0 B11R1.3 BrCc1ccc(cc1)C(=O)C Amb10603321 [0,0,0,0,0,0|2,0,0]=2 1 B11R1.3 BrCc1ccc(cc1)C(=O)O Amb1210709 [0,0,0,0,0,0|3,0,0]=3 2 B11R1.3 BrCc1ccc(cc1)N(C)C Amb10609828 [0,0,0,0,0,0|4,0,0]=4 3 B11R1.3 BrCc1ccc(cc1)[N+](=O)[O-] Amb1152822 [0,0,0,0,0,0|4,0,0]=4 4 B11R1.3 C#Cc1c[n]c(cc1)C(O)=O Amb19243676 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.3 C#Cc1ccc(c[n]1)C(O)=O Amb19316322 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.3 C#Cc1ccc(cc1)C(=O)C Amb1802568 [0,0,0,0,0,0|1,0,1]=2 7 B11R1.3 C#Cc1ccc(cc1)C(=O)Cl Amb24091579 [0,0,0,0,0,0|2,0,1]=3 8 B11R1.3 C#Cc1ccc(cc1)C(C)C Amb13807778 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.3 C#Cc1ccc(cc1)C(N)=O Amb23411993 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.3 C#Cc1ccc(cc1)[N+](=O)[O-] Amb2227470 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.3 C=C(O)c1ccc(C=O)cc1 Amb24602984 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.3 C=Cc1ccc([n]c1)C(O)=O Amb24657323 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.3 C=Cc1ccc(c[n]1)C(N)=O Amb24487047 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.3 C=Cc1ccc(cc1)C(=O)Cl Amb19930037 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.3 C=Cc1ccc(cc1)C(N)=O Amb24070687 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.3 C=Cc1ccc(cc1)S(O)=O Amb25240119 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.3 C=Cc1ccc(cc1)S([O-])=O Amb22732443 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.3 C=Nc1ccc(cc1)C(O)=O Amb24103009 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.3 CC(=C)c1ccc(C=O)[n]c1 Amb25735693 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.3 CC(=C)c1ccc(C=O)c[n]1 Amb25194834 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.3 CC(=C)c1ccc(CN)c[n]1 Amb24745545 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.3 CC(=C)c1ccc(c[n]1)C#N Amb24451820 [0,0,0,0,0,0|4,0,0]=4 23 B11R1.3 CC(=C)c1ccc(cc1)NC Amb25040380 [0,0,0,0,0,0|2,0,0]=2 24 B11R1.3 CC(=O)N1CC=C(CC1)OC Amb24105761 [0,0,0,0,0,0|1,0,3]=4 25 B11R1.3 CC(=O)c1[n]cc(c[n]1)OC Amb25707017 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.3 CC(=O)c1c[n]c(CC)[n]c1 Amb25067017 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.3 CC(=O)c1c[n]c(CC)c[n]1 Amb24103812 [0,0,0,0,0,0|3,0,0]=3 28 B11R1.3 CC(=O)c1c[n]c(NC)[n]c1 Amb25367205 [0,0,0,0,0,0|3,0,0]=3 29 B11R1.3 CC(=O)c1c[n]c([n][n]1)OC Amb24518795 [0,0,0,0,0,0|3,0,0]=3 30 B11R1.3 CC(=O)c1c[n]c([n][n]1)SC Amb24536172 [0,0,0,0,0,0|3,1,0]=4 31 B11R1.3 CC(=O)c1c[n]c([n]c1)SC Amb25087873 [0,0,0,0,0,0|2,1,0]=3 32 B11R1.3 CC(=O)c1c[n]c(c[n]1)C#N Amb21964514 [0,0,0,0,0,0|4,0,0]=4 33 B11R1.3 CC(=O)c1c[n]c(c[n]1)C=O Amb24070976 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.3 CC(=O)c1c[n]c(c[n]1)OC Amb22728840 [0,0,0,0,0,0|2,0,0]=2 35 B11R1.3 CC(=O)c1c[n]c(cc1)C#C Amb24056390 [0,0,0,0,0,0|2,0,1]=3 36 B11R1.3 CC(=O)c1c[n]c(cc1)NO Amb25053079 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.3 CC(=O)c1cc[n+](CC)cc1 Amb24688559 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.3 CC(=O)c1ccc(C=O)[n]c1 Amb24056391 [0,0,0,0,0,0|3,0,0]=3 39 B11R1.3 CC(=O)c1ccc(CC)[n]c1 Amb24390807 [0,0,0,0,0,0|2,0,0]=2 40 B11R1.3 CC(=O)c1ccc(CC)c[n]1 Amb22396239 [0,0,0,0,0,0|2,0,0]=2 41 B11R1.3 CC(=O)c1ccc(CC)cc1 Amb23552928 [0,0,0,0,0,0|1,0,0]=1 42 B11R1.3 CC(=O)c1ccc(CCl)[n]c1 Amb24509088 [0,0,0,0,0,0|3,0,0]=3 43 B11R1.3 CC(=O)c1ccc(CCl)c[n]1 Amb24738375 [0,0,0,0,0,0|3,0,0]=3 44 B11R1.3 CC(=O)c1ccc(CCl)cc1 Amb20623067 [0,0,0,0,0,0|2,0,0]=2 45 B11R1.3 CC(=O)c1ccc(CF)cc1 Amb25273009 [0,0,0,0,0,0|2,0,0]=2 46 B11R1.3 CC(=O)c1ccc(CN)cc1 Amb22728112 [0,0,0,0,0,0|2,0,0]=2 47 B11R1.3 CC(=O)c1ccc(CO)[n]c1 Amb25684239 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.3 CC(=O)c1ccc(CO)c[n]1 Amb22754983 [0,0,0,0,0,0|3,0,0]=3 49 B11R1.3 CC(=O)c1ccc(CO)cc1 Amb22735803 [0,0,0,0,0,0|2,0,0]=2 50 B11R1.3 CC(=O)c1ccc([n][n]1)OC Amb23585439 [0,0,0,0,0,0|2,0,0]=2 51 B11R1.3 CC(=O)c1ccc([n]c1)SC Amb24486171 [0,0,0,0,0,0|1,1,0]=2 52 B11R1.3 CC(=O)c1ccc(c[n]1)C#C Amb24589233 [0,0,0,0,0,0|2,0,1]=3 53 B11R1.3 CC(=O)c1ccc(c[n]1)C#N Amb24545902 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.3 CC(=O)c1ccc(c[n]1)C=O Amb24071864 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.3 CC(=O)c1ccc(c[n]1)OC Amb21964476 [0,0,0,0,0,0|1,0,0]=1 56 B11R1.3 CC(=O)c1ccc(c[n]1)SC Amb24582162 [0,0,0,0,0,0|1,1,0]=2 57 B11R1.3 CC(=O)c1ccc(cc1)N=O Amb24485819 [0,0,0,0,0,0|2,0,0]=2 58 B11R1.3 CC(C)c1ccc(CI)cc1 Amb25169286 [0,0,0,0,0,0|3,0,1]=4 59 B11R1.3 CC(C)c1ccc(cc1)NO Amb24096637 [0,0,0,0,0,0|3,0,1]=4 60 B11R1.3 CC(C)c1ccc(cc1)[Mg]Br Amb22000544 [0,0,0,0,0,0|3,0,1]=4 61 B11R1.3 CC(C)c1ccc(cc1)[N+]#N Amb17940014 [0,0,0,0,0,0|3,0,1]=4 62 B11R1.3 CC(C)c1ccc(cc1)[Zn]Br Amb22897814 [0,0,0,0,0,0|3,0,1]=4 63 B11R1.3 CC(C)c1ccc(cc1)[Zn]I Amb22000426 [0,0,0,0,0,0|3,0,1]=4 64 B11R1.3 CC(Cl)c1ccc(CO)cc1 Amb25189140 [0,0,0,0,0,0|3,0,1]=4 65 B11R1.3 CC(F)c1ccc(CO)cc1 Amb25212926 [0,0,0,0,0,0|3,0,1]=4 66 B11R1.3 CC(N)c1ccc(C=C)cc1 Amb24583488 [0,0,0,0,0,0|2,0,2]=4 67 B11R1.3 CC(N)c1ccc(CO)cc1 Amb25103385 [0,0,0,0,0,0|3,0,1]=4 68 B11R1.3 CC(O)c1ccc(C=O)cc1 Amb18125139 [0,0,0,0,0,0|2,0,2]=4 69 B11R1.3 CC(O)c1ccc(CBr)cc1 Amb24350671 [0,0,0,0,0,0|2,0,2]=4 70 B11R1.3 CC(O)c1ccc(cc1)NO Amb25697315 [0,0,0,0,0,0|2,0,2]=4 71 B11R1.3 CC(S)c1ccc(cc1)C#N Amb25791706 [0,0,0,0,0,0|2,1,1]=4 72 B11R1.3 CCN1C=CC(C=C1)=[N+](C)C Amb25164387 [0,0,0,0,0,0|4,0,0]=4 73 B11R1.3 CCc1[n]cc(c[n]1)C(=O)Cl Amb25074014 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.3 CCc1c[n]c([n]c1)C(O)=O Amb25350758 [0,0,0,0,0,0|4,0,0]=4 75 B11R1.3 CCc1c[n]c(c[n]1)C(N)=O Amb24071327 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.3 CCc1c[n]c(c[n]1)C(O)=O Amb22489687 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.3 CCc1ccc([n]c1)C(C)C Amb24071316 [0,0,0,0,0,0|3,0,1]=4 78 B11R1.3 CCc1ccc([n]c1)C(C)N Amb22396205 [0,0,0,0,0,0|3,0,1]=4 79 B11R1.3 CCc1ccc([n]c1)C(N)=N Amb22277030 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.3 CCc1ccc([n]c1)C(N)=N Amb25839236 [0,0,0,0,0,0|4,0,0]=4 81 B11R1.3 CCc1ccc([n]c1)C(N)=S Amb24709349 [0,0,0,0,0,0|3,1,0]=4 82 B11R1.3 CCc1ccc(c[n]1)C(=O)Cl Amb24091672 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.3 CCc1ccc(c[n]1)N(=O)=O Amb20621245 [0,0,0,0,0,0|4,0,0]=4 84 B11R1.3 CCc1ccc(cc1)B(O)O Amb1795803 [0,0,0,0,0,0|3,0,1]=4 85 B11R1.3 CCc1ccc(cc1)C(=O)Br Amb18602746 [0,0,0,0,0,0|2,0,0]=2 86 B11R1.3 CCc1ccc(cc1)C(=O)F Amb24487659 [0,0,0,0,0,0|2,0,0]=2 87 B11R1.3 CCc1ccc(cc1)C(=O)O Amb2568275 [0,0,0,0,0,0|2,0,0]=2 88 B11R1.3 CCc1ccc(cc1)C(C)C Amb22227948 [0,0,0,0,0,0|2,0,1]=3 89 B11R1.3 CCc1ccc(cc1)C(C)N Amb22586744 [0,0,0,0,0,0|2,0,1]=3 90 B11R1.3 CCc1ccc(cc1)C(N)=N Amb19115343 [0,0,0,0,0,0|3,0,0]=3 91 B11R1.3 CCc1ccc(cc1)C(N)C Amb2568477 [0,0,0,0,0,0|2,0,1]=3 92 B11R1.3 CCc1ccc(cc1)N(N)C Amb17232085 [0,0,0,0,0,0|3,0,0]=3 93 B11R1.3 CCc1ccc(cc1)S(=O)Cl Amb18066222 [0,0,0,0,0,0|3,0,0]=3 94 B11R1.3 CCc1ccc(cc1)S(O)=O Amb18065477 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.3 CCc1ccc(cc1)[C@@H](C)N Amb22288634 [0,0,0,0,0,0|2,0,1]=3 96 B11R1.3 CCc1ccc(cc1)[C@H](C)N Amb22406368 [0,0,0,0,0,0|2,0,1]=3 97 B11R1.3 CCc1ccc(cn1)[N+](=O)[O-] Amb2441545 [0,0,0,0,0,0|4,0,0]=4 98 B11R1.3 CCc1ncc(cn1)C(=O)O Amb10607906 [0,0,0,0,0,0|4,0,0]=4 99 B11R1.3 CClc1ccc(cc1)B(O)O Amb22047787 [0,0,0,0,0,0|3,0,1]=4 100 B11R1.3 CN(C)c1ccc(C=C)cc1 Amb22002346 [0,0,0,0,0,0|3,0,1]=4 101 B11R1.3 CN(C)c1ccc(CCl)cc1 Amb19372821 [0,0,0,0,0,0|4,0,0]=4 102 B11R1.3 CN(C)c1ccc(CI)cc1 Amb24488055 [0,0,0,0,0,0|4,0,0]=4 103 B11R1.3 CN(C)c1ccc(CN)cc1 Amb22347972 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.3 CN(C)c1ccc(cc1)ON Amb24405841 [0,0,0,0,0,0|3,0,0]=3 105 B11R1.3 CN(C)c1ccc(cc1)[Mg]Br Amb22000524 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.3 CN(C)c1ccc(cc1)[N+]#N Amb22461436 [0,0,0,0,0,0|4,0,0]=4 107 B11R1.3 CN(C)c1ccc(cc1)[Zn]Br Amb22897761 [0,0,0,0,0,0|4,0,0]=4 108 B11R1.3 CN(N)c1ccc(cc1)C#N Amb18124834 [0,0,0,0,0,0|4,0,0]=4 109 B11R1.3 CNc1c[n]c(cc1)C(N)=N Amb25731744 [0,0,0,0,0,0|4,0,0]=4 110 B11R1.3 CNc1c[n]c(cc1)N(C)C Amb18288729 [0,0,0,0,0,0|4,0,0]=4 111 B11R1.3 CNc1c[n]c(cc1)[N+]([O-])=O Amb18962373 [0,0,0,0,0,0|4,0,0]=4 112 B11R1.3 CNc1ccc([n][n]1)C(N)=O Amb18959086 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.3 CNc1ccc(c[n]1)C(C)N Amb23446317 [0,0,0,0,0,0|3,0,1]=4 114 B11R1.3 CNc1ccc(c[n]1)C(C)O Amb23446313 [0,0,0,0,0,0|2,0,2]=4 115 B11R1.3 CNc1ccc(c[n]1)C(N)=N Amb18284786 [0,0,0,0,0,0|4,0,0]=4 116 B11R1.3 CNc1ccc(c[n]1)C(N)=O Amb18959246 [0,0,0,0,0,0|3,0,0]=3 117 B11R1.3 CNc1ccc(c[n]1)N(C)C Amb25244777 [0,0,0,0,0,0|4,0,0]=4 118 B11R1.3 CNc1ccc(c[n]1)[C@H](C)N Amb25152713 [0,0,0,0,0,0|3,0,1]=4 119 B11R1.3 CNc1ccc(cc1)B(O)O Amb22899819 [0,0,0,0,0,0|3,0,1]=4 120 B11R1.3 CNc1ccc(cc1)C(=O)C Amb17305941 [0,0,0,0,0,0|1,0,0]=1 121 B11R1.3 CNc1ccc(cc1)C(=O)Cl Amb24103008 [0,0,0,0,0,0|2,0,0]=2 122 B11R1.3 CNc1ccc(cc1)C(=O)N Amb10609631 [0,0,0,0,0,0|2,0,0]=2 123 B11R1.3 CNc1ccc(cc1)C(C)C Amb20625033 [0,0,0,0,0,0|2,0,1]=3 124 B11R1.3 CNc1ccc(cc1)C(C)N Amb24484652 [0,0,0,0,0,0|2,0,1]=3 125 B11R1.3 CNc1ccc(cc1)C(F)F Amb25247365 [0,0,0,0,0,0|3,0,1]=4 126 B11R1.3 CNc1ccc(cc1)C(N)=N Amb18284906 [0,0,0,0,0,0|3,0,0]=3 127 B11R1.3 CNc1ccc(cc1)C(N)=N Amb20668260 [0,0,0,0,0,0|3,0,0]=3 128 B11R1.3 CNc1ccc(cc1)C(O)=O Amb24070550 [0,0,0,0,0,0|2,0,0]=2 129 B11R1.3 CNc1ccc(cc1)N(=O)=O Amb20621645 [0,0,0,0,0,0|3,0,0]=3 