)NCCO2 Amb17570298 [0,0,0,0,0,1|2,0,1]=4 737 B14R2.112 CNCc1ccc2c(c1)OCCO2 Amb2009792 [0,0,0,0,0,1|1,0,1]=3 738 B14R2.112 CSCc1ccc2OCCOc2c1 Amb25818140 [0,0,0,0,0,1|1,0,1]=3 739 B14R2.112 ClCCc1cc2CCCOc2cc1 Amb18864099 [0,0,0,0,0,1|2,0,1]=4 740 B14R2.112 ClCCc1cc2OCCOc2cc1 Amb18322116 [0,0,0,0,0,1|1,0,1]=3 741 B14R2.112 ClCSc1cc2OCCOc2cc1 Amb24409831 [0,0,0,0,0,1|2,0,1]=4 742 B14R2.112 N#CCc1cc2CCCOc2cc1 Amb18224430 [0,0,0,0,0,1|2,0,1]=4 743 B14R2.112 N#CCc1ccc2NCCOc2c1 Amb24702633 [0,0,0,0,0,1|2,0,1]=4 744 B14R2.112 N#CNc1cc2OCCOc2cc1 Amb18185960 [0,0,0,0,0,1|2,0,1]=4 745 B14R2.112 NCCc1cc2CCOCc2cc1 Amb18195925 [0,0,0,0,0,1|2,0,1]=4 746 B14R2.112 NCCc1cc2COCCc2cc1 Amb18195924 [0,0,0,0,0,1|2,0,1]=4 747 B14R2.112 NCCc1cc2COCOc2cc1 Amb18194708 [0,0,0,0,0,1|1,0,1]=3 748 B14R2.112 NCCc1cc2OCCNc2cc1 Amb25682433 [0,0,0,0,0,1|2,0,1]=4 749 B14R2.112 NCCc1ccc2COCOc2c1 Amb18194705 [0,0,0,0,0,1|1,0,1]=3 750 B14R2.112 NCCc1ccc2c(c1)CCCO2 Amb17578295 [0,0,0,0,0,1|2,0,1]=4 751 B14R2.112 NCCc1ccc2c(c1)NCCO2 Amb17199883 [0,0,0,0,0,1|2,0,1]=4 752 B14R2.112 NCCc1ccc2c(c1)OCCO2 Amb1105676 [0,0,0,0,0,1|1,0,1]=3 753 B14R2.112 NOCc1ccc2OCCCc2c1 Amb25705191 [0,0,0,0,0,1|3,0,0]=4 754 B14R2.112 N\N=C\c1cc2OCCOc2cc1 Amb24618589 [0,0,0,0,0,1|2,0,1]=4 755 B14R2.112 O=CCc1ccc2c(c1)OCCO2 Amb17089537 [0,0,0,0,0,1|1,0,0]=2 756 B14R2.112 OCCc1cc2CCCOc2cc1 Amb18224605 [0,0,0,0,0,1|2,0,1]=4 757 B14R2.112 OCCc1ccc2c(c1)OCCO2 Amb17089521 [0,0,0,0,0,1|1,0,1]=3 758 B14R2.112 ONCc1cc2CCCOc2cc1 Amb24397208 [0,0,0,0,0,1|3,0,0]=4 759 B14R2.112 S=C=Nc1ccc2c(c1)OCCO2 Amb1157178 [0,0,0,0,0,1|2,0,1]=4 760 B14R2.112 SCCc1ccc2c(c1)OCCO2 Amb17402133 [0,0,0,0,0,1|1,0,1]=3 761 B14R2.112 [C-]#[N+]Cc1cc2CCCOc2cc1 Amb25689017 [0,0,0,0,0,1|2,0,1]=4 762 B11R1.83 C=CCc1ccc(C=O)cc1 Amb18124790 [1,0,1,0,0,0|0,0,2]=4 763 B11R1.83 C=CCc1ccc(CBr)c[n]1 Amb24536138 [1,0,1,0,0,0|2,0,0]=4 764 B11R1.83 C=CCc1ccc(CCl)c[n]1 Amb25311464 [1,0,1,0,0,0|2,0,0]=4 765 B11R1.83 C=CCc1ccc(CN)[n]c1 Amb25335344 [1,0,1,0,0,0|2,0,0]=4 766 B11R1.83 C=CCc1ccc(CN)cc1 Amb24647871 [1,0,1,0,0,0|1,0,0]=3 767 B11R1.83 C=Cc1ccc(CCBr)cc1 Amb25046693 [1,0,1,0,0,0|2,0,0]=4 768 B11R1.83 C=Cc1ccc(CCN)cc1 Amb18644346 [1,0,1,0,0,0|2,0,0]=4 769 B11R1.83 C=Cc1ccc(CCO)[n]c1 Amb24675619 [1,0,1,0,0,0|2,0,0]=4 770 B11R1.83 C=Cc1ccc(cc1)OCO Amb24068621 [1,0,1,0,0,0|0,0,0]=2 771 B11R1.83 CCCc1ccc(C=C)cc1 Amb20407515 [1,0,1,0,0,0|2,0,0]=4 772 B11R1.83 CCCc1ccc(cc1)CO Amb17232074 [1,0,1,0,0,0|0,0,2]=4 773 B11R1.83 CCOc1ccc(C=C)[n]c1 Amb25126890 [1,0,1,0,0,0|2,0,0]=4 774 B11R1.83 CCOc1ccc(C=C)c[n]1 Amb23446338 [1,0,1,0,0,0|2,0,0]=4 775 B11R1.83 CCOc1ccc(CI)cc1 Amb24550390 [1,0,1,0,0,0|2,0,0]=4 776 B11R1.83 CCOc1ccc(cc1)C=O Amb1351324 [1,0,1,0,0,0|2,0,0]=4 777 B11R1.83 CCOc1ccc(cc1)CBr Amb1105844 [1,0,1,0,0,0|2,0,0]=4 778 B11R1.83 CCOc1ccc(cc1)CC Amb15690898 [1,0,1,0,0,0|1,0,1]=4 779 B11R1.83 CCOc1ccc(cc1)CCl Amb1105731 [1,0,1,0,0,0|2,0,0]=4 780 B11R1.83 CCOc1ccc(cc1)CN Amb1117462 [1,0,1,0,0,0|2,0,0]=4 781 B11R1.83 CCOc1ccc(cc1)CN Amb2099457 [1,0,1,0,0,0|2,0,0]=4 782 B11R1.83 CCOc1ccc(cc1)CO Amb2132302 [1,0,1,0,0,0|2,0,0]=4 783 B11R1.83 CCOc1ccc(cc1)CS Amb17400288 [1,0,1,0,0,0|2,0,0]=4 784 B11R1.83 CCOc1ccc(cc1)N=C Amb24621829 [1,0,1,0,0,0|2,0,0]=4 785 B11R1.83 CCc1ccc(cc1)CC=O Amb17089530 [1,0,1,0,0,0|2,0,0]=4 786 B11R1.83 CCc1ccc(cc1)OC=C Amb25267482 [1,0,1,0,0,0|2,0,0]=4 787 B11R1.83 CNCc1ccc(CO)cc1 Amb19649770 [1,0,1,0,0,0|1,0,1]=4 788 B11R1.83 CNCc1ccc(cc1)OC Amb10069043 [1,0,1,0,0,0|1,0,1]=4 789 B11R1.83 CNCc1ccc(cc1)OC Amb2370575 [1,0,1,0,0,0|1,0,1]=4 790 B11R1.83 COCc1ccc(CO)cc1 Amb22295888 [1,0,1,0,0,0|1,0,1]=4 791 B11R1.83 COc1ccc(CC=C)c[n]1 Amb24738377 [1,0,1,0,0,0|1,0,0]=3 792 B11R1.83 COc1ccc(CCBr)cc1 Amb20671126 [1,0,1,0,0,0|1,0,1]=4 793 B11R1.83 COc1ccc(CCI)cc1 Amb25151259 [1,0,1,0,0,0|1,0,1]=4 794 B11R1.83 COc1ccc(CCN)cc1 Amb20621532 [1,0,1,0,0,0|1,0,1]=4 795 B11R1.83 COc1ccc(CC[NH3+])cc1 Amb24123059 [1,0,1,0,0,0|1,0,1]=4 796 B11R1.83 COc1ccc(CNN)cc1 Amb19515860 [1,0,1,0,0,0|2,0,0]=4 797 B11R1.83 COc1ccc(CNO)cc1 Amb22233225 [1,0,1,0,0,0|2,0,0]=4 798 B11R1.83 COc1ccc(CNO)cc1 Amb22235218 [1,0,1,0,0,0|2,0,0]=4 799 B11R1.83 COc1ccc(CON)cc1 Amb19889167 [1,0,1,0,0,0|2,0,0]=4 800 B11R1.83 COc1ccc(C[Mg]Cl)cc1 Amb19886362 [1,0,1,0,0,0|2,0,0]=4 801 B11R1.83 COc1ccc(C[Zn]Cl)cc1 Amb22000454 [1,0,1,0,0,0|2,0,0]=4 802 B11R1.83 COc1ccc(\C=C\I)cc1 Amb25323773 [1,0,1,0,0,0|1,0,1]=4 803 B11R1.83 COc1ccc(\C=C\O)cc1 Amb24068817 [1,0,1,0,0,0|1,0,1]=4 804 B11R1.83 COc1ccc(cc1)CC#N Amb1220313 [1,0,1,0,0,0|1,0,1]=4 805 B11R1.83 COc1ccc(cc1)CO[NH3+] Amb2424116 [1,0,1,0,0,0|2,0,0]=4 806 B11R1.83 COc1ccc(cc1)SC=C Amb10808994 [1,0,1,0,0,0|1,0,0]=3 807 B11R1.83 CSc1ccc(CC=O)cc1 Amb18635884 [1,0,1,0,0,0|1,1,0]=4 808 B11R1.83 C\C=C\c1ccc(CO)cc1 Amb25792430 [1,0,1,0,0,0|0,0,2]=4 809 B11R1.83 ClCCc1ccc(cc1)OC Amb1210118 [1,0,1,0,0,0|1,0,1]=4 810 B11R1.83 FCOc1ccc(CCl)cc1 Amb24622836 [1,0,1,0,0,0|2,0,0]=4 811 B11R1.83 N#CCc1ccc(CO)cc1 Amb25760686 [1,0,1,0,0,0|1,0,1]=4 812 B11R1.83 NCCc1ccc(CO)cc1 Amb22755754 [1,0,1,0,0,0|1,0,1]=4 813 B11R1.83 NCCc1ccc(cc1)CO Amb10603292 [1,0,1,0,0,0|1,0,1]=4 814 B11R1.83 NNCc1ccc(CO)cc1 Amb24069099 [1,0,1,0,0,0|2,0,0]=4 815 B11R1.83 NOCc1ccc(CO)cc1 Amb24468005 [1,0,1,0,0,0|2,0,0]=4 816 B11R1.83 NOCc1ccc(cc1)OC Amb17091437 [1,0,1,0,0,0|2,0,0]=4 817 B11R1.83 OCCc1ccc(C=O)cc1 Amb21963895 [1,0,1,0,0,0|2,0,0]=4 818 B11R1.83 OCCc1ccc(CO)cc1 Amb22001673 [1,0,1,0,0,0|1,0,1]=4 819 B11R1.83 OCCc1ccc(cc1)CC Amb17089517 [1,0,1,0,0,0|1,0,1]=4 820 B11R1.83 OCNc1ccc(C=O)cc1 Amb24103241 [1,0,1,0,0,0|2,0,0]=4 821 B11R1.83 OCc1ccc(CCCl)cc1 Amb25765666 [1,0,1,0,0,0|1,0,1]=4 822 B11R1.83 OCc1ccc(cc1)NC=O Amb25769716 [1,0,1,0,0,0|2,0,0]=4 823 B11R1.83 OCc1ccc(cc1)OC=O Amb25343823 [1,0,1,0,0,0|2,0,0]=4 824 B11R1.83 OCc1ccc(cc1)OCF Amb25847798 [1,0,1,0,0,0|2,0,0]=4 825 B11R1.83 SCCc1ccc(cc1)OC Amb17400287 [1,0,1,0,0,0|1,0,1]=4 826 B11R1.189 C=CCc1cc(C=O)ccc1 Amb25066956 [1,0,1,0,0,0|0,0,2]=4 827 B11R1.189 C=CCc1cc(CCl)c[n]c1 Amb24433831 [1,0,1,0,0,0|2,0,0]=4 828 B11R1.189 C=CCc1cc(CCl)cc[n]1 Amb25760653 [1,0,1,0,0,0|2,0,0]=4 829 B11R1.189 C=CCc1cc(CCl)ccc1 Amb25077232 [1,0,1,0,0,0|1,0,0]=3 830 B11R1.189 C=CCc1cc(CN)c[n]c1 Amb25143982 [1,0,1,0,0,0|2,0,0]=4 831 B11R1.189 C=CCc1cc(CO)ccc1 Amb24682182 [1,0,1,0,0,0|0,0,0]=2 832 B11R1.189 C=Cc1cccc(CCN)c1 Amb25292174 [1,0,1,0,0,0|2,0,0]=4 833 B11R1.189 C=Cc1cccc(CCO)[n]1 Amb24360605 [1,0,1,0,0,0|2,0,0]=4 834 B11R1.189 CCCc1cc(CO)ccc1 Amb25340766 [1,0,1,0,0,0|0,0,2]=4 835 B11R1.189 CCCc1cccc(c1)OC Amb10601909 [1,0,1,0,0,0|0,0,2]=4 836 B11R1.189 CCNc1cccc(C=C)c1 Amb24486040 [1,0,1,0,0,0|2,0,0]=4 837 B11R1.189 CCOc1cc(C=C)cc[n]1 Amb25121853 [1,0,1,0,0,0|2,0,0]=4 838 B11R1.189 CCOc1cc[n]c(C=C)c1 Amb24091484 [1,0,1,0,0,0|2,0,0]=4 839 B11R1.189 CCOc1cccc(C=C)[n]1 Amb24487079 [1,0,1,0,0,0|2,0,0]=4 840 B11R1.189 CCOc1cccc(C=C)c1 Amb25151360 [1,0,1,0,0,0|1,0,0]=3 841 B11R1.189 CCOc1cccc(c1)CN Amb1130363 [1,0,1,0,0,0|2,0,0]=4 842 B11R1.189 CCc1cc(CC=C)cc[n]1 Amb24091165 [1,0,1,0,0,0|2,0,0]=4 843 B11R1.189 CCc1cccc(CC=C)c1 Amb25757508 [1,0,1,0,0,0|1,0,0]=3 844 B11R1.189 CCc1cccc(CC=O)c1 Amb25688093 [1,0,1,0,0,0|2,0,0]=4 845 B11R1.189 CNCc1cc(CO)ccc1 Amb18125292 [1,0,1,0,0,0|1,0,1]=4 846 B11R1.189 CNCc1cccc(c1)OC Amb1209056 [1,0,1,0,0,0|1,0,1]=4 847 B11R1.189 COCc1cc(CO)ccc1 Amb24332395 [1,0,1,0,0,0|1,0,1]=4 848 B11R1.189 COc1c[n]cc(CC=C)c1 Amb25172784 [1,0,1,0,0,0|1,0,0]=3 849 B11R1.189 COc1c[n]cc(CC=O)c1 Amb25797328 [1,0,1,0,0,0|2,0,0]=4 850 B11R1.189 COc1cc(ccc1)NC=S Amb25828937 [1,0,1,0,0,0|2,0,0]=4 851 B11R1.189 COc1cccc(CC=O)[n]1 Amb25801460 [1,0,1,0,0,0|2,0,0]=4 852 B11R1.189 COc1cccc(CCI)c1 Amb24664177 [1,0,1,0,0,0|1,0,1]=4 853 B11R1.189 COc1cccc(CCN)c1 Amb22728038 [1,0,1,0,0,0|1,0,1]=4 854 B11R1.189 COc1cccc(CNO)c1 Amb23449446 [1,0,1,0,0,0|2,0,0]=4 855 B11R1.189 COc1cccc(CON)c1 Amb21929133 [1,0,1,0,0,0|2,0,0]=4 856 B11R1.189 COc1cccc(CSC)c1 Amb25188883 [1,0,1,0,0,0|1,0,1]=4 857 B11R1.189 COc1cccc(C[Zn]Cl)c1 Amb22000435 [1,0,1,0,0,0|2,0,0]=4 858 B11R1.189 COc1cccc(\C=C\Br)c1 Amb24673730 [1,0,1,0,0,0|1,0,1]=4 859 B11R1.189 COc1cccc(\C=C\Cl)c1 Amb24602476 [1,0,1,0,0,0|1,0,1]=4 860 B11R1.189 COc1cccc(c1)CO[NH3+] Amb2424128 [1,0,1,0,0,0|2,0,0]=4 861 B11R1.189 COc1cccc(c1)OC=C Amb25251062 [1,0,1,0,0,0|1,0,0]=3 862 B11R1.189 CSCc1cc(CO)ccc1 Amb25084282 [1,0,1,0,0,0|1,0,1]=4 863 B11R1.189 CSc1cccc(CC=C)c1 Amb25169450 [1,0,1,0,0,0|0,1,0]=3 864 B11R1.189 CSc1cccc(CC=O)c1 Amb25131118 [1,0,1,0,0,0|1,1,0]=4 865 B11R1.189 N#CCc1cc(CO)ccc1 Amb22228086 [1,0,1,0,0,0|1,0,1]=4 866 B11R1.189 NCCc1cc(CO)ccc1 Amb24093850 [1,0,1,0,0,0|1,0,1]=4 867 B11R1.189 NCc1cccc(CCO)c1 Amb22235875 [1,0,1,0,0,0|2,0,0]=4 868 B11R1.189 NNCc1cc(CO)ccc1 Amb24629227 [1,0,1,0,0,0|2,0,0]=4 869 B11R1.189 NNCc1cccc(c1)OC Amb13949119 [1,0,1,0,0,0|2,0,0]=4 870 B11R1.189 NOCc1cccc(c1)OC Amb17091436 [1,0,1,0,0,0|2,0,0]=4 871 B11R1.189 O=CCc1cccc(c1)OC Amb16230452 [1,0,1,0,0,0|1,0,0]=3 872 B11R1.189 O=Cc1cc(ccc1)OCCl Amb24676801 [1,0,1,0,0,0|2,0,0]=4 873 B11R1.189 O=Cc1cc(ccc1)OCF Amb25821446 [1,0,1,0,0,0|2,0,0]=4 874 B11R1.189 OCCc1cc(C=O)ccc1 Amb22490342 [1,0,1,0,0,0|2,0,0]=4 875 B11R1.189 OCCc1cc(CF)ccc1 Amb25088891 [1,0,1,0,0,0|2,0,0]=4 876 B11R1.189 OCc1cc(ccc1)NC=O Amb18179390 [1,0,1,0,0,0|2,0,0]=4 877 B11R1.189 OCc1cccc(CC=O)c1 Amb24069055 [1,0,1,0,0,0|1,0,0]=3 878 B11R1.189 OCc1cccc(CCCl)c1 Amb22496731 [1,0,1,0,0,0|1,0,1]=4 879 B11R1.189 SCCc1cccc(c1)OC Amb17400286 [1,0,1,0,0,0|1,0,1]=4 880 B11R1.192 C=CCC1=CC(=O)C(=O)C=C1 Amb24545621 [1,0,1,0,0,0|0,0,2]=4 881 B11R1.192 C=CCc1ccc(Br)c(Cl)c1 Amb24504906 [1,0,1,0,0,0|2,0,0]=4 882 B11R1.192 C=CCc1ccc(I)c(N)c1 Amb24734952 [1,0,1,0,0,0|2,0,0]=4 883 B11R1.192 C=CCc1ccc(O)c(F)c1 Amb24408351 [1,0,1,0,0,0|1,0,0]=3 884 B11R1.192 C=CCc1ccc(O)c(N)c1 Amb18124969 [1,0,1,0,0,0|1,0,0]=3 885 B11R1.192 C=CCc1ccc(c(c1)O)O Amb1792959 [1,0,1,0,0,0|0,0,0]=2 886 B11R1.192 CC1=CN(CC=C)C=CC1=O Amb24357698 [1,0,1,0,0,0|1,0,1]=4 887 B11R1.192 CCCc1cc(O)c(O)cc1 Amb18644510 [1,0,1,0,0,0|0,0,2]=4 888 B11R1.192 CNCc1ccc(c(c1)O)O Amb1119460 [1,0,1,0,0,0|1,0,1]=4 889 B11R1.192 C\C=C\c1cc(O)c(O)cc1 Amb25128468 [1,0,1,0,0,0|0,0,2]=4 890 B11R1.192 Cc1cc(CC#N)ccc1O Amb18124819 [1,0,1,0,0,0|1,0,1]=4 891 B11R1.192 Cc1cc(CC=C)c[n]c1Cl Amb25174136 [1,0,1,0,0,0|2,0,0]=4 892 B11R1.192 Cc1cc(CC=C)ccc1O Amb18124919 [1,0,1,0,0,0|0,0,0]=2 893 B11R1.192 Cc1cc(CC=O)ccc1C Amb25728205 [1,0,1,0,0,0|2,0,0]=4 894 B11R1.192 Cc1cc(CC=O)ccc1Cl Amb24675337 [1,0,1,0,0,0|2,0,0]=4 895 B11R1.192 Cc1cc(CC=O)ccc1F Amb18791500 [1,0,1,0,0,0|2,0,0]=4 896 B11R1.192 Cc1cc(CC=O)ccc1O Amb24068574 [1,0,1,0,0,0|1,0,0]=3 897 B11R1.192 Cc1cc(CCBr)ccc1O Amb24358197 [1,0,1,0,0,0|1,0,1]=4 898 B11R1.192 Cc1cc(CCN)ccc1O Amb24585069 [1,0,1,0,0,0|1,0,1]=4 899 B11R1.192 Cc1cc(CNC)ccc1O Amb25188667 [1,0,1,0,0,0|1,0,1]=4 900 B11R1.192 Cc1cc(CSC)ccc1O Amb25059749 [1,0,1,0,0,0|1,0,1]=4 901 B11R1.192 Cc1cc(ccc1C)OC=C Amb25125523 [1,0,1,0,0,0|2,0,0]=4 902 B11R1.192 Cc1cc(ccc1O)NC=O Amb25055258 [1,0,1,0,0,0|2,0,0]=4 903 B11R1.192 Cc1ccc(CC#N)cc1O Amb24533067 [1,0,1,0,0,0|1,0,1]=4 904 B11R1.192 Cc1ccc(CC=O)cc1Cl Amb25145720 [1,0,1,0,0,0|2,0,0]=4 905 B11R1.192 Cc1ccc(CCN)cc1O Amb18125289 [1,0,1,0,0,0|1,0,1]=4 906 B11R1.192 Cc1ccc(cc1Br)OC=C Amb24691436 [1,0,1,0,0,0|2,0,0]=4 907 B11R1.192 Cc1ccc(cc1F)OC=C Amb25263872 [1,0,1,0,0,0|2,0,0]=4 908 B11R1.192 N#CCc1ccc(c(c1)O)O Amb17592985 [1,0,1,0,0,0|1,0,1]=4 909 B11R1.192 NCCc1cc(O)c(O)cc1 Amb22348073 [1,0,1,0,0,0|1,0,1]=4 910 B11R1.192 NCCc1ccc(c(c1)O)O Amb1935096 [1,0,1,0,0,0|1,0,1]=4 911 B11R1.192 NNCc1cc(O)c(O)cc1 Amb19664696 [1,0,1,0,0,0|2,0,0]=4 912 B11R1.192 O\C=C\c1cc(O)c(O)cc1 Amb24545682 [1,0,1,0,0,0|1,0,1]=4 913 B11R1.192 Oc1cc(CC=O)ccc1O Amb18125349 [1,0,1,0,0,0|1,0,0]=3 914 B11R1.192 Oc1cc(CCBr)ccc1O Amb24719016 [1,0,1,0,0,0|1,0,1]=4 915 B11R1.192 Oc1cc(CCCl)ccc1O Amb18126985 [1,0,1,0,0,0|1,0,1]=4 916 B11R1.192 Oc1cc(ccc1O)NC=O Amb25685408 [1,0,1,0,0,0|2,0,0]=4 917 B11R1.192 Oc1ccc(CC=O)cc1F Amb25808544 [1,0,1,0,0,0|2,0,0]=4 918 B11R1.280 C=Cc1cc(C=O)c(O)cc1 Amb24084377 [1,0,1,0,0,0|2,0,0]=4 919 B11R1.280 CCc1cc(CC)ccc1O Amb22011722 [1,0,1,0,0,0|1,0,1]=4 920 B11R1.280 CCc1cc(CN)ccc1O Amb25806200 [1,0,1,0,0,0|2,0,0]=4 921 B11R1.280 CCc1cc(OC)c(Br)cc1 Amb22752637 [1,0,1,0,0,0|1,0,1]=4 922 B11R1.280 CCc1cc(OC)c(Cl)cc1 Amb20242485 [1,0,1,0,0,0|1,0,1]=4 923 B11R1.280 CCc1cc(OC)c(F)cc1 Amb22749060 [1,0,1,0,0,0|1,0,1]=4 924 B11R1.280 CNc1cc(OC)c(O)cc1 Amb18554489 [1,0,1,0,0,0|1,0,1]=4 925 B11R1.280 CO[13c]1[13cH][13c](C=O)[13cH][13cH][13c]1O Amb17621211 [1,0,1,0,0,0|1,0,0]=3 926 B11R1.280 COc1[n]c(C=O)ccc1O Amb25152837 [1,0,1,0,0,0|2,0,0]=4 927 B11R1.280 COc1cc(C#N)ccc1O Amb1209844 [1,0,1,0,0,0|1,0,1]=4 928 B11R1.280 COc1cc(C=C)[n]cc1F Amb24487045 [1,0,1,0,0,0|2,0,0]=4 929 B11R1.280 COc1cc(C=C)c[n]c1N Amb25849926 [1,0,1,0,0,0|2,0,0]=4 930 B11R1.280 COc1cc(C=C)ccc1F Amb22749045 [1,0,1,0,0,0|1,0,0]=3 931 B11R1.280 COc1cc(C=O)[n]cc1O Amb24395057 [1,0,1,0,0,0|2,0,0]=4 932 B11R1.280 COc1cc(C=O)ccc1Br Amb18771155 [1,0,1,0,0,0|2,0,0]=4 933 B11R1.280 COc1cc(C=O)ccc1I Amb22500722 [1,0,1,0,0,0|2,0,0]=4 934 B11R1.280 COc1cc(C=O)ccc1N Amb10603960 [1,0,1,0,0,0|2,0,0]=4 935 B11R1.280 COc1cc(C=O)ccc1O Amb1880873 [1,0,1,0,0,0|1,0,0]=3 936 B11R1.280 COc1cc(C=O)ccc1O Amb22231744 [1,0,1,0,0,0|1,0,0]=3 