130 B11R1.3 CNc1ccc(cc1)[C@H](C)N Amb24410678 [0,0,0,0,0,0|2,0,1]=3 131 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] Amb1772707 [0,0,0,0,0,0|3,0,0]=3 132 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] Amb1773278 [0,0,0,0,0,0|3,0,0]=3 133 B11R1.3 CNc1ccc(cc1)[N+](=O)[O-] Amb2223057 [0,0,0,0,0,0|3,0,0]=3 134 B11R1.3 COC=1CC=C(CC1)C(C)C Amb22342344 [0,0,0,0,0,0|1,0,3]=4 135 B11R1.3 COc1[n]cc([n][n]1)C(O)=O Amb25218020 [0,0,0,0,0,0|4,0,0]=4 136 B11R1.3 COc1[n]cc(c[n]1)C(C)N Amb18201006 [0,0,0,0,0,0|3,0,1]=4 137 B11R1.3 COc1[n]cc(c[n]1)C(C)O Amb25369467 [0,0,0,0,0,0|2,0,2]=4 138 B11R1.3 COc1[n]cc(c[n]1)C(N)=O Amb24404567 [0,0,0,0,0,0|3,0,0]=3 139 B11R1.3 COc1[n]cc(c[n]1)[C@@H](C)N Amb24681144 [0,0,0,0,0,0|3,0,1]=4 140 B11R1.3 COc1[n]cc(c[n]1)[N+]([O-])=O Amb19957950 [0,0,0,0,0,0|4,0,0]=4 141 B11R1.3 COc1c[n]c([n]c1)C(C)N Amb24627405 [0,0,0,0,0,0|3,0,1]=4 142 B11R1.3 COc1c[n]c([n]c1)C(O)=O Amb18125648 [0,0,0,0,0,0|3,0,0]=3 143 B11R1.3 COc1c[n]c(c[n]1)C(C)C Amb24065713 [0,0,0,0,0,0|3,0,1]=4 144 B11R1.3 COc1c[n]c(c[n]1)C(O)=O Amb19515941 [0,0,0,0,0,0|3,0,0]=3 145 B11R1.3 COc1c[n]c(c[n]1)N(C)C Amb23437302 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.3 COc1c[n]c(c[n]1)[N+]([O-])=O Amb24084564 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.3 COc1c[n]c(cc1)C(C)N Amb25335363 [0,0,0,0,0,0|2,0,1]=3 148 B11R1.3 COc1c[n]c(cc1)C(C)O Amb24501999 [0,0,0,0,0,0|1,0,2]=3 149 B11R1.3 COc1c[n]c(cc1)C(N)=N Amb22235904 [0,0,0,0,0,0|3,0,0]=3 150 B11R1.3 COc1c[n]c(cc1)C(N)=O Amb19959630 [0,0,0,0,0,0|2,0,0]=2 151 B11R1.3 COc1c[n]c(cc1)C(N)=S Amb24649777 [0,0,0,0,0,0|2,1,0]=3 152 B11R1.3 COc1c[n]c(cc1)C(O)=O Amb19944230 [0,0,0,0,0,0|2,0,0]=2 153 B11R1.3 COc1c[n]c(cc1)N(C)C Amb25696279 [0,0,0,0,0,0|3,0,0]=3 154 B11R1.3 COc1c[n]c(cc1)[C@H](C)N Amb24706315 [0,0,0,0,0,0|2,0,1]=3 155 B11R1.3 COc1c[n]c(cc1)[N+]([O-])=O Amb22167787 [0,0,0,0,0,0|3,0,0]=3 156 B11R1.3 COc1ccc([n][n]1)C(=C)Cl Amb24511633 [0,0,0,0,0,0|3,0,1]=4 157 B11R1.3 COc1ccc([n][n]1)C(N)=N Amb24367588 [0,0,0,0,0,0|4,0,0]=4 158 B11R1.3 COc1ccc([n][n]1)C(N)=O Amb25107766 [0,0,0,0,0,0|3,0,0]=3 159 B11R1.3 COc1ccc([n][n]1)C(N)=S Amb25742262 [0,0,0,0,0,0|3,1,0]=4 160 B11R1.3 COc1ccc([n][n]1)N(C)N Amb18125726 [0,0,0,0,0,0|4,0,0]=4 161 B11R1.3 COc1ccc([n][n]1)[C@@H](C)N Amb25133342 [0,0,0,0,0,0|3,0,1]=4 162 B11R1.3 COc1ccc(c[n]1)C(=O)Cl Amb24081731 [0,0,0,0,0,0|2,0,0]=2 163 B11R1.3 COc1ccc(c[n]1)C(=O)Cl Amb24091803 [0,0,0,0,0,0|2,0,0]=2 164 B11R1.3 COc1ccc(c[n]1)C(C)Br Amb25152257 [0,0,0,0,0,0|2,0,1]=3 165 B11R1.3 COc1ccc(c[n]1)C(C)N Amb23446268 [0,0,0,0,0,0|2,0,1]=3 166 B11R1.3 COc1ccc(c[n]1)C(C)O Amb23446265 [0,0,0,0,0,0|1,0,2]=3 167 B11R1.3 COc1ccc(c[n]1)N(C)C Amb25100863 [0,0,0,0,0,0|3,0,0]=3 168 B11R1.3 COc1ccc(c[n]1)[C@@H](C)N Amb25145708 [0,0,0,0,0,0|2,0,1]=3 169 B11R1.3 COc1ccc(c[n]1)[C@@H](C)O Amb25378780 [0,0,0,0,0,0|1,0,2]=3 170 B11R1.3 COc1ccc(c[n]1)[C@H](C)N Amb25145709 [0,0,0,0,0,0|2,0,1]=3 171 B11R1.3 COc1ccc(c[n]1)[C@H](C)O Amb24718478 [0,0,0,0,0,0|1,0,2]=3 172 B11R1.3 COc1ccc(cc1)B(O)O Amb2235052 [0,0,0,0,0,0|2,0,1]=3 173 B11R1.3 COc1ccc(cc1)C(=C)C Amb10069923 [0,0,0,0,0,0|1,0,0]=1 174 B11R1.3 COc1ccc(cc1)C(=C)F Amb25244765 [0,0,0,0,0,0|1,0,1]=2 175 B11R1.3 COc1ccc(cc1)C(=N)N Amb2545701 [0,0,0,0,0,0|2,0,0]=2 176 B11R1.3 COc1ccc(cc1)C(=O)F Amb24640758 [0,0,0,0,0,0|1,0,0]=1 177 B11R1.3 COc1ccc(cc1)C(=O)O Amb1208772 [0,0,0,0,0,0|1,0,0]=1 178 B11R1.3 COc1ccc(cc1)C(=S)Cl Amb25281590 [0,0,0,0,0,0|1,1,0]=2 179 B11R1.3 COc1ccc(cc1)C(=S)N Amb1209970 [0,0,0,0,0,0|1,1,0]=2 180 B11R1.3 COc1ccc(cc1)C(C)C Amb10071544 [0,0,0,0,0,0|1,0,1]=2 181 B11R1.3 COc1ccc(cc1)C(C)F Amb25301542 [0,0,0,0,0,0|1,0,1]=2 182 B11R1.3 COc1ccc(cc1)C(C)N Amb17798435 [0,0,0,0,0,0|1,0,1]=2 183 B11R1.3 COc1ccc(cc1)C(Cl)Cl Amb24105754 [0,0,0,0,0,0|2,0,1]=3 184 B11R1.3 COc1ccc(cc1)C(F)F Amb23412233 [0,0,0,0,0,0|2,0,1]=3 185 B11R1.3 COc1ccc(cc1)C(N)C Amb1108511 [0,0,0,0,0,0|1,0,1]=2 186 B11R1.3 COc1ccc(cc1)C(N)F Amb24334663 [0,0,0,0,0,0|2,0,1]=3 187 B11R1.3 COc1ccc(cc1)C(O)O Amb25806688 [0,0,0,0,0,0|1,0,2]=3 188 B11R1.3 COc1ccc(cc1)C(S)=S Amb25067934 [0,0,0,0,0,0|1,1,0]=2 189 B11R1.3 COc1ccc(cc1)N(=O)=O Amb20621761 [0,0,0,0,0,0|2,0,0]=2 190 B11R1.3 COc1ccc(cc1)N(C)C Amb2583234 [0,0,0,0,0,0|2,0,0]=2 191 B11R1.3 COc1ccc(cc1)N(N)C Amb17232110 [0,0,0,0,0,0|2,0,0]=2 192 B11R1.3 COc1ccc(cc1)S(=O)Cl Amb18066264 [0,0,0,0,0,0|2,0,0]=2 193 B11R1.3 COc1ccc(cc1)S(C)=O Amb25785000 [0,0,0,0,0,0|1,0,0]=1 194 B11R1.3 COc1ccc(cc1)S(O)=O Amb18563977 [0,0,0,0,0,0|2,0,0]=2 195 B11R1.3 COc1ccc(cc1)S([O-])=O Amb24112907 [0,0,0,0,0,0|2,0,0]=2 196 B11R1.3 COc1ccc(cc1)[13C](=O)O Amb17616916 [0,0,0,0,0,0|1,0,0]=1 197 B11R1.3 COc1ccc(cc1)[C@@H](C)N Amb22288607 [0,0,0,0,0,0|1,0,1]=2 198 B11R1.3 COc1ccc(cc1)[C@@H](N)C Amb13884842 [0,0,0,0,0,0|1,0,1]=2 199 B11R1.3 COc1ccc(cc1)[C@H](C)Br Amb25028178 [0,0,0,0,0,0|1,0,1]=2 200 B11R1.3 COc1ccc(cc1)[C@H](C)N Amb22288673 [0,0,0,0,0,0|1,0,1]=2 201 B11R1.3 COc1ccc(cc1)[I](=O)=O Amb10553245 [0,0,0,0,0,0|2,0,0]=2 202 B11R1.3 COc1ccc(cc1)[S-](=O)=O Amb13881373 [0,0,0,0,0,0|2,0,0]=2 203 B11R1.3 COc1ccc(cc1)[S-](=O)=O Amb22042483 [0,0,0,0,0,0|2,0,0]=2 204 B11R1.3 COc1ccc(cc1)[Te](=O)Cl Amb22359441 [0,0,0,0,0,0|2,0,0]=2 205 B11R1.3 COc1ccc(cn1)B(O)O Amb10069110 [0,0,0,0,0,0|3,0,1]=4 206 B11R1.3 COc1ccc(cn1)B(O)O Amb2447059 [0,0,0,0,0,0|3,0,1]=4 207 B11R1.3 COc1ccc(cn1)C(=N)N Amb10609275 [0,0,0,0,0,0|3,0,0]=3 208 B11R1.3 COc1ccc(cn1)C(=O)O Amb1088866 [0,0,0,0,0,0|2,0,0]=2 209 B11R1.3 COc1ccc(cn1)[N+](=O)[O-] Amb16205903 [0,0,0,0,0,0|3,0,0]=3 210 B11R1.3 COc1ccc(cn1)[N+](=O)[O-] Amb16207404 [0,0,0,0,0,0|3,0,0]=3 211 B11R1.3 COc1ccc(nc1)B(O)O Amb10597539 [0,0,0,0,0,0|3,0,1]=4 212 B11R1.3 CP(C)c1ccc(CO)cc1 Amb24748435 [0,0,0,0,0,0|4,0,0]=4 213 B11R1.3 CS(=O)c1ccc(CCl)cc1 Amb24423886 [0,0,0,0,0,0|3,0,0]=3 214 B11R1.3 CS(=O)c1ccc(CN)cc1 Amb18908788 [0,0,0,0,0,0|3,0,0]=3 215 B11R1.3 CS(=O)c1ccc(cc1)C=O Amb18126521 [0,0,0,0,0,0|3,0,0]=3 216 B11R1.3 CSc1[n]cc(c[n]1)C(=O)Cl Amb24730651 [0,0,0,0,0,0|3,1,0]=4 217 B11R1.3 CSc1[n]cc(c[n]1)C(N)=O Amb25301414 [0,0,0,0,0,0|3,1,0]=4 218 B11R1.3 CSc1c[n]c(c[n]1)C(O)=O Amb25075416 [0,0,0,0,0,0|3,1,0]=4 219 B11R1.3 CSc1c[n]c(cc1)C(C)O Amb25151887 [0,0,0,0,0,0|1,1,2]=4 220 B11R1.3 CSc1c[n]c(cc1)C(O)=O Amb18647178 [0,0,0,0,0,0|2,1,0]=3 221 B11R1.3 CSc1c[n]c(cc1)[C@@H](C)N Amb25796476 [0,0,0,0,0,0|2,1,1]=4 222 B11R1.3 CSc1c[n]c(cc1)[C@@H](C)O Amb25151888 [0,0,0,0,0,0|1,1,2]=4 223 B11R1.3 CSc1c[n]c(cc1)[C@H](C)O Amb25151886 [0,0,0,0,0,0|1,1,2]=4 224 B11R1.3 CSc1c[n]c(cc1)[N+]([O-])=O Amb22284698 [0,0,0,0,0,0|3,1,0]=4 225 B11R1.3 CSc1ccc([n][n]1)C(O)=O Amb18281642 [0,0,0,0,0,0|3,1,0]=4 226 B11R1.3 CSc1ccc(c[n]1)C(=O)Cl Amb24071746 [0,0,0,0,0,0|2,1,0]=3 227 B11R1.3 CSc1ccc(c[n]1)C(C)N Amb23446299 [0,0,0,0,0,0|2,1,1]=4 228 B11R1.3 CSc1ccc(c[n]1)C(C)O Amb23446296 [0,0,0,0,0,0|1,1,2]=4 229 B11R1.3 CSc1ccc(c[n]1)C(N)=N Amb18180136 [0,0,0,0,0,0|3,1,0]=4 230 B11R1.3 CSc1ccc(c[n]1)[C@@H](C)N Amb25141716 [0,0,0,0,0,0|2,1,1]=4 231 B11R1.3 CSc1ccc(c[n]1)[C@H](C)N Amb24700683 [0,0,0,0,0,0|2,1,1]=4 232 B11R1.3 CSc1ccc(c[n]1)[C@H](C)O Amb25682044 [0,0,0,0,0,0|1,1,2]=4 233 B11R1.3 CSc1ccc(cc1)B(O)O Amb2456036 [0,0,0,0,0,0|2,1,1]=4 234 B11R1.3 CSc1ccc(cc1)C(=O)Cl Amb22337423 [0,0,0,0,0,0|1,1,0]=2 235 B11R1.3 CSc1ccc(cc1)C(C)Cl Amb24677620 [0,0,0,0,0,0|1,1,1]=3 236 B11R1.3 CSc1ccc(cc1)C(N)=N Amb19375427 [0,0,0,0,0,0|2,1,0]=3 237 B11R1.3 CSc1ccc(cc1)C(N)C Amb1107963 [0,0,0,0,0,0|1,1,1]=3 238 B11R1.3 CSc1ccc(cc1)N(=O)=O Amb20621932 [0,0,0,0,0,0|2,1,0]=3 239 B11R1.3 CSc1ccc(cc1)P(Cl)Cl Amb24388505 [0,0,0,0,0,0|3,1,0]=4 240 B11R1.3 CSc1ccc(cc1)S(O)=O Amb18224840 [0,0,0,0,0,0|2,1,0]=3 241 B11R1.3 CSc1ccc(cc1)[C@@H](C)N Amb22288630 [0,0,0,0,0,0|1,1,1]=3 242 B11R1.3 CSc1ccc(cc1)[C@@H](N)C Amb13952962 [0,0,0,0,0,0|1,1,1]=3 243 B11R1.3 CSc1ccc(cc1)[C@@H](O)C Amb13952955 [0,0,0,0,0,0|0,1,2]=3 244 B11R1.3 CSc1ccc(cc1)[C@H](C)N Amb22288688 [0,0,0,0,0,0|1,1,1]=3 245 B11R1.3 CSc1ccc(cc1)[C@H](N)C Amb13952961 [0,0,0,0,0,0|1,1,1]=3 246 B11R1.3 CSc1ccc(cc1)[C@H](O)C Amb13952944 [0,0,0,0,0,0|0,1,2]=3 247 B11R1.3 CSc1ccc(cn1)[N+](=O)[O-] Amb17598344 [0,0,0,0,0,0|3,1,0]=4 248 B11R1.3 C[13CH2]c1ccc(cc1)C(O)=O Amb22351476 [0,0,0,0,0,0|2,0,0]=2 249 B11R1.3 C[C@@H](N)c1ccc(C=C)cc1 Amb25242041 [0,0,0,0,0,0|2,0,2]=4 250 B11R1.3 C[C@@H](N)c1ccc(CO)cc1 Amb24092978 [0,0,0,0,0,0|3,0,1]=4 251 B11R1.3 C[C@@H](N)c1ccc(cc1)C#N Amb22288663 [0,0,0,0,0,0|3,0,1]=4 252 B11R1.3 C[C@@H](O)c1ccc(C=C)cc1 Amb24556360 [0,0,0,0,0,0|1,0,3]=4 253 B11R1.3 C[C@@H](O)c1ccc(C=O)cc1 Amb24103165 [0,0,0,0,0,0|2,0,2]=4 254 B11R1.3 C[C@@H](O)c1ccc(cc1)C#C Amb25769398 [0,0,0,0,0,0|1,0,3]=4 255 B11R1.3 C[C@@H](O)c1ccc(cc1)C#N Amb22745270 [0,0,0,0,0,0|2,0,2]=4 256 B11R1.3 C[C@H](N)c1ccc(C=C)cc1 Amb24390410 [0,0,0,0,0,0|2,0,2]=4 257 B11R1.3 C[C@H](N)c1ccc(cc1)C#C Amb25152710 [0,0,0,0,0,0|2,0,2]=4 258 B11R1.3 C[C@H](N)c1ccc(cc1)C#N Amb22288708 [0,0,0,0,0,0|3,0,1]=4 259 B11R1.3 C[C@H](O)c1ccc(C=O)cc1 Amb24097188 [0,0,0,0,0,0|2,0,2]=4 260 B11R1.3 C[C@H](O)c1ccc(CO)cc1 Amb24501946 [0,0,0,0,0,0|2,0,2]=4 261 B11R1.3 C[C@H](O)c1ccc(cc1)C#C Amb24592075 [0,0,0,0,0,0|1,0,3]=4 262 B11R1.3 C[C@H](O)c1ccc(cc1)C#N Amb20241227 [0,0,0,0,0,0|2,0,2]=4 263 B11R1.3 C[SiH](C)c1ccc(C=C)cc1 Amb23438878 [0,0,0,0,0,0|2,1,1]=4 264 B11R1.3 C[SiH](C)c1ccc(C=O)cc1 Amb25758958 [0,0,0,0,0,0|3,1,0]=4 265 B11R1.3 C[SiH](C)c1ccc(cc1)C#N Amb24408851 [0,0,0,0,0,0|3,1,0]=4 266 B11R1.3 ClC(=O)c1ccc(B=O)cc1 Amb17938053 [0,0,0,0,0,0|3,0,0]=3 267 B11R1.3 ClCc1ccc(cc1)C(=O)N Amb1223574 [0,0,0,0,0,0|3,0,0]=3 268 B11R1.3 ClCc1ccc(cc1)C(=O)O Amb2371361 [0,0,0,0,0,0|3,0,0]=3 269 B11R1.3 ClCc1ccc(cc1)C(C)C Amb1651282 [0,0,0,0,0,0|3,0,1]=4 270 B11R1.3 ClCc1ccc(cc1)[N+](=O)[O-] Amb1152166 [0,0,0,0,0,0|4,0,0]=4 271 B11R1.3 Cl[Hg]c1ccc(cc1)C(=O)O Amb10071522 [0,0,0,0,0,0|3,0,0]=3 272 B11R1.3 N#Cc1c[n]c(cc1)C(=O)Cl Amb25069820 [0,0,0,0,0,0|4,0,0]=4 273 B11R1.3 N#Cc1ccc(cc1)C(=O)Br Amb24091430 [0,0,0,0,0,0|3,0,0]=3 274 B11R1.3 N#Cc1ccc(cc1)C(=O)C Amb1635239 [0,0,0,0,0,0|2,0,0]=2 275 B11R1.3 N#Cc1ccc(cc1)C(=O)N Amb10601531 [0,0,0,0,0,0|3,0,0]=3 276 B11R1.3 N#Cc1ccc(cc1)C(=O)[O-] Amb16231900 [0,0,0,0,0,0|3,0,0]=3 277 B11R1.3 N#Cc1ccc(cc1)C(C)C Amb1648895 [0,0,0,0,0,0|3,0,1]=4 278 B11R1.3 N#Cc1ccc(cc1)C(N)C Amb1131431 [0,0,0,0,0,0|3,0,1]=4 279 B11R1.3 N#Cc1ccc(cc1)N(=O)=O Amb20621776 [0,0,0,0,0,0|4,0,0]=4 280 B11R1.3 N#Cc1ccc(cc1)N(C)C Amb1214911 [0,0,0,0,0,0|4,0,0]=4 281 B11R1.3 N#Cc1ccc(cc1)S([O-])=O Amb24606697 [0,0,0,0,0,0|4,0,0]=4 282 B11R1.3 N#Cc1ccc(cc1)[C@@H](N)C Amb10603246 [0,0,0,0,0,0|3,0,1]=4 283 B11R1.3 N#Cc1ccc(cc1)[C@H](N)C Amb10603204 [0,0,0,0,0,0|3,0,1]=4 284 B11R1.3 N#Cc1ccc(cn1)C(=O)C Amb10573584 [0,0,0,0,0,0|3,0,0]=3 285 B11R1.3 N#[N+]c1ccc(cc1)C(O)=O Amb24711272 [0,0,0,0,0,0|3,0,0]=3 286 B11R1.3 N#[N+]c1ccc(cc1)[N+](=O)[O-] Amb10838538 [0,0,0,0,0,0|4,0,0]=4 287 B11R1.3 N#[N+]c1ccc(cc1)[N+](=O)[O-] Amb17618384 [0,0,0,0,0,0|4,0,0]=4 288 B11R1.3 N=C=C1CC=C(C=C1)C(O)=O Amb24091357 [0,0,0,0,0,0|3,0,1]=4 289 B11R1.3 N=Cc1ccc(cc1)C(O)=O Amb24359908 [0,0,0,0,0,0|3,0,0]=3 290 B11R1.3 N=Nc1ccc(cc1)C(O)=O Amb22232868 [0,0,0,0,0,0|3,0,0]=3 291 B11R1.3 N=[NH+]c1ccc(cc1)[N+]([O-])=O Amb22336395 [0,0,0,0,0,0|4,0,0]=4 292 B11R1.3 NC(=N)c1ccc(C=O)cc1 Amb21962524 [0,0,0,0,0,0|4,0,0]=4 293 B11R1.3 NC(=N)c1ccc(C=O)cc1 Amb24070289 [0,0,0,0,0,0|4,0,0]=4 294 B11R1.3 NC(=N)c1ccc(CBr)cc1 Amb25103194 [0,0,0,0,0,0|4,0,0]=4 295 B11R1.3 NC(=N)c1ccc(CN)cc1 Amb23590697 [0,0,0,0,0,0|4,0,0]=4 296 B11R1.3 NC(=N)c1ccc(cc1)C#N Amb19892314 [0,0,0,0,0,0|4,0,0]=4 297 B11R1.3 NC(=N)c1ccc(cc1)NN Amb25367175 [0,0,0,0,0,0|4,0,0]=4 298 B11R1.3 NC(=O)C1=CCC(C=C1)=C=N Amb24091356 [0,0,0,0,0,0|3,0,1]=4 299 B11R1.3 NC(=O)c1c[n]c(cc1)SS Amb25099457 [0,0,0,0,0,0|3,1,0]=4 300 B11R1.3 NC(=O)c1ccc(C=N)cc1 Amb25794243 [0,0,0,0,0,0|3,0,0]=3 301 B11R1.3 NC(=O)c1ccc(CBr)cc1 Amb21856118 [0,0,0,0,0,0|3,0,0]=3 302 B11R1.3 NC(=O)c1ccc(CF)cc1 Amb25691034 [0,0,0,0,0,0|3,0,0]=3 303 B11R1.3 NC(=O)c1ccc(CN)[n]c1 Amb18251343 [0,0,0,0,0,0|4,0,0]=4 304 B11R1.3 NC(=O)c1ccc(CN)[n]c1 Amb24179187 [0,0,0,0,0,0|4,0,0]=4 305 B11R1.3 NC(=O)c1ccc(CN)c[n]1 Amb18251342 [0,0,0,0,0,0|4,0,0]=4 306 B11R1.3 NC(=O)c1ccc(CO)[n]c1 Amb23441364 [0,0,0,0,0,0|4,0,0]=4 307 B11R1.3 NC(=O)c1ccc(NN)[n]c1 Amb18179417 [0,0,0,0,0,0|4,0,0]=4 308 B11R1.3 NC(=O)c1ccc(c[n]1)C#N Amb18124812 [0,0,0,0,0,0|4,0,0]=4 309 B11R1.3 NC(=O)c1ccc(c[n]1)C=O Amb24087315 [0,0,0,0,0,0|4,0,0]=4 310 B11R1.3 NC(=O)c1ccc(c[n]1)[N+]#N Amb24681094 [0,0,0,0,0,0|4,0,0]=4 311 B11R1.3 NC(=O)c1ccc(cc1)N=N Amb24091441 [0,0,0,0,0,0|3,0,0]=3 312 B11R1.3 NC(=O)c1ccc(cc1)N=O Amb24056500 [0,0,0,0,0,0|3,0,0]=3 313 B11R1.3 NC(=O)c1ccc(cc1)NN Amb22494220 [0,0,0,0,0,0|3,0,0]=3 314 B11R1.3 NC(=O)c1ccc(cc1)NO Amb24102989 [0,0,0,0,0,0|3,0,0]=3 315 B11R1.3 NC(=O)c1ccc(cc1)SCl Amb24486564 [0,0,0,0,0,0|2,1,0]=3 316 B11R1.3 NC(=S)c1ccc(C=O)cc1 Amb25336480 [0,0,0,0,0,0|3,1,0]=4 317 B11R1.3 NC(=S)c1ccc(CN)cc1 Amb18908699 [0,0,0,0,0,0|3,1,0]=4 318 B11R1.3 NC(=S)c1ccc(CS)cc1 Amb22044124 [0,0,0,0,0,0|3,1,0]=4 319 B11R1.3 NC(=S)c1ccc(cc1)C#N Amb25322004 [0,0,0,0,0,0|3,1,0]=4 320 B11R1.3 NCc1ccc([n]c1)C(O)=O Amb19148688 [0,0,0,0,0,0|4,0,0]=4 321 B11R1.3 NCc1ccc(c[n]1)C(O)=O Amb23399606 [0,0,0,0,0,0|4,0,0]=4 322 B11R1.3 NCc1ccc(cc1)C(=O)C Amb17101539 [0,0,0,0,0,0|2,0,0]=2 323 B11R1.3 NCc1ccc(cc1)C(=O)Cl Amb17142911 [0,0,0,0,0,0|3,0,0]=3 324 B11R1.3 NCc1ccc(cc1)C(=O)N Amb1211942 [0,0,0,0,0,0|3,0,0]=3 325 B11R1.3 NCc1ccc(cc1)C(=O)O Amb16185430 [0,0,0,0,0,0|3,0,0]=3 326 B11R1.3 NCc1ccc(cc1)C(=O)O Amb1905628 [0,0,0,0,0,0|3,0,0]=3 327 B11R1.3 NCc1ccc(cc1)C(C)C Amb1113279 [0,0,0,0,0,0|3,0,1]=4 328 B11R1.3 NCc1ccc(cc1)C(O)C Amb10609144 [0,0,0,0,0,0|2,0,2]=4 329 B11R1.3 NCc1ccc(cc1)N(=O)=O Amb20621785 [0,0,0,0,0,0|4,0,0]=4 330 B11R1.3 NCc1ccc(cc1)N(C)C Amb1215270 [0,0,0,0,0,0|4,0,0]=4 331 B11R1.3 NCc1ccc(cc1)S(=O)C Amb10808659 [0,0,0,0,0,0|3,0,0]=3 332 B11R1.3 NNc1c[n]c(cc1)C(O)=O Amb22490278 [0,0,0,0,0,0|4,0,0]=4 333 B11R1.3 NNc1ccc(c[n]1)C(O)=O Amb22899553 [0,0,0,0,0,0|4,0,0]=4 334 B11R1.3 NNc1ccc(cc1)C(=O)O Amb1209661 [0,0,0,0,0,0|3,0,0]=3 335 B11R1.3 NNc1ccc(cc1)C(=O)O Amb2236560 [0,0,0,0,0,0|3,0,0]=3 336 B11R1.3 NNc1ccc(cc1)C(C)C Amb2236006 [0,0,0,0,0,0|3,0,1]=4 337 B11R1.3 NNc1ccc(cc1)N(=O)=O Amb20621856 [0,0,0,0,0,0|4,0,0]=4 338 B11R1.3 NNc1ccc(cc1)N(=O)=O Amb20621885 [0,0,0,0,0,0|4,0,0]=4 339 B11R1.3 NNc1ccc(cc1)S(=O)=O Amb24377115 [0,0,0,0,0,0|4,0,0]=4 340 B11R1.3 NNc1ccc(cc1)[N+](=O)[O-] Amb10610093 [0,0,0,0,0,0|4,0,0]=4 341 B11R1.3 NNc1ccc(cn1)C(=O)O Amb2446294 [0,0,0,0,0,0|4,0,0]=4 342 B11R1.3 NOc1ccc(c[n]1)C(O)=O Amb24695786 [0,0,0,0,0,0|3,0,0]=3 343 B11R1.3 O=C(Br)c1ccc(CBr)cc1 Amb22347921 [0,0,0,0,0,0|3,0,0]=3 344 B11R1.3 O=C(Cl)c1ccc(CBr)cc1 Amb21953447 [0,0,0,0,0,0|3,0,0]=3 345 B11R1.3 O=C(Cl)c1ccc(CF)cc1 Amb24102983 [0,0,0,0,0,0|3,0,0]=3 346 B11R1.3 O=C(Cl)c1ccc(cc1)C=O Amb24070290 [0,0,0,0,0,0|3,0,0]=3 347 B11R1.3 O=C(Cl)c1ccc(cc1)N=O Amb24070597 [0,0,0,0,0,0|3,0,0]=3 348 B11R1.3 O=Cc1ccc(cc1)C(=C)C Amb16232119 [0,0,0,0,0,0|3,0,0]=3 349 B11R1.3 O=Cc1ccc(cc1)C(=O)C Amb17334280 [0,0,0,0,0,0|2,0,0]=2 350 B11R1.3 O=Cc1ccc(cc1)C(=O)O Amb1905480 [0,0,0,0,0,0|3,0,0]=3 351 B11R1.3 O=Cc1ccc(cc1)C(=O)[O-] Amb10241565 [0,0,0,0,0,0|3,0,0]=3 352 B11R1.3 O=Cc1ccc(cc1)N(=O)=O Amb20621764 [0,0,0,0,0,0|4,0,0]=4 353 B11R1.3 O=Cc1ccc(cc1)N(C)C Amb1880874 [0,0,0,0,0,0|4,0,0]=4 354 B11R1.3 O=Cc1ccc(cc1)[N+](=O)[O-] Amb1880877 [0,0,0,0,0,0|4,0,0]=4 355 B11R1.3 O=Nc1ccc(cc1)C(=O)O Amb17593755 [0,0,0,0,0,0|3,0,0]=3 356 B11R1.3 O=[I]c1ccc(cc1)[N+](=O)[O-] Amb10553243 [0,0,0,0,0,0|4,0,0]=4 357 B11R1.3 OC(=O)c1ccc(B=O)cc1 Amb24437192 [0,0,0,0,0,0|3,0,0]=3 358 B11R1.3 OC(=O)c1ccc(CBr)[n]c1 Amb22011864 [0,0,0,0,0,0|4,0,0]=4 359 B11R1.3 OC(=O)c1ccc(CBr)c[n]1 Amb25824038 [0,0,0,0,0,0|4,0,0]=4 360 B11R1.3 OC(=O)c1ccc(CCl)[n]c1 Amb22751505 [0,0,0,0,0,0|4,0,0]=4 361 B11R1.3 OC(=O)c1ccc(CF)[n]c1 Amb24062476 [0,0,0,0,0,0|4,0,0]=4 362 B11R1.3 OC(=O)c1ccc(CF)cc1 Amb25765665 [0,0,0,0,0,0|3,0,0]=3 363 B11R1.3 OC(=O)c1ccc(CO)c[n]1 Amb18125516 [0,0,0,0,0,0|4,0,0]=4 364 B11R1.3 OC(=O)c1ccc([n]c1)N=O Amb25177635 [0,0,0,0,0,0|4,0,0]=4 365 B11R1.3 OC(=O)c1ccc(c[n]1)C=O Amb20247833 [0,0,0,0,0,0|4,0,0]=4 366 B11R1.3 OC(=O)c1ccc(c[n]1)NO Amb25684711 [0,0,0,0,0,0|4,0,0]=4 367 B11R1.3 OC(=O)c1ccc(cc1)NCl Amb24425499 [0,0,0,0,0,0|3,0,0]=3 368 B11R1.3 OC(=O)c1ccc(cc1)NF Amb24102980 [0,0,0,0,0,0|3,0,0]=3 369 B11R1.3 OC(=O)c1ccc(cc1)NO Amb22492021 [0,0,0,0,0,0|3,0,0]=3 370 B11R1.3 OCc1ccc(cc1)C(C)C Amb1211894 [0,0,0,0,0,0|3,0,1]=4 371 B11R1.3 OCc1ccc(cc1)N(C)C Amb1110179 [0,0,0,0,0,0|4,0,0]=4 372 B11R1.3 OCc1ccc(cc1)N(C)C Amb16185739 [0,0,0,0,0,0|4,0,0]=4 373 B11R1.3 [2H]C(=O)c1ccc(cc1)OC Amb22353633 [0,0,0,0,0,0|1,0,0]=1 374 B11R1.3 [2H][13C](=O)c1ccc(cc1)OC Amb22367279 [0,0,0,0,0,0|1,0,0]=1 375 B11R1.3 [C-]#[N+]c1ccc(cc1)C(C)O Amb24484574 [0,0,0,0,0,0|1,0,3]=4 376 B11R1.3 [C-]#[N+]c1ccc(cc1)N(=O)=O Amb10572010 [0,0,0,0,0,0|3,0,1]=4 377 B11R1.3 [C-]#[N+]c1ccc(cc1)N(C)C Amb1981068 [0,0,0,0,0,0|3,0,1]=4 378 B11R1.3 [C-]#[N+]c1ccc(cc1)[C@H](C)O Amb22225451 [0,0,0,0,0,0|1,0,3]=4 379 B11R1.3 [C-]#[N+]c1ccc(cc1)[C@H](O)C Amb16231703 [0,0,0,0,0,0|1,0,3]=4 380 B11R1.3 [C-]#[N+]c1ccc(cc1)[N+](=O)[O-] Amb2235907 [0,0,0,0,0,0|3,0,1]=4 381 B11R1.3 [NH3+]Nc1ccc(cc1)[N+]([O-])=O Amb24113855 [0,0,0,0,0,0|4,0,0]=4 382 B11R1.3 [Na]Oc1ccc(cc1)[N+](=O)[O-] Amb10570883 [0,0,0,0,0,0|3,0,0]=3 383 B11R1.3 [O-]C(=O)c1ccc(cc1)[Hg]Cl Amb22731189 [0,0,0,0,0,0|3,0,0]=3 384 B11R1.3 [O-]C(=O)c1ccc(cc1)[Hg]O Amb22359796 [0,0,0,0,0,0|3,0,0]=3 385 B11R1.3 [O-]S(=O)c1ccc(CBr)cc1 Amb25738807 [0,0,0,0,0,0|4,0,0]=4 386 B11R1.3 [O-]S(=O)c1ccc(CCl)cc1 Amb25307615 [0,0,0,0,0,0|4,0,0]=4 387 B11R1.3 [O-][N+](=O)c1ccc(CI)cc1 Amb21618919 [0,0,0,0,0,0|4,0,0]=4 388 B11R1.3 [O-][N+](=O)c1ccc(CS)cc1 Amb24101070 [0,0,0,0,0,0|4,0,0]=4 389 B10R1.3 BrCc1ccc(cc1)OC Amb1106251 [1,0,0,0,0,0|1,0,1]=3 390 B10R1.3 C#Cc1ccc(C=O)[n]c1 Amb23399740 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.3 C=Cc1ccc(C=O)[n]c1 Amb24683555 [1,0,0,0,0,0|2,0,1]=4 392 B10R1.3 C=Cc1ccc(CBr)cc1 Amb22008099 [1,0,0,0,0,0|2,0,1]=4 393 B10R1.3 C=Cc1ccc(CCl)cc1 Amb22049532 [1,0,0,0,0,0|2,0,1]=4 394 B10R1.3 C=Cc1ccc(CN)cc1 Amb18124390 [1,0,0,0,0,0|2,0,1]=4 395 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336337 [1,0,0,0,0,0|1,0,2]=4 396 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336375 [1,0,0,0,0,0|1,0,2]=4 397 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336424 [1,0,0,0,0,0|1,0,2]=4 398 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336434 [1,0,0,0,0,0|1,0,2]=4 399 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336435 [1,0,0,0,0,0|1,0,2]=4 400 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336454 [1,0,0,0,0,0|1,0,2]=4 401 B10R1.3 C=Cc1ccc(cc1)C=C Amb22336668 [1,0,0,0,0,0|1,0,2]=4 402 B10R1.3 C=Cc1ccc(cc1)C=C Amb22338005 [1,0,0,0,0,0|1,0,2]=4 403 B10R1.3 C=Cc1ccc(cc1)C=C Amb22338008 [1,0,0,0,0,0|1,0,2]=4 404 B10R1.3 C=Cc1ccc(cc1)C=C Amb22338272 [1,0,0,0,0,0|1,0,2]=4 405 B10R1.3 C=Cc1ccc(cc1)C=C Amb22348355 [1,0,0,0,0,0|1,0,2]=4 406 B10R1.3 C=Cc1ccc(cc1)C=C Amb22351596 [1,0,0,0,0,0|1,0,2]=4 407 B10R1.3 C=Cc1ccc(cc1)C=C Amb22351694 [1,0,0,0,0,0|1,0,2]=4 408 B10R1.3 C=Cc1ccc(cc1)C=C Amb22353100 [1,0,0,0,0,0|1,0,2]=4 409 B10R1.3 C=Cc1ccc(cc1)C=C Amb22353202 [1,0,0,0,0,0|1,0,2]=4 410 B10R1.3 C=Cc1ccc(cc1)C=C Amb22353385 [1,0,0,0,0,0|1,0,2]=4 411 B10R1.3 C=Cc1ccc(cc1)C=C Amb22363146 [1,0,0,0,0,0|1,0,2]=4 412 B10R1.3 C=Cc1ccc(cc1)C=C Amb22366830 [1,0,0,0,0,0|1,0,2]=4 413 B10R1.3 C=Cc1ccc(cc1)C=C Amb22366842 [1,0,0,0,0,0|1,0,2]=4 414 B10R1.3 C=Cc1ccc(cc1)C=C Amb22367011 [1,0,0,0,0,0|1,0,2]=4 415 B10R1.3 C=Cc1ccc(cc1)C=C Amb22369713 [1,0,0,0,0,0|1,0,2]=4 416 B10R1.3 C=Cc1ccc(cc1)NN Amb25762973 [1,0,0,0,0,0|2,0,1]=4 417 B10R1.3 CC[n+]1ccc(CC)cc1 Amb24573827 [1,0,0,0,0,0|2,0,1]=4 418 B10R1.3 CCc1c[n]c(C=O)c[n]1 Amb18832468 [1,0,0,0,0,0|3,0,0]=4 419 B10R1.3 CCc1c[n]c([n]c1)OC Amb24071277 [1,0,0,0,0,0|2,0,1]=4 420 B10R1.3 CCc1c[n]c(c[n]1)OC Amb24105762 [1,0,0,0,0,0|2,0,1]=4 421 B10R1.3 CCc1ccc(C=C)cc1 Amb20407513 [1,0,0,0,0,0|1,0,1]=3 422 B10R1.3 CCc1ccc(C=O)c[n]1 Amb18203106 [1,0,0,0,0,0|2,0,0]=3 423 B10R1.3 CCc1ccc(CC)c[n]1 Amb24080590 [1,0,0,0,0,0|2,0,1]=4 424 B10R1.3 CCc1ccc(CN)cc1 Amb22436460 [1,0,0,0,0,0|2,0,1]=4 425 B10R1.3 CCc1ccc([n]c1)OC Amb24081494 [1,0,0,0,0,0|1,0,1]=3 426 B10R1.3 CCc1ccc(c[n]1)OC Amb24084060 [1,0,0,0,0,0|1,0,1]=3 427 B10R1.3 CCc1ccc(c[n]1)SC Amb22277014 [1,0,0,0,0,0|1,1,1]=4 428 B10R1.3 CCc1ccc(cc1)C#N Amb1657324 [1,0,0,0,0,0|2,0,1]=4 429 B10R1.3 CCc1ccc(cc1)CN Amb1113829 [1,0,0,0,0,0|2,0,1]=4 430 B10R1.3 CCc1ccc(cc1)CS Amb17399940 [1,0,0,0,0,0|1,1,1]=4 431 B10R1.3 CCc1ccc(cc1)NN Amb1043748 [1,0,0,0,0,0|2,0,1]=4 432 B10R1.3 CCc1ccc(cc1)NN Amb2235222 [1,0,0,0,0,0|2,0,1]=4 433 B10R1.3 CCc1ccc(cc1)NO Amb24116987 [1,0,0,0,0,0|2,0,1]=4 434 B10R1.3 CCc1ccc(cc1)[Mg]Br Amb22000529 [1,0,0,0,0,0|2,0,1]=4 435 B10R1.3 CCc1ccc(cc1)[N+]#N Amb17940662 [1,0,0,0,0,0|2,0,1]=4 436 B10R1.3 CCc1ccc(cc1)[N+]#[C-] Amb2235421 [1,0,0,0,0,0|1,0,2]=4 437 B10R1.3 CCc1ccc(cc1)[Zn]Br Amb22897786 [1,0,0,0,0,0|2,0,1]=4 438 B10R1.3 CCc1ccc(cc1)[Zn]I Amb22000450 [1,0,0,0,0,0|2,0,1]=4 439 B10R1.3 CCc1ccc(nc1)C=C Amb17614199 [1,0,0,0,0,0|2,0,1]=4 440 B10R1.3 CCc1ccc(nc1)C=O Amb10607843 [1,0,0,0,0,0|2,0,0]=3 441 B10R1.3 CNc1[n]cc(c[n]1)OC Amb25789394 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.3 CNc1c[n]c([n]c1)OC Amb24502432 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.3 CNc1c[n]c(c[n]1)OC Amb23403158 [1,0,0,0,0,0|3,0,0]=4 444 B10R1.3 CNc1ccc(C=C)c[n]1 Amb23446320 [1,0,0,0,0,0|2,0,1]=4 445 B10R1.3 CNc1ccc(C=C)cc1 Amb22751066 [1,0,0,0,0,0|1,0,1]=3 446 B10R1.3 CNc1ccc(C=O)[n]c1 Amb25113494 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.3 CNc1ccc(C=O)cc1 Amb18642996 [1,0,0,0,0,0|1,0,0]=2 448 B10R1.3 CNc1ccc(CN)cc1 Amb18284508 [1,0,0,0,0,0|2,0,1]=4 449 B10R1.3 CNc1ccc(cc1)C#C Amb19944537 [1,0,0,0,0,0|1,0,2]=4 450 B10R1.3 CNc1ccc(cc1)OC Amb22235996 [1,0,0,0,0,0|1,0,0]=2 451 B10R1.3 CNc1ccc(cc1)[N+]#N Amb25702022 [1,0,0,0,0,0|3,0,0]=4 452 B10R1.3 CO[13c]1[13cH][13cH][13c]([13cH][13cH]1)C=O Amb17608459 [1,0,0,0,0,0|0,0,0]=1 453 B10R1.3 COc1[n]cc(C=C)c[n]1 Amb24084566 [1,0,0,0,0,0|2,0,1]=4 454 B10R1.3 COc1[n]cc(c[n]1)OC Amb22235602 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.3 COc1c[n]c(C=O)[n]c1 Amb17933836 [1,0,0,0,0,0|2,0,0]=3 456 B10R1.3 COc1c[n]c(C=O)c[n]1 Amb20171046 [1,0,0,0,0,0|2,0,0]=3 457 B10R1.3 COc1c[n]c(c[n]1)OC Amb22498308 [1,0,0,0,0,0|3,0,0]=4 458 B10R1.3 COc1c[n]c(cc1)C#C Amb19516444 [1,0,0,0,0,0|1,0,2]=4 459 B10R1.3 COc1c[n]c(cc1)NN Amb18832091 [1,0,0,0,0,0|3,0,0]=4 460 B10R1.3 COc1c[n]c(cc1)[Mg]Br Amb22897393 [1,0,0,0,0,0|3,0,0]=4 461 B10R1.3 COc1c[n]c(cc1)[Zn]Br Amb22897911 [1,0,0,0,0,0|3,0,0]=4 462 B10R1.3 COc1ccc(C=C)[n][n]1 Amb25178863 [1,0,0,0,0,0|2,0,1]=4 463 B10R1.3 COc1ccc(C=C)[n]c1 Amb24056359 [1,0,0,0,0,0|1,0,1]=3 464 B10R1.3 COc1ccc(C=C)c[n]1 Amb23446272 [1,0,0,0,0,0|1,0,1]=3 465 B10R1.3 COc1ccc(C=O)[n][n]1 Amb18643215 [1,0,0,0,0,0|2,0,0]=3 466 B10R1.3 COc1ccc(C=O)nc1 Amb17942813 [1,0,0,0,0,0|1,0,0]=2 467 B10R1.3 COc1ccc(CBr)[n]c1 Amb22233953 [1,0,0,0,0,0|2,0,1]=4 468 B10R1.3 COc1ccc(CBr)[n]c1 Amb24179189 [1,0,0,0,0,0|2,0,1]=4 469 B10R1.3 COc1ccc(CBr)c[n]1 Amb21857064 [1,0,0,0,0,0|2,0,1]=4 470 B10R1.3 COc1ccc(CBr)c[n]1 Amb22263133 [1,0,0,0,0,0|2,0,1]=4 471 B10R1.3 COc1ccc(CCl)[n]c1 Amb20669042 [1,0,0,0,0,0|2,0,1]=4 472 B10R1.3 COc1ccc(CCl)c[n]1 Amb18787740 [1,0,0,0,0,0|2,0,1]=4 473 B10R1.3 COc1ccc(CCl)c[n]1 Amb21857199 [1,0,0,0,0,0|2,0,1]=4 474 B10R1.3 COc1ccc(CF)cc1 Amb24672454 [1,0,0,0,0,0|1,0,1]=3 475 B10R1.3 COc1ccc(CN)[n]c1 Amb22500959 [1,0,0,0,0,0|2,0,1]=4 476 B10R1.3 COc1ccc(CN)[n]c1 Amb22747314 [1,0,0,0,0,0|2,0,1]=4 477 B10R1.3 COc1ccc(CN)c[n]1 Amb21857198 [1,0,0,0,0,0|2,0,1]=4 478 B10R1.3 COc1ccc(CO)c[n]1 Amb19148868 [1,0,0,0,0,0|1,0,2]=4 479 B10R1.3 COc1ccc(c[n]1)NN Amb20241269 [1,0,0,0,0,0|3,0,0]=4 480 B10R1.3 COc1ccc(c[n]1)NN Amb22001479 [1,0,0,0,0,0|3,0,0]=4 481 B10R1.3 COc1ccc(c[n]1)OC Amb22728695 [1,0,0,0,0,0|2,0,0]=3 482 B10R1.3 COc1ccc(c[n]1)SC Amb25376936 [1,0,0,0,0,0|2,0,0]=3 483 B10R1.3 COc1ccc(c[n]1)[Mg]Br Amb22897370 [1,0,0,0,0,0|3,0,0]=4 484 B10R1.3 COc1ccc(c[n]1)[Zn]Br Amb22897888 [1,0,0,0,0,0|3,0,0]=4 485 B10R1.3 COc1ccc(cc1)C#C Amb2227469 [1,0,0,0,0,0|0,0,2]=3 486 B10R1.3 COc1ccc(cc1)C#N Amb1209785 [1,0,0,0,0,0|1,0,1]=3 487 B10R1.3 COc1ccc(cc1)N=O Amb24586645 [1,0,0,0,0,0|1,0,0]=2 488 B10R1.3 COc1ccc(cc1)NO Amb25174292 [1,0,0,0,0,0|1,0,1]=3 489 B10R1.3 COc1ccc(cc1)OC Amb1802079 [1,0,0,0,0,0|1,0,0]=2 490 B10R1.3 COc1ccc(cc1)[13CH]=O Amb17608458 [1,0,0,0,0,0|0,0,0]=1 491 B10R1.3 COc1ccc(cc1)[Hg]Cl Amb22347643 [1,0,0,0,0,0|2,0,0]=3 492 B10R1.3 COc1ccc(cc1)[I]=O Amb10553244 [1,0,0,0,0,0|1,0,0]=2 493 B10R1.3 COc1ccc(cc1)[N+]#N Amb22350660 [1,0,0,0,0,0|2,0,0]=3 494 B10R1.3 COc1ccc(cc1)[N+]#[C-] Amb2235963 [1,0,0,0,0,0|1,0,1]=3 495 B10R1.3 COc1ccc(cc1)[NH+]=N Amb22731753 [1,0,0,0,0,0|2,0,0]=3 496 B10R1.3 COc1ccc(cc1)[Zn]Br Amb22897825 [1,0,0,0,0,0|2,0,0]=3 497 B10R1.3 COc1ccc(cn1)C#C Amb13883474 [1,0,0,0,0,0|1,0,2]=4 498 B10R1.3 COc1ccc(cn1)C#N Amb1158674 [1,0,0,0,0,0|2,0,1]=4 499 B10R1.3 COc1ccc(nc1)C#N Amb10071934 [1,0,0,0,0,0|2,0,1]=4 500 B10R1.3 COc1ccc(nc1)CCl Amb16191946 [1,0,0,0,0,0|2,0,1]=4 501 B10R1.3 COc1ccc(nc1)CO Amb16191884 [1,0,0,0,0,0|1,0,2]=4 502 B10R1.3 CSc1c[n]c(C=O)c[n]1 Amb25376485 [1,0,0,0,0,0|2,1,0]=4 503 B10R1.3 CSc1ccc(C=C)[n]c1 Amb25281829 [1,0,0,0,0,0|1,1,1]=4 504 B10R1.3 CSc1ccc(C=C)c[n]1 Amb23446302 [1,0,0,0,0,0|1,1,1]=4 505 B10R1.3 CSc1ccc(C=O)c[n]1 Amb23446290 [1,0,0,0,0,0|1,1,0]=3 506 B10R1.3 CSc1ccc(CBr)cc1 Amb22337206 [1,0,0,0,0,0|1,1,1]=4 507 B10R1.3 CSc1ccc(c[n]1)SC Amb24404154 [1,0,0,0,0,0|2,1,0]=4 508 B10R1.3 CSc1ccc(cc1)ON Amb25185170 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.3 CSc1ccc(cc1)SC Amb10553024 [1,0,0,0,0,0|1,1,0]=3 510 B10R1.3 CSc1ccc(cc1)[Mg]Br Amb22000526 [1,0,0,0,0,0|2,1,0]=4 511 B10R1.3 CSc1ccc(cc1)[N+]#N Amb25850995 [1,0,0,0,0,0|2,1,0]=4 512 B10R1.3 CSc1ccc(cc1)[Zn]Br Amb22336655 [1,0,0,0,0,0|2,1,0]=4 513 B10R1.3 ClC=C1C=CC(C=C1)=CCl Amb24482174 [1,0,0,0,0,0|3,0,0]=4 514 B10R1.3 ClCc1ccc(cc1)SC Amb1153060 [1,0,0,0,0,0|1,1,1]=4 515 B10R1.3 N#Cc1ccc(C=O)c[n]1 Amb19957980 [1,0,0,0,0,0|3,0,0]=4 516 B10R1.3 NCc1ccc(C=O)cc1 Amb24120640 [1,0,0,0,0,0|2,0,0]=3 517 B10R1.3 NCc1ccc(cc1)OC Amb2221661 [1,0,0,0,0,0|1,0,1]=3 518 B10R1.3 NCc1ccc(cc1)ON Amb25113892 [1,0,0,0,0,0|2,0,1]=4 519 B10R1.3 NCc1ccc(nc1)OC Amb10576325 [1,0,0,0,0,0|2,0,1]=4 520 B10R1.3 NNc1ccc(C=O)cc1 Amb25294197 [1,0,0,0,0,0|2,0,0]=3 521 B10R1.3 NNc1ccc(cc1)OC Amb1043744 [1,0,0,0,0,0|2,0,0]=3 522 B10R1.3 NNc1ccc(cc1)OC Amb1152338 [1,0,0,0,0,0|2,0,0]=3 523 B10R1.3 NNc1ccc(cc1)OC Amb2236559 [1,0,0,0,0,0|2,0,0]=3 524 B10R1.3 NOc1ccc(cc1)C#N Amb18642948 [1,0,0,0,0,0|2,0,1]=4 525 B10R1.3 O=Cc1ccc(C=O)cc1 Amb17748028 [1,0,0,0,0,0|2,0,0]=3 526 B10R1.3 O=Cc1ccc(CCl)[n]c1 Amb25709610 [1,0,0,0,0,0|3,0,0]=4 527 B10R1.3 O=Cc1ccc(CCl)c[n]1 Amb22739837 [1,0,0,0,0,0|3,0,0]=4 528 B10R1.3 O=Cc1ccc(CCl)cc1 Amb18644700 [1,0,0,0,0,0|2,0,0]=3 529 B10R1.3 O=Cc1ccc(CF)[n]c1 Amb25359887 [1,0,0,0,0,0|3,0,0]=4 530 B10R1.3 O=Cc1ccc(CF)c[n]1 Amb25806530 [1,0,0,0,0,0|3,0,0]=4 531 B10R1.3 O=Cc1ccc(CF)cc1 Amb20671087 [1,0,0,0,0,0|2,0,0]=3 532 B10R1.3 O=Cc1ccc(CI)cc1 Amb22753057 [1,0,0,0,0,0|2,0,0]=3 533 B10R1.3 O=Cc1ccc(CS)cc1 Amb24554507 [1,0,0,0,0,0|2,0,0]=3 534 B10R1.3 O=Cc1ccc(cc1)N=O Amb17593426 [1,0,0,0,0,0|2,0,0]=3 535 B10R1.3 O=Cc1ccc(nc1)OC Amb2447452 [1,0,0,0,0,0|1,0,0]=2 536 B10R1.3 O=Nc1ccc(cc1)N=O Amb10552552 [1,0,0,0,0,0|3,0,0]=4 537 B10R1.3 OCc1ccc(C=O)cc1 Amb18643060 [1,0,0,0,0,0|2,0,0]=3 538 B10R1.3 OCc1ccc(cc1)NC Amb17593483 [1,0,0,0,0,0|1,0,2]=4 539 B10R1.3 ONc1ccc(cc1)N=O Amb24576747 [1,0,0,0,0,0|3,0,0]=4 540 B10R1.3 O[13CH2]c1ccc(cc1)OC Amb17616919 [1,0,0,0,0,0|0,0,2]=3 541 B10R1.3 [C-]#[N+]c1ccc(C=O)cc1 Amb20246727 [1,0,0,0,0,0|1,0,1]=3 542 B10R1.13 BrC(c1ccc(cc1)C)Br Amb16234185 [1,0,0,0,0,0|2,0,1]=4 543 B10R1.13 Brc1ccc(cc1)P(=O)O Amb10571105 [1,0,0,0,0,0|3,0,0]=4 544 B10R1.13 Brc1ccc(cc1)[N+](=O)[O-] Amb1929309 [1,0,0,0,0,0|3,0,0]=4 545 B10R1.13 Brc1ccc(cn1)C(=O)N Amb10070703 [1,0,0,0,0,0|3,0,0]=4 546 B10R1.13 Brc1ccc(nc1)C(=O)C Amb10601919 [1,0,0,0,0,0|2,0,0]=3 547 B10R1.13 