937 B11R1.280 COc1cc(C=O)ccc1S Amb10610424 [1,0,1,0,0,0|1,1,0]=4 938 B11R1.280 COc1cc(CBr)ccc1Br Amb22501129 [1,0,1,0,0,0|2,0,0]=4 939 B11R1.280 COc1cc(CBr)ccc1Cl Amb22002709 [1,0,1,0,0,0|2,0,0]=4 940 B11R1.280 COc1cc(CBr)ccc1F Amb10605881 [1,0,1,0,0,0|2,0,0]=4 941 B11R1.280 COc1cc(CBr)ccc1I Amb23437522 [1,0,1,0,0,0|2,0,0]=4 942 B11R1.280 COc1cc(CBr)ccc1N Amb25756767 [1,0,1,0,0,0|2,0,0]=4 943 B11R1.280 COc1cc(CBr)ccc1O Amb24079588 [1,0,1,0,0,0|1,0,0]=3 944 B11R1.280 COc1cc(CCl)ccc1Br Amb22501124 [1,0,1,0,0,0|2,0,0]=4 945 B11R1.280 COc1cc(CCl)ccc1Cl Amb22501136 [1,0,1,0,0,0|2,0,0]=4 946 B11R1.280 COc1cc(CCl)ccc1F Amb19958737 [1,0,1,0,0,0|2,0,0]=4 947 B11R1.280 COc1cc(CCl)ccc1I Amb23437521 [1,0,1,0,0,0|2,0,0]=4 948 B11R1.280 COc1cc(CCl)ccc1O Amb17477803 [1,0,1,0,0,0|1,0,0]=3 949 B11R1.280 COc1cc(CN)ccc1Br Amb22500493 [1,0,1,0,0,0|2,0,0]=4 950 B11R1.280 COc1cc(CN)ccc1Br Amb22500718 [1,0,1,0,0,0|2,0,0]=4 951 B11R1.280 COc1cc(CN)ccc1C Amb10610104 [1,0,1,0,0,0|2,0,0]=4 952 B11R1.280 COc1cc(CN)ccc1Cl Amb18908883 [1,0,1,0,0,0|2,0,0]=4 953 B11R1.280 COc1cc(CN)ccc1Cl Amb22501133 [1,0,1,0,0,0|2,0,0]=4 954 B11R1.280 COc1cc(CN)ccc1F Amb19884033 [1,0,1,0,0,0|2,0,0]=4 955 B11R1.280 COc1cc(CN)ccc1F Amb22498732 [1,0,1,0,0,0|2,0,0]=4 956 B11R1.280 COc1cc(CN)ccc1I Amb23437523 [1,0,1,0,0,0|2,0,0]=4 957 B11R1.280 COc1cc(CN)ccc1N Amb18201291 [1,0,1,0,0,0|2,0,0]=4 958 B11R1.280 COc1cc(CN)ccc1O Amb1111183 [1,0,1,0,0,0|1,0,0]=3 959 B11R1.280 COc1cc(CN)ccc1S Amb24485952 [1,0,1,0,0,0|1,1,0]=4 960 B11R1.280 COc1cc(CO)ccc1Br Amb10602018 [1,0,1,0,0,0|2,0,0]=4 961 B11R1.280 COc1cc(CO)ccc1Cl Amb22170282 [1,0,1,0,0,0|2,0,0]=4 962 B11R1.280 COc1cc(CO)ccc1F Amb10605579 [1,0,1,0,0,0|2,0,0]=4 963 B11R1.280 COc1cc(CO)ccc1I Amb23437520 [1,0,1,0,0,0|2,0,0]=4 964 B11R1.280 COc1cc(CO)ccc1N Amb22001532 [1,0,1,0,0,0|2,0,0]=4 965 B11R1.280 COc1cc(CO)ccc1S Amb24485951 [1,0,1,0,0,0|1,1,0]=4 966 B11R1.280 COc1cc(CS)ccc1Br Amb24682300 [1,0,1,0,0,0|2,0,0]=4 967 B11R1.280 COc1cc(CS)ccc1O Amb25803294 [1,0,1,0,0,0|1,0,0]=3 968 B11R1.280 COc1cc(ccc1O)N=O Amb25128869 [1,0,1,0,0,0|2,0,0]=4 969 B11R1.280 COc1cc(ccc1O)NN Amb24712582 [1,0,1,0,0,0|2,0,0]=4 970 B11R1.280 COc1cc(ccc1O)SC Amb18126705 [1,0,1,0,0,0|1,0,1]=4 971 B11R1.280 COc1cc(ccc1O)[13CH]=O Amb22367302 [1,0,1,0,0,0|1,0,0]=3 972 B11R1.280 COc1ccc(c(c1)OC)O Amb17199437 [1,0,1,0,0,0|1,0,1]=4 973 B11R1.280 CSc1cc(C=O)ccc1O Amb24648702 [1,0,1,0,0,0|1,1,0]=4 974 B11R1.280 CSc1cc(CN)ccc1O Amb25707597 [1,0,1,0,0,0|1,1,0]=4 975 B11R1.280 C\C=C\1/C=C(OC)C(=O)C=C1 Amb25734317 [1,0,1,0,0,0|0,0,2]=4 976 B11R1.280 Cc1c[n]c(C=C)cc1OC Amb25850087 [1,0,1,0,0,0|2,0,0]=4 977 B11R1.280 Cc1ccc(C=C)[n]c1OC Amb24487091 [1,0,1,0,0,0|2,0,0]=4 978 B11R1.280 Cc1ccc(CBr)cc1OC Amb25075362 [1,0,1,0,0,0|2,0,0]=4 979 B11R1.280 [13CH3]Oc1cc(C=O)ccc1O Amb17621210 [1,0,1,0,0,0|1,0,0]=3 980 B11R1.279 C=Cc1ccc(C=O)c(O)c1 Amb24084366 [1,0,1,0,0,0|2,0,0]=4 981 B11R1.279 CCc1[n]cc(C=C)cc1O Amb25251771 [1,0,1,0,0,0|2,0,0]=4 982 B11R1.279 CCc1ccc(C=O)cc1O Amb24091549 [1,0,1,0,0,0|2,0,0]=4 983 B11R1.279 CCc1ccc(OC)c(Br)c1 Amb18244006 [1,0,1,0,0,0|1,0,1]=4 984 B11R1.279 CCc1ccc(OC)c(Cl)c1 Amb23483098 [1,0,1,0,0,0|1,0,1]=4 985 B11R1.279 CCc1ccc(OC)c(I)c1 Amb22752599 [1,0,1,0,0,0|1,0,1]=4 986 B11R1.279 CCc1ccc(OC)c(O)c1 Amb18054876 [1,0,1,0,0,0|0,0,1]=3 987 B11R1.279 CCc1ccc(c(c1)N)OC Amb17138434 [1,0,1,0,0,0|1,0,1]=4 988 B11R1.279 CNc1cc(O)c(cc1)OC Amb18967642 [1,0,1,0,0,0|1,0,1]=4 989 B11R1.279 CNc1ccc(C=O)cc1O Amb24509072 [1,0,1,0,0,0|2,0,0]=4 990 B11R1.279 COc1[n]cc(C=C)cc1Cl Amb25324659 [1,0,1,0,0,0|2,0,0]=4 991 B11R1.279 COc1[n]cc(CO)cc1O Amb24062534 [1,0,1,0,0,0|2,0,0]=4 992 B11R1.279 COc1ccc(C=C)[n]c1N Amb25720884 [1,0,1,0,0,0|2,0,0]=4 993 B11R1.279 COc1ccc(C=C)cc1F Amb24356928 [1,0,1,0,0,0|1,0,0]=3 994 B11R1.279 COc1ccc(C=C)cc1N Amb18124990 [1,0,1,0,0,0|1,0,0]=3 995 B11R1.279 COc1ccc(C=O)cc1N Amb24117565 [1,0,1,0,0,0|2,0,0]=4 996 B11R1.279 COc1ccc(CBr)cc1I Amb24088423 [1,0,1,0,0,0|2,0,0]=4 997 B11R1.279 COc1ccc(CBr)cc1O Amb18132408 [1,0,1,0,0,0|1,0,0]=3 998 B11R1.279 COc1ccc(CF)cc1Br Amb24596488 [1,0,1,0,0,0|2,0,0]=4 999 B11R1.279 COc1ccc(CI)cc1F Amb24471049 [1,0,1,0,0,0|2,0,0]=4 1000 B11R1.279 COc1ccc(CN)cc1N Amb18251367 [1,0,1,0,0,0|2,0,0]=4 1001 B11R1.279 COc1ccc(CN)cc1N Amb22499590 [1,0,1,0,0,0|2,0,0]=4 1002 B11R1.279 COc1ccc(CN)cc1N Amb22754631 [1,0,1,0,0,0|2,0,0]=4 1003 B11R1.279 COc1ccc(CS)cc1Br Amb25108883 [1,0,1,0,0,0|2,0,0]=4 1004 B11R1.279 COc1ccc(cc1O)C#C Amb24575208 [1,0,1,0,0,0|0,0,2]=4 1005 B11R1.279 COc1ccc(cc1O)NN Amb25709875 [1,0,1,0,0,0|2,0,0]=4 1006 B11R1.279 COc1cnc(cc1O)CN Amb17218020 [1,0,1,0,0,0|2,0,0]=4 1007 B11R1.279 CSc1ccc(C=O)cc1O Amb24509258 [1,0,1,0,0,0|1,1,0]=4 1008 B11R1.279 CSc1ccc(CCl)cc1O Amb25229540 [1,0,1,0,0,0|1,1,0]=4 1009 B11R1.279 CSc1ccc(CF)cc1O Amb24432199 [1,0,1,0,0,0|1,1,0]=4 1010 B11R1.279 CSc1ccc(CN)cc1O Amb25263956 [1,0,1,0,0,0|1,1,0]=4 1011 B11R1.279 Cc1cc(C=C)c[n]c1OC Amb23578509 [1,0,1,0,0,0|2,0,0]=4 1012 B11R1.279 ClCc1ccc(c(c1)F)OC Amb1104858 [1,0,1,0,0,0|2,0,0]=4 1013 B11R1.279 ClCc1ccc(c(c1)O)OC Amb17477804 [1,0,1,0,0,0|1,0,0]=3 1014 B11R1.279 N#Cc1ccc(c(c1)O)OC Amb1080881 [1,0,1,0,0,0|1,0,1]=4 1015 B11R1.279 NCc1ccc(c(c1)O)OC Amb1088911 [1,0,1,0,0,0|1,0,0]=3 1016 B11R1.279 O=Cc1ccc(c(c1)Br)OC Amb1014103 [1,0,1,0,0,0|2,0,0]=4 1017 B11R1.279 O=Cc1ccc(c(c1)F)OC Amb1658860 [1,0,1,0,0,0|2,0,0]=4 1018 B11R1.279 O=Cc1ccc(c(c1)I)OC Amb1774696 [1,0,1,0,0,0|2,0,0]=4 1019 B11R1.279 O=Cc1ccc(c(c1)N)OC Amb16230439 [1,0,1,0,0,0|2,0,0]=4 1020 B11R1.279 OCc1ccc(c(c1)Br)OC Amb1110727 [1,0,1,0,0,0|2,0,0]=4 1021 B11R1.279 OCc1ccc(c(c1)Cl)OC Amb2417048 [1,0,1,0,0,0|2,0,0]=4 1022 B11R1.279 OCc1ccc(c(c1)F)OC Amb1109828 [1,0,1,0,0,0|2,0,0]=4 1023 B11R1.279 OCc1ccc(c(c1)I)OC Amb1880608 [1,0,1,0,0,0|2,0,0]=4 1024 B11R1.279 SCc1ccc(c(c1)C)OC Amb17400289 [1,0,1,0,0,0|2,0,0]=4 1025 B11R1.279 SCc1ccc(c(c1)Cl)OC Amb17401244 [1,0,1,0,0,0|2,0,0]=4 1026 B11R1.279 [2H]c1cc(C=O)ccc1OC Amb22354027 [1,0,1,0,0,0|2,0,0]=4 1027 B11R1.279 [C-]#[N+]c1cc(O)c(cc1)OC Amb24721743 [1,0,1,0,0,0|1,0,1]=4 1028 B11R2.36 Brc1cc2NCOc2cc1 Amb25258645 [2,0,0,0,0,0|2,0,0]=4 1029 B11R2.36 Brc1cc2OCOc2[n]c1 Amb18787301 [2,0,0,0,0,0|2,0,0]=4 1030 B11R2.36 Brc1ccc2CCOc2c1 Amb22002410 [2,0,0,0,0,0|2,0,0]=4 1031 B11R2.36 Brc1ccc2OCOc2[n]1 Amb18787302 [2,0,0,0,0,0|2,0,0]=4 1032 B11R2.36 Cc1cc2CCNc2cc1 Amb22500480 [2,0,0,0,0,0|2,0,0]=4 1033 B11R2.36 Cc1cc2NCOc2cc1 Amb24477260 [2,0,0,0,0,0|1,0,0]=3 1034 B11R2.36 Cc1cc2ccoc2cc1 Amb22751743 [2,0,0,0,0,0|1,0,1]=4 1035 B11R2.36 Cc1cc2o[n]cc2cc1 Amb22002117 [2,0,0,0,0,0|2,0,0]=4 1036 B11R2.36 Cc1cc2occc2cc1 Amb22039412 [2,0,0,0,0,0|1,0,1]=4 1037 B11R2.36 Cc1ccc2CCNc2c1 Amb19305323 [2,0,0,0,0,0|2,0,0]=4 1038 B11R2.36 Cc1ccc2CCOc2[n]1 Amb24091813 [2,0,0,0,0,0|2,0,0]=4 1039 B11R2.36 Cc1ccc2CCOc2c1 Amb23412185 [2,0,0,0,0,0|1,0,0]=3 1040 B11R2.36 Cc1ccc2c(c1)CCC2 Amb17231880 [2,0,0,0,0,0|2,0,0]=4 1041 B11R2.36 Cc1ccc2c(c1)CCN2 Amb1108847 [2,0,0,0,0,0|2,0,0]=4 1042 B11R2.36 Cc1ccc2c(c1)CCO2 Amb2447310 [2,0,0,0,0,0|1,0,0]=3 1043 B11R2.36 Cc1ccc2c(c1)NCC2 Amb2383431 [2,0,0,0,0,0|2,0,0]=4 1044 B11R2.36 Cc1ccc2c(c1)nco2 Amb2433105 [2,0,0,0,0,0|1,0,1]=4 1045 B11R2.36 Clc1cc2CCOc2cc1 Amb22498241 [2,0,0,0,0,0|2,0,0]=4 1046 B11R2.36 Clc1cc2OCOc2[n]c1 Amb25061205 [2,0,0,0,0,0|2,0,0]=4 1047 B11R2.36 Clc1ccc2CCOc2c1 Amb22755871 [2,0,0,0,0,0|2,0,0]=4 1048 B11R2.36 Fc1cc2OCOc2[n]c1 Amb25138635 [2,0,0,0,0,0|2,0,0]=4 1049 B11R2.36 Fc1cc2OCOc2cc1 Amb25125976 [2,0,0,0,0,0|1,0,0]=3 1050 B11R2.36 Fc1ccc2CCOc2c1 Amb23412188 [2,0,0,0,0,0|2,0,0]=4 1051 B11R2.36 Fc1ccc2c(c1)CCO2 Amb10841652 [2,0,0,0,0,0|2,0,0]=4 1052 B11R2.36 Ic1ccc2c(c1)CCO2 Amb2455961 [2,0,0,0,0,0|2,0,0]=4 1053 B11R2.36 Nc1cc2OCOc2[n]c1 Amb18832265 [2,0,0,0,0,0|2,0,0]=4 1054 B11R2.36 Nc1cc2OCOc2cc1 Amb21857702 [2,0,0,0,0,0|1,0,0]=3 1055 B11R2.36 Nc1ccc2CCOc2c1 Amb18124451 [2,0,0,0,0,0|2,0,0]=4 1056 B11R2.36 Nc1ccc2OCOc2[n]1 Amb18832249 [2,0,0,0,0,0|2,0,0]=4 1057 B11R2.36 Nc1ccc2c(c1)CCO2 Amb1125736 [2,0,0,0,0,0|2,0,0]=4 1058 B11R2.36 Oc1cc2OCOc2cc1 Amb21912504 [2,0,0,0,0,0|1,0,0]=3 1059 B11R2.36 Oc1cc2OCSc2cc1 Amb24664690 [2,0,0,0,0,0|1,1,0]=4 1060 B11R2.36 Oc1ccc2CCOc2c1 Amb18643055 [2,0,0,0,0,0|2,0,0]=4 1061 B11R2.36 Sc1cc2OCOc2[n]c1 Amb24060669 [2,0,0,0,0,0|2,0,0]=4 1062 B11R2.36 [O-]c1cc2OCOc2cc1 Amb20247683 [2,0,0,0,0,0|1,0,0]=3 1063 B13R1.77 C=CCOc1ccc(CCN)cc1 Amb18180664 [0,1,1,0,0,0|2,0,0]=4 1064 B13R1.77 C=CCOc1ccc(cc1)\C=N/O Amb1774097 [0,1,1,0,0,0|2,0,0]=4 1065 B13R1.77 CCNc1ccc(cc1)NCC=C Amb25808097 [0,1,1,0,0,0|2,0,0]=4 1066 B13R1.77 CCNc1ccc(cc1)OCC=C Amb24102914 [0,1,1,0,0,0|2,0,0]=4 1067 B13R1.77 CCOc1ccc(cc1)CCC=O Amb17081683 [0,1,1,0,0,0|1,0,1]=4 1068 B13R1.77 CCOc1ccc(cc1)NCC=C Amb17306072 [0,1,1,0,0,0|1,0,0]=3 1069 B13R1.77 CCOc1ccc(cc1)\C=C\C=O Amb17335119 [0,1,1,0,0,0|1,0,1]=4 1070 B13R1.77 COCOc1ccc(CC=C)cc1 Amb24060255 [0,1,1,0,0,0|0,0,0]=2 1071 B13R1.77 NCCc1ccc(cc1)OCCO Amb10610414 [0,1,1,0,0,0|1,0,1]=4 1072 B13R1.77 OCCOc1ccc(cc1)NC=O Amb24403422 [0,1,1,0,0,0|2,0,0]=4 1073 B13R1.139 CCOc1ccc(cc1)C(=O)C=C Amb18065617 [0,1,1,0,0,0|1,0,1]=4 1074 B13R1.139 CCOc1ccc(cc1)C(C=O)C Amb17194523 [0,1,1,0,0,0|2,0,0]=4 1075 B13R1.142 CCOc1ccc(CC(N)=N)cc1 Amb21972128 [0,1,1,0,0,0|2,0,0]=4 1076 B13R1.142 CCOc1ccc(cc1)CC(=O)Cl Amb17143206 [0,1,1,0,0,0|2,0,0]=4 1077 B13R1.142 CCOc1ccc(cc1)CC(=O)O Amb1205936 [0,1,1,0,0,0|2,0,0]=4 1078 B13R1.567 CCNc1cc(ccc1)OCC=C Amb23539742 [0,1,1,0,0,0|2,0,0]=4 1079 B13R1.567 CCOc1cccc(c1)\C=C\C=O Amb17335118 [0,1,1,0,0,0|1,0,1]=4 1080 B13R1.567 COCOc1cc(ccc1)NC=O Amb25832355 [0,1,1,0,0,0|2,0,0]=4 1081 B13R1.49 C=C[C@@H](N)c1ccc(O)c(CO)c1 Amb25301823 [0,1,1,0,0,0|2,0,0]=4 1082 B13R1.49 C=C[C@H](N)c1cc(C#N)c(O)cc1 Amb24496768 [0,1,1,0,0,0|2,0,0]=4 1083 B13R1.49 C=C[C@H](N)c1ccc(O)c(CO)c1 Amb24712386 [0,1,1,0,0,0|2,0,0]=4 1084 B13R1.49 CC(OC)c1cc(OC)c(O)cc1 Amb24096851 [0,1,1,0,0,0|1,0,1]=4 1085 B13R1.49 CCC(N)c1cc(OC)c(O)cc1 Amb18056265 [0,1,1,0,0,0|0,0,2]=4 1086 B13R1.49 CCC(c1ccc(c(c1)OC)O)O Amb1787750 [0,1,1,0,0,0|0,0,2]=4 1087 B13R1.49 CC[C@@H](N)c1cc(OC)c(O)cc1 Amb24383276 [0,1,1,0,0,0|0,0,2]=4 1088 B13R1.49 CC[C@H](N)c1cc(OC)c(O)cc1 Amb24739882 [0,1,1,0,0,0|0,0,2]=4 1089 B13R1.49 CCc1cc(ccc1I)C(N)C=C Amb24350563 [0,1,1,0,0,0|2,0,0]=4 1090 B13R1.49 CCc1cc(ccc1I)[C@@H](N)C=C Amb25155340 [0,1,1,0,0,0|2,0,0]=4 1091 B13R1.49 CCc1cc(ccc1I)[C@H](N)C=C Amb24760308 [0,1,1,0,0,0|2,0,0]=4 1092 B13R1.49 CNC(c1ccc(c(c1)OC)O)C Amb1119752 [0,1,1,0,0,0|1,0,1]=4 1093 B13R1.49 CN[C@@H](C)c1cc(OC)c(O)cc1 Amb24493929 [0,1,1,0,0,0|1,0,1]=4 1094 B13R1.49 COc1cc(ccc1Br)C(=O)C=C Amb25832749 [0,1,1,0,0,0|1,0,1]=4 1095 B13R1.49 COc1cc(ccc1Br)[C@H](N)C=C Amb24463559 [0,1,1,0,0,0|1,0,0]=3 1096 B13R1.49 COc1cc(ccc1Cl)C(=O)C=C Amb24567009 [0,1,1,0,0,0|1,0,1]=4 1097 B13R1.49 COc1cc(ccc1F)[C@H](N)C=C Amb25727210 [0,1,1,0,0,0|1,0,0]=3 1098 B13R1.49 COc1cc(ccc1I)C(N)C=C Amb25779296 [0,1,1,0,0,0|1,0,0]=3 1099 B13R1.49 COc1cc(ccc1I)[C@H](N)C=C Amb25770596 [0,1,1,0,0,0|1,0,0]=3 1100 B13R1.49 COc1cc(ccc1N)C(N)C=C Amb25102716 [0,1,1,0,0,0|1,0,0]=3 1101 B13R1.49 COc1cc(ccc1O)C(=O)C=C Amb18128068 [0,1,1,0,0,0|0,0,1]=3 1102 B13R1.49 COc1cc(ccc1O)C(N)C=C Amb25703118 [0,1,1,0,0,0|0,0,0]=2 1103 B13R1.49 COc1cc(ccc1O)C(N)CF Amb24369497 [0,1,1,0,0,0|1,0,1]=4 1104 B13R1.49 COc1cc(ccc1O)C(N)CO Amb25843819 [0,1,1,0,0,0|1,0,1]=4 1105 B13R1.49 COc1cc(ccc1O)C(O)C#C Amb24723942 [0,1,1,0,0,0|0,0,2]=4 1106 B13R1.49 COc1cc(ccc1O)C(O)C=C Amb25788963 [0,1,1,0,0,0|0,0,0]=2 1107 B13R1.49 COc1cc(ccc1O)C(O)C=O Amb24489690 [0,1,1,0,0,0|1,0,0]=3 1108 B13R1.49 COc1cc(ccc1O)C(O)CS Amb24494940 [0,1,1,0,0,0|1,0,1]=4 1109 B13R1.49 COc1cc(ccc1O)[C@@H](C)NO Amb25673798 [0,1,1,0,0,0|2,0,0]=4 1110 B13R1.49 COc1cc(ccc1O)[C@@H](N)CO Amb25843041 [0,1,1,0,0,0|1,0,1]=4 1111 B13R1.49 COc1cc(ccc1O)[C@H](N)C=C Amb24604402 [0,1,1,0,0,0|0,0,0]=2 1112 B13R1.49 COc1cc(ccc1O)[C@H](N)CN Amb24377190 [0,1,1,0,0,0|1,0,1]=4 1113 B13R1.49 COc1cc(ccc1O)[C@H](N)CO Amb25817483 [0,1,1,0,0,0|1,0,1]=4 1114 B13R1.49 COc1cc(ccc1O)[C@H](O)CO Amb25180753 [0,1,1,0,0,0|1,0,1]=4 1115 B13R1.49 Cc1ccc(cc1OC)C(=O)C=C Amb24730319 [0,1,1,0,0,0|1,0,1]=4 1116 B13R1.49 Cc1ccc(cc1OC)C(N)C=C Amb25843810 [0,1,1,0,0,0|1,0,0]=3 1117 B13R1.49 Cc1ccc(cc1OC)C(O)C=C Amb25076079 [0,1,1,0,0,0|1,0,0]=3 1118 B13R1.49 Cc1ccc(cc1OC)[C@H](N)C=C Amb24346930 [0,1,1,0,0,0|1,0,0]=3 1119 B13R1.49 N#CC(c1ccc(c(c1)OC)O)N Amb1135614 [0,1,1,0,0,0|1,0,1]=4 1120 B13R1.49 NCC(c1ccc(c(c1)OC)O)O Amb1108645 [0,1,1,0,0,0|1,0,1]=4 1121 B13R1.49 NCC(c1ccc(c(c1)OC)O)O Amb2099656 [0,1,1,0,0,0|1,0,1]=4 1122 B13R1.52 CC(=O)Cc1cc(OC)c(Cl)cc1 Amb24393362 [0,1,1,0,0,0|1,0,1]=4 1123 B13R1.52 CC(=O)Cc1cc(OC)c(I)cc1 Amb25230130 [0,1,1,0,0,0|1,0,1]=4 1124 B13R1.52 CN(C)Cc1cc(OC)c(O)cc1 Amb18648505 [0,1,1,0,0,0|1,0,1]=4 1125 B13R1.52 CO[13c]1[13cH][13c]([13cH][13cH][13c]1O)CC(=O)O Amb17614996 [0,1,1,0,0,0|1,0,0]=3 1126 B13R1.52 COc1cc(C=C(Br)Br)ccc1O Amb18117891 [0,1,1,0,0,0|1,0,1]=4 1127 B13R1.52 COc1cc(CC(=O)Cl)ccc1F Amb24694578 [0,1,1,0,0,0|2,0,0]=4 1128 B13R1.52 COc1cc(CC(=O)Cl)ccc1O Amb25086556 [0,1,1,0,0,0|1,0,0]=3 1129 B13R1.52 COc1cc(CC(C)C)ccc1O Amb25192100 [0,1,1,0,0,0|0,0,2]=4 1130 B13R1.52 COc1cc(CC(C)Cl)ccc1O Amb24490162 [0,1,1,0,0,0|0,0,2]=4 1131 B13R1.52 COc1cc(CC(C)N)ccc1O Amb22055456 [0,1,1,0,0,0|0,0,2]=4 1132 B13R1.52 COc1cc(CC(N)=S)ccc1F Amb24667869 [0,1,1,0,0,0|2,0,0]=4 1133 B13R1.52 COc1cc(CC(N)O)ccc1O Amb25680609 [0,1,1,0,0,0|1,0,1]=4 1134 B13R1.52 COc1cc(CC(O)=O)ccc1N Amb24680955 [0,1,1,0,0,0|2,0,0]=4 1135 B13R1.52 COc1cc(C[C@H](C)N)ccc1O Amb25326282 [0,1,1,0,0,0|0,0,2]=4 1136 B13R1.52 COc1cc(ccc1O)CC(Br)C Amb17596769 [0,1,1,0,0,0|0,0,2]=4 1137 B13R1.52 COc1cc(ccc1O)NC(=O)C Amb17616815 [0,1,1,0,0,0|1,0,1]=4 1138 B13R1.52 COc1cc(ccc1O)NC(N)=S Amb25311133 [0,1,1,0,0,0|2,0,0]=4 1139 B13R1.52 CSc1cc(CC(O)=O)ccc1O Amb24494748 [0,1,1,0,0,0|1,1,0]=4 1140 B13R1.52 Cc1ccc(CC(N)=N)cc1OC Amb24545944 [0,1,1,0,0,0|2,0,0]=4 1141 B13R1.386 CNCc1cc(OC)c(cc1)OC Amb22052593 [0,1,1,0,0,0|1,0,1]=4 1142 B13R1.386 CNCc1ccc(c(c1)OC)OC Amb1215282 [0,1,1,0,0,0|1,0,1]=4 1143 B13R1.386 COc1cc(CC#N)ccc1CO Amb24069101 [0,1,1,0,0,0|1,0,1]=4 1144 B13R1.386 COc1cc(CC=O)ccc1C#N Amb25723266 [0,1,1,0,0,0|2,0,0]=4 1145 B13R1.386 COc1ccc(CCF)cc1OC Amb23454445 [0,1,1,0,0,0|1,0,1]=4 1146 B13R1.386 COc1ccc(CNN)cc1OC Amb24093870 [0,1,1,0,0,0|2,0,0]=4 1147 B13R1.386 COc1ccc(\C=C\Cl)cc1OC Amb25779986 [0,1,1,0,0,0|1,0,1]=4 1148 B13R1.386 COc1ccc(\C=C\I)cc1OC Amb24382613 [0,1,1,0,0,0|1,0,1]=4 1149 B13R1.386 COc1ccc(cc1OC)NC=O Amb25102200 [0,1,1,0,0,0|2,0,0]=4 1150 B13R1.386 NNCc1ccc(c(c1)OC)OC Amb1805152 [0,1,1,0,0,0|2,0,0]=4 1151 B13R1.386 NOCc1ccc(c(c1)OC)OC Amb17091445 [0,1,1,0,0,0|2,0,0]=4 1152 B13R1.386 O=CCc1ccc(c(c1)OC)OC Amb10605711 [0,1,1,0,0,0|1,0,0]=3 1153 B13R1.386 SCCc1ccc(c(c1)OC)OC Amb17402265 [0,1,1,0,0,0|1,0,1]=4 1154 B13R1.575 CC\C=C\c1cc(OC)c(O)cc1 Amb18128172 [0,1,1,0,0,0|0,0,2]=4 1155 B13R1.575 CCc1cc(ccc1F)NCC=C Amb24705476 [0,1,1,0,0,0|2,0,0]=4 1156 B13R1.575 CNCCc1ccc(O)c(c1)OC Amb18276775 [0,1,1,0,0,0|0,0,2]=4 1157 B13R1.575 COc1[n]c(ccc1N)NCC=C Amb19023813 [0,1,1,0,0,0|2,0,0]=4 1158 B13R1.575 COc1cc(C=CCO)ccc1O Amb24062844 [0,1,1,0,0,0|0,0,2]=4 1159 B13R1.575 COc1cc(CCC#N)ccc1O Amb25378728 [0,1,1,0,0,0|0,0,2]=4 1160 B13R1.575 COc1cc(COCC)ccc1O Amb18129028 [0,1,1,0,0,0|0,0,2]=4 1161 B13R1.575 COc1cc(C\C=C\O)ccc1O Amb24076218 [0,1,1,0,0,0|0,0,0]=2 1162 B13R1.575 COc1cc(C\C=N\O)ccc1O Amb24550136 [0,1,1,0,0,0|1,0,0]=3 1163 B13R1.575 COc1cc(ccc1Cl)NCC=C Amb25160957 [0,1,1,0,0,0|1,0,0]=3 1164 B13R1.575 COc1cc(ccc1F)NCC=C Amb25133097 [0,1,1,0,0,0|1,0,0]=3 1165 B13R1.575 COc1cc(ccc1O)C#CC=O Amb18116990 [0,1,1,0,0,0|0,0,2]=4 1166 B13R1.575 COc1cc(ccc1O)\C=C\OC Amb24364227 [0,1,1,0,0,0|0,0,2]=4 1167 B13R1.575 C\C=C\Cc1cc(OC)c(O)cc1 Amb25245269 [0,1,1,0,0,0|0,0,0]=2 1168 B13R1.575 Cc1ccc(\C=C\C=O)cc1OC Amb25275464 [0,1,1,0,0,0|1,0,1]=4 1169 B13R1.575 N#CSCc1ccc(c(c1)OC)O Amb10564096 [0,1,1,0,0,0|1,0,1]=4 1170 B13R1.575 N#C\C=C\c1ccc(c(c1)OC)O Amb1279813 [0,1,1,0,0,0|0,0,2]=4 1171 B13R1.575 O=C=NCc1ccc(c(c1)OC)O Amb17090276 [0,1,1,0,0,0|1,0,1]=4 1172 B13R1.575 O=CCCc1ccc(c(c1)OC)O Amb17081691 [0,1,1,0,0,0|0,0,1]=3 1173 B13R1.575 OCCCc1ccc(c(c1)OC)O Amb16192925 [0,1,1,0,0,0|0,0,2]=4 1174 B13R1.575 OC\C=C/c1ccc(c(c1)OC)O Amb10069613 [0,1,1,0,0,0|0,0,2]=4 1175 B13R1.1255 COc1c(C)ccc(CC=O)c1C Amb24668964 [0,1,1,0,0,0|2,0,0]=4 1176 B13R1.1255 COc1c(F)c(CC=O)ccc1Br Amb24618706 [0,1,1,0,0,0|2,0,0]=4 1177 B13R1.1255 Cc1c(OC)c(O)ccc1CC#N Amb18127842 [0,1,1,0,0,0|1,0,1]=4 1178 B13R1.1255 Cc1c(OC)c(O)ccc1COC Amb18648604 [0,1,1,0,0,0|1,0,1]=4 1179 B13R1.1255 Cc1c(OC)c(O)ccc1\C=C\C Amb25717695 [0,1,1,0,0,0|0,0,2]=4 1180 B13R1.1255 Cc1ccc(CC=C)c(O)c1OC Amb25190277 [0,1,1,0,0,0|1,0,0]=3 1181 B13R1.2900 COc1cc(CC#N)c(F)cc1O Amb25249562 [0,1,1,0,0,0|1,0,1]=4 1182 B13R1.2900 COc1cc(CCN)c(F)cc1O Amb25066988 [0,1,1,0,0,0|1,0,1]=4 1183 B13R1.2900 COc1cc(CSC)c(Cl)cc1O Amb25212036 [0,1,1,0,0,0|1,0,1]=4 1184 B13R1.4030 CCCc1cc(OC)c(O)c(N)c1 Amb18648504 [0,1,1,0,0,0|0,0,2]=4 1185 B13R1.4030 CNCc1cc(OC)c(O)c(O)c1 Amb24676313 [0,1,1,0,0,0|1,0,1]=4 1186 B13R1.4030 CNCc1cc(OC)c(c(c1)Br)O Amb1118043 [0,1,1,0,0,0|1,0,1]=4 1187 B13R1.4030 CNCc1cc(OC)c(c(c1)Cl)O Amb17099983 [0,1,1,0,0,0|1,0,1]=4 1188 B13R1.4030 COc1cc(CC#N)cc(Cl)c1O Amb24086631 [0,1,1,0,0,0|1,0,1]=4 1189 B13R1.4030 COc1cc(CC#N)cc(F)c1O Amb18128804 [0,1,1,0,0,0|1,0,1]=4 1190 B13R1.4030 COc1cc(CC#N)cc(O)c1O Amb24582466 [0,1,1,0,0,0|1,0,1]=4 1191 B13R1.4030 COc1cc(CC=C)cc(N)c1O Amb18128402 [0,1,1,0,0,0|0,0,0]=2 1192 B13R1.4030 COc1cc(CC=C)cc(O)c1O Amb25674732 [0,1,1,0,0,0|0,0,0]=2 1193 B13R1.4030 COc1cc(CC=O)cc(Br)c1O Amb18117883 [0,1,1,0,0,0|1,0,0]=3 1194 B13R1.4030 COc1cc(CCN)cc(F)c1O Amb25076785 [0,1,1,0,0,0|1,0,1]=4 1195 B13R1.4030 COc1cc(CCN)cc(I)c1O Amb25790954 [0,1,1,0,0,0|1,0,1]=4 1196 B13R1.4030 COc1cc(CCN)cc(O)c1O Amb22750903 [0,1,1,0,0,0|1,0,1]=4 1197 B13R1.4030 COc1cc(CCO)cc(Br)c1O Amb24358663 [0,1,1,0,0,0|1,0,1]=4 1198 B13R1.4030 COc1cc(CNN)cc(Br)c1O Amb24097524 [0,1,1,0,0,0|2,0,0]=4 1199 B13R1.4030 COc1cc(CNN)cc(I)c1O Amb25103212 [0,1,1,0,0,0|2,0,0]=4 1200 B13R1.4030 COc1cc(CNO)cc(Br)c1O Amb24494751 [0,1,1,0,0,0|2,0,0]=4 1201 B13R1.4030 Cc1cc(CC#N)cc(OC)c1O Amb18127877 [0,1,1,0,0,0|1,0,1]=4 1202 B13R1.4030 Cc1cc(CCO)cc(OC)c1O Amb24492449 [0,1,1,0,0,0|1,0,1]=4 1203 B13R1.4030 Cc1cc(COC)cc(OC)c1O Amb18129038 [0,1,1,0,0,0|1,0,1]=4 1204 B13R1.4030 Cc1cc(CSC)cc(OC)c1O Amb25793037 [0,1,1,0,0,0|1,0,1]=4 1205 B13R1.4030 Cc1cc(cc(OC)c1O)\C=C\C Amb24633611 [0,1,1,0,0,0|0,0,2]=4 1206 B13R1.35 CC(=O)Cc1ccc(CC)c(O)c1 Amb24628198 [0,1,1,0,0,0|1,0,1]=4 1207 B13R1.35 CN(C)Cc1ccc(OC)c(O)c1 Amb18128894 [0,1,1,0,0,0|1,0,1]=4 1208 B13R1.35 COc1c[n]c(CC(O)=O)cc1O Amb24729326 [0,1,1,0,0,0|2,0,0]=4 1209 B13R1.35 COc1ccc(CC(=O)Cl)cc1F Amb25738463 [0,1,1,0,0,0|2,0,0]=4 1210 B13R1.35 COc1ccc(CC(=O)Cl)cc1O Amb25347539 [0,1,1,0,0,0|1,0,0]=3 1211 B13R1.35 COc1ccc(CC(N)=N)cc1Cl Amb18066495 [0,1,1,0,0,0|2,0,0]=4 1212 B13R1.35 COc1ccc(CC(N)=N)cc1F Amb19343861 [0,1,1,0,0,0|2,0,0]=4 1213 B13R1.35 COc1ccc(CC(O)=O)cc1N Amb19001507 [0,1,1,0,0,0|2,0,0]=4 1214 B13R1.35 COc1ccc(CC(O)=O)cc1S Amb18652884 [0,1,1,0,0,0|1,1,0]=4 1215 B13R1.35 COc1ccc(cc1Br)CC(=O)N Amb17410953 [0,1,1,0,0,0|2,0,0]=4 1216 B13R1.35 COc1ccc(cc1Br)CC(=O)O Amb2542765 [0,1,1,0,0,0|2,0,0]=4 1217 B13R1.35 COc1ccc(cc1C)CC(=O)C Amb16193027 [0,1,1,0,0,0|1,0,1]=4 1218 B13R1.35 COc1ccc(cc1C)CC(=O)N Amb17400716 [0,1,1,0,0,0|2,0,0]=4 1219 B13R1.35 COc1ccc(cc1C)CC(=O)O Amb1830256 [0,1,1,0,0,0|2,0,0]=4 1220 B13R1.35 COc1ccc(cc1Cl)CC(=O)N Amb17402323 [0,1,1,0,0,0|2,0,0]=4 1221 B13R1.35 COc1ccc(cc1Cl)CC(=O)O Amb1102441 [0,1,1,0,0,0|2,0,0]=4 1222 B13R1.35 COc1ccc(cc1F)CC(=O)O Amb1216490 [0,1,1,0,0,0|2,0,0]=4 1223 B13R1.35 COc1ccc(cc1O)NC(N)=O Amb24489143 [0,1,1,0,0,0|2,0,0]=4 1224 B13R1.35 Cc1cc(CC(=O)Cl)ccc1OC Amb22642138 [0,1,1,0,0,0|2,0,0]=4 1225 B13R1.577 C=CCNc1ccc(c(c1)Cl)OC Amb17306166 [0,1,1,0,0,0|1,0,0]=3 1226 B13R1.577 C=CCOc1cc(O)c(cc1)C#N Amb23569452 [0,1,1,0,0,0|2,0,0]=4 1227 B13R1.577 C=CCOc1ccc(C=O)c(O)c1 Amb18128095 [0,1,1,0,0,0|2,0,0]=4 1228 B13R1.577 CNc1ccc(cc1F)OCC=C Amb24556932 [0,1,1,0,0,0|2,0,0]=4 1229 B13R1.577 COc1ccc(CCC#N)cc1O Amb24583508 [0,1,1,0,0,0|0,0,2]=4 1230 B13R1.577 COc1ccc(CCC=O)cc1Cl Amb18066487 [0,1,1,0,0,0|1,0,1]=4 1231 B13R1.577 COc1ccc(CCC=O)cc1F Amb18805491 [0,1,1,0,0,0|1,0,1]=4 1232 B13R1.577 COc1ccc(COC#N)cc1O Amb25128831 [0,1,1,0,0,0|1,0,1]=4 1233 B13R1.577 COc1ccc(C\C=N\O)cc1O Amb25245270 [0,1,1,0,0,0|1,0,0]=3 1234 B13R1.577 COc1ccc(cc1F)NCC=C Amb18796417 [0,1,1,0,0,0|1,0,0]=3 1235 B13R1.577 COc1ccc(cc1N)SCC=C Amb23537951 [0,1,1,0,0,0|1,0,0]=3 1236 B13R1.577 COc1ccc(cc1O)\C=C/OC Amb24422476 [0,1,1,0,0,0|0,0,2]=4 1237 B13R1.577 COc1ccc(cc1O)\C=C\OC Amb25094344 [0,1,1,0,0,0|0,0,2]=4 1238 B13R1.577 CSc1ccc(cc1F)NCC=C Amb25144171 [0,1,1,0,0,0|1,1,0]=4 1239 B13R1.577 Cc1cc(ccc1OC)NCC=C Amb18180672 [0,1,1,0,0,0|1,0,0]=3 1240 B13R1.577 O=C=NCc1ccc(c(c1)O)OC Amb17090277 [0,1,1,0,0,0|1,0,1]=4 1241 B13R1.577 O=CCCc1ccc(c(c1)O)OC Amb17081692 [0,1,1,0,0,0|0,0,1]=3 1242 B13R1.577 O=CCSc1ccc(c(c1)C)OC Amb17082919 [0,1,1,0,0,0|2,0,0]=4 1243 B13R1.577 O=CCSc1ccc(c(c1)Cl)OC Amb17082931 [0,1,1,0,0,0|2,0,0]=4 1244 B13R1.577 O=CNCc1ccc(c(c1)Cl)OC Amb2423582 [0,1,1,0,0,0|2,0,0]=4 1245 B13R1.577 O=C\C=C\c1ccc(c(c1)Cl)OC Amb17236493 [0,1,1,0,0,0|1,0,1]=4 1246 B13R1.577 O=C\C=C\c1ccc(c(c1)O)OC Amb17335207 [0,1,1,0,0,0|0,0,1]=3 1247 B13R1.577 OCCCc1ccc(c(c1)O)OC Amb17089513 [0,1,1,0,0,0|0,0,2]=4 1248 B13R1.1254 C=CCc1ccc(C=O)c(O)c1O Amb25063161 [0,1,1,0,0,0|2,0,0]=4 1249 B13R1.1254 COc1ccc(CC=O)c(Cl)c1Cl Amb18132695 [0,1,1,0,0,0|2,0,0]=4 1250 B13R1.1254 COc1ccc(CCN)c(Cl)c1O Amb25155282 [0,1,1,0,0,0|1,0,1]=4 1251 B13R1.1254 Cc1c(CC=C)ccc(OC)c1C Amb25131640 [0,1,1,0,0,0|1,0,0]=3 1252 B13R1.2901 CCCc1cc(O)c(cc1O)OC Amb25717769 [0,1,1,0,0,0|0,0,2]=4 1253 B13R1.2901 CNCc1cc(O)c(cc1Br)OC Amb25307282 [0,1,1,0,0,0|1,0,1]=4 1254 B13R1.2901 COC1=CC(=O)C(CC=C)=CC1=O Amb25034477 [0,1,1,0,0,0|0,0,1]=3 1255 B13R1.2901 COc1cc(Br)c(CCN)cc1O Amb25800229 [0,1,1,0,0,0|1,0,1]=4 1256 B13R1.2901 COc1cc(Cl)c(CC#N)cc1O Amb24086630 [0,1,1,0,0,0|1,0,1]=4 1257 B13R1.2901 COc1cc(O)c(CC=C)cc1O Amb25086747 [0,1,1,0,0,0|0,0,0]=2 1258 B13R1.2901 COc1cc(O)c(CCN)cc1O Amb22750905 [0,1,1,0,0,0|1,0,1]=4 1259 B13R1.2901 Cc1cc(OC)c(C)cc1CC=O Amb25034212 [0,1,1,0,0,0|2,0,0]=4 1260 B13R1.3088 C=C[C@@H](N)c1cc(O)c(CO)cc1 Amb24543658 [0,1,1,0,0,0|2,0,0]=4 1261 B13R1.3088 CCC(N)c1cc(O)c(cc1)OC Amb24655925 [0,1,1,0,0,0|0,0,2]=4 1262 B13R1.3088 CC[C@@H](N)c1cc(O)c(cc1)OC Amb25114873 [0,1,1,0,0,0|0,0,2]=4 1263 B13R1.3088 CN[C@H](C)c1cc(O)c(cc1)OC Amb25713972 [0,1,1,0,0,0|1,0,1]=4 1264 B13R1.3088 COc1[n]cc(cc1Cl)C(N)C=C Amb25267488 [0,1,1,0,0,0|2,0,0]=4 1265 B13R1.3088 COc1[n]cc(cc1Cl)[C@@H](N)C=C Amb25837395 [0,1,1,0,0,0|2,0,0]=4 1266 B13R1.3088 COc1[n]cc(cc1N)C(N)C=C Amb25246672 [0,1,1,0,0,0|2,0,0]=4 1267 B13R1.3088 COc1ccc(cc1Br)C(=O)C=C Amb18577487 [0,1,1,0,0,0|1,0,1]=4 1268 B13R1.3088 COc1ccc(cc1Br)C(N)C=C Amb24383465 [0,1,1,0,0,0|1,0,0]=3 1269 B13R1.3088 COc1ccc(cc1Br)[C@@H](N)C=C Amb25154967 [0,1,1,0,0,0|1,0,0]=3 1270 B13R1.3088 COc1ccc(cc1Cl)C(=O)C=C Amb18066408 [0,1,1,0,0,0|1,0,1]=4 1271 B13R1.3088 COc1ccc(cc1Cl)C(O)C=C Amb24488992 [0,1,1,0,0,0|1,0,0]=3 1272 B13R1.3088 COc1ccc(cc1Cl)[C@H](N)C=C Amb25674528 [0,1,1,0,0,0|1,0,0]=3 1273 B13R1.3088 COc1ccc(cc1F)C(=O)C=C Amb18065900 [0,1,1,0,0,0|1,0,1]=4 1274 B13R1.3088 COc1ccc(cc1F)C(N)C=C Amb25063794 [0,1,1,0,0,0|1,0,0]=3 1275 B13R1.3088 COc1ccc(cc1F)[C@@H](N)C=C Amb24493964 [0,1,1,0,0,0|1,0,0]=3 1276 B13R1.3088 COc1ccc(cc1F)[C@H](N)C=C Amb24493963 [0,1,1,0,0,0|1,0,0]=3 1277 B13R1.3088 COc1ccc(cc1I)C(N)C=C Amb24637928 [0,1,1,0,0,0|1,0,0]=3 1278 B13R1.3088 COc1ccc(cc1I)[C@@H](N)C=C Amb25155452 [0,1,1,0,0,0|1,0,0]=3 1279 B13R1.3088 COc1ccc(cc1I)[C@H](N)C=C Amb25192148 [0,1,1,0,0,0|1,0,0]=3 1280 B13R1.3088 COc1ccc(cc1N)C(N)C=C Amb25104750 [0,1,1,0,0,0|1,0,0]=3 1281 B13R1.3088 COc1ccc(cc1N)[C@@H](N)C=C Amb25707779 [0,1,1,0,0,0|1,0,0]=3 1282 B13R1.3088 COc1ccc(cc1N)[C@H](N)C=C Amb24709355 [0,1,1,0,0,0|1,0,0]=3 1283 B13R1.3088 COc1ccc(cc1O)C(C)C#N Amb24584093 [0,1,1,0,0,0|1,0,1]=4 1284 B13R1.3088 COc1ccc(cc1O)C(C)NN Amb25160553 [0,1,1,0,0,0|2,0,0]=4 1285 B13R1.3088 COc1ccc(cc1O)C(C)NO Amb25677449 [0,1,1,0,0,0|2,0,0]=4 1286 B13R1.3088 COc1ccc(cc1O)C(F)CN Amb24511527 [0,1,1,0,0,0|1,0,1]=4 1287 B13R1.3088 COc1ccc(cc1O)C(N)C=C Amb24386104 [0,1,1,0,0,0|0,0,0]=2 1288 B13R1.3088 COc1ccc(cc1O)C(N)CN Amb24679638 [0,1,1,0,0,0|1,0,1]=4 1289 B13R1.3088 COc1ccc(cc1O)C(N)CO Amb18971966 [0,1,1,0,0,0|1,0,1]=4 1290 B13R1.3088 COc1ccc(cc1O)C(O)CC Amb25717747 [0,1,1,0,0,0|0,0,2]=4 1291 B13R1.3088 COc1ccc(cc1O)[C@@H](N)C#N Amb25070558 [0,1,1,0,0,0|1,0,1]=4 1292 B13R1.3088 COc1ccc(cc1O)[C@@H](N)C=C Amb25117965 [0,1,1,0,0,0|0,0,0]=2 1293 B13R1.3088 COc1ccc(cc1O)[C@@H](N)CF Amb25324760 [0,1,1,0,0,0|1,0,1]=4 1294 B13R1.3088 COc1ccc(cc1O)[C@@H](O)C#N Amb25034100 [0,1,1,0,0,0|1,0,1]=4 1295 B13R1.3088 COc1ccc(cc1O)[C@H](C)NO Amb25125342 [0,1,1,0,0,0|2,0,0]=4 1296 B13R1.3088 COc1ccc(cc1O)[C@H](N)C#N Amb25304071 [0,1,1,0,0,0|1,0,1]=4 1297 B13R1.3088 COc1ccc(cc1O)[C@H](N)C=C Amb25039511 [0,1,1,0,0,0|0,0,0]=2 1298 B13R1.3088 COc1ccc(cc1O)[C@H](N)CN Amb24384397 [0,1,1,0,0,0|1,0,1]=4 1299 B13R1.3088 COc1ccc(cc1O)[C@H](N)CO Amb24617464 [0,1,1,0,0,0|1,0,1]=4 1300 B13R1.3088 Cc1cc(ccc1OC)C(=O)C=C Amb18065613 [0,1,1,0,0,0|1,0,1]=4 1301 B13R1.3088 Cc1cc(ccc1OC)C(O)C=C Amb24488988 [0,1,1,0,0,0|1,0,0]=3 1302 B13R1.3088 Cc1cc(ccc1OC)[C@@H](N)C=C Amb24655816 [0,1,1,0,0,0|1,0,0]=3 1303 B13R1.3088 Cc1cc(ccc1OC)[C@H](N)C=C Amb25301985 [0,1,1,0,0,0|1,0,0]=3 1304 B13R1.3088 N#CC(c1ccc(c(c1)O)OC)N Amb1132366 [0,1,1,0,0,0|1,0,1]=4 1305 B13R1.3088 NCC(c1ccc(c(c1)O)OC)O Amb1107917 [0,1,1,0,0,0|1,0,1]=4 1306 B13R1.3088 O=CC(c1ccc(c(c1)Br)OC)C Amb17196240 [0,1,1,0,0,0|2,0,0]=4 1307 B13R1.3088 O=CC(c1ccc(c(c1)C)OC)C Amb17138857 [0,1,1,0,0,0|2,0,0]=4 1308 B13R1.3088 O=CC(c1ccc(c(c1)Cl)OC)C Amb17194778 [0,1,1,0,0,0|2,0,0]=4 1309 B13R1.3088 O=CC(c1ccc(c(c1)F)OC)C Amb17194549 [0,1,1,0,0,0|2,0,0]=4 1310 B13R1.4031 CCCc1cc(O)c(OC)c(O)c1 Amb25322806 [0,1,1,0,0,0|0,0,2]=4 1311 B13R1.4031 COc1c(F)cc(CC=C)cc1F Amb25189898 [0,1,1,0,0,0|1,0,0]=3 1312 B13R1.4031 COc1c(F)cc(CC=O)cc1F Amb25152933 [0,1,1,0,0,0|2,0,0]=4 1313 B13R1.4031 COc1c(O)cc(CC=C)cc1O Amb24434555 [0,1,1,0,0,0|0,0,0]=2 1314 B13R1.4031 COc1c(O)cc(CCO)cc1O Amb25741461 [0,1,1,0,0,0|1,0,1]=4 1315 B13R2.84 CCc1ccc2OCCc2c1O Amb25097175 [1,1,0,0,0,0|1,0,1]=4 1316 B13R2.84 CCc1ccc2OCOc2c1Br Amb24437679 [1,1,0,0,0,0|0,0,1]=3 