Brc1ccc(nc1)C(=O)Cl Amb10068998 [1,0,0,0,0,0|3,0,0]=4 548 B10R1.13 Brc1ccc(nc1)C(=O)O Amb2447466 [1,0,0,0,0,0|3,0,0]=4 549 B10R1.13 C=C(Br)c1ccc(Cl)cc1 Amb22336832 [1,0,0,0,0,0|2,0,1]=4 550 B10R1.13 C=C(F)c1ccc(Br)cc1 Amb25169370 [1,0,0,0,0,0|2,0,1]=4 551 B10R1.13 C=C(F)c1ccc(Cl)cc1 Amb22008097 [1,0,0,0,0,0|2,0,1]=4 552 B10R1.13 C=C(F)c1ccc(F)cc1 Amb24053856 [1,0,0,0,0,0|2,0,1]=4 553 B10R1.13 C=C1CC=C(C=C1)C(N)=O Amb25336291 [1,0,0,0,0,0|1,0,2]=4 554 B10R1.13 CC(=C)c1ccc(Br)c[n]1 Amb20617316 [1,0,0,0,0,0|3,0,0]=4 555 B10R1.13 CC(=C)c1ccc(Cl)[n]c1 Amb20620746 [1,0,0,0,0,0|3,0,0]=4 556 B10R1.13 CC(=C)c1ccc(F)[n]c1 Amb24655160 [1,0,0,0,0,0|3,0,0]=4 557 B10R1.13 CC(=C)c1ccc(N)[n]c1 Amb25077205 [1,0,0,0,0,0|3,0,0]=4 558 B10R1.13 CC(=C)c1ccc(N)c[n]1 Amb20617317 [1,0,0,0,0,0|3,0,0]=4 559 B10R1.13 CC(=C)c1ccc(cc1)N Amb17107085 [1,0,0,0,0,0|2,0,0]=3 560 B10R1.13 CC(=C)c1ccc(cc1)O Amb13883631 [1,0,0,0,0,0|1,0,0]=2 561 B10R1.13 CC(=N)c1ccc(cc1)O Amb10576568 [1,0,0,0,0,0|1,0,0]=2 562 B10R1.13 CC(=O)C1=CNC(=O)N=C1 Amb24591740 [1,0,0,0,0,0|2,0,1]=4 563 B10R1.13 CC(=O)C=1C=CC(=C)CC1 Amb24758694 [1,0,0,0,0,0|0,0,2]=3 564 B10R1.13 CC(=O)C=1C=CC(=O)NC1 Amb22744839 [1,0,0,0,0,0|1,0,1]=3 565 B10R1.13 CC(=O)C=1C=CC(=O)NN1 Amb18212060 [1,0,0,0,0,0|2,0,1]=4 566 B10R1.13 CC(=O)N1C=CC(=O)C=C1 Amb25320190 [1,0,0,0,0,0|1,0,1]=3 567 B10R1.13 CC(=O)N1C=CC(=S)C=C1 Amb24062617 [1,0,0,0,0,0|1,1,0]=3 568 B10R1.13 CC(=O)[n+]1ccc(N)cc1 Amb24661347 [1,0,0,0,0,0|2,0,0]=3 569 B10R1.13 CC(=O)c1[n]cc(Br)c[n]1 Amb22235694 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.13 CC(=O)c1[n]cc(Cl)c[n]1 Amb25716753 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.13 CC(=O)c1[n]cc(F)c[n]1 Amb19958828 [1,0,0,0,0,0|3,0,0]=4 572 B10R1.13 CC(=O)c1[n]cc(O)c[n]1 Amb24643950 [1,0,0,0,0,0|2,0,0]=3 573 B10R1.13 CC(=O)c1c[n]c(Br)[n]c1 Amb25063412 [1,0,0,0,0,0|3,0,0]=4 574 B10R1.13 CC(=O)c1c[n]c(Br)c[n]1 Amb24321495 [1,0,0,0,0,0|3,0,0]=4 575 B10R1.13 CC(=O)c1c[n]c(Cl)[n]c1 Amb22277123 [1,0,0,0,0,0|3,0,0]=4 576 B10R1.13 CC(=O)c1c[n]c(N)[n]c1 Amb22494266 [1,0,0,0,0,0|3,0,0]=4 577 B10R1.13 CC(=O)c1c[n]c(O)c[n]1 Amb22276069 [1,0,0,0,0,0|2,0,0]=3 578 B10R1.13 CC(=O)c1c[n]c(O)cc1 Amb22490878 [1,0,0,0,0,0|1,0,0]=2 579 B10R1.13 CC(=O)c1cc[n+](C)cc1 Amb22481987 [1,0,0,0,0,0|1,0,0]=2 580 B10R1.13 CC(=O)c1cc[n+](cc1)[O-] Amb10552750 [1,0,0,0,0,0|1,0,1]=3 581 B10R1.13 CC(=O)c1ccc(Cl)[n][n]1 Amb20241427 [1,0,0,0,0,0|3,0,0]=4 582 B10R1.13 CC(=O)c1ccc(F)c[n]1 Amb21864749 [1,0,0,0,0,0|2,0,0]=3 583 B10R1.13 CC(=O)c1ccc(I)[n][n]1 Amb23585437 [1,0,0,0,0,0|3,0,0]=4 584 B10R1.13 CC(=O)c1ccc(I)[n]c1 Amb25217952 [1,0,0,0,0,0|2,0,0]=3 585 B10R1.13 CC(=O)c1ccc(N)[n][n]1 Amb23585449 [1,0,0,0,0,0|3,0,0]=4 586 B10R1.13 CC(=O)c1ccc(N)c[n]1 Amb20247966 [1,0,0,0,0,0|2,0,0]=3 587 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [1,0,0,0,0,0|1,0,0]=2 588 B10R1.13 CC(=O)c1ccc(O)[n]c1 Amb19958095 [1,0,0,0,0,0|1,0,0]=2 589 B10R1.13 CC(=O)c1ccc(S)[n]c1 Amb24505216 [1,0,0,0,0,0|1,1,0]=3 590 B10R1.13 CC(=O)c1ccc(cc1)Br Amb1221363 [1,0,0,0,0,0|1,0,0]=2 591 B10R1.13 CC(=O)c1ccc(cc1)I Amb1233200 [1,0,0,0,0,0|1,0,0]=2 592 B10R1.13 CC(=O)c1ccc(cc1)O Amb1212250 [1,0,0,0,0,0|0,0,0]=1 593 B10R1.13 CC(=O)c1ccc(cc1)S Amb17593795 [1,0,0,0,0,0|0,1,0]=2 594 B10R1.13 CC(=O)c1cnc(cn1)Cl Amb16232378 [1,0,0,0,0,0|3,0,0]=4 595 B10R1.13 CC(=S)c1ccc(Cl)[n]c1 Amb21961335 [1,0,0,0,0,0|2,1,0]=4 596 B10R1.13 CC(Br)c1ccc(O)cc1 Amb24759115 [1,0,0,0,0,0|1,0,1]=3 597 B10R1.13 CC(C)=C1C=CC(=O)C=C1 Amb24690878 [1,0,0,0,0,0|1,0,1]=3 598 B10R1.13 CC(C)c1ccc(Cl)cc1 Amb22059617 [1,0,0,0,0,0|2,0,1]=4 599 B10R1.13 CC(Cl)c1ccc(I)cc1 Amb24479297 [1,0,0,0,0,0|2,0,1]=4 600 B10R1.13 CC(F)c1ccc(Br)cc1 Amb22896470 [1,0,0,0,0,0|2,0,1]=4 601 B10R1.13 CC(F)c1ccc(F)cc1 Amb22008083 [1,0,0,0,0,0|2,0,1]=4 602 B10R1.13 CC(F)c1ccc(O)cc1 Amb25084251 [1,0,0,0,0,0|1,0,1]=3 603 B10R1.13 CC(N)c1ccc(F)cc1 Amb19373284 [1,0,0,0,0,0|2,0,1]=4 604 B10R1.13 CC(N)c1ccc(O)[n]c1 Amb23446713 [1,0,0,0,0,0|2,0,1]=4 605 B10R1.13 CC(N)c1ccc(O)c[n]1 Amb25097193 [1,0,0,0,0,0|2,0,1]=4 606 B10R1.13 CC(N)c1ccc(O)cc1 Amb19888161 [1,0,0,0,0,0|1,0,1]=3 607 B10R1.13 CC(N)c1ccc(S)cc1 Amb25233878 [1,0,0,0,0,0|1,1,1]=4 608 B10R1.13 CC(O)=C1C=CC(=O)C=C1 Amb24480664 [1,0,0,0,0,0|0,0,2]=3 609 B10R1.13 CC(O)[n+]1ccc(C)cc1 Amb25206607 [1,0,0,0,0,0|1,0,2]=4 610 B10R1.13 CC(O)c1ccc(O)[n]c1 Amb23446710 [1,0,0,0,0,0|1,0,2]=4 611 B10R1.13 CC(S)c1ccc(I)cc1 Amb24480962 [1,0,0,0,0,0|1,1,1]=4 612 B10R1.13 CC(S)c1ccc(N)cc1 Amb25764450 [1,0,0,0,0,0|1,1,1]=4 613 B10R1.13 CC(c1ccc(cc1)Br)N Amb1211897 [1,0,0,0,0,0|2,0,1]=4 614 B10R1.13 CC(c1ccc(cc1)Br)N Amb2137046 [1,0,0,0,0,0|2,0,1]=4 615 B10R1.13 CC(c1ccc(cc1)Cl)N Amb10782077 [1,0,0,0,0,0|2,0,1]=4 616 B10R1.13 CC(c1ccc(cc1)F)N Amb2568493 [1,0,0,0,0,0|2,0,1]=4 617 B10R1.13 CC(c1ccc(cc1)F)O Amb1211893 [1,0,0,0,0,0|1,0,2]=4 618 B10R1.13 CC(c1ccc(cc1)I)O Amb1110523 [1,0,0,0,0,0|1,0,2]=4 619 B10R1.13 CC(c1ccc(cc1)N)C Amb1239129 [1,0,0,0,0,0|2,0,1]=4 620 B10R1.13 CC(c1ccc(cc1)O)C Amb1211898 [1,0,0,0,0,0|1,0,1]=3 621 B10R1.13 CC(c1ccc(cc1)S)O Amb17593857 [1,0,0,0,0,0|0,1,2]=4 622 B10R1.13 CC1=CC=C(CS1)C(C)=O Amb25694329 [1,0,0,0,0,0|1,0,1]=3 623 B10R1.13 CC1=CCC(=CN1)C(N)=O Amb24062355 [1,0,0,0,0,0|2,0,1]=4 624 B10R1.13 CC1C=CC(C=C1)C(O)=O Amb22364714 [1,0,0,0,0,0|1,0,2]=4 625 B10R1.13 CN(C)c1ccc(I)cc1 Amb17940199 [1,0,0,0,0,0|3,0,0]=4 626 B10R1.13 CN(C)c1ccc(N)cc1 Amb22167797 [1,0,0,0,0,0|3,0,0]=4 627 B10R1.13 CN(C)c1ccc(N)cc1 Amb22388752 [1,0,0,0,0,0|3,0,0]=4 628 B10R1.13 CN(C)c1ccc(N)cc1 Amb22732453 [1,0,0,0,0,0|3,0,0]=4 629 B10R1.13 CN(C)c1ccc(O)cc1 Amb21864855 [1,0,0,0,0,0|2,0,0]=3 630 B10R1.13 CN(c1ccc(cc1)Br)N Amb17237219 [1,0,0,0,0,0|3,0,0]=4 631 B10R1.13 CN(c1ccc(cc1)Cl)N Amb16202770 [1,0,0,0,0,0|3,0,0]=4 632 B10R1.13 CN(c1ccc(cc1)Cl)N Amb17232198 [1,0,0,0,0,0|3,0,0]=4 633 B10R1.13 CN(c1ccc(cc1)F)N Amb17231916 [1,0,0,0,0,0|3,0,0]=4 634 B10R1.13 CN(c1ccc(cc1)N)C Amb1153912 [1,0,0,0,0,0|3,0,0]=4 635 B10R1.13 CN1C=CC(C=C1)C(N)=O Amb25100929 [1,0,0,0,0,0|2,0,1]=4 636 B10R1.13 CN1CC=C(C=C1)C(O)=O Amb24622513 [1,0,0,0,0,0|2,0,1]=4 637 B10R1.13 CS(=O)C=1C=CC(=O)NC1 Amb25248845 [1,0,0,0,0,0|2,0,1]=4 638 B10R1.13 CS(=O)c1ccc(Br)[n]c1 Amb22899805 [1,0,0,0,0,0|3,0,0]=4 639 B10R1.13 CS(=O)c1ccc(Cl)cc1 Amb19892199 [1,0,0,0,0,0|2,0,0]=3 640 B10R1.13 CS(=O)c1ccc(F)cc1 Amb19892152 [1,0,0,0,0,0|2,0,0]=3 641 B10R1.13 CS(=O)c1ccc(N)c[n]1 Amb24529303 [1,0,0,0,0,0|3,0,0]=4 642 B10R1.13 CS(=O)c1ccc(N)cc1 Amb18945202 [1,0,0,0,0,0|2,0,0]=3 643 B10R1.13 CS(=O)c1ccc(O)cc1 Amb17873067 [1,0,0,0,0,0|1,0,0]=2 644 B10R1.13 C[13C](=O)c1ccc(cc1)N Amb17607866 [1,0,0,0,0,0|1,0,0]=2 645 B10R1.13 C[As](C)c1ccc(Br)cc1 Amb22347193 [1,0,0,0,0,0|3,0,0]=4 646 B10R1.13 C[As](C)c1ccc(O)cc1 Amb22347181 [1,0,0,0,0,0|2,0,0]=3 647 B10R1.13 C[C@@H](N)c1ccc(Cl)cc1 Amb22288609 [1,0,0,0,0,0|2,0,1]=4 648 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22406362 [1,0,0,0,0,0|2,0,1]=4 649 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22504246 [1,0,0,0,0,0|2,0,1]=4 650 B10R1.13 C[C@@H](N)c1ccc(O)c[n]1 Amb25062520 [1,0,0,0,0,0|2,0,1]=4 651 B10R1.13 C[C@@H](O)c1ccc(Cl)cc1 Amb20241103 [1,0,0,0,0,0|1,0,2]=4 652 B10R1.13 C[C@@H](O)c1ccc(N)cc1 Amb25228343 [1,0,0,0,0,0|1,0,2]=4 653 B10R1.13 C[C@@H](O)c1ccc(O)cc1 Amb25273162 [1,0,0,0,0,0|0,0,2]=3 654 B10R1.13 C[C@@H](c1ccc(cc1)F)N Amb10838303 [1,0,0,0,0,0|2,0,1]=4 655 B10R1.13 C[C@@H](c1ccc(cc1)F)O Amb16185872 [1,0,0,0,0,0|1,0,2]=4 656 B10R1.13 C[C@H](F)c1ccc(Br)cc1 Amb22008088 [1,0,0,0,0,0|2,0,1]=4 657 B10R1.13 C[C@H](N)c1ccc(Br)cc1 Amb22274557 [1,0,0,0,0,0|2,0,1]=4 658 B10R1.13 C[C@H](N)c1ccc(Cl)cc1 Amb22288669 [1,0,0,0,0,0|2,0,1]=4 659 B10R1.13 C[C@H](N)c1ccc(F)cc1 Amb22406364 [1,0,0,0,0,0|2,0,1]=4 660 B10R1.13 C[C@H](N)c1ccc(N)cc1 Amb24106647 [1,0,0,0,0,0|2,0,1]=4 661 B10R1.13 C[C@H](N)c1ccc(O)[n]c1 Amb24562815 [1,0,0,0,0,0|2,0,1]=4 662 B10R1.13 C[C@H](N)c1ccc(O)c[n]1 Amb24700259 [1,0,0,0,0,0|2,0,1]=4 663 B10R1.13 C[C@H](O)c1ccc(Cl)cc1 Amb20241104 [1,0,0,0,0,0|1,0,2]=4 664 B10R1.13 C[C@H](O)c1ccc(N)cc1 Amb24384238 [1,0,0,0,0,0|1,0,2]=4 665 B10R1.13 C[C@H](O)c1ccc(O)cc1 Amb24644699 [1,0,0,0,0,0|0,0,2]=3 666 B10R1.13 C[C@H](O)c1ccc(S)cc1 Amb25823717 [1,0,0,0,0,0|0,1,2]=4 667 B10R1.13 C[C@H](c1ccc(cc1)F)N Amb10839828 [1,0,0,0,0,0|2,0,1]=4 668 B10R1.13 C[C@H](c1ccc(cc1)F)N Amb16233880 [1,0,0,0,0,0|2,0,1]=4 669 B10R1.13 C[C@H](c1ccc(cc1)I)N Amb15690597 [1,0,0,0,0,0|2,0,1]=4 670 B10R1.13 C[N+](C)=C1C=CC(=O)C=C1 Amb25730270 [1,0,0,0,0,0|2,0,1]=4 671 B10R1.13 C[NH+](C)c1ccc(N)cc1 Amb25289220 [1,0,0,0,0,0|3,0,0]=4 672 B10R1.13 C[NH+](C)c1ccc([NH3+])cc1 Amb20246441 [1,0,0,0,0,0|3,0,0]=4 673 B10R1.13 C[S+](C)c1ccc(O)cc1 Amb24066115 [1,0,0,0,0,0|2,0,0]=3 674 B10R1.13 C[S+](C)c1ccc(O)cc1 Amb25093771 [1,0,0,0,0,0|2,0,0]=3 675 B10R1.13 C[SiH](C)c1ccc(O)cc1 Amb24676783 [1,0,0,0,0,0|1,1,0]=3 676 B10R1.13 C[n+]1ccc(cc1)C(C)C Amb10573358 [1,0,0,0,0,0|2,0,1]=4 677 B10R1.13 C[n+]1ccc(cc1)C(N)=S Amb22472413 [1,0,0,0,0,0|2,1,0]=4 678 B10R1.13 C[n+]1ccc(cc1)N(C)C Amb10553078 [1,0,0,0,0,0|3,0,0]=4 679 B10R1.13 Cc1[n][n]c(c[n]1)C(C)=O Amb18832374 [1,0,0,0,0,0|3,0,0]=4 680 B10R1.13 Cc1[n]cc(c[n]1)C(=O)Cl Amb24743634 [1,0,0,0,0,0|3,0,0]=4 681 B10R1.13 Cc1[n]cc(c[n]1)C(C)=O Amb18832462 [1,0,0,0,0,0|2,0,0]=3 682 B10R1.13 Cc1[n]cc(c[n]1)C(O)=O Amb22492357 [1,0,0,0,0,0|3,0,0]=4 683 B10R1.13 Cc1c[n]c([n]c1)C(C)=O Amb22735972 [1,0,0,0,0,0|2,0,0]=3 684 B10R1.13 Cc1c[n]c([n]c1)C(N)=O Amb25724440 [1,0,0,0,0,0|3,0,0]=4 685 B10R1.13 Cc1c[n]c(c[n]1)C(=O)Cl Amb20673371 [1,0,0,0,0,0|3,0,0]=4 686 B10R1.13 Cc1c[n]c(c[n]1)C(C)=O Amb22755693 [1,0,0,0,0,0|2,0,0]=3 687 B10R1.13 Cc1ccc([n][n]1)C(C)=O Amb25060161 [1,0,0,0,0,0|2,0,0]=3 688 B10R1.13 Cc1ccc([n][n]1)C(N)=O Amb22501095 [1,0,0,0,0,0|3,0,0]=4 689 B10R1.13 Cc1ccc([n]c1)C(C)=C Amb24084447 [1,0,0,0,0,0|2,0,0]=3 690 B10R1.13 Cc1ccc([n]c1)C(C)=O Amb22587200 [1,0,0,0,0,0|1,0,0]=2 691 B10R1.13 Cc1ccc([n]c1)C(C)Cl Amb22753450 [1,0,0,0,0,0|2,0,1]=4 692 B10R1.13 Cc1ccc([n]c1)C(C)N Amb22756401 [1,0,0,0,0,0|2,0,1]=4 693 B10R1.13 Cc1ccc([n]c1)C(N)=N Amb22235876 [1,0,0,0,0,0|3,0,0]=4 694 B10R1.13 Cc1ccc([n]c1)C(N)=N Amb25139175 [1,0,0,0,0,0|3,0,0]=4 695 B10R1.13 Cc1ccc([n]c1)C(N)=O Amb25288938 [1,0,0,0,0,0|2,0,0]=3 696 B10R1.13 Cc1ccc([n]c1)C(O)=O Amb21962879 [1,0,0,0,0,0|2,0,0]=3 697 B10R1.13 Cc1ccc([n]c1)C(O)=O Amb22276156 [1,0,0,0,0,0|2,0,0]=3 698 B10R1.13 Cc1ccc([n]c1)N(=O)=O Amb20621853 [1,0,0,0,0,0|3,0,0]=4 699 B10R1.13 Cc1ccc([n]c1)S(C)=O Amb25837594 [1,0,0,0,0,0|2,0,0]=3 700 B10R1.13 Cc1ccc([n]c1)[C@@H](C)N Amb25146463 [1,0,0,0,0,0|2,0,1]=4 701 B10R1.13 Cc1ccc([n]c1)[C@@H](C)O Amb24549031 [1,0,0,0,0,0|1,0,2]=4 702 B10R1.13 Cc1ccc(c[n]1)C(=C)Br Amb24579300 [1,0,0,0,0,0|2,0,1]=4 703 B10R1.13 Cc1ccc(c[n]1)C(C)C Amb25268487 [1,0,0,0,0,0|2,0,1]=4 704 B10R1.13 Cc1ccc(c[n]1)C(N)=N Amb17933172 [1,0,0,0,0,0|3,0,0]=4 705 B10R1.13 Cc1ccc(c[n]1)C(N)=N Amb19958286 [1,0,0,0,0,0|3,0,0]=4 706 B10R1.13 Cc1ccc(c[n]1)N(=O)=O Amb20621690 [1,0,0,0,0,0|3,0,0]=4 707 B10R1.13 Cc1ccc(cc1)B(C)O Amb25120944 [1,0,0,0,0,0|1,0,1]=3 708 B10R1.13 Cc1ccc(cc1)B(O)O Amb22044308 [1,0,0,0,0,0|2,0,1]=4 709 B10R1.13 Cc1ccc(cc1)C(=C)F Amb25354650 [1,0,0,0,0,0|1,0,1]=3 710 B10R1.13 Cc1ccc(cc1)C(=O)C Amb2447132 [1,0,0,0,0,0|0,0,0]=1 711 B10R1.13 Cc1ccc(cc1)C(=S)C Amb10602373 [1,0,0,0,0,0|0,1,0]=2 712 B10R1.13 Cc1ccc(cc1)C(C)C Amb19929657 [1,0,0,0,0,0|1,0,1]=3 713 B10R1.13 Cc1ccc(cc1)C(C)F Amb25292877 [1,0,0,0,0,0|1,0,1]=3 714 B10R1.13 Cc1ccc(cc1)C(N)=S Amb22047967 [1,0,0,0,0,0|1,1,0]=3 715 B10R1.13 Cc1ccc(cc1)C(N)C Amb1108137 [1,0,0,0,0,0|1,0,1]=3 716 B10R1.13 Cc1ccc(cc1)C(O)=S Amb22262973 [1,0,0,0,0,0|1,0,1]=3 717 B10R1.13 Cc1ccc(cc1)C([O-])=O Amb21962678 [1,0,0,0,0,0|1,0,0]=2 718 B10R1.13 Cc1ccc(cc1)N(N)C Amb17231897 [1,0,0,0,0,0|2,0,0]=3 719 B10R1.13 Cc1ccc(cc1)P(=O)O Amb10571101 [1,0,0,0,0,0|2,0,0]=3 720 B10R1.13 Cc1ccc(cc1)P(Cl)Cl Amb24702481 [1,0,0,0,0,0|3,0,0]=4 721 B10R1.13 Cc1ccc(cc1)S(=O)O Amb10601729 [1,0,0,0,0,0|2,0,0]=3 722 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb10790480 [1,0,0,0,0,0|2,0,0]=3 723 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb16185755 [1,0,0,0,0,0|2,0,0]=3 724 B10R1.13 Cc1ccc(cc1)S(Cl)=O Amb17939004 [1,0,0,0,0,0|2,0,0]=3 725 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22436806 [1,0,0,0,0,0|2,0,0]=3 726 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22730230 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22360764 [1,0,0,0,0,0|2,0,0]=3 728 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22411411 [1,0,0,0,0,0|2,0,0]=3 729 B10R1.13 Cc1ccc(cc1)[C@@H](C)N Amb20242449 [1,0,0,0,0,0|1,0,1]=3 730 B10R1.13 Cc1ccc(cc1)[C@@H](C)N Amb22288639 [1,0,0,0,0,0|1,0,1]=3 731 B10R1.13 Cc1ccc(cc1)[C@@H](C)O Amb25859279 [1,0,0,0,0,0|0,0,2]=3 732 B10R1.13 Cc1ccc(cc1)[C@H](C)N Amb22288674 [1,0,0,0,0,0|1,0,1]=3 733 B10R1.13 Cc1ccc(cc1)[C@H](C)O Amb20241494 [1,0,0,0,0,0|0,0,2]=3 734 B10R1.13 Cc1ccc(cc1)[C@H](O)Cl Amb25065327 [1,0,0,0,0,0|1,0,2]=4 735 B10R1.13 Cc1ccc(cc1)[S@](=O)N Amb16233804 [1,0,0,0,0,0|2,0,0]=3 736 B10R1.13 Cc1ccc(cc1)[S@](C)=O Amb22226741 [1,0,0,0,0,0|1,0,0]=2 737 B10R1.13 Cc1ccc(cc1)[S@](N)=O Amb19889838 [1,0,0,0,0,0|2,0,0]=3 738 B10R1.13 Cc1ccc(cn1)C(=O)O Amb2371808 [1,0,0,0,0,0|2,0,0]=3 739 B10R1.13 Cc1ccc(cn1)C(=O)[O-] Amb10070842 [1,0,0,0,0,0|2,0,0]=3 740 B10R1.13 Cc1ccc(nc1)C(=O)C Amb10608263 [1,0,0,0,0,0|1,0,0]=2 741 B10R1.13 Cc1ccc(nc1)C(=S)N Amb16231245 [1,0,0,0,0,0|2,1,0]=4 742 B10R1.13 Cc1ccc(nc1)C(N)C Amb10608253 [1,0,0,0,0,0|2,0,1]=4 743 B10R1.13 Cc1ccc(nn1)C(O)=O Amb17798483 [1,0,0,0,0,0|3,0,0]=4 744 B10R1.13 ClC(=C)c1ccc(cc1)F Amb17610890 [1,0,0,0,0,0|2,0,1]=4 745 B10R1.13 Clc1ccc(cc1)S(=O)[O-] Amb10790466 [1,0,0,0,0,0|3,0,0]=4 746 B10R1.13 Clc1ccc(cc1)[I](=O)=O Amb10553247 [1,0,0,0,0,0|3,0,0]=4 747 B10R1.13 Clc1ccc(nc1)C(=O)C Amb16191910 [1,0,0,0,0,0|2,0,0]=3 748 B10R1.13 F[I](c1ccc(cc1)C)F Amb10605586 [1,0,0,0,0,0|3,0,0]=4 749 B10R1.13 Fc1ccc(cc1)C(I)=O Amb17942820 [1,0,0,0,0,0|2,0,0]=3 750 B10R1.13 Fc1ccc(cc1)S(=O)Cl Amb13881361 [1,0,0,0,0,0|3,0,0]=4 751 B10R1.13 Fc1ccc(cn1)C(=O)C Amb10603339 [1,0,0,0,0,0|2,0,0]=3 752 B10R1.13 Fc1ccc(cn1)C(=O)Cl Amb2447511 [1,0,0,0,0,0|3,0,0]=4 753 B10R1.13 Fc1ccc(cn1)C(=O)O Amb2447507 [1,0,0,0,0,0|3,0,0]=4 754 B10R1.13 Ic1ccc(cc1)[N+](=O)[O-] Amb1151924 [1,0,0,0,0,0|3,0,0]=4 755 B10R1.13 Ic1ccc(nc1)C(=O)O Amb10602946 [1,0,0,0,0,0|3,0,0]=4 756 B10R1.13 N=C(/N)\c1ccc(N)cc1 Amb20665523 [1,0,0,0,0,0|3,0,0]=4 757 B10R1.13 NC(=N)c1ccc(Cl)cc1 Amb22489466 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.13 NC(=N)c1ccc(I)cc1 Amb22463737 [1,0,0,0,0,0|3,0,0]=4 759 B10R1.13 NC(=N)c1ccc(cc1)Cl Amb1145037 [1,0,0,0,0,0|3,0,0]=4 760 B10R1.13 NC(=O)C=1C=CC(=O)NC1 Amb19419628 [1,0,0,0,0,0|2,0,1]=4 761 B10R1.13 NC(=O)C=1C=CC(=O)OC1 Amb25147558 [1,0,0,0,0,0|2,0,1]=4 762 B10R1.13 NC(=O)c1c[n]c(O)c[n]1 Amb24652042 [1,0,0,0,0,0|3,0,0]=4 763 B10R1.13 NC(=O)c1cc[n+](cc1)[O-] Amb10573737 [1,0,0,0,0,0|2,0,1]=4 764 B10R1.13 NC(=O)c1ccc(Cl)c[n]1 Amb22500440 [1,0,0,0,0,0|3,0,0]=4 765 B10R1.13 NC(=O)c1ccc(Cl)c[n]1 Amb22899146 [1,0,0,0,0,0|3,0,0]=4 766 B10R1.13 NC(=O)c1ccc(F)c[n]1 Amb22001839 [1,0,0,0,0,0|3,0,0]=4 767 B10R1.13 NC(=O)c1ccc(I)c[n]1 Amb24482132 [1,0,0,0,0,0|3,0,0]=4 768 B10R1.13 NC(=O)c1ccc(O)[n][n]1 Amb22497224 [1,0,0,0,0,0|3,0,0]=4 769 B10R1.13 NC(=O)c1ccc(S)[n]c1 Amb24081719 [1,0,0,0,0,0|2,1,0]=4 770 B10R1.13 NC(=O)c1ccc(cc1)Br Amb1232839 [1,0,0,0,0,0|2,0,0]=3 771 B10R1.13 NC(=O)c1ccc(cc1)F Amb1230540 [1,0,0,0,0,0|2,0,0]=3 772 B10R1.13 NC(=O)c1ccc(cc1)I Amb2227687 [1,0,0,0,0,0|2,0,0]=3 773 B10R1.13 NC(=O)c1ccc(cc1)O Amb1240570 [1,0,0,0,0,0|1,0,0]=2 774 B10R1.13 NC(=O)c1ccc(cc1)O Amb13951374 [1,0,0,0,0,0|1,0,0]=2 775 B10R1.13 NC(=S)c1ccc(I)cc1 Amb18617991 [1,0,0,0,0,0|2,1,0]=4 776 B10R1.13 NC(=S)c1ccc(O)c[n]1 Amb24715171 [1,0,0,0,0,0|2,1,0]=4 777 B10R1.13 NC(=S)c1ccc(cc1)Br Amb1152460 [1,0,0,0,0,0|2,1,0]=4 778 B10R1.13 NC(=S)c1ccc(cc1)F Amb1152550 [1,0,0,0,0,0|2,1,0]=4 779 B10R1.13 NC(=S)c1ccc(cc1)O Amb1154194 [1,0,0,0,0,0|1,1,0]=3 780 B10R1.13 NC(N)=C1C=CC(=N)C=C1 Amb24409784 [1,0,0,0,0,0|3,0,0]=4 781 B10R1.13 NC(N)=C1C=CC(=O)C=C1 Amb25278698 [1,0,0,0,0,0|2,0,1]=4 782 B10R1.13 Nc1ccc(c[n]1)C(=O)Cl Amb24071897 [1,0,0,0,0,0|3,0,0]=4 783 B10R1.13 Nc1ccc(c[n]1)C(O)=O Amb24062482 [1,0,0,0,0,0|3,0,0]=4 784 B10R1.13 Nc1ccc(cc1)C(=N)N Amb16224864 [1,0,0,0,0,0|3,0,0]=4 785 B10R1.13 Nc1ccc(cc1)C(=O)F Amb24548959 [1,0,0,0,0,0|2,0,0]=3 786 B10R1.13 Nc1ccc(cc1)C(N)C Amb10070180 [1,0,0,0,0,0|2,0,1]=4 787 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22349631 [1,0,0,0,0,0|2,0,0]=3 788 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22363131 [1,0,0,0,0,0|2,0,0]=3 789 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24066899 [1,0,0,0,0,0|2,0,0]=3 790 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24091246 [1,0,0,0,0,0|2,0,0]=3 791 B10R1.13 Nc1ccc(cc1)P(O)=O Amb24482412 [1,0,0,0,0,0|3,0,0]=4 792 B10R1.13 Nc1ccc(cc1)S(=O)=O Amb25065185 [1,0,0,0,0,0|3,0,0]=4 793 B10R1.13 Nc1ccc(cc1)S(N)=O Amb24446357 [1,0,0,0,0,0|3,0,0]=4 794 B10R1.13 Nc1ccc(cc1)[C@@H](N)C Amb16233993 [1,0,0,0,0,0|2,0,1]=4 795 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] Amb1935140 [1,0,0,0,0,0|3,0,0]=4 796 B10R1.13 Nc1ccc(cn1)C(=O)C Amb10608783 [1,0,0,0,0,0|2,0,0]=3 797 B10R1.13 Nc1ccc(cn1)C(=O)O Amb1215277 [1,0,0,0,0,0|3,0,0]=4 798 B10R1.13 O=C(Br)c1ccc(Br)cc1 Amb24079095 [1,0,0,0,0,0|2,0,0]=3 799 B10R1.13 O=C(Br)c1ccc(Cl)cc1 Amb25843658 [1,0,0,0,0,0|2,0,0]=3 800 B10R1.13 O=C(Br)c1ccc(F)cc1 Amb24070269 [1,0,0,0,0,0|2,0,0]=3 801 B10R1.13 O=C(Cl)c1ccc(Br)[n]c1 Amb20620534 [1,0,0,0,0,0|3,0,0]=4 802 B10R1.13 O=C(Cl)c1ccc(Cl)[n]c1 Amb22728126 [1,0,0,0,0,0|3,0,0]=4 803 B10R1.13 O=C(Cl)c1ccc(Cl)c[n]1 Amb22002486 [1,0,0,0,0,0|3,0,0]=4 804 B10R1.13 O=C(Cl)c1ccc(F)c[n]1 Amb22388450 [1,0,0,0,0,0|3,0,0]=4 805 B10R1.13 O=C(Cl)c1ccc(I)[n]c1 Amb25351712 [1,0,0,0,0,0|3,0,0]=4 806 B10R1.13 O=C(Cl)c1ccc(S)cc1 Amb24070681 [1,0,0,0,0,0|1,1,0]=3 807 B10R1.13 O=C(Cl)c1ccc([n]c1)[*] Amb22052730 [1,0,0,0,0,0|3,0,0]=4 808 B10R1.13 O=C(Cl)c1ccc(cc1)[*] Amb22045243 [1,0,0,0,0,0|2,0,0]=3 809 B10R1.13 O=C(F)c1ccc(Cl)[n]c1 Amb24091605 [1,0,0,0,0,0|3,0,0]=4 810 B10R1.13 O=C1C=CC(=CN1)C(=O)Cl Amb24082934 [1,0,0,0,0,0|2,0,1]=4 811 B10R1.13 O=C1C=CC(=CO1)C(=O)Cl Amb19895315 [1,0,0,0,0,0|2,0,1]=4 812 B10R1.13 O=N(=O)c1ccc(Cl)cc1 Amb20621796 [1,0,0,0,0,0|3,0,0]=4 813 B10R1.13 O=N(=O)c1ccc(F)cc1 Amb20621319 [1,0,0,0,0,0|3,0,0]=4 814 B10R1.13 O=N(=O)c1ccc(I)cc1 Amb20621832 [1,0,0,0,0,0|3,0,0]=4 815 B10R1.13 O=S(Cl)c1ccc(Br)cc1 Amb18071349 [1,0,0,0,0,0|3,0,0]=4 816 B10R1.13 O=S(Cl)c1ccc(Cl)cc1 Amb18565622 [1,0,0,0,0,0|3,0,0]=4 817 B10R1.13 O=[13C](Cl)c1ccc(Cl)cc1 Amb22367579 [1,0,0,0,0,0|2,0,0]=3 818 B10R1.13 O=[13C](Cl)c1ccc(F)cc1 Amb22351347 [1,0,0,0,0,0|2,0,0]=3 819 B10R1.13 O=[S-](=O)c1ccc(cc1)F Amb13881372 [1,0,0,0,0,0|3,0,0]=4 820 B10R1.13 OB(c1ccc(cc1)C)O Amb2447083 [1,0,0,0,0,0|2,0,1]=4 821 B10R1.13 OC(=O)C=1C=CC(=O)NC1 Amb18028595 [1,0,0,0,0,0|2,0,1]=4 822 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb19723416 [1,0,0,0,0,0|2,0,1]=4 823 B10R1.13 OC(=O)C=1C=CC(=O)OC1 Amb20661802 [1,0,0,0,0,0|2,0,1]=4 824 B10R1.13 OC(=O)C=1C=CC(=S)NC1 Amb18947773 [1,0,0,0,0,0|2,1,0]=4 825 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22336507 [1,0,0,0,0,0|2,0,0]=3 826 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Cl)[13cH][13cH]1 Amb22336969 [1,0,0,0,0,0|2,0,0]=3 827 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)N Amb17607883 [1,0,0,0,0,0|2,0,0]=3 828 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22432829 [1,0,0,0,0,0|2,0,0]=3 829 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22445441 [1,0,0,0,0,0|2,0,0]=3 830 B10R1.13 OC(=O)c1ccc(O)cc1 Amb22338464 [1,0,0,0,0,0|1,0,0]=2 831 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17755179 [1,0,0,0,0,0|3,0,0]=4 832 B10R1.13 OC(=O)c1ccc(O)nn1 Amb17935842 [1,0,0,0,0,0|3,0,0]=4 833 B10R1.13 OC(=O)c1ccc(S)c[n]1 Amb18644721 [1,0,0,0,0,0|2,1,0]=4 834 B10R1.13 OC(=O)c1ccc(cc1)Br Amb1935068 [1,0,0,0,0,0|2,0,0]=3 835 B10R1.13 OC(=O)c1ccc(cc1)S Amb2371749 [1,0,0,0,0,0|1,1,0]=3 836 B10R1.13 OC(=O)c1ccc(cc1)[Hg+] Amb17610950 [1,0,0,0,0,0|2,0,0]=3 837 B10R1.13 OC(=O)c1ncc(cn1)C Amb10602959 [1,0,0,0,0,0|3,0,0]=4 838 B10R1.13 OP(=O)c1ccc(Br)cc1 Amb21963574 [1,0,0,0,0,0|3,0,0]=4 839 B10R1.13 OS(=O)c1ccc(Br)cc1 Amb18570792 [1,0,0,0,0,0|3,0,0]=4 840 B10R1.13 OS(=O)c1ccc(Cl)cc1 Amb18564047 [1,0,0,0,0,0|3,0,0]=4 841 B10R1.13 OS(=O)c1ccc(F)cc1 Amb18065461 [1,0,0,0,0,0|3,0,0]=4 842 B10R1.13 O[13C](=O)c1ccc(Cl)cc1 Amb22367343 [1,0,0,0,0,0|2,0,0]=3 843 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)C(O)=O Amb22367403 [1,0,0,0,0,0|1,0,0]=2 844 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)[13C](O)=O Amb22367323 [1,0,0,0,0,0|1,0,0]=2 845 B10R1.13 Oc1c[n]c([n]c1)C(O)=O Amb18831952 [1,0,0,0,0,0|3,0,0]=4 846 B10R1.13 Oc1c[n]c(c[n]1)C(=O)Cl Amb22499483 [1,0,0,0,0,0|3,0,0]=4 847 B10R1.13 Oc1ccc([n]c1)N(=O)=O Amb20621440 [1,0,0,0,0,0|3,0,0]=4 848 B10R1.13 Oc1ccc([p]c1)C(O)=O Amb25321003 [1,0,0,0,0,0|2,0,0]=3 849 B10R1.13 Oc1ccc(cc1)B(O)O Amb2447026 [1,0,0,0,0,0|2,0,1]=4 850 B10R1.13 Oc1ccc(cc1)C(=O)Br Amb24070379 [1,0,0,0,0,0|1,0,0]=2 851 B10R1.13 Oc1ccc(cc1)C(=O)F Amb25736983 [1,0,0,0,0,0|1,0,0]=2 852 B10R1.13 Oc1ccc(cc1)C(=O)O Amb2569657 [1,0,0,0,0,0|1,0,0]=2 853 B10R1.13 Oc1ccc(cc1)C(F)F Amb20241070 [1,0,0,0,0,0|2,0,1]=4 854 B10R1.13 Oc1ccc(cc1)C(O)=S Amb24476276 [1,0,0,0,0,0|1,0,1]=3 855 B10R1.13 Oc1ccc(cc1)C(O)O Amb24478338 [1,0,0,0,0,0|1,0,2]=4 856 B10R1.13 Oc1ccc(cc1)N(=O)=O Amb20621866 [1,0,0,0,0,0|2,0,0]=3 857 B10R1.13 Oc1ccc(cc1)S(=O)=O Amb25321036 [1,0,0,0,0,0|2,0,0]=3 858 B10R1.13 Oc1ccc(cc1)[13C](O)=O Amb22353368 [1,0,0,0,0,0|1,0,0]=2 859 B10R1.13 Oc1ccc(cc1)[15N+](=O)[O-] Amb17618438 [1,0,0,0,0,0|2,0,0]=3 860 B10R1.13 Oc1ccc(cc1)[N+]([O-])=O Amb17679040 [1,0,0,0,0,0|2,0,0]=3 861 B10R1.13 Oc1ccc(cn1)C(=O)N Amb2371669 [1,0,0,0,0,0|2,0,0]=3 862 B10R1.13 Oc1ccc(cn1)C(=O)O Amb1085852 [1,0,0,0,0,0|2,0,0]=3 863 B10R1.13 Oc1ccc(cn1)C(C)C Amb10600535 [1,0,0,0,0,0|2,0,1]=4 864 B10R1.13 Oc1ccc(cn1)[N+](=O)[O-] Amb1397674 [1,0,0,0,0,0|3,0,0]=4 865 B10R1.13 Oc1ccc(nc1)C(=O)C Amb16231971 [1,0,0,0,0,0|1,0,0]=2 866 B10R1.13 Oc1ccc(nc1)C(=O)O Amb2235994 [1,0,0,0,0,0|2,0,0]=3 867 B10R1.13 Oc1ccc(nc1)C(C)C Amb10600812 [1,0,0,0,0,0|2,0,1]=4 868 B10R1.13 Oc1ccc(nc1)[N+](=O)[O-] Amb10603874 [1,0,0,0,0,0|3,0,0]=4 869 B10R1.13 Oc1ncc(cn1)C(=O)O Amb10067812 [1,0,0,0,0,0|3,0,0]=4 870 B10R1.13 [15NH2]c1ccc(cc1)[15N+]([O-])=O Amb22338600 [1,0,0,0,0,0|3,0,0]=4 871 B10R1.13 [2H]C(=O)c1ccc(O)cc1 Amb22367155 [1,0,0,0,0,0|1,0,0]=2 872 B10R1.13 [2H]c1ccc(cc1)C(O)=O Amb22345875 [1,0,0,0,0,0|2,0,0]=3 873 B10R1.13 [O-]C(=O)c1c[n]c(O)c[n]1 Amb22284358 [1,0,0,0,0,0|3,0,0]=4 874 B10R1.13 [O-]C(=O)c1cc[n+](cc1)N Amb10560830 [1,0,0,0,0,0|3,0,0]=4 875 B10R1.13 [O-]C(=O)c1ccc(Br)c[n]1 Amb21927969 [1,0,0,0,0,0|3,0,0]=4 876 B10R1.13 [O-]C(=O)c1ccc(I)cc1 Amb22347262 [1,0,0,0,0,0|2,0,0]=3 877 B10R1.13 [O-]S(=O)c1ccc(Br)cc1 Amb17871926 [1,0,0,0,0,0|3,0,0]=4 878 B10R1.13 [O-]S(=O)c1ccc(Cl)cc1 Amb22167650 [1,0,0,0,0,0|3,0,0]=4 879 B10R1.13 [O-]S(=O)c1ccc(F)cc1 Amb22899783 [1,0,0,0,0,0|3,0,0]=4 880 B10R1.13 [O-]S(=O)c1ccc(I)cc1 Amb24589703 [1,0,0,0,0,0|3,0,0]=4 881 B10R1.13 [O-][N+](=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22338850 [1,0,0,0,0,0|3,0,0]=4 882 B10R1.13 [O-][N+](=O)c1c[13cH][13c](O)[13cH]c1 Amb22055938 [1,0,0,0,0,0|2,0,0]=3 883 B10R1.13 [O-]c1ccc(cc1)[N+]([O-])=O Amb24308951 [1,0,0,0,0,0|2,0,1]=4 884 B12R1.5 BrCC(=O)c1ccc(cc1)C#N Amb1105831 [0,1,0,0,0,0|2,0,0]=3 885 B12R1.5 BrCC(=O)c1ccc(cc1)SC Amb10072017 [0,1,0,0,0,0|0,1,0]=2 886 B12R1.5 BrCC(c1ccc(cc1)CC)C Amb17247628 [0,1,0,0,0,0|2,0,1]=4 887 B12R1.5 BrCC(c1ccc(cc1)CC)O Amb17206108 [0,1,0,0,0,0|1,0,2]=4 888 B12R1.5 BrCC(c1ccc(cc1)OC)C Amb17248427 [0,1,0,0,0,0|1,0,1]=3 889 B12R1.5 BrCC(c1ccc(cc1)OC)O Amb17206121 [0,1,0,0,0,0|0,0,2]=3 890 B12R1.5 BrCc1ccc(cc1)C(=O)NC Amb17326736 [0,1,0,0,0,0|2,0,0]=3 891 B12R1.5 BrCc1ccc(cc1)C(=O)OC Amb1239098 [0,1,0,0,0,0|2,0,0]=3 892 B12R1.5 C#CC(=O)c1ccc(CCl)cc1 Amb25189409 [0,1,0,0,0,0|2,0,1]=4 893 B12R1.5 C#CC(=O)c1ccc(CN)cc1 Amb24426681 [0,1,0,0,0,0|2,0,1]=4 894 B12R1.5 C#Cc1ccc(cc1)C(=O)CBr Amb20620441 [0,1,0,0,0,0|1,0,1]=3 895 B12R1.5 C#Cc1ccc(cc1)C(=O)O[Na] Amb22411555 [0,1,0,0,0,0|2,0,1]=4 896 B12R1.5 C=C(CO)c1ccc(cc1)C#N Amb25333521 [0,1,0,0,0,0|3,0,0]=4 897 B12R1.5 C=Cc1ccc(cc1)C(=O)NO Amb24096645 [0,1,0,0,0,0|2,0,1]=4 898 B12R1.5 CC(=NN)c1ccc(cc1)OC Amb24080061 [0,1,0,0,0,0|1,0,0]=2 899 B12R1.5 CC(CC)c1ccc(CC)cc1 Amb24096906 [0,1,0,0,0,0|2,0,1]=4 900 B12R1.5 CC(NC)c1ccc(cc1)NC Amb24419927 [0,1,0,0,0,0|2,0,1]=4 901 B12R1.5 CCC(=C)c1ccc(C=O)cc1 Amb24102650 [0,1,0,0,0,0|3,0,0]=4 902 B12R1.5 CCC(=C)c1ccc(cc1)OC Amb25088064 [0,1,0,0,0,0|1,0,0]=2 903 B12R1.5 CCC(=O)c1[n]cc(c[n]1)OC Amb24696881 [0,1,0,0,0,0|2,0,0]=3 904 B12R1.5 CCC(=O)c1c[n]c(cc1)NC Amb23446311 [0,1,0,0,0,0|2,0,0]=3 905 B12R1.5 CCC(=O)c1c[n]c(cc1)OC Amb23446263 [0,1,0,0,0,0|1,0,0]=2 906 B12R1.5 CCC(=O)c1c[n]c(cc1)SC Amb23446294 [0,1,0,0,0,0|1,1,0]=3 907 B12R1.5 CCC(=O)c1ccc(C=C)cc1 Amb25807560 [0,1,0,0,0,0|1,0,1]=3 908 B12R1.5 CCC(=O)c1ccc(CCl)cc1 Amb25124106 [0,1,0,0,0,0|2,0,0]=3 909 B12R1.5 CCC(=O)c1ccc(CO)cc1 Amb24378952 [0,1,0,0,0,0|2,0,0]=3 910 B12R1.5 CCC(=O)c1ccc([n][n]1)OC Amb24593434 [0,1,0,0,0,0|2,0,0]=3 911 B12R1.5 CCC(=O)c1ccc(cc1)C#C Amb25730278 [0,1,0,0,0,0|1,0,1]=3 912 B12R1.5 CCC(=O)c1ccc(cc1)C#N Amb15772349 [0,1,0,0,0,0|2,0,0]=3 913 B12R1.5 CCC(=O)c1ccc(cc1)C=O Amb17334554 [0,1,0,0,0,0|2,0,0]=3 914 B12R1.5 CCC(=O)c1ccc(cc1)CN Amb17101540 [0,1,0,0,0,0|2,0,0]=3 915 B12R1.5 CCC(=O)c1ccc(cc1)NC Amb18563588 [0,1,0,0,0,0|1,0,0]=2 916 B12R1.5 CCC(=O)c1ccc(cc1)NO Amb24738426 [0,1,0,0,0,0|2,0,0]=3 917 B12R1.5 CCC(Br)c1c[n]c(cc1)OC Amb25681373 [0,1,0,0,0,0|2,0,1]=4 918 B12R1.5 CCC(C)c1ccc(cc1)NC Amb18177793 [0,1,0,0,0,0|2,0,1]=4 919 B12R1.5 CCC(C)c1ccc(cc1)OC Amb25707460 [0,1,0,0,0,0|1,0,1]=3 920 B12R1.5 CCC(C)c1ccc(cc1)ON Amb24698716 [0,1,0,0,0,0|2,0,1]=4 921 B12R1.5 CCC(N)c1c[n]c(cc1)OC Amb23446269 [0,1,0,0,0,0|2,0,1]=4 922 B12R1.5 CCC(N)c1ccc(cc1)NC Amb25242913 [0,1,0,0,0,0|2,0,1]=4 923 B12R1.5 CCC(N)c1ccc(cc1)SC Amb18055312 [0,1,0,0,0,0|1,1,1]=4 924 B12R1.5 CCC(O)c1c[n]c(cc1)OC Amb23446266 [0,1,0,0,0,0|1,0,2]=4 925 B12R1.5 CCC(O)c1ccc(cc1)SC Amb18055317 [0,1,0,0,0,0|0,1,2]=4 926 B12R1.5 CCC(c1ccc(cc1)OC)N Amb10610238 [0,1,0,0,0,0|1,0,1]=3 927 B12R1.5 CCC(c1ccc(cc1)OC)O Amb1110048 [0,1,0,0,0,0|0,0,2]=3 928 B12R1.5 CCN(C)c1ccc(cc1)OC Amb25204517 [0,1,0,0,0,0|2,0,0]=3 929 B12R1.5 CCN(N)c1ccc(cc1)OC Amb18646597 [0,1,0,0,0,0|2,0,0]=3 930 B12R1.5 CCS(=O)c1ccc(cc1)C=O Amb25790641 [0,1,0,0,0,0|3,0,0]=4 931 B12R1.5 CCS(=O)c1ccc(cc1)OC Amb24459755 [0,1,0,0,0,0|1,0,0]=2 932 B12R1.5 CC[C@@H](N)c1c[n]c(cc1)OC Amb23440382 [0,1,0,0,0,0|2,0,1]=4 933 B12R1.5 CC[C@@H](N)c1ccc(CC)cc1 Amb22288635 [0,1,0,0,0,0|2,0,1]=4 934 B12R1.5 CC[C@@H](N)c1ccc(CC)cc1 Amb25098001 [0,1,0,0,0,0|2,0,1]=4 935 B12R1.5 CC[C@@H](N)c1ccc(cc1)OC Amb22288638 [0,1,0,0,0,0|1,0,1]=3 936 B12R1.5 CC[C@@H](N)c1ccc(cc1)SC Amb25789995 [0,1,0,0,0,0|1,1,1]=4 937 B12R1.5 CC[C@@H](O)c1c[n]c(cc1)OC Amb25252699 [0,1,0,0,0,0|1,0,2]=4 938 B12R1.5 CC[C@H](N)c1c[n]c(cc1)OC Amb25303619 [0,1,0,0,0,0|2,0,1]=4 939 B12R1.5 CC[C@H](N)c1ccc(CC)cc1 Amb22288691 [0,1,0,0,0,0|2,0,1]=4 940 B12R1.5 CC[C@H](N)c1ccc(CC)cc1 Amb25106128 [0,1,0,0,0,0|2,0,1]=4 941 B12R1.5 CC[C@H](N)c1ccc(c[n]1)OC Amb25323789 [0,1,0,0,0,0|2,0,1]=4 942 B12R1.5 CC[C@H](N)c1ccc(cc1)OC Amb22288693 [0,1,0,0,0,0|1,0,1]=3 943 B12R1.5 CC[C@H](N)c1ccc(cc1)SC Amb24746684 [0,1,0,0,0,0|1,1,1]=4 944 B12R1.5 CC[C@H](O)c1c[n]c(cc1)OC Amb24753451 [0,1,0,0,0,0|1,0,2]=4 945 B12R1.5 CC[C@H](O)c1ccc(cc1)OC Amb25211582 [0,1,0,0,0,0|0,0,2]=3 946 B12R1.5 CC[C@H](O)c1ccc(cc1)SC Amb25816497 [0,1,0,0,0,0|0,1,2]=4 947 B12R1.5 CC[n+]1ccc(cc1)C(=O)OC Amb22336518 [0,1,0,0,0,0|2,0,0]=3 948 B12R1.5 CC[n+]1ccc(cc1)C(=O)OC Amb23567014 [0,1,0,0,0,0|2,0,0]=3 949 B12R1.5 CCc1c[n]c(cc1)C(=O)CBr Amb24727391 [0,1,0,0,0,0|2,0,0]=3 950 B12R1.5 CCc1ccc([n]c1)C(=O)NN Amb24071328 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.5 CCc1ccc(c[n]1)C(=O)OC Amb22170395 [0,1,0,0,0,0|2,0,0]=3 952 B12R1.5 CCc1ccc(cc1)C(=C)C#N Amb17232219 [0,1,0,0,0,0|2,0,1]=4 953 B12R1.5 CCc1ccc(cc1)C(=N)NC Amb25100640 [0,1,0,0,0,0|2,0,0]=3 954 B12R1.5 