1317 B13R2.84 CCc1ccc2OCOc2c1Cl Amb24691434 [1,1,0,0,0,0|0,0,1]=3 1318 B13R2.84 Cc1c(C=O)ccc2OCCc21 Amb18675555 [1,1,0,0,0,0|2,0,0]=4 1319 B13R2.84 Cc1c(C=O)ccc2OCOc21 Amb18829061 [1,1,0,0,0,0|1,0,0]=3 1320 B13R2.84 Cc1c2OCOc2ccc1OC Amb25735652 [1,1,0,0,0,0|1,0,1]=4 1321 B13R2.84 Clc1c2OCOc2ccc1CCl Amb25102672 [1,1,0,0,0,0|1,0,0]=3 1322 B13R2.84 O=Cc1ccc2OCOc2c1Br Amb23400627 [1,1,0,0,0,0|1,0,0]=3 1323 B13R2.84 O=Cc1ccc2OCOc2c1Cl Amb25751586 [1,1,0,0,0,0|1,0,0]=3 1324 B13R2.84 O=Cc1ccc2OCOc2c1I Amb23400625 [1,1,0,0,0,0|1,0,0]=3 1325 B13R2.84 OCc1ccc2OCOc2c1Cl Amb25154130 [1,1,0,0,0,0|1,0,0]=3 1326 B13R2.84 Oc1c(C=O)ccc2OCOc21 Amb22802487 [1,1,0,0,0,0|1,0,0]=3 1327 B13R2.84 Oc1c2OCOc2ccc1CCl Amb25816209 [1,1,0,0,0,0|1,0,0]=3 1328 B13R2.84 Oc1c2OCOc2ccc1CO Amb25700087 [1,1,0,0,0,0|1,0,0]=3 1329 B13R2.430 CC(=C)c1cc2ccoc2cc1 Amb24460889 [1,1,0,0,0,0|1,0,1]=4 1330 B13R2.430 CC(=C)c1ccc2CCNc2c1 Amb25705238 [1,1,0,0,0,0|2,0,0]=4 1331 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 Amb1680104 [1,1,0,0,0,0|1,0,1]=4 1332 B13R2.430 CC(=S)c1cc2OCOc2cc1 Amb24720829 [1,1,0,0,0,0|0,0,1]=3 1333 B13R2.430 CC(Cl)c1cc2CCOc2cc1 Amb19057043 [1,1,0,0,0,0|1,0,1]=4 1334 B13R2.430 CC(Cl)c1ccc2CCOc2c1 Amb25114879 [1,1,0,0,0,0|1,0,1]=4 1335 B13R2.430 CC(N)c1ccc2CCOc2c1 Amb22899533 [1,1,0,0,0,0|1,0,1]=4 1336 B13R2.430 CC(N)c1ccc2CCOc2c1 Amb22900040 [1,1,0,0,0,0|1,0,1]=4 1337 B13R2.430 CC(c1ccc2c(c1)CCO2)N Amb1108948 [1,1,0,0,0,0|1,0,1]=4 1338 B13R2.430 CC(c1ccc2c(c1)OCO2)N Amb1108031 [1,1,0,0,0,0|0,0,1]=3 1339 B13R2.430 CN(c1ccc2c(c1)OCO2)C Amb15772457 [1,1,0,0,0,0|1,0,1]=4 1340 B13R2.430 C[C@@H](N)c1cc2CCOc2cc1 Amb22746901 [1,1,0,0,0,0|1,0,1]=4 1341 B13R2.430 C[C@@H](N)c1ccc2CCOc2c1 Amb25839755 [1,1,0,0,0,0|1,0,1]=4 1342 B13R2.430 C[C@H](N)c1cc2CCOc2cc1 Amb25034594 [1,1,0,0,0,0|1,0,1]=4 1343 B13R2.430 C[C@H](N)c1ccc2CCOc2c1 Amb24737315 [1,1,0,0,0,0|1,0,1]=4 1344 B13R2.430 C[C@H](c1ccc2c(c1)CCO2)N Amb16233828 [1,1,0,0,0,0|1,0,1]=4 1345 B13R2.430 ClC(Cl)c1cc2OCOc2cc1 Amb25693351 [1,1,0,0,0,0|1,0,0]=3 1346 B13R2.430 NC(=O)c1c[n]c2OCOc2c1 Amb25700364 [1,1,0,0,0,0|2,0,0]=4 1347 B13R2.430 NC(=O)c1cc2OCOc2c[n]1 Amb25837412 [1,1,0,0,0,0|2,0,0]=4 1348 B13R2.430 NC(=O)c1ccc2CCOc2c1 Amb23399917 [1,1,0,0,0,0|2,0,0]=4 1349 B13R2.430 O=C(Cl)c1ccc2CCOc2c1 Amb24101537 [1,1,0,0,0,0|2,0,0]=4 1350 B13R2.430 O=S(Cl)c1cc2OCOc2cc1 Amb18567170 [1,1,0,0,0,0|2,0,0]=4 1351 B13R2.430 OC(=O)c1c[n]c2OCOc2c1 Amb18827404 [1,1,0,0,0,0|2,0,0]=4 1352 B13R2.430 OC(=O)c1cc2OCOc2c[n]1 Amb24060671 [1,1,0,0,0,0|2,0,0]=4 1353 B13R2.430 OC(=O)c1ccc2OCOc2[n]1 Amb18827396 [1,1,0,0,0,0|2,0,0]=4 1354 B13R2.430 OC(=O)c1ccc2c(c1)OCC2 Amb10602522 [1,1,0,0,0,0|2,0,0]=4 1355 B13R2.430 OC(=O)c1ccc2c(c1)OCN2 Amb17621777 [1,1,0,0,0,0|2,0,0]=4 1356 B13R2.430 OC(=O)c1ccc2c(c1)OCO2 Amb2542764 [1,1,0,0,0,0|1,0,0]=3 1357 B13R2.430 OS(=O)c1cc2OCOc2cc1 Amb18066175 [1,1,0,0,0,0|2,0,0]=4 1358 B13R2.430 [O-]C(=O)c1cc2OCOc2cc1 Amb24309015 [1,1,0,0,0,0|1,0,0]=3 1359 B13R2.430 [O-]S(=O)c1cc2OCOc2cc1 Amb25677807 [1,1,0,0,0,0|2,0,0]=4 1360 B13R2.430 [O-][N+](=O)c1ccc2c(c1)OCO2 Amb1950845 [1,1,0,0,0,0|2,0,0]=4 1361 B13R2.599 BrCc1cc2OCOc2cc1I Amb22410894 [1,1,0,0,0,0|1,0,0]=3 1362 B13R2.599 Brc1cc2OCCc2cc1CBr Amb24726803 [1,1,0,0,0,0|2,0,0]=4 1363 B13R2.599 CCc1cc2CCOc2cc1O Amb25713634 [1,1,0,0,0,0|1,0,1]=4 1364 B13R2.599 CCc1cc2OCOc2cc1Cl Amb25743479 [1,1,0,0,0,0|0,0,1]=3 1365 B13R2.599 CCc1cc2OCOc2cc1I Amb22263455 [1,1,0,0,0,0|0,0,1]=3 1366 B13R2.599 CCc1cc2OCOc2cc1O Amb25104203 [1,1,0,0,0,0|0,0,1]=3 1367 B13R2.599 CNc1cc2OCOc2cc1Cl Amb18280993 [1,1,0,0,0,0|1,0,1]=4 1368 B13R2.599 COc1cc2OCOc2cc1N Amb1099143 [1,1,0,0,0,0|1,0,1]=4 1369 B13R2.599 COc1cc2OCOc2cc1O Amb23590639 [1,1,0,0,0,0|1,0,1]=4 1370 B13R2.599 CSc1cc2OCOc2cc1I Amb22263454 [1,1,0,0,0,0|1,0,1]=4 1371 B13R2.599 CSc1cc2OCOc2cc1N Amb22263768 [1,1,0,0,0,0|1,0,1]=4 1372 B13R2.599 Cc1cc2OCCc2cc1C=O Amb18673178 [1,1,0,0,0,0|2,0,0]=4 1373 B13R2.599 Cc1cc2OCOc2cc1CCl Amb21963640 [1,1,0,0,0,0|1,0,0]=3 1374 B13R2.599 Cc1cc2OCOc2cc1NC Amb25800866 [1,1,0,0,0,0|1,0,1]=4 1375 B13R2.599 Cc1cc2OCOc2cc1OC Amb25692434 [1,1,0,0,0,0|1,0,1]=4 1376 B13R2.599 ClCc1cc2CCOc2cc1Br Amb24355515 [1,1,0,0,0,0|2,0,0]=4 1377 B13R2.599 Fc1cc2OCOc2cc1CCl Amb25061333 [1,1,0,0,0,0|1,0,0]=3 1378 B13R2.599 N#Cc1cc2OCOc2cc1Br Amb2438549 [1,1,0,0,0,0|1,0,1]=4 1379 B13R2.599 N#Cc1cc2OCOc2cc1Cl Amb1083977 [1,1,0,0,0,0|1,0,1]=4 1380 B13R2.599 N#Cc1cc2OCOc2cc1N Amb1058816 [1,1,0,0,0,0|1,0,1]=4 1381 B13R2.599 NCc1cc2OCOc2cc1Br Amb22284254 [1,1,0,0,0,0|1,0,0]=3 1382 B13R2.599 NCc1cc2OCOc2cc1Cl Amb13883614 [1,1,0,0,0,0|1,0,0]=3 1383 B13R2.599 NCc1cc2OCOc2cc1F Amb24446493 [1,1,0,0,0,0|1,0,0]=3 1384 B13R2.599 NCc1cc2OCOc2cc1O Amb18945833 [1,1,0,0,0,0|1,0,0]=3 1385 B13R2.599 Nc1cc2OCOc2cc1C=O Amb19929935 [1,1,0,0,0,0|1,0,0]=3 1386 B13R2.599 Nc1cc2OCOc2cc1CN Amb18251782 [1,1,0,0,0,0|1,0,0]=3 1387 B13R2.599 Nc1cc2OCOc2cc1CO Amb24487247 [1,1,0,0,0,0|1,0,0]=3 1388 B13R2.599 O=Cc1cc2CCOc2cc1Br Amb24741979 [1,1,0,0,0,0|2,0,0]=4 1389 B13R2.599 O=Cc1cc2CCOc2cc1F Amb18675551 [1,1,0,0,0,0|2,0,0]=4 1390 B13R2.599 O=Cc1cc2OCOc2cc1Br Amb1033071 [1,1,0,0,0,0|1,0,0]=3 1391 B13R2.599 O=Cc1cc2OCOc2cc1Cl Amb1794991 [1,1,0,0,0,0|1,0,0]=3 1392 B13R2.599 O=Cc1cc2OCOc2cc1F Amb18199345 [1,1,0,0,0,0|1,0,0]=3 1393 B13R2.599 O=Cc1cc2OCOc2cc1S Amb24370160 [1,1,0,0,0,0|1,0,0]=3 1394 B13R2.599 OCc1cc2CCOc2cc1Br Amb24365409 [1,1,0,0,0,0|2,0,0]=4 1395 B13R2.599 OCc1cc2OCOc2cc1Br Amb1111151 [1,1,0,0,0,0|1,0,0]=3 1396 B13R2.599 OCc1cc2OCOc2cc1Cl Amb1922949 [1,1,0,0,0,0|1,0,0]=3 1397 B13R2.599 O\N=C/1\C=C2OCOC2=CC1=O Amb2100200 [1,1,0,0,0,0|2,0,0]=4 1398 B13R2.599 O\N=C\1/C=C2OCOC2=CC1=O Amb1089808 [1,1,0,0,0,0|2,0,0]=4 1399 B13R2.599 O\N=C\1/C=C2OCOC2=CC1=O Amb21863051 [1,1,0,0,0,0|2,0,0]=4 1400 B13R2.599 Oc1cc2CCOc2cc1C=O Amb18645960 [1,1,0,0,0,0|2,0,0]=4 1401 B13R2.599 Oc1cc2OCCc2cc1C=O Amb18645962 [1,1,0,0,0,0|2,0,0]=4 1402 B13R2.599 Oc1cc2OCOc2cc1CO Amb18793016 [1,1,0,0,0,0|1,0,0]=3 1403 B13R2.654 C#Cc1cc(Cl)c2OCOc2c1 Amb25832100 [1,1,0,0,0,0|0,0,2]=4 1404 B13R2.654 CCc1cc2OCOc2c(Br)c1 Amb24625662 [1,1,0,0,0,0|0,0,1]=3 1405 B13R2.654 CCc1cc2OCOc2c(Cl)c1 Amb25126033 [1,1,0,0,0,0|0,0,1]=3 1406 B13R2.654 CCc1cc2OCOc2c(F)c1 Amb25273805 [1,1,0,0,0,0|0,0,1]=3 1407 B13R2.654 CCc1cc2OCOc2c(N)c1 Amb25047365 [1,1,0,0,0,0|0,0,1]=3 1408 B13R2.654 CNc1cc(Cl)c2OCOc2c1 Amb20672030 [1,1,0,0,0,0|1,0,1]=4 1409 B13R2.654 COc1cc(Br)c2OCOc2c1 Amb25261984 [1,1,0,0,0,0|1,0,1]=4 1410 B13R2.654 COc1cc(N)c2c(c1)OCO2 Amb16233844 [1,1,0,0,0,0|1,0,1]=4 1411 B13R2.654 COc1cc(O)c2OCOc2c1 Amb24722855 [1,1,0,0,0,0|1,0,1]=4 1412 B13R2.654 Cc1cc(C=O)cc2OCOc21 Amb25322838 [1,1,0,0,0,0|1,0,0]=3 1413 B13R2.654 Cc1cc(CC)cc2OCOc12 Amb25100429 [1,1,0,0,0,0|0,0,1]=3 1414 B13R2.654 Cc1cc(CN)cc2CCOc21 Amb24616032 [1,1,0,0,0,0|2,0,0]=4 1415 B13R2.654 Cc1cc(CN)cc2OCOc21 Amb25239552 [1,1,0,0,0,0|1,0,0]=3 1416 B13R2.654 Cc1cc(CO)cc2CCOc21 Amb25213007 [1,1,0,0,0,0|2,0,0]=4 1417 B13R2.654 Cc1cc(CO)cc2OCOc21 Amb24564857 [1,1,0,0,0,0|1,0,0]=3 1418 B13R2.654 ClCc1cc(Cl)c2c(c1)OCO2 Amb1157179 [1,1,0,0,0,0|1,0,0]=3 1419 B13R2.654 Clc1cc(CI)cc2OCOc21 Amb25209411 [1,1,0,0,0,0|1,0,0]=3 1420 B13R2.654 Fc1cc(CCl)cc2OCOc21 Amb25685269 [1,1,0,0,0,0|1,0,0]=3 1421 B13R2.654 NCc1cc(O)c2CCOc2c1 Amb25090329 [1,1,0,0,0,0|2,0,0]=4 1422 B13R2.654 NCc1cc2OCOc2c(O)c1 Amb24511778 [1,1,0,0,0,0|1,0,0]=3 1423 B13R2.654 Nc1cc(CO)cc2OCOc21 Amb25780960 [1,1,0,0,0,0|1,0,0]=3 1424 B13R2.654 O=Cc1cc(Br)c2c(c1)OCO2 Amb1107233 [1,1,0,0,0,0|1,0,0]=3 1425 B13R2.654 O=Cc1cc(Cl)c2c(c1)OCO2 Amb1153623 [1,1,0,0,0,0|1,0,0]=3 1426 B13R2.654 O=Cc1cc2CCOc2c(F)c1 Amb25239510 [1,1,0,0,0,0|2,0,0]=4 1427 B13R2.654 OCc1cc(Br)c2c(c1)OCO2 Amb247856 [1,1,0,0,0,0|1,0,0]=3 1428 B13R2.654 OCc1cc2CCOc2c(Br)c1 Amb21926697 [1,1,0,0,0,0|2,0,0]=4 1429 B13R2.654 Oc1cc(C=O)cc2CCOc21 Amb18829060 [1,1,0,0,0,0|2,0,0]=4 1430 B13R2.654 SCc1cc2OCOc2c(Br)c1 Amb25782041 [1,1,0,0,0,0|1,0,0]=3 1431 B13R2.654 SCc1cc2OCOc2c(Cl)c1 Amb24722174 [1,1,0,0,0,0|1,0,0]=3 1432 B13R2.669 C=Cc1cc2C(=O)NOc2cc1 Amb24497710 [1,1,0,0,0,0|2,0,0]=4 1433 B13R2.669 C=Cc1cc2[C@@H](N)COc2cc1 Amb25076726 [1,1,0,0,0,0|1,0,0]=3 1434 B13R2.669 C=Cc1cc2c(Br)coc2cc1 Amb24642782 [1,1,0,0,0,0|1,0,1]=4 1435 B13R2.669 C=Cc1ccc2CCC(=O)c2c1 Amb25320727 [1,1,0,0,0,0|2,0,0]=4 1436 B13R2.669 C=Cc1ccc2CCC(O)c2c1 Amb25069663 [1,1,0,0,0,0|2,0,0]=4 1437 B13R2.669 CC1COc2ccc(CN)cc21 Amb24396136 [1,1,0,0,0,0|2,0,0]=4 1438 B13R2.669 CCc1cc2[C@H](N)COc2cc1 Amb24341696 [1,1,0,0,0,0|1,0,1]=4 1439 B13R2.2121 CC1Cc2ccc(C=C)cc2N1 Amb25786289 [1,1,0,0,0,0|2,0,0]=4 1440 B13R2.2121 CC1Oc2cc(C=O)ccc2O1 Amb25055880 [1,1,0,0,0,0|1,0,0]=3 1441 B13R2.2121 C[C@@H]1Cc2cc(C=C)ccc2N1 Amb25036188 [1,1,0,0,0,0|2,0,0]=4 1442 B13R2.2121 C[C@@H]1Cc2ccc(C=C)cc2N1 Amb24493114 [1,1,0,0,0,0|2,0,0]=4 1443 B13R2.2121 C[C@H]1Cc2cc(C=C)ccc2N1 Amb25156550 [1,1,0,0,0,0|2,0,0]=4 1444 B13R2.2121 C[C@H]1Cc2ccc(C=C)cc2N1 Amb24658482 [1,1,0,0,0,0|2,0,0]=4 1445 B13R2.2121 Cc1[n]c2cc(C=C)ccc2o1 Amb24708030 [1,1,0,0,0,0|1,0,1]=4 1446 B13R2.2121 O=C1Oc2cc(ccc2O1)C=O Amb25758669 [1,1,0,0,0,0|1,0,1]=4 1447 B13R2.2121 OCc1ccc2c(c1)CC(O2)C Amb10782054 [1,1,0,0,0,0|2,0,0]=4 1448 B13R2.2130 C=Cc1cc2CCC(=O)c2cc1 Amb25781430 [1,1,0,0,0,0|2,0,0]=4 1449 B13R2.2130 C=Cc1cc2CCC(N)c2cc1 Amb25273244 [1,1,0,0,0,0|2,0,0]=4 1450 B13R2.2130 C=Cc1cc2CC[C@@H](N)c2cc1 Amb25744456 [1,1,0,0,0,0|2,0,0]=4 1451 B13R2.2130 CC1COc2cc(CN)ccc21 Amb25850209 [1,1,0,0,0,0|2,0,0]=4 1452 B13R2.2130 CCc1cc2OCC(N)c2cc1 Amb24655876 [1,1,0,0,0,0|1,0,1]=4 1453 B13R2.2130 N[C@@H]1COc2cc(CO)ccc21 Amb25324212 [1,1,0,0,0,0|2,0,0]=4 1454 B13R2.2130 N[C@H]1COc2cc(CO)ccc21 Amb25187576 [1,1,0,0,0,0|2,0,0]=4 1455 B13R2.2130 O=C1COc2cc(CBr)ccc21 Amb24461300 [1,1,0,0,0,0|2,0,0]=4 1456 B13R2.2130 OC1COc2cc(C=O)ccc21 Amb18829058 [1,1,0,0,0,0|2,0,0]=4 1457 B13R2.2130 OCc1cc2OCC(=O)c2cc1 Amb25678282 [1,1,0,0,0,0|2,0,0]=4 1458 B13R2.687 OC(=O)Cc1c[s]c2OCOc12 Amb18822220 [0,1,0,0,1,0|2,0,0]=4 1459 B15R2.352 BrCCCc1ccc2c(c1)OCCO2 Amb17104571 [0,1,0,0,0,1|0,0,2]=4 1460 B15R2.352 BrCCSc1cc2OCCOc2cc1 Amb24336821 [0,1,0,0,0,1|1,0,1]=4 1461 B15R2.352 C#CCCc1ccc2OCCOc2c1 Amb18636003 [0,1,0,0,0,1|0,0,2]=4 1462 B15R2.352 C#CCNc1cc2OCCOc2cc1 Amb18284532 [0,1,0,0,0,1|0,0,2]=4 1463 B15R2.352 C=CCNc1cc2OCCOc2cc1 Amb18295660 [0,1,0,0,0,1|0,0,0]=2 1464 B15R2.352 CCNCc1ccc2c(c1)OCCO2 Amb2009793 [0,1,0,0,0,1|0,0,2]=4 1465 B15R2.352 CCNCc1ccc2c(c1)OCCO2 Amb2370855 [0,1,0,0,0,1|0,0,2]=4 1466 B15R2.352 CONCc1ccc2OCCOc2c1 Amb25830893 [0,1,0,0,0,1|1,0,1]=4 1467 B15R2.352 ClCCCc1ccc2c(c1)OCCO2 Amb17104543 [0,1,0,0,0,1|0,0,2]=4 1468 B15R2.352 ClCCNc1ccc2c(c1)OCCO2 Amb17340106 [0,1,0,0,0,1|1,0,1]=4 1469 B15R2.352 N#CCCc1ccc2OCCOc2c1 Amb18863391 [0,1,0,0,0,1|0,0,2]=4 1470 B15R2.352 N#CCSc1ccc2c(c1)OCCO2 Amb21232 [0,1,0,0,0,1|1,0,1]=4 1471 B15R2.352 NCCCc1cc2COCOc2cc1 Amb18816208 [0,1,0,0,0,1|0,0,2]=4 1472 B15R2.352 NCCCc1cc2OCCOc2cc1 Amb20630060 [0,1,0,0,0,1|0,0,2]=4 1473 B15R2.352 NCCNc1ccc2c(c1)OCCO2 Amb17057756 [0,1,0,0,0,1|1,0,1]=4 1474 B15R2.352 NCCOc1cc2OCCOc2cc1 Amb18894483 [0,1,0,0,0,1|1,0,1]=4 1475 B15R2.352 NCCSc1ccc2c(c1)OCCO2 Amb17083038 [0,1,0,0,0,1|1,0,1]=4 1476 B15R2.352 NC\C=C\c1cc2OCCOc2cc1 Amb18564831 [0,1,0,0,0,1|0,0,2]=4 1477 B15R2.352 NNCCc1ccc2c(c1)OCCO2 Amb17401887 [0,1,0,0,0,1|1,0,1]=4 1478 B15R2.352 O=C=NCc1ccc2c(c1)OCCO2 Amb17090272 [0,1,0,0,0,1|1,0,1]=4 1479 B15R2.352 O=CCCc1ccc2c(c1)OCCO2 Amb17081686 [0,1,0,0,0,1|0,0,1]=3 1480 B15R2.352 O=CCOc1cc2CCCOc2cc1 Amb24588555 [0,1,0,0,0,1|2,0,0]=4 1481 B15R2.352 O=CCSc1ccc2c(c1)OCCO2 Amb17082926 [0,1,0,0,0,1|1,0,0]=3 1482 B15R2.352 O=CNCc1ccc2OCCOc2c1 Amb24407066 [0,1,0,0,0,1|1,0,0]=3 1483 B15R2.352 O=C\C=C\c1ccc2c(c1)OCCO2 Amb17336192 [0,1,0,0,0,1|0,0,1]=3 1484 B15R2.352 OCCCc1ccc2c(c1)OCCO2 Amb17089508 [0,1,0,0,0,1|0,0,2]=4 1485 B15R2.352 OCCSc1cc2OCCOc2cc1 Amb24674565 [0,1,0,0,0,1|1,0,1]=4 1486 B15R2.352 OC\C=C\c1cc2OCCOc2cc1 Amb24498551 [0,1,0,0,0,1|0,0,2]=4 1487 B15R2.352 SCCCc1cc2OCCOc2cc1 Amb18569138 [0,1,0,0,0,1|0,0,2]=4 1488 B15R2.352 SCCSc1cc2OCCOc2cc1 Amb24336822 [0,1,0,0,0,1|1,0,1]=4 1489 B15R2.886 ClCCc1cc2OCCOc2c(Br)c1 Amb24510901 [0,1,0,0,0,1|1,0,1]=4 1490 B15R2.886 N#CCc1cc2COCOc2c(Cl)c1 Amb25325678 [0,1,0,0,0,1|1,0,1]=4 1491 B15R2.886 NCCc1cc2OCCOc2c(c1)Cl Amb111233 [0,1,0,0,0,1|1,0,1]=4 1492 B15R2.886 NCCc1cc2OCCOc2c(c1)Cl Amb2371590 [0,1,0,0,0,1|1,0,1]=4 1493 B15R2.886 OCCc1cc2OCCOc2c(Cl)c1 Amb25183209 [0,1,0,0,0,1|1,0,1]=4 1494 B15R2.888 C=CCc1cc2OCCCc2cc1O Amb25759297 [0,1,0,0,0,1|1,0,0]=3 1495 B15R2.888 CNCc1cc2OCCOc2cc1Br Amb23450371 [0,1,0,0,0,1|1,0,1]=4 1496 B15R2.888 CNCc1cc2OCCOc2cc1Cl Amb18277040 [0,1,0,0,0,1|1,0,1]=4 1497 B15R2.888 CNCc1cc2OCCOc2cc1F Amb25312445 [0,1,0,0,0,1|1,0,1]=4 1498 B15R2.888 CNCc1cc2OCCOc2cc1N Amb18940491 [0,1,0,0,0,1|1,0,1]=4 1499 B15R2.888 COCc1cc2OCCOc2cc1Br Amb23510462 [0,1,0,0,0,1|1,0,1]=4 1500 B15R2.888 CSCc1cc2OCCOc2cc1N Amb18951027 [0,1,0,0,0,1|1,0,1]=4 1501 B15R2.888 Cc1cc2OCCOc2cc1CC#N Amb18863392 [0,1,0,0,0,1|1,0,1]=4 1502 B15R2.888 Cc1cc2OCCOc2cc1CCBr Amb18229839 [0,1,0,0,0,1|1,0,1]=4 1503 B15R2.888 Cc1cc2OCCOc2cc1CCCl Amb18866402 [0,1,0,0,0,1|1,0,1]=4 1504 B15R2.888 Cc1cc2OCCOc2cc1CCN Amb18244034 [0,1,0,0,0,1|1,0,1]=4 1505 B15R2.888 Cc1cc2OCCOc2cc1CCO Amb18863884 [0,1,0,0,0,1|1,0,1]=4 1506 B15R2.888 Cc1cc2OCCOc2cc1CCS Amb24405388 [0,1,0,0,0,1|1,0,1]=4 1507 B15R2.888 Cc1cc2OCCOc2cc1CNC Amb18863826 [0,1,0,0,0,1|1,0,1]=4 1508 B15R2.888 NCCc1cc2OCCOc2cc1Br Amb17200009 [0,1,0,0,0,1|1,0,1]=4 1509 B15R2.888 NCCc1cc2OCCOc2cc1Cl Amb17199997 [0,1,0,0,0,1|1,0,1]=4 1510 B15R2.888 NCCc1cc2OCCOc2cc1N Amb17200051 [0,1,0,0,0,1|1,0,1]=4 1511 B15R2.888 NNCc1cc2OCCOc2cc1Br Amb1113514 [0,1,0,0,0,1|2,0,0]=4 1512 B15R2.1601 BrCC(c1ccc2c(c1)OCCO2)C Amb17265529 [0,1,0,0,0,1|1,0,1]=4 1513 B15R2.1601 BrCC(c1ccc2c(c1)OCCO2)O Amb17206116 [0,1,0,0,0,1|1,0,1]=4 1514 B15R2.1601 C=CC(=O)c1cc2CCCOc2cc1 Amb18224832 [0,1,0,0,0,1|1,0,1]=4 1515 B15R2.1601 C=CC(=O)c1cc2OCCOc2cc1 Amb18066251 [0,1,0,0,0,1|0,0,1]=3 1516 B15R2.1601 C=CC(N)c1cc2CCCCc2cc1 Amb25836879 [0,1,0,0,0,1|2,0,0]=4 1517 B15R2.1601 C=CC(N)c1cc2CCCNc2cc1 Amb25679848 [0,1,0,0,0,1|2,0,0]=4 1518 B15R2.1601 C=CC(O)c1cc2CCCCc2cc1 Amb25283217 [0,1,0,0,0,1|2,0,0]=4 1519 B15R2.1601 C=CC(O)c1cc2OCCOc2cc1 Amb25280473 [0,1,0,0,0,1|0,0,0]=2 1520 B15R2.1601 C=C[C@@H](N)c1cc2CCCCc2cc1 Amb25724306 [0,1,0,0,0,1|2,0,0]=4 1521 B15R2.1601 C=C[C@@H](N)c1cc2OCCOc2cc1 Amb24401123 [0,1,0,0,0,1|0,0,0]=2 1522 B15R2.1601 C=C[C@@H](N)c1ccc2CCCOc2c1 Amb24364685 [0,1,0,0,0,1|1,0,0]=3 1523 B15R2.1601 C=C[C@@H](N)c1ccc2NCCOc2[n]1 Amb24417774 [0,1,0,0,0,1|2,0,0]=4 1524 B15R2.1601 C=C[C@H](N)c1cc2CCCOc2cc1 Amb25762200 [0,1,0,0,0,1|1,0,0]=3 1525 B15R2.1601 C=C[C@H](N)c1cc2OCCOc2cc1 Amb25809451 [0,1,0,0,0,1|0,0,0]=2 1526 B15R2.1601 C=C[C@H](N)c1ccc2CCCOc2c1 Amb25364822 [0,1,0,0,0,1|1,0,0]=3 1527 B15R2.1601 CCC(c1ccc2c(c1)OCCO2)Cl Amb17140719 [0,1,0,0,0,1|0,0,2]=4 1528 B15R2.1601 CCC(c1ccc2c(c1)OCCO2)N Amb10609666 [0,1,0,0,0,1|0,0,2]=4 1529 B15R2.1601 CC[C@@H](O)c1cc2OCCOc2cc1 Amb24692287 [0,1,0,0,0,1|0,0,2]=4 1530 B15R2.1601 CC[C@H](N)c1cc2OCCOc2cc1 Amb25698326 [0,1,0,0,0,1|0,0,2]=4 1531 B15R2.1601 CNC(c1ccc2c(c1)OCCO2)C Amb1041468 [0,1,0,0,0,1|1,0,1]=4 1532 B15R2.1601 ClCC(c1ccc2c(c1)OCCO2)C Amb17241256 [0,1,0,0,0,1|1,0,1]=4 1533 B15R2.1601 ClCC(c1ccc2c(c1)OCCO2)O Amb17195183 [0,1,0,0,0,1|1,0,1]=4 1534 B15R2.1601 FCC(c1ccc2c(c1)OCCO2)N Amb2372614 [0,1,0,0,0,1|1,0,1]=4 1535 B15R2.1601 N#CC(O)c1cc2COCOc2cc1 Amb25831776 [0,1,0,0,0,1|1,0,1]=4 1536 B15R2.1601 N#CC(c1ccc2c(c1)OCCO2)N Amb10609750 [0,1,0,0,0,1|1,0,1]=4 1537 B15R2.1601 N#CC(c1ccc2c(c1)OCCO2)N Amb1108015 [0,1,0,0,0,1|1,0,1]=4 1538 B15R2.1601 N#C[C@H](O)c1cc2COCOc2cc1 Amb25284272 [0,1,0,0,0,1|1,0,1]=4 1539 B15R2.1601 NCC(c1ccc2c(c1)OCCO2)O Amb1055149 [0,1,0,0,0,1|1,0,1]=4 1540 B15R2.1601 NC[C@H](O)c1cc2OCCOc2cc1 Amb24678460 [0,1,0,0,0,1|1,0,1]=4 1541 B15R2.1601 NOC(c1ccc2c(c1)OCCO2)C Amb17089201 [0,1,0,0,0,1|2,0,0]=4 1542 B15R2.1601 N[C@H](CF)c1cc2OCCOc2cc1 Amb24337062 [0,1,0,0,0,1|1,0,1]=4 1543 B15R2.1601 N[C@H](CO)c1cc2OCCOc2cc1 Amb25671054 [0,1,0,0,0,1|1,0,1]=4 1544 B15R2.1601 O=C(C=O)c1cc2OCCOc2cc1 Amb25119190 [0,1,0,0,0,1|1,0,1]=4 1545 B15R2.1601 O=CC(c1ccc2c(c1)OCCO2)C Amb17139344 [0,1,0,0,0,1|1,0,0]=3 1546 B15R2.1601 OCC(F)c1cc2OCCOc2cc1 Amb24628216 [0,1,0,0,0,1|1,0,1]=4 1547 B15R2.1601 OCC(O)c1cc2OCCOc2cc1 Amb18565801 [0,1,0,0,0,1|1,0,1]=4 1548 B15R2.1601 OCC(c1ccc2c(c1)OCCO2)C Amb17235902 [0,1,0,0,0,1|1,0,1]=4 1549 B15R2.1601 OCC(c1ccc2c(c1)OCCO2)N Amb17236160 [0,1,0,0,0,1|1,0,1]=4 1550 B15R2.1601 ONC(c1ccc2c(c1)OCCO2)C Amb17089218 [0,1,0,0,0,1|2,0,0]=4 1551 B15R2.1601 O[C@@H](CCl)c1cc2OCCOc2cc1 Amb24336944 [0,1,0,0,0,1|1,0,1]=4 1552 B15R2.1601 O[C@H](CCl)c1cc2OCCOc2cc1 Amb25059869 [0,1,0,0,0,1|1,0,1]=4 1553 B15R2.1668 BrC(Br)=Cc1cc2OCCOc2cc1 Amb24390592 [0,1,0,0,0,1|1,0,1]=4 1554 B15R2.1668 CC(=O)Cc1cc2CCCOc2cc1 Amb18243942 [0,1,0,0,0,1|1,0,1]=4 1555 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 Amb1211222 [0,1,0,0,0,1|1,0,1]=4 1556 B15R2.1668 CC(=O)Oc1ccc2c(c1)OCCO2 Amb17615069 [0,1,0,0,0,1|1,0,1]=4 1557 B15R2.1668 CC(Br)Cc1ccc2OCCOc2c1 Amb18548895 [0,1,0,0,0,1|0,0,2]=4 1558 B15R2.1668 CC(Cl)Cc1ccc2OCCOc2c1 Amb18549155 [0,1,0,0,0,1|0,0,2]=4 1559 B15R2.1668 NC(=N)Cc1cc2CCCOc2cc1 Amb25080069 [0,1,0,0,0,1|2,0,0]=4 1560 B15R2.1668 NC(=N)Cc1ccc2OCCOc2c1 Amb25064646 [0,1,0,0,0,1|1,0,0]=3 1561 B15R2.1668 NC(=N)Nc1ccc2c(c1)OCCO2 Amb10879723 [0,1,0,0,0,1|2,0,0]=4 1562 B15R2.1668 NC(=N)Sc1cc2OCCOc2cc1 Amb25693544 [0,1,0,0,0,1|2,0,0]=4 1563 B15R2.1668 NC(=O)Cc1cc2CCCOc2cc1 Amb18894063 [0,1,0,0,0,1|2,0,0]=4 1564 B15R2.1668 NC(=O)Nc1ccc2c(c1)OCCO2 Amb1086709 [0,1,0,0,0,1|2,0,0]=4 1565 B15R2.1668 NC(=S)Cc1ccc2c(c1)OCCO2 Amb17464667 [0,1,0,0,0,1|1,0,0]=3 1566 B15R2.1668 NC(=S)Nc1ccc2c(c1)OCCO2 Amb1151337 [0,1,0,0,0,1|2,0,0]=4 1567 B15R2.1668 OC(=O)Cc1cc2CCOCc2cc1 Amb18817576 [0,1,0,0,0,1|2,0,0]=4 1568 B15R2.1668 OC(=O)Cc1cc2COCOc2cc1 Amb18815456 [0,1,0,0,0,1|1,0,0]=3 1569 B15R2.1668 OC(=O)Cc1cc2OCCCc2cc1 Amb24634190 [0,1,0,0,0,1|2,0,0]=4 1570 B15R2.1668 OC(=O)Cc1ccc2CCOCc2c1 Amb18817575 [0,1,0,0,0,1|2,0,0]=4 1571 B15R2.1668 OC(=O)Cc1ccc2COCOc2c1 Amb18815455 [0,1,0,0,0,1|1,0,0]=3 1572 B15R2.1668 OC(=O)Cc1ccc2OCCOc2[n]1 Amb22496518 [0,1,0,0,0,1|2,0,0]=4 1573 B15R2.1668 OC(=O)Cc1ccc2c(c1)NCCO2 Amb17199840 [0,1,0,0,0,1|2,0,0]=4 1574 B15R2.1668 OC(=O)Cc1ccc2c(c1)OCCO2 Amb1102278 [0,1,0,0,0,1|1,0,0]=3 1575 B15R2.2220 C=CCc1ccc2OCCOc2c1O Amb18651081 [0,1,0,0,0,1|0,0,0]=2 1576 B15R2.2220 C\C=C\c1ccc2OCCOc2c1O Amb18651090 [0,1,0,0,0,1|0,0,2]=4 1577 B15R2.10252 CC1OCc2cc(CCN)ccc2O1 Amb18816202 [0,1,0,0,0,1|1,0,1]=4 1578 B15R2.1393 C=CCOc1ccc2c(c1)C(=O)CC2 Amb10021518 [0,2,0,0,0,0|2,0,0]=4 1579 B15R2.10452 C=CCc1ccc2CCC(=O)c2c1O Amb25373160 [0,2,0,0,0,0|2,0,0]=4 1580 B15R2.10453 CC1(C)COc2ccc(CC=O)cc12 Amb25775126 [0,2,0,0,0,0|2,0,0]=4 1581 B15R2.10454 CCN1CCc2ccc(CC=C)cc12 Amb25684381 [0,2,0,0,0,0|2,0,0]=4 1582 B15R2.964 CC(=C)Cc1cc2CCCc2cc1O Amb24689570 [0,2,0,0,0,0|2,0,0]=4 1583 B15R2.964 CC(=O)Cc1cc2OCOc2cc1C Amb17595026 [0,2,0,0,0,0|0,0,1]=3 1584 B15R2.964 CC(=O)Nc1cc2OCOc2cc1Cl Amb25128376 [0,2,0,0,0,0|1,0,1]=4 1585 B15R2.964 CC(=O)Nc1cc2OCOc2cc1I Amb22284690 [0,2,0,0,0,0|1,0,1]=4 1586 B15R2.964 CC(=O)Nc1cc2OCOc2cc1O Amb25046731 [0,2,0,0,0,0|1,0,1]=4 1587 B15R2.964 CC(=O)Oc1cc2OCOc2cc1Br Amb24063787 [0,2,0,0,0,0|1,0,1]=4 1588 B15R2.964 CC(N)Cc1cc2OCOc2cc1Br Amb17939549 [0,2,0,0,0,0|0,0,2]=4 1589 B15R2.964 CC(N)Cc1cc2OCOc2cc1Cl Amb24336273 [0,2,0,0,0,0|0,0,2]=4 1590 B15R2.964 CC(N)Cc1cc2OCOc2cc1O Amb25703171 [0,2,0,0,0,0|0,0,2]=4 1591 B15R2.964 CN(C)Cc1cc2OCOc2cc1Br Amb23510461 [0,2,0,0,0,0|1,0,1]=4 1592 B15R2.964 CN(C)Cc1cc2OCOc2cc1O Amb24686434 [0,2,0,0,0,0|1,0,1]=4 1593 B15R2.964 Cc1cc2OCCc2cc1CC(O)=O Amb18817540 [0,2,0,0,0,0|2,0,0]=4 1594 B15R2.964 NC(=O)Nc1cc2OCOc2cc1C Amb1089392 [0,2,0,0,0,0|2,0,0]=4 1595 B15R2.964 Nc1cc2OCOc2cc1CC(N)=O Amb25299335 [0,2,0,0,0,0|1,0,0]=3 1596 B15R2.964 OC(=O)Cc1cc2OCOc2cc1Cl Amb17199921 [0,2,0,0,0,0|1,0,0]=3 1597 B15R2.964 Oc1cc2CCOc2cc1CC(O)=O Amb18815436 [0,2,0,0,0,0|2,0,0]=4 1598 B15R2.1503 Brc1cc2OCOc2cc1CCC#N Amb17943500 [0,2,0,0,0,0|0,0,2]=4 1599 B15R2.1503 CCNCc1cc2OCOc2cc1O Amb18980097 [0,2,0,0,0,0|0,0,2]=4 1600 B15R2.1503 COCOc1cc2OCOc2cc1N Amb25664148 [0,2,0,0,0,0|1,0,1]=4 1601 B15R2.1503 CONCc1cc2OCOc2cc1Br Amb24406993 [0,2,0,0,0,0|1,0,1]=4 1602 B15R2.1503 CONCc1cc2OCOc2cc1O Amb25183262 [0,2,0,0,0,0|1,0,1]=4 1603 B15R2.1503 Cc1cc2OCOc2cc1CCCN Amb24745682 [0,2,0,0,0,0|0,0,2]=4 1604 B15R2.1503 Cc1cc2OCOc2cc1CCCO Amb25723009 [0,2,0,0,0,0|0,0,2]=4 1605 B15R2.1503 NCCCc1cc2OCOc2cc1Cl Amb18914842 [0,2,0,0,0,0|0,0,2]=4 1606 B15R2.1503 NCCNc1cc2OCOc2cc1Cl Amb25373523 [0,2,0,0,0,0|1,0,1]=4 1607 B15R2.1503 NCCOc1cc2OCOc2cc1F Amb25217078 [0,2,0,0,0,0|1,0,1]=4 1608 B15R2.1503 Nc1cc2OCOc2cc1CCCO Amb24365944 [0,2,0,0,0,0|0,0,2]=4 1609 B15R2.1503 Nc1cc2OCOc2cc1OCCO Amb24106707 [0,2,0,0,0,0|1,0,1]=4 1610 B15R2.1503 O=CCCc1cc2OCOc2cc1Br Amb24615676 [0,2,0,0,0,0|0,0,1]=3 1611 B15R2.1503 OCCCc1cc2OCOc2cc1Br Amb24461683 [0,2,0,0,0,0|0,0,2]=4 1612 B15R2.1503 OCCCc1cc2OCOc2cc1Cl Amb25697661 [0,2,0,0,0,0|0,0,2]=4 1613 B15R2.2215 C=CCc1cc2OCOc2cc1C=O Amb25288307 [0,2,0,0,0,0|0,0,0]=2 1614 B15R2.2215 CCCc1cc2OCOc2cc1C=O Amb24422670 [0,2,0,0,0,0|0,0,2]=4 1615 B15R2.2215 CCCc1cc2OCOc2cc1NC Amb25301451 [0,2,0,0,0,0|0,0,2]=4 1616 B15R2.2215 CCc1cc2OCOc2cc1CCO Amb25855814 [0,2,0,0,0,0|1,0,1]=4 1617 B15R2.2215 COc1cc2CCOc2cc1CC=C Amb25249484 [0,2,0,0,0,0|1,0,0]=3 1618 B15R2.2215 COc1cc2OCOc2cc1CCN Amb18980096 [0,2,0,0,0,0|1,0,1]=4 1619 B15R2.2215 COc1cc2OCOc2cc1CNC Amb18980092 [0,2,0,0,0,0|1,0,1]=4 1620 B15R2.2215 N#CCc1cc2OCOc2cc1C=O Amb24506371 [0,2,0,0,0,0|1,0,1]=4 1621 B15R2.2215 N#CCc1cc2OCOc2cc1CCl Amb25758805 [0,2,0,0,0,0|1,0,1]=4 1622 B15R2.2215 N#Cc1cc2OCOc2cc1CC#N Amb24657276 [0,2,0,0,0,0|1,0,1]=4 1623 B15R2.2215 N#Cc1cc2OCOc2cc1CC=O Amb24706844 [0,2,0,0,0,0|1,0,0]=3 1624 B15R2.11741 CCCc1c(N)cc2OCOc2c1N Amb24347914 [0,2,0,0,0,0|0,0,2]=4 1625 B15R2.12627 N#CCc1cc2OCOc2c(Cl)c1F Amb24679247 [0,2,0,0,0,0|1,0,1]=4 1626 B15R2.12627 NCCc1cc2OCOc2c(Cl)c1F Amb24743989 [0,2,0,0,0,0|1,0,1]=4 1627 B15R2.12751 CC1CCc2cc(CC=C)c(O)cc21 Amb25073363 [0,2,0,0,0,0|2,0,0]=4 1628 B15R2.19053 C=CC(N)c1cc2CCCc2cc1Cl Amb25756661 [0,2,0,0,0,0|2,0,0]=4 1629 B15R2.19053 C=CC(N)c1cc2OCOc2cc1Br Amb25704184 [0,2,0,0,0,0|0,0,0]=2 1630 B15R2.19053 C=C[C@@H](N)c1cc2CCOc2cc1F Amb24406572 [0,2,0,0,0,0|1,0,0]=3 1631 B15R2.19053 C=C[C@@H](O)c1cc2OCOc2cc1Br Amb25682497 [0,2,0,0,0,0|0,0,0]=2 1632 B15R2.19053 C=C[C@H](N)c1cc2CCCc2cc1Cl Amb25364233 [0,2,0,0,0,0|2,0,0]=4 1633 B15R2.19053 C=C[C@H](N)c1cc2CCOc2cc1F Amb25053403 [0,2,0,0,0,0|1,0,0]=3 1634 B15R2.19053 C=C[C@H](N)c1cc2OCOc2cc1Br Amb25665406 [0,2,0,0,0,0|0,0,0]=2 1635 B15R2.19053 C=C[C@H](O)c1cc2OCOc2cc1Br Amb24436578 [0,2,0,0,0,0|0,0,0]=2 1636 B15R2.19053 CCC(O)c1cc2OCOc2cc1Br Amb25826065 [0,2,0,0,0,0|0,0,2]=4 1637 B15R2.19053 CC[C@@H](N)c1cc2OCOc2cc1Br Amb25028262 [0,2,0,0,0,0|0,0,2]=4 1638 B15R2.19053 CC[C@@H](N)c1cc2OCOc2cc1Cl Amb25355020 [0,2,0,0,0,0|0,0,2]=4 1639 B15R2.19053 CC[C@H](N)c1cc2OCOc2cc1Cl Amb25132986 [0,2,0,0,0,0|0,0,2]=4 1640 B15R2.19053 CC[C@H](O)c1cc2OCOc2cc1Br Amb24683986 [0,2,0,0,0,0|0,0,2]=4 1641 B15R2.19053 CNC(C)c1cc2OCOc2cc1Br Amb25844978 [0,2,0,0,0,0|1,0,1]=4 1642 B15R2.19053 CN[C@@H](C)c1cc2OCOc2cc1Cl Amb24382662 [0,2,0,0,0,0|1,0,1]=4 1643 B15R2.19053 CN[C@H](C)c1cc2OCOc2cc1Br Amb25181395 [0,2,0,0,0,0|1,0,1]=4 1644 B15R2.19053 Cc1cc2CCCc2cc1[C@@H](N)C=C Amb24432721 [0,2,0,0,0,0|2,0,0]=4 1645 B15R2.19053 Cc1cc2CCCc2cc1[C@H](N)C=C Amb25089978 [0,2,0,0,0,0|2,0,0]=4 1646 B15R2.19053 Cc1cc2OCCc2cc1[C@H](N)C=C Amb25295353 [0,2,0,0,0,0|1,0,0]=3 1647 B15R2.19053 Cc1cc2OCOc2cc1C(C)C#N Amb24704299 [0,2,0,0,0,0|1,0,1]=4 1648 B15R2.19053 Cc1cc2OCOc2cc1C(C)NC Amb25082709 [0,2,0,0,0,0|1,0,1]=4 1649 B15R2.19053 Cc1cc2OCOc2cc1C(N)C=C Amb25170293 [0,2,0,0,0,0|0,0,0]=2 1650 B15R2.19053 Cc1cc2OCOc2cc1C(N)CN Amb24440210 [0,2,0,0,0,0|1,0,1]=4 1651 B15R2.19053 Cc1cc2OCOc2cc1C(O)C=C Amb24507153 [0,2,0,0,0,0|0,0,0]=2 1652 B15R2.19053 Cc1cc2OCOc2cc1[C@@H](N)CN Amb25814442 [0,2,0,0,0,0|1,0,1]=4 1653 B15R2.19053 Cc1cc2OCOc2cc1[C@@H](N)CO Amb24461252 [0,2,0,0,0,0|1,0,1]=4 1654 B15R2.19053 Cc1cc2OCOc2cc1[C@H](C)NC Amb25742780 [0,2,0,0,0,0|1,0,1]=4 1655 B15R2.19053 N#C[C@@H](O)c1cc2OCOc2cc1Br Amb25256068 [0,2,0,0,0,0|1,0,1]=4 1656 B15R2.19053 NC(C#N)c1cc2OCOc2cc1Br Amb24682283 [0,2,0,0,0,0|1,0,1]=4 1657 B15R2.19053 NC(C#N)c1cc2OCOc2cc1Cl Amb25840464 [0,2,0,0,0,0|1,0,1]=4 1658 B15R2.19053 NC(CO)c1cc2OCOc2cc1Cl Amb25036872 [0,2,0,0,0,0|1,0,1]=4 1659 B15R2.19053 NC(CO)c1cc2OCOc2cc1F Amb24651170 [0,2,0,0,0,0|1,0,1]=4 1660 B15R2.19053 NCC(N)c1cc2OCOc2cc1Br Amb24521944 [0,2,0,0,0,0|1,0,1]=4 1661 B15R2.19053 NCC(O)c1cc2OCOc2cc1Cl Amb24434982 [0,2,0,0,0,0|1,0,1]=4 1662 B15R2.19053 NC[C@@H](N)c1cc2OCOc2cc1Cl Amb24682616 [0,2,0,0,0,0|1,0,1]=4 1663 B15R2.19053 NC[C@@H](O)c1cc2OCOc2cc1Br Amb24701453 [0,2,0,0,0,0|1,0,1]=4 1664 B15R2.19053 NC[C@H](N)c1cc2OCOc2cc1Br Amb24578821 [0,2,0,0,0,0|1,0,1]=4 1665 B15R2.19053 NC[C@H](O)c1cc2OCOc2cc1Br Amb25665738 [0,2,0,0,0,0|1,0,1]=4 1666 B15R2.19053 N[C@@H](C#N)c1cc2OCOc2cc1Br Amb24531976 [0,2,0,0,0,0|1,0,1]=4 1667 B15R2.19053 N[C@@H](C#N)c1cc2OCOc2cc1Cl Amb25842359 [0,2,0,0,0,0|1,0,1]=4 1668 B15R2.19053 N[C@@H](CF)c1cc2OCOc2cc1Br Amb25715942 [0,2,0,0,0,0|1,0,1]=4 1669 B15R2.19053 N[C@H](C#N)c1cc2OCOc2cc1Br Amb25752484 [0,2,0,0,0,0|1,0,1]=4 1670 B15R2.19053 N[C@H](CF)c1cc2OCOc2cc1Br Amb25133667 [0,2,0,0,0,0|1,0,1]=4 1671 B15R2.19053 N[C@H](CO)c1cc2OCOc2cc1Br Amb24443897 [0,2,0,0,0,0|1,0,1]=4 1672 B15R2.19053 OC[C@@H](O)c1cc2OCOc2cc1Br Amb25341258 [0,2,0,0,0,0|1,0,1]=4 1673 B15R2.1507 CNCCc1cc2OCOc2c(Br)c1 Amb24720867 [0,2,0,0,0,0|0,0,2]=4 1674 B15R2.1507 OC\C=C\c1cc2OCOc2c(Cl)c1 Amb24498443 [0,2,0,0,0,0|0,0,2]=4 1675 B15R2.1507 [N-]=[N+]=NCc1cc2OCOc2c(Cl)c1 Amb25315036 [0,2,0,0,0,0|2,0,0]=4 1676 B15R2.4367 C=CCc1cc(OC)c2c(c1)OCO2 Amb1101861 [0,2,0,0,0,0|0,0,0]=2 1677 B15R2.4367 CCCc1cc(OC)c2c(c1)OCO2 Amb10843471 [0,2,0,0,0,0|0,0,2]=4 1678 B15R2.4367 COc1cc(CC=O)cc2OCOc21 Amb24499641 [0,2,0,0,0,0|1,0,0]=3 1679 B15R2.4367 COc1cc(CCN)cc2OCOc21 Amb22284292 [0,2,0,0,0,0|1,0,1]=4 1680 B15R2.4367 COc1cc(CCN)cc2OCOc21 Amb22458369 [0,2,0,0,0,0|1,0,1]=4 1681 B15R2.4367 COc1cc(CNN)cc2OCOc21 Amb24063815 [0,2,0,0,0,0|2,0,0]=4 1682 B15R2.4367 C\C=C\c1cc(OC)c2c(c1)OCO2 Amb1102258 [0,2,0,0,0,0|0,0,2]=4 1683 B15R2.12848 Cc1cc(CC=C)c(O)c2CCCc21 Amb25752579 [0,2,0,0,0,0|2,0,0]=4 1684 B15R2.14950 BrC(Br)=Cc1cc2OCOc2c(Br)c1 Amb25337257 [0,2,0,0,0,0|1,0,1]=4 1685 B15R2.14950 CC(N)Cc1cc2OCOc2c(O)c1 Amb25378695 [0,2,0,0,0,0|0,0,2]=4 1686 B15R2.14950 OC(=O)Cc1cc2OCOc2c(Br)c1 Amb25664642 [0,2,0,0,0,0|1,0,0]=3 1687 B15R2.14950 OC(=O)Cc1cc2OCOc2c(F)c1 Amb24359077 [0,2,0,0,0,0|1,0,0]=3 1688 B15R2.19363 C=CC(N)c1cc2CCCc2c(Br)c1 Amb24526821 [0,2,0,0,0,0|2,0,0]=4 1689 B15R2.19363 C=CC(N)c1cc2CCCc2c(F)c1 Amb25817810 [0,2,0,0,0,0|2,0,0]=4 1690 B15R2.19363 C=CC(N)c1cc2CCOc2c(F)c1 Amb24375305 [0,2,0,0,0,0|1,0,0]=3 1691 B15R2.19363 C=CC(O)c1cc(Cl)c2OCOc2c1 Amb24653861 [0,2,0,0,0,0|0,0,0]=2 1692 B15R2.19363 C=C[C@@H](N)c1cc(N)c2CCCc2c1 Amb25815645 [0,2,0,0,0,0|2,0,0]=4 1693 B15R2.19363 C=C[C@@H](N)c1cc2CCCc2c(Cl)c1 Amb24382022 [0,2,0,0,0,0|2,0,0]=4 1694 B15R2.19363 C=C[C@@H](N)c1cc2CCCc2c(O)c1 Amb24379063 [0,2,0,0,0,0|2,0,0]=4 1695 B15R2.19363 C=C[C@H](N)c1cc2CCOc2c(F)c1 Amb25837323 [0,2,0,0,0,0|1,0,0]=3 1696 B15R2.19363 CCC(O)c1cc2OCOc2c(Br)c1 Amb25753531 [0,2,0,0,0,0|0,0,2]=4 1697 B15R2.19363 CCC(O)c1cc2OCOc2c(Cl)c1 Amb25079519 [0,2,0,0,0,0|0,0,2]=4 1698 B15R2.19363 Cc1cc(cc2CCCc21)C(N)C=C Amb25095143 [0,2,0,0,0,0|2,0,0]=4 1699 B15R2.19363 Cc1cc(cc2CCCc21)[C@H](N)C=C Amb25684209 [0,2,0,0,0,0|2,0,0]=4 1700 B15R2.19363 Cc1cc(cc2CCOc21)[C@H](N)C=C Amb25672411 [0,2,0,0,0,0|1,0,0]=3 1701 B15R2.19363 NC(CO)c1cc2OCOc2c(Br)c1 Amb25302512 [0,2,0,0,0,0|1,0,1]=4 1702 B15R2.19363 NC(CO)c1cc2OCOc2c(Cl)c1 Amb18951208 [0,2,0,0,0,0|1,0,1]=4 1703 B15R2.19363 NCC(c1cc(Cl)c2c(c1)OCO2)O Amb1108314 [0,2,0,0,0,0|1,0,1]=4 1704 B15R2.19363 OCC(O)c1cc(Br)c2OCOc2c1 Amb25829260 [0,2,0,0,0,0|1,0,1]=4 1705 B15R2.19363 OCC(O)c1cc(Cl)c2OCOc2c1 Amb24427959 [0,2,0,0,0,0|1,0,1]=4 1706 B15R2.656 COc1c2OCOc2ccc1CC#N Amb25781741 [0,2,0,0,0,0|1,0,1]=4 1707 B15R2.656 CSc1c2OCOc2ccc1CCN Amb24402182 [0,2,0,0,0,0|1,0,1]=4 1708 B15R2.1586 C=CC(N)c1ccc2CCCc2c1N Amb24375345 [0,2,0,0,0,0|2,0,0]=4 1709 B15R2.1586 C=CC(N)c1ccc2OCOc2c1O Amb25815431 [0,2,0,0,0,0|0,0,0]=2 1710 B15R2.1586 C=C[C@@H](N)c1ccc2CCCc2c1N Amb25087232 [0,2,0,0,0,0|2,0,0]=4 1711 B15R2.1586 C=C[C@H](N)c1ccc2CCCc2c1N Amb24374990 [0,2,0,0,0,0|2,0,0]=4 1712 B15R2.1586 CC[C@@H](N)c1ccc2OCOc2c1O Amb25070688 [0,2,0,0,0,0|0,0,2]=4 1713 B15R2.1586 CC[C@H](N)c1ccc2OCOc2c1O Amb24686848 [0,2,0,0,0,0|0,0,2]=4 1714 B15R2.1586 NC(CF)c1ccc2OCOc2c1O Amb24471562 [0,2,0,0,0,0|1,0,1]=4 1715 B15R2.1586 NC(CO)c1ccc2OCOc2c1O Amb25070562 [0,2,0,0,0,0|1,0,1]=4 1716 B15R2.1586 NCC(N)c1ccc2OCOc2c1O Amb25070563 [0,2,0,0,0,0|1,0,1]=4 1717 B15R2.1586 NC[C@@H](N)c1ccc2OCOc2c1O Amb24367756 [0,2,0,0,0,0|1,0,1]=4 1718 B15R2.1586 N[C@@H](CF)c1ccc2OCOc2c1O Amb24337066 [0,2,0,0,0,0|1,0,1]=4 1719 B15R2.1586 N[C@H](C#N)c1ccc2OCOc2c1O Amb24405128 [0,2,0,0,0,0|1,0,1]=4 1720 B15R2.1586 N[C@H](CF)c1ccc2OCOc2c1O Amb25721034 [0,2,0,0,0,0|1,0,1]=4 1721 B15R2.1636 C=CCOc1ccc2OCOc2c1O Amb25319974 [0,2,0,0,0,0|0,0,0]=2 1722 B15R2.1636 COCOc1ccc2OCOc2c1O Amb24646442 [0,2,0,0,0,0|1,0,1]=4 1723 B15R2.1636 Cc1c(ccc2OCCc21)OCC=C Amb25699274 [0,2,0,0,0,0|1,0,0]=3 1724 B15R2.43323 Cc1c2CCOc2ccc1CC(O)=O Amb18817541 [0,2,0,0,0,0|2,0,0]=4 1725 B15R2.43323 OC(=O)Cc1ccc2OCOc2c1Cl Amb25857398 [0,2,0,0,0,0|1,0,0]=3 1726 B15R2.902 CC(F)(CN)c1cc2OCOc2cc1 Amb24518848 [0,2,0,0,0,0|1,0,1]=4 1727 B15R2.902 CC(N)(CO)c1cc2OCOc2cc1 Amb18281688 [0,2,0,0,0,0|1,0,1]=4 1728 B15R2.902 CC(O)(CCl)c1cc2OCOc2cc1 Amb24428665 [0,2,0,0,0,0|1,0,1]=4 1729 B15R2.902 CCC(C)(N)c1cc2OCOc2cc1 Amb18863819 [0,2,0,0,0,0|0,0,2]=4 1730 B15R2.902 CCC(C)(O)c1cc2OCOc2cc1 Amb25739096 [0,2,0,0,0,0|0,0,2]=4 1731 B15R2.902 CC[C@@](C)(N)c1cc2OCOc2cc1 Amb24437460 [0,2,0,0,0,0|0,0,2]=4 1732 B15R2.902 CC[C@](C)(N)c1cc2OCOc2cc1 Amb25140299 [0,2,0,0,0,0|0,0,2]=4 1733 B15R2.902 CNC(c1ccc2c(c1)OCO2)(C)C Amb13951648 [0,2,0,0,0,0|1,0,1]=4 1734 B15R2.902 C[C@@](N)(C#N)c1cc2OCOc2cc1 Amb25353899 [0,2,0,0,0,0|1,0,1]=4 1735 B15R2.902 C[C@@](N)(CO)c1cc2OCOc2cc1 Amb25698305 [0,2,0,0,0,0|1,0,1]=4 1736 B15R2.902 C[C@](N)(C#N)c1cc2OCOc2cc1 Amb25714706 [0,2,0,0,0,0|1,0,1]=4 1737 B15R2.902 C[C@](N)(CO)c1cc2OCOc2cc1 Amb25790011 [0,2,0,0,0,0|1,0,1]=4 1738 B15R2.902 N#CC(c1ccc2c(c1)OCO2)(C)C Amb17570437 [0,2,0,0,0,0|1,0,1]=4 1739 B15R2.902 NCC(F)(F)c1cc2OCOc2cc1 Amb25344321 [0,2,0,0,0,0|1,0,1]=4 1740 B15R2.902 NCC(c1ccc2c(c1)OCO2)(C)C Amb13951646 [0,2,0,0,0,0|1,0,1]=4 1741 B15R2.902 NCC(c1ccc2c(c1)OCO2)(O)C Amb17194082 [0,2,0,0,0,0|1,0,1]=4 1742 B15R2.902 O=CC(c1ccc2c(c1)OCO2)(C)C Amb17401620 [0,2,0,0,0,0|1,0,0]=3 1743 B15R2.902 OCC(c1ccc2c(c1)OCO2)(C)C Amb17570721 [0,2,0,0,0,0|1,0,1]=4 1744 B15R2.1198 C=CC(NN)c1cc2CCOc2cc1 Amb25710930 [0,2,0,0,0,0|1,0,0]=3 1745 B15R2.1198 CCC(NN)c1cc2OCOc2cc1 Amb24552250 [0,2,0,0,0,0|0,0,2]=4 1746 B15R2.1198 CCC(c1ccc2c(c1)OCO2)C#N Amb17234641 [0,2,0,0,0,0|0,0,2]=4 1747 B15R2.1198 CCC(c1ccc2c(c1)OCO2)C=O Amb17235341 [0,2,0,0,0,0|1,0,0]=3 1748 B15R2.1198 CCC(c1ccc2c(c1)OCO2)CBr Amb17265532 [0,2,0,0,0,0|0,0,2]=4 1749 B15R2.1198 CCC(c1ccc2c(c1)OCO2)CCl Amb17241260 [0,2,0,0,0,0|0,0,2]=4 1750 B15R2.1198 CCC(c1ccc2c(c1)OCO2)CN Amb17235631 [0,2,0,0,0,0|0,0,2]=4 1751 B15R2.1198 CCC(c1ccc2c(c1)OCO2)CO Amb17235904 [0,2,0,0,0,0|0,0,2]=4 1752 B15R2.1198 CNC(CN)c1cc2OCOc2cc1 Amb18294974 [0,2,0,0,0,0|1,0,1]=4 1753 B15R2.1198 CNC(c1ccc2c(c1)OCO2)C#N Amb17044435 [0,2,0,0,0,0|1,0,1]=4 1754 B15R2.1198 CNC(c1ccc2c(c1)OCO2)CO Amb17236161 [0,2,0,0,0,0|1,0,1]=4 1755 B15R2.1198 COC(C=O)c1ccc2OCCc2c1 Amb24425682 [0,2,0,0,0,0|2,0,0]=4 1756 B15R2.1198 COC(c1ccc2c(c1)OCO2)CN Amb17336934 [0,2,0,0,0,0|1,0,1]=4 1757 B15R2.1198 COC(c1ccc2c(c1)OCO2)CN Amb17616825 [0,2,0,0,0,0|1,0,1]=4 1758 B15R2.1198 CO[C@H](C=O)c1cc2OCOc2cc1 Amb24722824 [0,2,0,0,0,0|1,0,0]=3 1759 B15R2.1198 C\C=C(/CC)\c1cc2OCOc2cc1 Amb22171826 [0,2,0,0,0,0|0,0,2]=4 1760 B15R2.1198 C\C=C(\C=O)/c1cc2OCOc2cc1 Amb25821432 [0,2,0,0,0,0|0,0,2]=4 1761 B15R2.1198 N#CC(C#N)c1cc2OCOc2cc1 Amb25843947 [0,2,0,0,0,0|1,0,1]=4 1762 B15R2.1198 NCC(CN)c1cc2OCOc2cc1 Amb18565516 [0,2,0,0,0,0|1,0,1]=4 1763 B15R2.1198 NCC(CO)c1cc2OCOc2cc1 Amb18066354 [0,2,0,0,0,0|1,0,1]=4 1764 B15R2.1198 NNC(c1ccc2c(c1)OCO2)C#N Amb17401480 [0,2,0,0,0,0|1,0,1]=4 1765 B15R2.1198 OCC(CO)c1cc2OCOc2cc1 Amb22172792 [0,2,0,0,0,0|1,0,1]=4 1766 B15R2.1198 OC[C@H](NO)c1cc2OCOc2cc1 Amb25038272 [0,2,0,0,0,0|1,0,1]=4 1767 B15R2.1198 O\C=C(/C=O)\c1cc2OCOc2cc1 Amb24382712 [0,2,0,0,0,0|1,0,1]=4 1768 B15R2.1198 O\C=C(\C=O)/c1cc2OCOc2cc1 Amb24561082 [0,2,0,0,0,0|1,0,1]=4 1769 B15R2.1350 BrCCC(=O)c1ccc2c(c1)OCO2 Amb17437893 [0,2,0,0,0,0|1,0,1]=4 1770 B15R2.1350 BrCCC(c1ccc2c(c1)OCO2)C Amb17265533 [0,2,0,0,0,0|0,0,2]=4 1771 B15R2.1350 C#CC[C@@H](O)c1cc2OCOc2cc1 Amb24736553 [0,2,0,0,0,0|0,0,2]=4 1772 B15R2.1350 C=CCC(=O)c1cc2CCNc2cc1 Amb25748224 [0,2,0,0,0,0|2,0,0]=4 1773 B15R2.1350 C=CCC(=O)c1cc2CCOc2cc1 Amb25183890 [0,2,0,0,0,0|1,0,0]=3 1774 B15R2.1350 C=CCC(=O)c1ccc2c(c1)OCO2 Amb17336193 [0,2,0,0,0,0|0,0,0]=2 1775 B15R2.1350 C=CCC(N)c1cc2CCCc2cc1 Amb25340384 [0,2,0,0,0,0|2,0,0]=4 1776 B15R2.1350 C=CCC(N)c1cc2CCOc2cc1 Amb25076741 [0,2,0,0,0,0|1,0,0]=3 1777 B15R2.1350 C=CCC(O)c1cc2CCCc2cc1 Amb24548126 [0,2,0,0,0,0|2,0,0]=4 1778 B15R2.1350 C=CCC(O)c1cc2CCOc2cc1 Amb24732342 [0,2,0,0,0,0|1,0,0]=3 1779 B15R2.1350 C=CCC(O)c1cc2OCOc2cc1 Amb24658146 [0,2,0,0,0,0|0,0,0]=2 1780 B15R2.1350 C=CCC(O)c1ccc2CCOc2c1 Amb24693031 [0,2,0,0,0,0|1,0,0]=3 1781 B15R2.1350 C=CC[C@@H](N)c1cc2CCOc2cc1 Amb25068495 [0,2,0,0,0,0|1,0,0]=3 1782 B15R2.1350 C=CC[C@@H](N)c1cc2OCOc2cc1 Amb25814532 [0,2,0,0,0,0|0,0,0]=2 1783 B15R2.1350 C=CC[C@@H](N)c1ccc2CCOc2c1 Amb25142189 [0,2,0,0,0,0|1,0,0]=3 1784 B15R2.1350 C=CC[C@H](N)c1cc2CCNc2cc1 Amb24763311 [0,2,0,0,0,0|2,0,0]=4 1785 B15R2.1350 C=CC[C@H](N)c1cc2OCOc2cc1 Amb25757503 [0,2,0,0,0,0|0,0,0]=2 1786 B15R2.1350 C=CC[C@H](O)c1cc2OCOc2cc1 Amb24683951 [0,2,0,0,0,0|0,0,0]=2 1787 B15R2.1350 CC(N=C=O)c1cc2OCOc2cc1 Amb25028816 [0,2,0,0,0,0|1,0,1]=4 1788 B15R2.1350 CC=CC(=O)c1cc2OCOc2cc1 Amb22452145 [0,2,0,0,0,0|0,0,1]=3 1789 B15R2.1350 CCCC(c1ccc2c(c1)OCO2)N Amb17194694 [0,2,0,0,0,0|0,0,2]=4 1790 B15R2.1350 CCCC(c1ccc2c(c1)OCO2)O Amb17194719 [0,2,0,0,0,0|0,0,2]=4 1791 B15R2.1350 CCC[C@@H](N)c1cc2OCOc2cc1 Amb19929659 [0,2,0,0,0,0|0,0,2]=4 1792 B15R2.1350 CCC[C@@H](O)c1cc2OCOc2cc1 Amb24475069 [0,2,0,0,0,0|0,0,2]=4 1793 B15R2.1350 CCC[C@@H]([NH3+])c1cc2OCOc2cc1 Amb22232343 [0,2,0,0,0,0|0,0,2]=4 1794 B15R2.1350 CCC[C@H](N)c1cc2OCOc2cc1 Amb25843779 [0,2,0,0,0,0|0,0,2]=4 1795 B15R2.1350 CCC[C@H](O)c1cc2OCOc2cc1 Amb25190912 [0,2,0,0,0,0|0,0,2]=4 1796 B15R2.1350 CNCC(=O)c1ccc2c(c1)OCO2 Amb17235567 [0,2,0,0,0,0|1,0,1]=4 1797 B15R2.1350 CNCC(Cl)c1cc2OCOc2cc1 Amb25733132 [0,2,0,0,0,0|0,0,2]=4 1798 B15R2.1350 CNCC(c1ccc2c(c1)OCO2)C Amb17235630 [0,2,0,0,0,0|0,0,2]=4 1799 B15R2.1350 COCC(O)c1cc2OCOc2cc1 Amb19081472 [0,2,0,0,0,0|0,0,2]=4 1800 B15R2.1350 COCC(c1ccc2c(c1)OCO2)N Amb1127834 [0,2,0,0,0,0|0,0,2]=4 1801 B15R2.1350 COC[C@@H](N)c1cc2OCOc2cc1 Amb25324373 [0,2,0,0,0,0|0,0,2]=4 1802 B15R2.1350 CONC(C)c1cc2OCOc2cc1 Amb24406541 [0,2,0,0,0,0|1,0,1]=4 1803 B15R2.1350 CSCC(=O)c1cc2OCOc2cc1 Amb25130507 [0,2,0,0,0,0|1,0,1]=4 1804 B15R2.1350 CSCC(N)c1cc2OCOc2cc1 Amb24510657 [0,2,0,0,0,0|0,0,2]=4 1805 B15R2.1350 C[C@H](N=[N+]=[N-])c1cc2OCOc2cc1 Amb25035821 [0,2,0,0,0,0|2,0,0]=4 1806 B15R2.1350 C\C(=C/C=O)\c1cc2OCOc2cc1 Amb24631602 [0,2,0,0,0,0|0,0,1]=3 1807 B15R2.1350 C\C=C\C(=O)c1cc2CCOc2cc1 Amb24550385 [0,2,0,0,0,0|1,0,1]=4 1808 B15R2.1350 C\C=C\C(=O)c1cc2OCOc2cc1 Amb25831903 [0,2,0,0,0,0|0,0,1]=3 1809 B15R2.1350 ClCCC(=O)c1ccc2c(c1)OCO2 Amb17109175 [0,2,0,0,0,0|1,0,1]=4 1810 B15R2.1350 ClCCC(c1ccc2c(c1)OCO2)C Amb17241261 [0,2,0,0,0,0|0,0,2]=4 1811 B15R2.1350 ClCCC(c1ccc2c(c1)OCO2)O Amb17195186 [0,2,0,0,0,0|0,0,2]=4 1812 B15R2.1350 ClCCN(c1ccc2c(c1)OCO2)C Amb17340122 [0,2,0,0,0,0|1,0,1]=4 1813 B15R2.1350 N#CCC(O)c1cc2OCOc2cc1 Amb25675836 [0,2,0,0,0,0|0,0,2]=4 1814 B15R2.1350 N#CCN(c1ccc2c(c1)OCO2)C Amb17336207 [0,2,0,0,0,0|1,0,1]=4 1815 B15R2.1350 N#CC[C@@H](O)c1cc2OCOc2cc1 Amb25761724 [0,2,0,0,0,0|0,0,2]=4 1816 B15R2.1350 NC(CC#N)c1cc2OCOc2cc1 Amb18564687 [0,2,0,0,0,0|0,0,2]=4 1817 B15R2.1350 NCCC(=O)c1ccc2c(c1)OCO2 Amb17194689 [0,2,0,0,0,0|1,0,1]=4 1818 B15R2.1350 NCCC(c1ccc2c(c1)OCO2)C Amb17235632 [0,2,0,0,0,0|0,0,2]=4 1819 B15R2.1350 NCCC(c1ccc2c(c1)OCO2)O Amb17194741 [0,2,0,0,0,0|0,0,2]=4 1820 B15R2.1350 NCCN(c1ccc2c(c1)OCO2)C Amb17059777 [0,2,0,0,0,0|1,0,1]=4 1821 B15R2.1350 NCC[C@H](N)c1cc2OCOc2cc1 Amb24610204 [0,2,0,0,0,0|0,0,2]=4 1822 B15R2.1350 NNCC(c1ccc2c(c1)OCO2)O Amb17236360 [0,2,0,0,0,0|1,0,1]=4 1823 B15R2.1350 NOCC(c1ccc2c(c1)OCO2)O Amb17337150 [0,2,0,0,0,0|1,0,1]=4 1824 B15R2.1350 N[C@@H](CCO)c1cc2OCOc2cc1 Amb25076676 [0,2,0,0,0,0|0,0,2]=4 1825 B15R2.1350 N[C@H](CC#N)c1cc2OCOc2cc1 Amb25363632 [0,2,0,0,0,0|0,0,2]=4 1826 B15R2.1350 N\C(=C\C#N)\c1cc2OCOc2cc1 Amb25127420 [0,2,0,0,0,0|0,0,2]=4 1827 B15R2.1350 O=CC=C(c1ccc2c(c1)OCO2)Cl Amb17240717 [0,2,0,0,0,0|0,0,1]=3 1828 B15R2.1350 O=C\C=C(\Cl)/c1cc2OCOc2cc1 Amb24561243 [0,2,0,0,0,0|0,0,1]=3 1829 B15R2.1350 OC(CC=O)c1cc2CCOc2cc1 Amb25033587 [0,2,0,0,0,0|1,0,1]=4 1830 B15R2.1350 OC(CC=O)c1cc2OCOc2cc1 Amb25266872 [0,2,0,0,0,0|0,0,1]=3 1831 B15R2.1350 OCCC(=O)c1cc2OCOc2cc1 Amb18565450 [0,2,0,0,0,0|1,0,1]=4 1832 B15R2.1350 OCCC(O)c1cc2OCOc2cc1 Amb18565802 [0,2,0,0,0,0|0,0,2]=4 1833 B15R2.1350 OCCC(c1ccc2c(c1)OCO2)C Amb17235905 [0,2,0,0,0,0|0,0,2]=4 1834 B15R2.1350 OCCC(c1ccc2c(c1)OCO2)N Amb1993955 [0,2,0,0,0,0|0,0,2]=4 1835 B15R2.1350 OCCN(c1ccc2c(c1)OCO2)C Amb17336945 [0,2,0,0,0,0|1,0,1]=4 1836 B15R2.1350 ONCC(c1ccc2c(c1)OCO2)O Amb17337149 [0,2,0,0,0,0|1,0,1]=4 1837 B15R2.1350 [N-]=[N+]=CC(=O)c1cc2OCOc2cc1 Amb25029071 [0,2,0,0,0,0|1,0,1]=4 1838 B15R2.1350 [O-]\C=C\C(=O)c1cc2OCOc2cc1 Amb19372412 [0,2,0,0,0,0|0,0,1]=3 1839 B15R2.4239 CC(=C)C(=O)c1cc2OCOc2cc1 Amb18066252 [0,2,0,0,0,0|0,0,1]=3 1840 B15R2.4239 CC(=C)C(N)c1cc2CCOc2cc1 Amb25786086 [0,2,0,0,0,0|1,0,0]=3 1841 B15R2.4239 CC(=C)C(O)c1cc2CCCc2cc1 Amb25183814 [0,2,0,0,0,0|2,0,0]=4 1842 B15R2.4239 CC(=C)C(O)c1cc2OCOc2cc1 Amb25798644 [0,2,0,0,0,0|0,0,0]=2 1843 B15R2.4239 CC(=O)C(=O)c1cc2OCOc2cc1 Amb18565047 [0,2,0,0,0,0|0,0,2]=4 1844 B15R2.4239 CC(=O)C(O)c1cc2OCOc2cc1 Amb25097684 [0,2,0,0,0,0|0,0,1]=3 1845 B15R2.4239 CC(C(c1ccc2c(c1)OCO2)N)C Amb17194693 [0,2,0,0,0,0|0,0,2]=4 1846 B15R2.4239 CC(C(c1ccc2c(c1)OCO2)N)O Amb17236162 [0,2,0,0,0,0|0,0,2]=4 1847 B15R2.4239 CC(C(c1ccc2c(c1)OCO2)O)C Amb17194718 [0,2,0,0,0,0|0,0,2]=4 1848 B15R2.4239 CC(C)[C@@H](O)c1ccc2OCOc2c1 Amb25716052 [0,2,0,0,0,0|0,0,2]=4 1849 B15R2.4239 CC(Cl)C(O)c1ccc2OCOc2c1 Amb25759087 [0,2,0,0,0,0|0,0,2]=4 1850 B15R2.4239 CC(N)C(N)c1cc2OCOc2cc1 Amb25109233 [0,2,0,0,0,0|0,0,2]=4 1851 B15R2.4239 CC(N)[C@H](O)c1ccc2OCOc2c1 Amb25118836 [0,2,0,0,0,0|0,0,2]=4 1852 B15R2.4239 CC(O)[C@H](N)c1ccc2OCOc2c1 Amb24526849 [0,2,0,0,0,0|0,0,2]=4 1853 B15R2.4239 C[C@@H](N)[C@@H](O)c1ccc2OCOc2c1 Amb25238356 [0,2,0,0,0,0|0,0,2]=4 1854 B15R2.4239 C[C@H](C(O)=O)c1cc2OCOc2cc1 Amb25299465 [0,2,0,0,0,0|1,0,0]=3 1855 B15R2.4239 C[C@H](O)[C@@H](N)c1ccc2OCOc2c1 Amb24616442 [0,2,0,0,0,0|0,0,2]=4 1856 B15R2.4239 C[C@H](O)[C@H](N)c1ccc2OCOc2c1 Amb24514789 [0,2,0,0,0,0|0,0,2]=4 1857 B15R2.4239 NC(=O)C(N)c1cc2CCOc2cc1 Amb18283255 [0,2,0,0,0,0|2,0,0]=4 1858 B15R2.4239 NC(=O)C(O)c1cc2CCOc2cc1 Amb19079247 [0,2,0,0,0,0|2,0,0]=4 1859 B15R2.4239 NC(=O)C(O)c1cc2OCOc2cc1 Amb19080546 [0,2,0,0,0,0|1,0,0]=3 1860 B15R2.4239 NC(=O)C(c1ccc2c(c1)OCO2)Cl Amb10070085 [0,2,0,0,0,0|1,0,0]=3 1861 B15R2.4239 NC(=O)C(c1ccc2c(c1)OCO2)N Amb17336783 [0,2,0,0,0,0|1,0,0]=3 1862 B15R2.4239 NC(=O)[C@H](N)c1cc2OCOc2cc1 Amb24436432 [0,2,0,0,0,0|1,0,0]=3 1863 B15R2.4239 N[C@@H](C(F)F)c1ccc2OCOc2c1 Amb24659469 [0,2,0,0,0,0|1,0,1]=4 1864 B15R2.4239 N[C@@H](C(O)=O)c1cc2OCOc2cc1 Amb25670919 [0,2,0,0,0,0|1,0,0]=3 1865 B15R2.4239 N[C@@H](C(O)=O)c1ccc2CCOc2c1 Amb24665772 [0,2,0,0,0,0|2,0,0]=4 1866 B15R2.4239 N[C@H](C(O)=O)c1cc2OCOc2cc1 Amb24460237 [0,2,0,0,0,0|1,0,0]=3 1867 B15R2.4239 OC(=O)C(=C)c1ccc2c(c1)OCO2 Amb17322183 [0,2,0,0,0,0|1,0,1]=4 1868 B15R2.4239 OC(=O)C(=O)c1ccc2c(c1)OCO2 Amb17235863 [0,2,0,0,0,0|1,0,1]=4 1869 B15R2.4239 OC(=O)C(F)c1cc2CCOc2cc1 Amb24438734 [0,2,0,0,0,0|2,0,0]=4 1870 B15R2.4239 OC(=O)C(F)c1ccc2CCOc2c1 Amb24443155 [0,2,0,0,0,0|2,0,0]=4 1871 B15R2.4239 OC(=O)C(O)c1cc2CCOc2cc1 Amb18952027 [0,2,0,0,0,0|2,0,0]=4 1872 B15R2.4239 OC(=O)C(c1ccc2c(c1)OCO2)C Amb17194716 [0,2,0,0,0,0|1,0,0]=3 1873 B15R2.4239 OC(=O)C(c1ccc2c(c1)OCO2)Cl Amb17241776 [0,2,0,0,0,0|1,0,0]=3 1874 B15R2.4239 OC(=O)C(c1ccc2c(c1)OCO2)N Amb1842027 [0,2,0,0,0,0|1,0,0]=3 1875 B15R2.4239 OC(=O)[C@@H](O)c1cc2OCOc2cc1 Amb25138724 [0,2,0,0,0,0|1,0,0]=3 1876 B15R2.4239 OC(=O)[C@H](O)c1cc2OCOc2cc1 Amb25109190 [0,2,0,0,0,0|1,0,0]=3 1877 B15R2.4239 OC(C(F)F)c1ccc2OCOc2c1 Amb25287701 [0,2,0,0,0,0|1,0,1]=4 1878 B15R2.19280 C=CC(O)c1cc2NC(=O)Oc2cc1 Amb24507249 [0,2,0,0,0,0|1,0,1]=4 1879 B15R2.19280 C=CC(O)c1cc2OC(=O)Nc2cc1 Amb24555488 [0,2,0,0,0,0|1,0,1]=4 1880 B15R2.19280 Cc1[n]c2cc(ccc2o1)C(O)C=C Amb24379087 [0,2,0,0,0,0|1,0,1]=4 1881 B15R2.19280 Cc1[n]c2ccc(cc2o1)C(N)C=C Amb25694163 [0,2,0,0,0,0|1,0,1]=4 1882 B15R2.19280 Cc1[n]c2ccc(cc2o1)C(O)C=C Amb25372031 [0,2,0,0,0,0|1,0,1]=4 1883 B15R2.2123 BrCC\C=C\c1ccc2c(c1)OCO2 Amb17264239 [0,2,0,0,0,0|0,0,2]=4 1884 B15R2.2123 C#CCOCc1ccc2OCOc2c1 Amb25821299 [0,2,0,0,0,0|0,0,2]=4 1885 B15R2.2123 C=CCCNc1cc2OCOc2cc1 Amb24544532 [0,2,0,0,0,0|0,0,0]=2 1886 B15R2.2123 C=CCNCc1ccc2OCOc2c1 Amb19890366 [0,2,0,0,0,0|0,0,0]=2 1887 B15R2.2123 C=CC\N=C\c1cc2OCOc2cc1 Amb25283242 [0,2,0,0,0,0|0,0,0]=2 1888 B15R2.2123 CC#CCNc1cc2OCOc2cc1 Amb18988239 [0,2,0,0,0,0|0,0,2]=4 1889 B15R2.2123 CCCNCc1ccc2OCOc2c1 Amb19890394 [0,2,0,0,0,0|0,0,2]=4 1890 B15R2.2123 CCC\N=C\c1cc2OCOc2cc1 Amb25122025 [0,2,0,0,0,0|0,0,2]=4 1891 B15R2.2123 CCNCCc1ccc2c(c1)OCO2 Amb17401783 [0,2,0,0,0,0|0,0,2]=4 1892 B15R2.2123 CNCCCc1ccc2c(c1)OCO2 Amb17104518 [0,2,0,0,0,0|0,0,2]=4 1893 B15R2.2123 CNCCNc1cc2OCOc2cc1 Amb20414391 [0,2,0,0,0,0|0,0,2]=4 1894 B15R2.2123 CNC\C=C\c1cc2OCOc2cc1 Amb24696601 [0,2,0,0,0,0|0,0,2]=4 1895 B15R2.2123 COC\C=C\c1cc2OCOc2cc1 Amb25145435 [0,2,0,0,0,0|0,0,2]=4 1896 B15R2.2123 CONCCc1ccc2OCOc2c1 Amb22897016 [0,2,0,0,0,0|0,0,2]=4 1897 B15R2.2123 CSCCNc1cc2OCOc2cc1 Amb24644746 [0,2,0,0,0,0|0,0,2]=4 1898 B15R2.2123 ClCCCNc1cc2OCOc2cc1 Amb20573557 [0,2,0,0,0,0|0,0,2]=4 1899 B15R2.2123 ClCCNCc1ccc2c(c1)OCO2 Amb17340102 [0,2,0,0,0,0|0,0,2]=4 1900 B15R2.2123 ClCC\C=C\c1ccc2c(c1)OCO2 Amb17240741 [0,2,0,0,0,0|0,0,2]=4 1901 B15R2.2123 Cl\C=C\CNc1cc2CCOc2cc1 Amb24582427 [0,2,0,0,0,0|1,0,0]=3 1902 B15R2.2123 Cl\C=C\CNc1cc2OCOc2cc1 Amb24543545 [0,2,0,0,0,0|0,0,0]=2 1903 B15R2.2123 N#CCCCc1ccc2c(c1)OCO2 Amb17234642 [0,2,0,0,0,0|0,0,2]=4 1904 B15R2.2123 N#CCNCc1ccc2c(c1)OCO2 Amb17401394 [0,2,0,0,0,0|0,0,2]=4 1905 B15R2.2123 N#CC\N=C\c1cc2OCOc2cc1 Amb25048443 [0,2,0,0,0,0|1,0,1]=4 1906 B15R2.2123 NCCCNc1cc2OCOc2cc1 Amb18244052 [0,2,0,0,0,0|0,0,2]=4 1907 B15R2.2123 NCCCOc1ccc2c(c1)OCO2 Amb1108082 [0,2,0,0,0,0|0,0,2]=4 1908 B15R2.2123 NCCCSc1ccc2c(c1)OCO2 Amb17083065 [0,2,0,0,0,0|0,0,2]=4 1909 B15R2.2123 NCCNCc1ccc2c(c1)OCO2 Amb17091027 [0,2,0,0,0,0|0,0,2]=4 1910 B15R2.2123 NCC\C=C\c1ccc2c(c1)OCO2 Amb17235070 [0,2,0,0,0,0|0,0,2]=4 1911 B15R2.2123 NNCCOc1ccc2c(c1)OCO2 Amb17402095 [0,2,0,0,0,0|1,0,1]=4 1912 B15R2.2123 NOCCCc1ccc2c(c1)OCO2 Amb17089570 [0,2,0,0,0,0|0,0,2]=4 1913 B15R2.2123 NOCCOc1ccc2c(c1)OCO2 Amb17088328 [0,2,0,0,0,0|1,0,1]=4 1914 B15R2.2123 O=C=NCCc1ccc2c(c1)OCO2 Amb17235027 [0,2,0,0,0,0|0,0,2]=4 1915 B15R2.2123 O=CCCCc1ccc2OCOc2c1 Amb18549416 [0,2,0,0,0,0|0,0,1]=3 1916 B15R2.2123 O=CCCSc1ccc2c(c1)OCO2 Amb17082965 [0,2,0,0,0,0|0,0,1]=3 1917 B15R2.2123 OCC#CCc1cc2OCOc2cc1 Amb24431780 [0,2,0,0,0,0|0,0,2]=4 1918 B15R2.2123 OCCCCc1ccc2c(c1)OCO2 Amb17194717 [0,2,0,0,0,0|0,0,2]=4 1919 B15R2.2123 OCCCNc1ccc2c(c1)OCO2 Amb17306216 [0,2,0,0,0,0|0,0,2]=4 1920 B15R2.2123 OCCNCc1ccc2OCOc2c1 Amb17843868 [0,2,0,0,0,0|0,0,2]=4 1921 B15R2.2123 OCC\C=C\c1cc2OCOc2cc1 Amb25280017 [0,2,0,0,0,0|0,0,2]=4 1922 B15R2.2123 OCC\N=C\c1ccc2c(c1)OCO2 Amb2520106 [0,2,0,0,0,0|1,0,1]=4 1923 B15R2.2123 ONCCOc1ccc2c(c1)OCO2 Amb17088454 [0,2,0,0,0,0|1,0,1]=4 1924 B15R2.2123 S=C=NCCc1ccc2c(c1)OCO2 Amb17239234 [0,2,0,0,0,0|0,0,2]=4 1925 B15R2.2123 SCCCCc1cc2OCOc2cc1 Amb18066602 [0,2,0,0,0,0|0,0,2]=4 1926 B15R2.2123 SCCCOc1ccc2c(c1)OCO2 Amb17241168 [0,2,0,0,0,0|0,0,2]=4 1927 B15R2.4343 BrCC(=O)Nc1ccc2c(c1)OCO2 Amb17329730 [0,2,0,0,0,0|1,0,1]=4 1928 B15R2.4343 BrCC(Oc1ccc2c(c1)OCO2)C Amb17266778 [0,2,0,0,0,0|1,0,1]=4 1929 B15R2.4343 C=CC(=O)Cc1cc2CCCc2cc1 Amb25119489 [0,2,0,0,0,0|2,0,0]=4 1930 B15R2.4343 CC(C#C)Nc1cc2OCOc2cc1 Amb25794819 [0,2,0,0,0,0|0,0,2]=4 1931 B15R2.4343 CC(C=C)Nc1cc2CCOc2cc1 Amb24737133 [0,2,0,0,0,0|1,0,0]=3 1932 B15R2.4343 CC(C=C)Nc1cc2OCOc2cc1 Amb25736750 [0,2,0,0,0,0|0,0,0]=2 1933 B15R2.4343 CC(CN)Nc1cc2OCOc2cc1 Amb18910589 [0,2,0,0,0,0|1,0,1]=4 1934 B15R2.4343 CC(CO)Cc1ccc2OCOc2c1 Amb24457784 [0,2,0,0,0,0|0,0,2]=4 1935 B15R2.4343 CC(CO)Nc1cc2OCOc2cc1 Amb24433680 [0,2,0,0,0,0|1,0,1]=4 1936 B15R2.4343 CC(Cc1cc2CCOc2cc1)C=O Amb25740868 [0,2,0,0,0,0|1,0,1]=4 1937 B15R2.4343 CC(Cc1cc2OCCc2cc1)C=O Amb25774562 [0,2,0,0,0,0|1,0,1]=4 1938 B15R2.4343 CC(Cc1ccc2OCOc2c1)NN Amb22446431 [0,2,0,0,0,0|0,0,2]=4 1939 B15R2.4343 CC(Cc1ccc2OCOc2c1)NN Amb25076707 [0,2,0,0,0,0|0,0,2]=4 1940 B15R2.4343 CC(Cc1ccc2OCOc2c1)NO Amb17939603 [0,2,0,0,0,0|0,0,2]=4 1941 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 Amb1234348 [0,2,0,0,0,0|1,0,1]=4 1942 B15R2.4343 CCC(Br)Cc1ccc2OCOc2c1 Amb18548949 [0,2,0,0,0,0|0,0,2]=4 1943 B15R2.4343 CCC(Cc1ccc2c(c1)OCO2)N Amb17608800 [0,2,0,0,0,0|0,0,2]=4 1944 B15R2.4343 CCC(Cc1ccc2c(c1)OCO2)O Amb17595098 [0,2,0,0,0,0|0,0,2]=4 1945 B15R2.4343 CN(Cc1ccc2OCOc2c1)C=O Amb25193549 [0,2,0,0,0,0|1,0,0]=3 1946 B15R2.4343 CNC(=N)Nc1ccc2OCOc2c1 Amb19061675 [0,2,0,0,0,0|1,0,1]=4 1947 B15R2.4343 CNC(=O)Nc1ccc2OCOc2c1 Amb24720551 [0,2,0,0,0,0|1,0,1]=4 1948 B15R2.4343 CNC(=O)Oc1ccc2OCOc2c1 Amb22446580 [0,2,0,0,0,0|1,0,1]=4 1949 B15R2.4343 CNC(Cc1ccc2c(c1)OCO2)C Amb17617396 [0,2,0,0,0,0|0,0,2]=4 1950 B15R2.4343 CNC(O)Cc1ccc2OCOc2c1 Amb25223086 [0,2,0,0,0,0|0,0,2]=4 1951 B15R2.4343 COC(=N)Cc1ccc2OCOc2c1 Amb18565196 [0,2,0,0,0,0|0,0,1]=3 1952 B15R2.4343 COC(=O)Cc1cc2OCCc2cc1 Amb24576372 [0,2,0,0,0,0|1,0,1]=4 1953 B15R2.4343 COC(=O)Cc1ccc2c(c1)CCO2 Amb17612895 [0,2,0,0,0,0|1,0,1]=4 1954 B15R2.4343 C[C@@H](Cc1ccc2OCOc2c1)C=O Amb24756705 [0,2,0,0,0,0|0,0,1]=3 1955 B15R2.4343 C[C@@H](Cc1ccc2OCOc2c1)NC Amb22349963 [0,2,0,0,0,0|0,0,2]=4 1956 B15R2.4343 C[C@@H](Cc1ccc2OCOc2c1)NC Amb25111987 [0,2,0,0,0,0|0,0,2]=4 1957 B15R2.4343 C[C@H](CO)Cc1ccc2OCOc2c1 Amb25080159 [0,2,0,0,0,0|0,0,2]=4 1958 B15R2.4343 C[C@H](Cc1ccc2OCOc2c1)NC Amb25724993 [0,2,0,0,0,0|0,0,2]=4 1959 B15R2.4343 C\C(\Cc1ccc2OCOc2c1)=N/O Amb25367295 [0,2,0,0,0,0|0,0,1]=3 1960 B15R2.4343 ClCC(=O)Nc1ccc2c(c1)OCO2 Amb1640389 [0,2,0,0,0,0|1,0,1]=4 1961 B15R2.4343 ClCC(Oc1ccc2c(c1)OCO2)C Amb17241790 [0,2,0,0,0,0|1,0,1]=4 1962 B15R2.4343 N#CC(Nc1ccc2c(c1)OCO2)C Amb17401395 [0,2,0,0,0,0|1,0,1]=4 1963 B15R2.4343 NC(Nc1cc2OCOc2cc1)=NO Amb19080553 [0,2,0,0,0,0|2,0,0]=4 1964 B15R2.4343 NCC(=O)Cc1ccc2OCOc2c1 Amb18910396 [0,2,0,0,0,0|0,0,1]=3 1965 B15R2.4343 NCC(=O)Nc1cc2OCOc2cc1 Amb18527883 [0,2,0,0,0,0|1,0,1]=4 1966 B15R2.4343 NCC(=O)Oc1ccc2c(c1)OCO2 Amb17336915 [0,2,0,0,0,0|1,0,1]=4 1967 B15R2.4343 NCC(Cc1ccc2c(c1)OCO2)O Amb17236163 [0,2,0,0,0,0|0,0,2]=4 1968 B15R2.4343 NCC(N)Cc1ccc2OCOc2c1 Amb25361991 [0,2,0,0,0,0|0,0,2]=4 1969 B15R2.4343 NNC(=N)Cc1ccc2c(c1)OCO2 Amb10576601 [0,2,0,0,0,0|1,0,0]=3 1970 B15R2.4343 NNC(=O)Cc1cc2CCOc2cc1 Amb24391014 [0,2,0,0,0,0|2,0,0]=4 1971 B15R2.4343 NNC(=O)Cc1ccc2c(c1)OCO2 Amb1099153 [0,2,0,0,0,0|1,0,0]=3 1972 B15R2.4343 N[C@H](CO)Cc1ccc2OCOc2c1 Amb25672567 [0,2,0,0,0,0|0,0,2]=4 1973 B15R2.4343 O=C(CCl)Cc1cc2CCOc2cc1 Amb25118796 [0,2,0,0,0,0|1,0,1]=4 1974 B15R2.4343 O=C(CI)Nc1cc2OCOc2cc1 Amb25778347 [0,2,0,0,0,0|1,0,1]=4 1975 B15R2.4343 OCC(=O)Cc1cc2CCOc2cc1 Amb25106897 [0,2,0,0,0,0|1,0,1]=4 1976 B15R2.4343 OCC(=O)Cc1ccc2OCOc2c1 Amb18565449 [0,2,0,0,0,0|0,0,1]=3 1977 B15R2.4343 OCC(Cc1ccc2c(c1)OCO2)N Amb17062704 [0,2,0,0,0,0|0,0,2]=4 1978 B15R2.4343 OCC(Cl)Cc1ccc2OCOc2c1 Amb25857440 [0,2,0,0,0,0|0,0,2]=4 1979 B15R2.4343 OCC(Oc1ccc2c(c1)OCO2)C Amb17236358 [0,2,0,0,0,0|1,0,1]=4 1980 B15R2.4343 ONC(=N)Cc1ccc2c(c1)OCO2 Amb10576600 [0,2,0,0,0,0|1,0,0]=3 1981 B15R2.7688 C=C(Cl)CNc1cc2OCOc2cc1 Amb18289307 [0,2,0,0,0,0|0,0,0]=2 1982 B15R2.7688 CC(=C)CCc1ccc2OCOc2c1 Amb24411501 [0,2,0,0,0,0|0,0,0]=2 1983 B15R2.7688 CC(=C)CNc1cc2CCCc2cc1 Amb18329736 [0,2,0,0,0,0|2,0,0]=4 1984 B15R2.7688 CC(=C)CNc1ccc2CCOc2c1 Amb24738605 [0,2,0,0,0,0|1,0,0]=3 1985 B15R2.7688 CC(=C)CNc1ccc2c(c1)OCO2 Amb17306215 [0,2,0,0,0,0|0,0,0]=2 1986 B15R2.7688 CC(=N)NCc1ccc2OCOc2c1 Amb25787412 [0,2,0,0,0,0|0,0,1]=3 1987 B15R2.7688 CC(=O)CCc1cc2CCOc2cc1 Amb18819323 [0,2,0,0,0,0|1,0,1]=4 1988 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 Amb1033014 [0,2,0,0,0,0|0,0,1]=3 1989 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 Amb1092045 [0,2,0,0,0,0|0,0,1]=3 1990 B15R2.7688 CC(=O)\C=C\c1cc2CCOc2cc1 Amb25120257 [0,2,0,0,0,0|1,0,1]=4 1991 B15R2.7688 CC(=O)\C=C\c1ccc2c(c1)OCO2 Amb1776321 [0,2,0,0,0,0|0,0,1]=3 1992 B15R2.7688 CC(Br)\C=C\c1cc2OCOc2cc1 Amb24340548 [0,2,0,0,0,0|0,0,2]=4 1993 B15R2.7688 CC(CCc1ccc2c(c1)OCO2)N Amb1130185 [0,2,0,0,0,0|0,0,2]=4 1994 B15R2.7688 CC(CNc1ccc2c(c1)OCO2)O Amb17139538 [0,2,0,0,0,0|0,0,2]=4 1995 B15R2.7688 CC(N)CNc1cc2OCOc2cc1 Amb24507362 [0,2,0,0,0,0|0,0,2]=4 1996 B15R2.7688 CC(N)CSc1cc2OCOc2cc1 Amb18569324 [0,2,0,0,0,0|0,0,2]=4 1997 B15R2.7688 CC(N)\C=C\c1cc2OCOc2cc1 Amb25094727 [0,2,0,0,0,0|0,0,2]=4 1998 B15R2.7688 CC(NCc1ccc2c(c1)OCO2)C Amb11012703 [0,2,0,0,0,0|0,0,2]=4 1999 B15R2.7688 CC(O)COc1cc2OCOc2cc1 Amb19081473 [0,2,0,0,0,0|0,0,2]=4 2000 B15R2.7688 CC(O)\C=C\c1cc2OCOc2cc1 Amb25185927 [0,2,0,0,0,0|0,0,2]=4 2001 B15R2.7688 CN(C)CCc1ccc2OCOc2c1 Amb24553671 [0,2,0,0,0,0|0,0,2]=4 2002 B15R2.7688 CN(C)NCc1ccc2OCOc2c1 Amb25736119 [0,2,0,0,0,0|1,0,1]=4 2003 B15R2.7688 CN(N)CCc1ccc2OCOc2c1 Amb18565518 [0,2,0,0,0,0|0,0,2]=4 2004 B15R2.7688 CN(\C=N\c1ccc2c(c1)OCO2)C Amb1395052 [0,2,0,0,0,0|1,0,1]=4 2005 B15R2.7688 C[C@@H](COc1ccc2c(c1)OCO2)N Amb17236164 [0,2,0,0,0,0|0,0,2]=4 2006 B15R2.7688 C[C@@H](N)COc1cc2OCOc2cc1 Amb18538556 [0,2,0,0,0,0|0,0,2]=4 2007 B15R2.7688 C[C@@H](O)CNc1cc2OCOc2cc1 Amb24736860 [0,2,0,0,0,0|0,0,2]=4 2008 B15R2.7688 C[C@@H](O)\C=C\c1cc2OCOc2cc1 Amb25065490 [0,2,0,0,0,0|0,0,2]=4 2009 B15R2.7688 C[C@H](O)COc1cc2OCOc2cc1 Amb24342892 [0,2,0,0,0,0|0,0,2]=4 2010 B15R2.7688 ClC(=O)COc1ccc2c(c1)OCO2 Amb17143617 [0,2,0,0,0,0|1,0,0]=3 2011 B15R2.7688 ClC(=O)\C=C\c1ccc2c(c1)OCO2 Amb16186544 [0,2,0,0,0,0|0,0,1]=3 2012 B15R2.7688 FC(F)CNc1cc2OCOc2cc1 Amb18320542 [0,2,0,0,0,0|1,0,1]=4 2013 B15R2.7688 NC(=N)CCc1ccc2OCOc2c1 Amb18565079 [0,2,0,0,0,0|0,0,1]=3 2014 B15R2.7688 NC(=N)NCc1cc2OCOc2cc1 Amb21959717 [0,2,0,0,0,0|1,0,0]=3 2015 B15R2.7688 NC(=N)SCc1ccc2OCOc2c1 Amb24442354 [0,2,0,0,0,0|1,0,0]=3 2016 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 Amb1646912 [0,2,0,0,0,0|1,0,0]=3 2017 B15R2.7688 NC(=O)\C=C/c1cc2OCOc2cc1 Amb25181161 [0,2,0,0,0,0|0,0,1]=3 2018 B15R2.7688 NC(=O)\N=C\c1cc2OCOc2cc1 Amb25193524 [0,2,0,0,0,0|1,0,1]=4 2019 B15R2.7688 NC(=S)CCc1cc2CCOc2cc1 Amb25037662 [0,2,0,0,0,0|1,0,1]=4 2020 B15R2.7688 OB(O)\C=C\c1cc2OCOc2cc1 Amb25320430 [0,2,0,0,0,0|1,0,1]=4 2021 B15R2.7688 OC(=O)CCc1cc2OCCc2cc1 Amb18817569 [0,2,0,0,0,0|1,0,1]=4 2022 B15R2.7688 OC(=O)CCc1ccc2c(c1)OCO2 Amb1225386 [0,2,0,0,0,0|0,0,1]=3 2023 B15R2.7688 OC(=O)CNc1cc2CCOc2cc1 Amb24345672 [0,2,0,0,0,0|2,0,0]=4 2024 B15R2.7688 OC(=O)COc1cc2CCOc2cc1 Amb24725246 [0,2,0,0,0,0|2,0,0]=4 2025 B15R2.7688 OC(=O)CSc1ccc2c(c1)OCO2 Amb17082992 [0,2,0,0,0,0|1,0,0]=3 2026 B15R2.7688 OC(=O)\C=C/c1ccc2c(c1)OCO2 Amb10069463 [0,2,0,0,0,0|0,0,1]=3 2027 B15R2.7688 OC(=O)\C=C\c1cc2OCCc2cc1 Amb24381651 [0,2,0,0,0,0|1,0,1]=4 2028 B15R2.7688 OC(=O)\C=C\c1ccc2c(c1)CCO2 Amb1158678 [0,2,0,0,0,0|1,0,1]=4 2029 B15R2.7688 OC(=O)\C=C\c1ccc2c(c1)OCO2 Amb1630294 [0,2,0,0,0,0|0,0,1]=3 2030 B15R2.7688 [O-][N+](=O)CCc1ccc2c(c1)OCO2 Amb17402001 [0,2,0,0,0,0|1,0,1]=4 2031 B15R2.17700 C=CCOc1ccc2SC(=O)Oc2c1 Amb24644139 [0,2,0,0,0,0|0,1,1]=4 2032 B15R2.17700 Cc1[n]c2ccc(cc2o1)OCC=C Amb23447060 [0,2,0,0,0,0|1,0,1]=4 2033 B15R2.17712 C=CCOc1cc2CC[C@@H](O)c2cc1 Amb25245095 [0,2,0,0,0,0|2,0,0]=4 2034 B15R2.17712 C=CCOc1cc2OCC(=O)c2cc1 Amb25753729 [0,2,0,0,0,0|1,0,0]=3 2035 B15R2.17712 O=C1COc2cc(ccc12)OCC=O Amb19078794 [0,2,0,0,0,0|2,0,0]=4 2036 B15R2.926 CC(=O)Nc1cc2OC(C)Oc2cc1 Amb25035994 [0,2,0,0,0,0|1,0,1]=4 2037 B15R2.9245 OC(=O)Cc1cc2OCC(O)c2cc1 Amb18815435 [0,2,0,0,0,0|2,0,0]=4 2038 B15R2.42998 CC(C)(Br)Cc1ccc2OCOc2c1 Amb18549056 [0,2,0,0,0,0|0,0,2]=4 2039 B15R2.42998 CC(Cc1ccc2c(c1)OCO2)(Cl)C Amb17102049 [0,2,0,0,0,0|0,0,2]=4 2040 B15R2.42998 CC(Cc1ccc2c(c1)OCO2)(O)C Amb17102031 [0,2,0,0,0,0|0,0,2]=4 2041 B15R2.42998 O=S(=O)(Cl)Cc1ccc2OCOc2c1 Amb25680095 [0,2,0,0,0,0|2,0,0]=4 2042 B15R2.16674 CC1(C)Oc2cc(CC#N)ccc2O1 Amb24624682 [0,2,0,0,0,0|1,0,1]=4 2043 B15R2.16674 CC1(C)Oc2cc(CC=O)ccc2O1 Amb24613926 [0,2,0,0,0,0|1,0,0]=3 2044 B15R2.16674 CC1(C)Oc2cc(CCN)ccc2O1 Amb24578785 [0,2,0,0,0,0|1,0,1]=4 2045 B15R2.16674 CC1(C)Oc2cc(CCO)ccc2O1 Amb25352549 [0,2,0,0,0,0|1,0,1]=4 2046 B15R2.16674 CC1(C)Oc2cc(ccc2O1)NC=O Amb25829310 [0,2,0,0,0,0|2,0,0]=4 2047 B15R2.16674 FC1(F)Oc2cc(CCBr)ccc2O1 Amb25265408 [0,2,0,0,0,0|1,0,1]=4 2048 B15R2.16674 FC1(F)Oc2cc(CCCl)ccc2O1 Amb25352823 [0,2,0,0,0,0|1,0,1]=4 2049 B15R2.16674 N#CCc1cc2OC(F)(F)Oc2cc1 Amb20248616 [0,2,0,0,0,0|1,0,1]=4 2050 B15R2.16674 NCCc1cc2OC(F)(F)Oc2cc1 Amb25826565 [0,2,0,0,0,0|1,0,1]=4 2051 B15R2.16674 O=CCc1cc2OC(F)(F)Oc2cc1 Amb24630671 [0,2,0,0,0,0|1,0,0]=3 2052 B15R2.16674 O=CNc1cc2OC(F)(F)Oc2cc1 Amb24431311 [0,2,0,0,0,0|2,0,0]=4 2053 B15R2.16674 OCCc1cc2OC(F)(F)Oc2cc1 Amb22546916 [0,2,0,0,0,0|1,0,1]=4 2054 B13R2.292 C=CCc1cccc2occc21 Amb25221947 [0,0,1,1,0,0|1,0,1]=4 2055 B13R2.1590 COc1cc2CC(=O)c2cc1C Amb17778714 [0,0,1,1,0,0|2,0,0]=4 2056 B13R2.2461 COc1cc(ccc1O)C2CC2 Amb25095630 [0,0,1,1,0,0|0,0,2]=4 2057 B13R2.2461 COc1cc(ccc1O)C2CO2 Amb17090256 [0,0,1,1,0,0|1,0,1]=4 2058 B13R2.2749 COc1c2C(=O)Cc2ccc1Br Amb17843969 [0,0,1,1,0,0|2,0,0]=4 2059 B13R2.2396 COc1ccc(cc1O)C2OC2 Amb17090257 [0,0,1,1,0,0|1,0,1]=4 2060 B13R3.1895 C1N=C2C(=CC=C3C=CN32)O1 Amb25250266 [1,0,0,1,0,0|2,0,0]=4 2061 B13R3.1910 C1Cc2cc3OCOc3cc12 Amb17778876 [1,0,0,1,0,0|0,0,1]=3 2062 B13R3.1910 C1Oc2cc3OCOc3cc21 Amb24081693 [1,0,0,1,0,0|1,0,0]=3 2063 B13R3.5732 C1OC=2C=C3CC(=CO3)C2O1 Amb24100924 [1,0,0,1,0,0|1,0,1]=4 2064 B13R3.1922 C1C=Cc2c3OCOc3oc21 Amb24090175 [0,0,0,1,1,0|1,0,0]=3 2065 B13R3.605 C1Oc2c3C=COc([nH]3)c2O1 Amb24611314 [0,0,0,1,1,0|2,0,0]=4 2066 B15R3.1739 C1C=Cc2c3cc[nH]c3ccc2O1 Amb24433975 [0,0,0,1,0,1|2,0,0]=4 2067 B15R3.1739 C1NCc2c3OCCOc3ccc21 Amb18196176 [0,0,0,1,0,1|1,0,1]=4 2068 B15R3.4266 C1CCOc2cc3[nH]ccc3cc21 Amb25779241 [0,0,0,1,0,1|2,0,0]=4 2069 B15R3.4266 C1COc2c(O1)cc3c(c2)cc[nH]3 Amb17138754 [0,0,0,1,0,1|1,0,0]=3 2070 B15R3.4266 C1COc2c(O1)cc3c(c2)nco3 Amb17570211 [0,0,0,1,0,1|2,0,0]=4 2071 B15R3.4266 C1COc2cc3c[n][nH]c3cc2O1 Amb24330438 [0,0,0,1,0,1|2,0,0]=4 2072 B15R3.4266 C1NCc2cc3OCCOc3cc21 Amb25350361 [0,0,0,1,0,1|1,0,1]=4 2073 B15R3.4266 C1OCOc2cc3[s]c[n]c3cc21 Amb24066348 [0,0,0,1,0,1|2,0,0]=4 2074 B15R3.31603 C1COc2c(O1)cc(cc2)C3CO3 Amb1124661 [0,0,0,1,0,1|1,0,1]=4 2075 B15R3.31603 C1NC1c2cc3OCCOc3cc2 Amb18224541 [0,0,0,1,0,1|1,0,1]=4 2076 B15R3.31603 C1O[C@@H]1c2cc3OCCOc3cc2 Amb25212155 [0,0,0,1,0,1|1,0,1]=4 2077 B15R3.10059 Brc1[n][nH]c2cc3OCOc3cc21 Amb24330442 [0,1,0,1,0,0|2,0,0]=4 2078 B15R3.10059 C[n]1ccc2cc3OCOc3cc12 Amb25034504 [0,1,0,1,0,0|1,0,0]=3 2079 B15R3.10059 Cc1c[nH]c2cc3OCOc3cc21 Amb18243607 [0,1,0,1,0,0|1,0,0]=3 2080 B15R3.10059 Cc1coc2cc3OCOc3cc21 Amb24416808 [0,1,0,1,0,0|1,0,0]=3 2081 B15R3.10059 Clc1c[s]c2cc3OCOc3cc21 Amb24099935 [0,1,0,1,0,0|1,0,0]=3 2082 B15R3.10059 Ic1[n][nH]c2cc3OCOc3cc21 Amb24330436 [0,1,0,1,0,0|2,0,0]=4 2083 B15R3.10059 NC1COc2cc3[nH]ccc3cc21 Amb25160586 [0,1,0,1,0,0|2,0,0]=4 2084 B15R3.10059 N[C@@H]1CCc2cc3OCOc3cc21 Amb25789925 [0,1,0,1,0,0|0,0,2]=4 2085 B15R3.10059 N[C@H]1CCc2cc3OCOc3cc21 Amb25265233 [0,1,0,1,0,0|0,0,2]=4 2086 B15R3.10059 N[C@H]1COc2cc3cc[nH]c3cc21 Amb24377673 [0,1,0,1,0,0|2,0,0]=4 2087 B15R3.10059 N[n]1ccc2cc3OCCc3cc12 Amb18825245 [0,1,0,1,0,0|2,0,0]=4 2088 B15R3.10059 N[n]1ccc2cc3OCOc3cc12 Amb18196974 [0,1,0,1,0,0|1,0,0]=3 2089 B15R3.10059 Nc1c[nH]c2cc3OCOc3cc21 Amb23557977 [0,1,0,1,0,0|1,0,0]=3 2090 B15R3.10059 O=C1CCc2cc3CCOc3cc21 Amb22288730 [0,1,0,1,0,0|1,0,1]=4 2091 B15R3.10059 O=C1CSc2cc3OCOc3cc21 Amb18190024 [0,1,0,1,0,0|1,0,0]=3 2092 B15R3.10059 O=C1NCc2cc3OCOc3cc21 Amb24083419 [0,1,0,1,0,0|1,0,0]=3 2093 B15R3.10059 O=C1NNc2cc3OCOc3cc21 Amb25161141 [0,1,0,1,0,0|2,0,0]=4 2094 B15R3.10059 O=C1OCc2cc3OCOc3cc21 Amb24081828 [0,1,0,1,0,0|1,0,0]=3 2095 B15R3.10059 OB1OCc2cc3OCOc3cc21 Amb25726321 [0,1,0,1,0,0|2,0,0]=4 2096 B15R3.10059 OC1CCc2cc3OCOc3cc21 Amb24386916 [0,1,0,1,0,0|0,0,2]=4 2097 B15R3.43766 O=C1COc2ccc3OCOc3c21 Amb24700190 [0,1,0,1,0,0|1,0,0]=3 2098 B15R3.43766 O=C1NCc2ccc3OCOc3c21 Amb22230080 [0,1,0,1,0,0|1,0,0]=3 2099 B15R3.604 Clc1cc2OCOc2cc1C3CO3 Amb25227741 [0,1,0,1,0,0|1,0,1]=4 2100 B15R3.622 Brc1cc2[nH]ccc2c3CCOc31 Amb18157704 [0,1,0,1,0,0|2,0,0]=4 2101 B15R3.622 Nc1cc2OCOc2c3[nH]ccc31 Amb18196972 [0,1,0,1,0,0|1,0,1]=4 2102 B15R3.622 Nc1cc2OCOc2c3ccoc31 Amb18676658 [0,1,0,1,0,0|1,0,0]=3 2103 B15R3.677 Brc1[n]c2cc3OCOc3cc2[s]1 Amb24083537 [0,1,0,1,0,0|2,0,0]=4 2104 B15R3.677 CC1Cc2cc3[nH]ccc3cc2O1 Amb25743766 [0,1,0,1,0,0|2,0,0]=4 2105 B15R3.677 CC=1Cc2cc3CCCc3cc2C1 Amb20241106 [0,1,0,1,0,0|2,0,0]=4 2106 B15R3.677 Cc1[nH]c2c(n1)cc3c(c2)OCO3 Amb17119498 [0,1,0,1,0,0|1,0,1]=4 2107 B15R3.677 Cc1cc2cc3OCOc3cc2[nH]1 Amb18243608 [0,1,0,1,0,0|1,0,0]=3 2108 B15R3.677 Cc1sc2c(n1)cc3c(c2)OCO3 Amb1150915 [0,1,0,1,0,0|1,0,1]=4 2109 B15R3.677 Clc1[nH]c2cc3OCOc3cc2[n]1 Amb25122717 [0,1,0,1,0,0|2,0,0]=4 2110 B15R3.677 NC1Cc2c(C1)cc3c(c2)OCO3 Amb16233887 [0,1,0,1,0,0|0,0,2]=4 2111 B15R3.677 Nc1cc2cc3OCCc3cc2o1 Amb18197478 [0,1,0,1,0,0|2,0,0]=4 2112 B15R3.677 O=C1Cc2cc3OCOc3cc2C1 Amb25320066 [0,1,0,1,0,0|0,0,1]=3 2113 B15R3.677 O=C1Cc2cc3OCOc3cc2N1 Amb18243672 [0,1,0,1,0,0|1,0,0]=3 2114 B15R3.677 O=C1Nc2cc3OCOc3cc2N1 Amb24441556 [0,1,0,1,0,0|2,0,0]=4 2115 B15R3.677 O=C1Nc2cc3OCOc3cc2O1 Amb25269732 [0,1,0,1,0,0|2,0,0]=4 2116 B15R3.677 O=C1Oc2cc3cc[nH]c3cc2O1 Amb24406669 [0,1,0,1,0,0|1,0,1]=4 2117 B15R3.677 OC1Cc2cc3OCOc3cc2C1 Amb25792407 [0,1,0,1,0,0|0,0,2]=4 2118 B15R3.677 S=C1N=C2C=C3OCOC3=CC2=N1 Amb25708941 [0,1,0,1,0,0|2,0,0]=4 2119 B15R3.677 S=C1Nc2cc3OCOc3cc2N1 Amb22557919 [0,1,0,1,0,0|2,0,0]=4 2120 B15R3.677 S=C1Nc2cc3OCOc3cc2O1 Amb24572855 [0,1,0,1,0,0|2,0,0]=4 2121 B15R3.677 S=C1Oc2cc3cc[nH]c3cc2O1 Amb25323884 [0,1,0,1,0,0|1,0,1]=4 2122 B15R3.22423 N#CC1Cc2cc3OCOc3cc12 Amb17844038 [0,1,0,1,0,0|0,0,2]=4 2123 B15R3.3669 Brc1c2NCCc2cc3OCOc31 Amb18728555 [0,1,0,1,0,0|1,0,1]=4 2124 B15R3.3669 Brc1c2OCOc2cc3NCCc31 Amb18728554 [0,1,0,1,0,0|1,0,1]=4 2125 B15R3.3669 Clc1c2NCCc2cc3OCOc31 Amb18188170 [0,1,0,1,0,0|1,0,1]=4 2126 B15R3.3669 Clc1c2OCOc2cc3NCCc31 Amb18188173 [0,1,0,1,0,0|1,0,1]=4 2127 B15R3.3669 Fc1c2NCCc2cc3OCOc31 Amb18193380 [0,1,0,1,0,0|1,0,1]=4 2128 B15R3.3669 Fc1c2OCOc2cc3NCCc31 Amb18824259 [0,1,0,1,0,0|1,0,1]=4 2129 B15R3.3669 Nc1c2OCCc2cc3cc[nH]c31 Amb18197712 [0,1,0,1,0,0|2,0,0]=4 2130 B15R3.3669 Nc1c2[s]ccc2cc3OCOc31 Amb18675523 [0,1,0,1,0,0|1,0,0]=3 2131 B15R3.3669 Oc1c2NCCc2cc3OCOc31 Amb18824770 [0,1,0,1,0,0|1,0,1]=4 2132 B15R3.3669 Oc1c2OCOc2cc3NCCc31 Amb18824769 [0,1,0,1,0,0|1,0,1]=4 2133 B15R3.909 CC1Cc2c3cc[nH]c3ccc2O1 Amb25082225 [0,1,0,1,0,0|2,0,0]=4 2134 B15R3.55 NC1CCc2c3OCOc3ccc21 Amb24715785 [0,1,0,1,0,0|0,0,2]=4 2135 B15R3.55 NC1COc2c3OCOc3ccc21 Amb25160584 [0,1,0,1,0,0|1,0,1]=4 2136 B15R3.55 N[C@@H]1CCc2c3OCOc3ccc21 Amb24618142 [0,1,0,1,0,0|0,0,2]=4 2137 B15R3.55 N[C@@H]1COc2c3cc[nH]c3ccc21 Amb24670239 [0,1,0,1,0,0|2,0,0]=4 2138 B15R3.55 N[C@H]1COc2c3cc[nH]c3ccc21 Amb24393349 [0,1,0,1,0,0|2,0,0]=4 2139 B15R3.55 N[n]1ccc2c1ccc3OCCc32 Amb18825244 [0,1,0,1,0,0|2,0,0]=4 2140 B15R3.55 O=C1COc2c1ccc3occc23 Amb24378601 [0,1,0,1,0,0|2,0,0]=4 2141 B15R3.55 O=C1COc2c3cc[nH]c3ccc21 Amb18198105 [0,1,0,1,0,0|2,0,0]=4 2142 B15R3.1957 C1OCC1c2cc3OCOc3cc2 Amb25711325 [0,1,0,1,0,0|0,0,2]=4 2143 B15R3.1957 C1Oc2cc(ccc2O1)C3CNC3 Amb18065655 [0,1,0,1,0,0|0,0,2]=4 2144 B15R3.1957 C1Oc2cc(ccc2O1)C=3CCC3 Amb22171955 [0,1,0,1,0,0|0,0,1]=3 2145 B15R3.1957 C1Oc2cc(ccc2O1)N3CCC3 Amb22263589 [0,1,0,1,0,0|0,0,2]=4 2146 B15R3.1957 C1Oc2cc(ccc2O1)[C@@H]3CCN3 Amb25324224 [0,1,0,1,0,0|0,0,2]=4 2147 B15R3.3648 CC1OC1c2ccc3OCOc3c2 Amb25224145 [0,1,0,1,0,0|0,0,2]=4 2148 B15R3.3648 N[C@@H]1C[C@H]1c2cc3OCOc3cc2 Amb24617703 [0,1,0,1,0,0|0,0,2]=4 2149 B15R3.6746 CC1(CN1)c2cc3OCOc3cc2 Amb18224543 [0,1,0,1,0,0|1,0,1]=4 2150 B15R3.6746 CC1(CO1)c2ccc3c(c2)OCO3 Amb17194521 [0,1,0,1,0,0|1,0,1]=4 2151 B15R3.6746 NC1(CC1)c2cc3OCOc3cc2 Amb20668365 [0,1,0,1,0,0|0,0,2]=4 2152 B15R3.6746 OC1(CC1)c2cc3OCOc3cc2 Amb18184273 [0,1,0,1,0,0|0,0,2]=4 2153 B15R3.9141 O=C1c2ccc3OCOc3c2C1=O Amb21991038 [0,1,0,1,0,0|1,0,1]=4 2154 B15R3.4379 C1Oc2cc(ccc2O1)NC3CC3 Amb18270540 [0,1,0,1,0,0|0,0,2]=4 2155 B15R4.153868 C1C2=Cc3cc1cc4o[n]c2c34 Amb24061729 [0,0,0,2,0,0|2,0,0]=4 2156 B11R2.15 O=Cc1cc2OCOc2[s]1 Amb18830797 [1,0,0,0,1,0|2,0,0]=4 2157 B11R2.190 C=Cc1cc2C=Cc2cc1 Amb20248943 [1,0,0,0,1,0|1,0,1]=4 2158 B11R2.191 NCc1c[s]c2OCOc21 Amb25848594 [1,0,0,0,1,0|2,0,0]=4 2159 B11R2.191 O=Cc1[s]cc2OCOc12 Amb18830798 [1,0,0,0,1,0|2,0,0]=4 2160 B11R2.191 O=Cc1c[s]c2OCOc21 Amb18830796 [1,0,0,0,1,0|2,0,0]=4 2161 B13R1.3954 COC1=CC=C(CC=C)C=CC1=O Amb25821437 [0,0,1,0,0,1|0,0,1]=3 2162 B13R2.57 BrCc1cc2CCCOc2cc1 Amb24677212 [1,0,0,0,0,1|2,0,0]=4 2163 B13R2.57 BrCc1ccc2OCCOc2[n]1 Amb25148744 [1,0,0,0,0,1|2,0,0]=4 2164 B13R2.57 Br[Mg]c1cc2OCCOc2cc1 Amb22000586 [1,0,0,0,0,1|2,0,0]=4 2165 B13R2.57 C#Cc1cc2OCCOc2cc1 Amb18787945 [1,0,0,0,0,1|0,0,2]=4 2166 B13R2.57 C#[N+]c1cc2OCCOc2cc1 Amb21618775 [1,0,0,0,0,1|1,0,1]=4 2167 B13R2.57 C=Cc1cc2CCCCc2cc1 Amb25711542 [1,0,0,0,0,1|2,0,0]=4 2168 B13R2.57 C=Cc1cc2CCOCc2cc1 Amb24437659 [1,0,0,0,0,1|1,0,0]=3 2169 B13R2.57 C=Cc1cc2CNCCc2cc1 Amb25335275 [1,0,0,0,0,1|2,0,0]=4 2170 B13R2.57 C=Cc1cc2OCCOc2cc1 Amb22230100 [1,0,0,0,0,1|0,0,0]=2 2171 B13R2.57 C=Cc1ccc2CCCOc2c1 Amb25281605 [1,0,0,0,0,1|1,0,0]=3 2172 B13R2.57 C=Nc1cc2OCCOc2cc1 Amb24428708 [1,0,0,0,0,1|1,0,0]=3 2173 B13R2.57 CCc1cc2C=CCOc2cc1 Amb23441446 [1,0,0,0,0,1|1,0,1]=4 2174 B13R2.57 CCc1cc2COCCc2cc1 Amb25303984 [1,0,0,0,0,1|1,0,1]=4 2175 B13R2.57 CCc1cc2OCCOc2cc1 Amb25062395 [1,0,0,0,0,1|0,0,1]=3 2176 B13R2.57 CCc1ccc2c(c1)NCCO2 Amb17063609 [1,0,0,0,0,1|1,0,1]=4 2177 B13R2.57 CNc1cc2OCCOc2cc1 Amb21955195 [1,0,0,0,0,1|1,0,1]=4 2178 B13R2.57 COc1cc2COCOc2cc1 Amb24695519 [1,0,0,0,0,1|1,0,1]=4 2179 B13R2.57 COc1cc2OCCOc2cc1 Amb23483106 [1,0,0,0,0,1|1,0,1]=4 2180 B13R2.57 CSc1cc2OCCOc2cc1 Amb24369928 [1,0,0,0,0,1|1,0,1]=4 2181 B13R2.57 ClCc1cc2CCCOc2cc1 Amb19057042 [1,0,0,0,0,1|2,0,0]=4 2182 B13R2.57 ClCc1cc2OCCOc2c[n]1 Amb24394977 [1,0,0,0,0,1|2,0,0]=4 2183 B13R2.57 N#[N+]c1cc2OCCOc2cc1 Amb24333140 [1,0,0,0,0,1|2,0,0]=4 2184 B13R2.57 NCc1cc2COCOc2cc1 Amb25762217 [1,0,0,0,0,1|1,0,0]=3 2185 B13R2.57 NCc1cc2OCCNc2cc1 Amb18101317 [1,0,0,0,0,1|2,0,0]=4 2186 B13R2.57 NCc1cc2OCCOc2c[n]1 Amb22756906 [1,0,0,0,0,1|2,0,0]=4 2187 B13R2.57 NCc1cc2OCCOc2c[n]1 Amb23455871 [1,0,0,0,0,1|2,0,0]=4 2188 B13R2.57 NCc1ccc2CCCOc2c1 Amb25042818 [1,0,0,0,0,1|2,0,0]=4 2189 B13R2.57 NCc1ccc2COCOc2c1 Amb24397225 [1,0,0,0,0,1|1,0,0]=3 2190 B13R2.57 NCc1ccc2c(c1)CCCO2 Amb13949146 [1,0,0,0,0,1|2,0,0]=4 2191 B13R2.57 NCc1ccc2c(c1)NCCO2 Amb17307411 [1,0,0,0,0,1|2,0,0]=4 2192 B13R2.57 NCc1ccc2c(c1)OCCO2 Amb1105285 [1,0,0,0,0,1|1,0,0]=3 2193 B13R2.57 NNc1ccc2OCCOc2c1 Amb17935627 [1,0,0,0,0,1|2,0,0]=4 2194 B13R2.57 NNc1ccc2c(c1)OCCO2 Amb17622288 [1,0,0,0,0,1|2,0,0]=4 2195 B13R2.57 NNc1ccc2c(c1)OCCO2 Amb2234484 [1,0,0,0,0,1|2,0,0]=4 2196 B13R2.57 O=Cc1cc2CCOCc2cc1 Amb25108583 [1,0,0,0,0,1|2,0,0]=4 2197 B13R2.57 O=Cc1cc2COCOc2cc1 Amb18829066 [1,0,0,0,0,1|1,0,0]=3 2198 B13R2.57 O=Cc1cc2NCCOc2cc1 Amb18829460 [1,0,0,0,0,1|2,0,0]=4 2199 B13R2.57 O=Cc1cc2OCC=Cc2cc1 Amb18645279 [1,0,0,0,0,1|2,0,0]=4 2200 B13R2.57 O=Cc1ccc2CCCOc2c1 Amb24640311 [1,0,0,0,0,1|2,0,0]=4 2201 B13R2.57 O=Cc1ccc2COCOc2c1 Amb18829064 [1,0,0,0,0,1|1,0,0]=3 2202 B13R2.57 O=Cc1ccc2OCC=Cc2c1 Amb18126249 [1,0,0,0,0,1|2,0,0]=4 2203 B13R2.57 O=Cc1ccc2c(c1)OCCO2 Amb1152780 [1,0,0,0,0,1|1,0,0]=3 2204 B13R2.57 O=Cc1ccc2c(n1)OCCO2 Amb16233625 [1,0,0,0,0,1|2,0,0]=4 2205 B13R2.57 O=Cc1cnc2c(c1)OCCO2 Amb16233626 [1,0,0,0,0,1|2,0,0]=4 2206 B13R2.57 O=Cc1ncc2c(c1)OCCO2 Amb16233624 [1,0,0,0,0,1|2,0,0]=4 2207 B13R2.57 OCc1cc2CCCOc2cc1 Amb18862599 [1,0,0,0,0,1|2,0,0]=4 2208 B13R2.57 OCc1cc2CCOCc2cc1 Amb25156622 [1,0,0,0,0,1|2,0,0]=4 2209 B13R2.57 OCc1cc2COCCc2cc1 Amb25229967 [1,0,0,0,0,1|2,0,0]=4 2210 B13R2.57 OCc1cc2COCOc2cc1 Amb25202486 [1,0,0,0,0,1|1,0,0]=3 2211 B13R2.57 OCc1cc2OCCOc2[n]c1 Amb21959404 [1,0,0,0,0,1|2,0,0]=4 2212 B13R2.57 OCc1cc2OCCOc2c[n]1 Amb22000954 [1,0,0,0,0,1|2,0,0]=4 2213 B13R2.57 OCc1ccc2COCOc2c1 Amb24066082 [1,0,0,0,0,1|1,0,0]=3 2214 B13R2.57 OCc1ccc2OCCOc2[n]1 Amb22001715 [1,0,0,0,0,1|2,0,0]=4 2215 B13R2.57 OCc1ccc2c(c1)NCCO2 Amb10975385 [1,0,0,0,0,1|2,0,0]=4 2216 B13R2.57 OCc1ccc2c(c1)OCCN2 Amb17209391 [1,0,0,0,0,1|2,0,0]=4 2217 B13R2.57 SCc1cc2OCCOc2cc1 Amb24584570 [1,0,0,0,0,1|1,0,0]=3 2218 B15R2.10338 BrCCc1cc2OCCCOc2cc1 Amb18548888 [0,0,0,0,0,2|1,0,1]=4 2219 B15R2.10338 NCCc1ccc2c(c1)OCCCO2 Amb2227448 [0,0,0,0,0,2|1,0,1]=4 2220 B15R2.10338 NNCc1ccc2c(c1)OCCCO2 Amb17401888 [0,0,0,0,0,2|2,0,0]=4 2221 B15R2.10338 O=CCc1ccc2OCCCOc2c1 Amb19050454 [0,0,0,0,0,2|1,0,0]=3 2222 B15R2.10338 O=CNc1cc2OCCCOc2cc1 Amb25073791 [0,0,0,0,0,2|2,0,0]=4 2223 B15R2.10338 OCCc1ccc2c(c1)OCCCO2 Amb17235906 [0,0,0,0,0,2|1,0,1]=4 2224 B15R2.10338 ONCc1ccc2OCCCOc2c1 Amb25837044 [0,0,0,0,0,2|2,0,0]=4 2225 B15R2.10338 SCCc1ccc2c(c1)OCCCO2 Amb17471412 [0,0,0,0,0,2|1,0,1]=4