CCc1ccc(cc1)C(=N)OC Amb18792486 [0,1,0,0,0,0|2,0,0]=3 955 B12R1.5 CCc1ccc(cc1)C(=O)C#C Amb24700803 [0,1,0,0,0,0|1,0,1]=3 956 B12R1.5 CCc1ccc(cc1)C(=O)C=C Amb18563493 [0,1,0,0,0,0|1,0,1]=3 957 B12R1.5 CCc1ccc(cc1)C(=O)C=O Amb10069048 [0,1,0,0,0,0|1,0,1]=3 958 B12R1.5 CCc1ccc(cc1)C(=O)C=O Amb17594031 [0,1,0,0,0,0|1,0,1]=3 959 B12R1.5 CCc1ccc(cc1)C(=O)CN Amb22963501 [0,1,0,0,0,0|1,0,0]=2 960 B12R1.5 CCc1ccc(cc1)C(=O)NC Amb24091563 [0,1,0,0,0,0|1,0,0]=2 961 B12R1.5 CCc1ccc(cc1)C(=O)NN Amb1208582 [0,1,0,0,0,0|2,0,0]=3 962 B12R1.5 CCc1ccc(cc1)C(C=O)C Amb17138537 [0,1,0,0,0,0|1,0,1]=3 963 B12R1.5 CCc1ccc(cc1)C(F)CN Amb25716027 [0,1,0,0,0,0|2,0,1]=4 964 B12R1.5 CCc1ccc(cc1)C(N)CF Amb25674417 [0,1,0,0,0,0|2,0,1]=4 965 B12R1.5 CCc1ccc(cc1)C(NO)C Amb17089204 [0,1,0,0,0,0|1,0,2]=4 966 B12R1.5 CCc1ccc(cc1)C(O)CO Amb18563723 [0,1,0,0,0,0|1,0,2]=4 967 B12R1.5 CCc1ccc(cc1)C(ON)C Amb17089187 [0,1,0,0,0,0|1,0,2]=4 968 B12R1.5 CCc1ccc(cc1)N(C)C=O Amb25150901 [0,1,0,0,0,0|2,0,0]=3 969 B12R1.5 CCc1ccc(cc1)S(=O)O[Na] Amb10564094 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.5 CCc1ccc(cc1)[C@@H](N)CF Amb25720234 [0,1,0,0,0,0|2,0,1]=4 971 B12R1.5 CCc1ccc(cc1)[C@@H](N)CN Amb24585133 [0,1,0,0,0,0|2,0,1]=4 972 B12R1.5 CCc1ccc(cc1)[C@@H](N)CO Amb25680069 [0,1,0,0,0,0|2,0,1]=4 973 B12R1.5 CCc1ccc(cc1)[C@@H](O)CO Amb24386954 [0,1,0,0,0,0|1,0,2]=4 974 B12R1.5 CCc1ccc(cc1)[C@H](C)NC Amb25724427 [0,1,0,0,0,0|2,0,1]=4 975 B12R1.5 CCc1ccc(cc1)[C@H](C)NO Amb24684872 [0,1,0,0,0,0|1,0,2]=4 976 B12R1.5 CCc1ccc(cc1)[C@H](N)CF Amb24483785 [0,1,0,0,0,0|2,0,1]=4 977 B12R1.5 CCc1ccc(cc1)[C@H](O)CN Amb25285878 [0,1,0,0,0,0|1,0,2]=4 978 B12R1.5 CCc1ccc(cc1)\C(=N/O)\N Amb2371279 [0,1,0,0,0,0|2,0,1]=4 979 B12R1.5 CCc1ccc(cc1)\C(\Cl)=N\O Amb23247549 [0,1,0,0,0,0|2,0,1]=4 980 B12R1.5 CCc1ccc(cc1)\C(\N)=N\N Amb18788193 [0,1,0,0,0,0|3,0,0]=4 981 B12R1.5 CN(C=O)c1ccc(cc1)C=O Amb24691560 [0,1,0,0,0,0|3,0,0]=4 982 B12R1.5 CN(N=O)c1ccc(CO)cc1 Amb25155909 [0,1,0,0,0,0|3,0,0]=4 983 B12R1.5 CN(N=O)c1ccc(cc1)N=O Amb24488583 [0,1,0,0,0,0|3,0,0]=4 984 B12R1.5 CNC(=N)c1ccc(cc1)OC Amb24483569 [0,1,0,0,0,0|1,0,0]=2 985 B12R1.5 CNC(=O)c1c[n]c(c[n]1)NC Amb24588259 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.5 CNC(=O)c1c[n]c(cc1)NN Amb18792745 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.5 CNC(=O)c1ccc(C=C)c[n]1 Amb25125943 [0,1,0,0,0,0|2,0,1]=4 988 B12R1.5 CNC(=O)c1ccc(C=C)cc1 Amb24056361 [0,1,0,0,0,0|1,0,1]=3 989 B12R1.5 CNC(=O)c1ccc(CN)c[n]1 Amb18251732 [0,1,0,0,0,0|3,0,0]=4 990 B12R1.5 CNC(=O)c1ccc(NC)[n][n]1 Amb18959241 [0,1,0,0,0,0|3,0,0]=4 991 B12R1.5 CNC(=O)c1ccc(c[n]1)NC Amb24471839 [0,1,0,0,0,0|2,0,0]=3 992 B12R1.5 CNC(=O)c1ccc(c[n]1)OC Amb25093450 [0,1,0,0,0,0|1,0,0]=2 993 B12R1.5 CNC(=O)c1ccc(cc1)C#C Amb24091580 [0,1,0,0,0,0|1,0,1]=3 994 B12R1.5 CNC(=O)c1ccc(cc1)N=O Amb24096723 [0,1,0,0,0,0|2,0,0]=3 995 B12R1.5 CNC(=O)c1ccc(cc1)NC Amb18959244 [0,1,0,0,0,0|1,0,0]=2 996 B12R1.5 CNC(=O)c1ccc(cc1)NN Amb18800909 [0,1,0,0,0,0|2,0,0]=3 997 B12R1.5 CNC(C)c1c[n]c(cc1)OC Amb24381464 [0,1,0,0,0,0|2,0,1]=4 998 B12R1.5 CNC(C)c1ccc(c[n]1)OC Amb25851837 [0,1,0,0,0,0|2,0,1]=4 999 B12R1.5 CNC(C)c1ccc(cc1)OC Amb21955430 [0,1,0,0,0,0|1,0,1]=3 1000 B12R1.5 CNC(c1ccc(cc1)OC)C Amb1113211 [0,1,0,0,0,0|1,0,1]=3 1001 B12R1.5 CN[C@@H](C)c1c[n]c(cc1)OC Amb24646228 [0,1,0,0,0,0|2,0,1]=4 1002 B12R1.5 CN[C@@H](C)c1ccc(cc1)OC Amb22008513 [0,1,0,0,0,0|1,0,1]=3 1003 B12R1.5 CN[C@@H](c1ccc(cc1)OC)C Amb10070543 [0,1,0,0,0,0|1,0,1]=3 1004 B12R1.5 CN[C@H](C)c1c[n]c(cc1)OC Amb25148563 [0,1,0,0,0,0|2,0,1]=4 1005 B12R1.5 CNc1[n]cc(c[n]1)C(=O)NC Amb25083778 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.5 CNc1c[n]c(c[n]1)C(=O)OC Amb24720767 [0,1,0,0,0,0|3,0,0]=4 1007 B12R1.5 CNc1ccc([n][n]1)C(=O)OC Amb18968264 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.5 CNc1ccc(c[n]1)C(=O)NC Amb18284564 [0,1,0,0,0,0|2,0,0]=3 1009 B12R1.5 CNc1ccc(c[n]1)C(=O)OC Amb23536531 [0,1,0,0,0,0|2,0,0]=3 1010 B12R1.5 CNc1ccc(cc1)C(C)CN Amb25217118 [0,1,0,0,0,0|2,0,1]=4 1011 B12R1.5 CNc1ccc(cc1)C(N)CN Amb25125248 [0,1,0,0,0,0|2,0,1]=4 1012 B12R1.5 CNc1ccc(cc1)[C@@H](N)CN Amb24763781 [0,1,0,0,0,0|2,0,1]=4 1013 B12R1.5 CNc1ccc(cc1)[C@H](N)CN Amb25185321 [0,1,0,0,0,0|2,0,1]=4 1014 B12R1.5 COC(=N)c1ccc(C=O)cc1 Amb25240000 [0,1,0,0,0,0|3,0,0]=4 1015 B12R1.5 COC(=N)c1ccc(CN)cc1 Amb25376928 [0,1,0,0,0,0|3,0,0]=4 1016 B12R1.5 COC(=N)c1ccc(c[n]1)OC Amb24544315 [0,1,0,0,0,0|2,0,0]=3 1017 B12R1.5 COC(=N)c1ccc(cc1)OC Amb18798394 [0,1,0,0,0,0|1,0,0]=2 1018 B12R1.5 COC(=N)c1ccc(cc1)SC Amb18796479 [0,1,0,0,0,0|1,1,0]=3 1019 B12R1.5 COC(=O)c1[n]cc(c[n]1)OC Amb24057465 [0,1,0,0,0,0|2,0,0]=3 1020 B12R1.5 COC(=O)c1[n]cc(c[n]1)SC Amb25268307 [0,1,0,0,0,0|2,1,0]=4 1021 B12R1.5 COC(=O)c1c[n]c(c[n]1)OC Amb20669374 [0,1,0,0,0,0|2,0,0]=3 1022 B12R1.5 COC(=O)c1c[n]c(c[n]1)SC Amb25820416 [0,1,0,0,0,0|2,1,0]=4 1023 B12R1.5 COC(=O)c1c[n]c(cc1)C#C Amb22751922 [0,1,0,0,0,0|2,0,1]=4 1024 B12R1.5 COC(=O)c1c[n]c(cc1)C#N Amb18645595 [0,1,0,0,0,0|3,0,0]=4 1025 B12R1.5 COC(=O)c1c[n]c(cc1)NN Amb23557558 [0,1,0,0,0,0|3,0,0]=4 1026 B12R1.5 COC(=O)c1ccc(C=C)c[n]1 Amb25360789 [0,1,0,0,0,0|2,0,1]=4 1027 B12R1.5 COC(=O)c1ccc(CCl)[n]c1 Amb19148470 [0,1,0,0,0,0|3,0,0]=4 1028 B12R1.5 COC(=O)c1ccc(CCl)[n]c1 Amb22495973 [0,1,0,0,0,0|3,0,0]=4 1029 B12R1.5 COC(=O)c1ccc(CCl)c[n]1 Amb24390765 [0,1,0,0,0,0|3,0,0]=4 1030 B12R1.5 COC(=O)c1ccc(CI)cc1 Amb25801036 [0,1,0,0,0,0|2,0,0]=3 1031 B12R1.5 COC(=O)c1ccc(CN)[n]c1 Amb21856144 [0,1,0,0,0,0|3,0,0]=4 1032 B12R1.5 COC(=O)c1ccc(CN)[n]c1 Amb22740211 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.5 COC(=O)c1ccc(CN)c[n]1 Amb20623534 [0,1,0,0,0,0|3,0,0]=4 1034 B12R1.5 COC(=O)c1ccc(CS)[n]c1 Amb25132082 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.5 COC(=O)c1ccc(CS)cc1 Amb18805555 [0,1,0,0,0,0|2,0,0]=3 1036 B12R1.5 COC(=O)c1ccc([n][n]1)OC Amb21937832 [0,1,0,0,0,0|2,0,0]=3 1037 B12R1.5 COC(=O)c1ccc(c[n]1)C#C Amb19895136 [0,1,0,0,0,0|2,0,1]=4 1038 B12R1.5 COC(=O)c1ccc(c[n]1)OC Amb22490922 [0,1,0,0,0,0|1,0,0]=2 1039 B12R1.5 COC(=O)c1ccc(c[n]1)[Zn]Br Amb22898064 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.5 COC(=O)c1ccc(cc1)C#C Amb10605831 [0,1,0,0,0,0|1,0,1]=3 1041 B12R1.5 COC(=O)c1ccc(cc1)C#N Amb17770092 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.5 COC(=O)c1ccc(cc1)C=O Amb1880882 [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.5 COC(=O)c1ccc(cc1)N=O Amb25698996 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.5 COC(=O)c1ccc(cc1)NO Amb22753288 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.5 COC(=O)c1ccc(cn1)CC Amb17617436 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.5 COC(=O)c1ccc(nc1)CBr Amb17621482 [0,1,0,0,0,0|3,0,0]=4 1047 B12R1.5 COC(=O)c1ccc(nc1)CN Amb16233305 [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.5 COC(=S)c1ccc(cc1)OC Amb25804912 [0,1,0,0,0,0|0,1,0]=2 1049 B12R1.5 CO[n+]1ccc(cc1)C(=O)OC Amb10573249 [0,1,0,0,0,0|1,0,0]=2 1050 B12R1.5 COc1[n]cc(c[n]1)C(=O)NN Amb24408132 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.5 COc1[n]cc(c[n]1)C(=O)NN Amb24438226 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.5 COc1[n]cc(c[n]1)C(=O)NO Amb25323349 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.5 COc1[n]cc(c[n]1)C(=O)OC Amb22493949 [0,1,0,0,0,0|2,0,0]=3 1054 B12R1.5 COc1c[n]c(c[n]1)C(=O)CBr Amb25311562 [0,1,0,0,0,0|2,0,0]=3 1055 B12R1.5 COc1c[n]c(c[n]1)C(=O)NN Amb25195084 [0,1,0,0,0,0|3,0,0]=4 1056 B12R1.5 COc1c[n]c(cc1)C(=N)NO Amb19958152 [0,1,0,0,0,0|2,0,1]=4 1057 B12R1.5 COc1c[n]c(cc1)C(=O)NN Amb22001678 [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.5 COc1c[n]c(cc1)C(N)CO Amb25690311 [0,1,0,0,0,0|2,0,1]=4 1059 B12R1.5 COc1c[n]c(cc1)[C@@H](N)CO Amb25263990 [0,1,0,0,0,0|2,0,1]=4 1060 B12R1.5 COc1ccc(c[n]1)C(=N)OC Amb25214162 [0,1,0,0,0,0|2,0,0]=3 1061 B12R1.5 COc1ccc(c[n]1)C(=O)C#C Amb25317351 [0,1,0,0,0,0|1,0,1]=3 1062 B12R1.5 COc1ccc(c[n]1)C(=O)C=C Amb25820348 [0,1,0,0,0,0|1,0,1]=3 1063 B12R1.5 COc1ccc(c[n]1)C(=O)CCl Amb24365962 [0,1,0,0,0,0|1,0,0]=2 1064 B12R1.5 COc1ccc(c[n]1)C(N)CN Amb25072707 [0,1,0,0,0,0|2,0,1]=4 1065 B12R1.5 COc1ccc(c[n]1)[C@@H](N)CN Amb24548840 [0,1,0,0,0,0|2,0,1]=4 1066 B12R1.5 COc1ccc(c[n]1)[C@@H](N)CO Amb25117963 [0,1,0,0,0,0|2,0,1]=4 1067 B12R1.5 COc1ccc(c[n]1)[C@H](C)C=O Amb24485676 [0,1,0,0,0,0|1,0,1]=3 1068 B12R1.5 COc1ccc(c[n]1)\C(\Cl)=N\O Amb25697459 [0,1,0,0,0,0|2,0,1]=4 1069 B12R1.5 COc1ccc(c[n]1)\C(\N)=N\N Amb25303530 [0,1,0,0,0,0|3,0,0]=4 1070 B12R1.5 COc1ccc(cc1)C(=C)C#N Amb17232288 [0,1,0,0,0,0|1,0,1]=3 1071 B12R1.5 COc1ccc(cc1)C(=C)CN Amb18126381 [0,1,0,0,0,0|1,0,0]=2 1072 B12R1.5 COc1ccc(cc1)C(=O)C#C Amb12805652 [0,1,0,0,0,0|0,0,1]=2 1073 B12R1.5 COc1ccc(cc1)C(=O)C#N Amb17232350 [0,1,0,0,0,0|0,0,1]=2 1074 B12R1.5 COc1ccc(cc1)C(=O)C=C Amb18563545 [0,1,0,0,0,0|0,0,1]=2 1075 B12R1.5 COc1ccc(cc1)C(=O)C=O Amb10067936 [0,1,0,0,0,0|0,0,1]=2 1076 B12R1.5 COc1ccc(cc1)C(=O)CN Amb20668082 [0,1,0,0,0,0|0,0,0]=1 1077 B12R1.5 COc1ccc(cc1)C(Br)C#N Amb18134751 [0,1,0,0,0,0|1,0,2]=4 1078 B12R1.5 COc1ccc(cc1)C(C#N)N Amb1108186 [0,1,0,0,0,0|1,0,2]=4 1079 B12R1.5 COc1ccc(cc1)C(C=O)C Amb17138571 [0,1,0,0,0,0|0,0,1]=2 1080 B12R1.5 COc1ccc(cc1)C(Cl)C#N Amb18805465 [0,1,0,0,0,0|1,0,2]=4 1081 B12R1.5 COc1ccc(cc1)C(Cl)CF Amb25074590 [0,1,0,0,0,0|1,0,1]=3 1082 B12R1.5 COc1ccc(cc1)C(F)C=O Amb24746381 [0,1,0,0,0,0|1,0,1]=3 1083 B12R1.5 COc1ccc(cc1)C(N)C#C Amb23448693 [0,1,0,0,0,0|1,0,2]=4 1084 B12R1.5 COc1ccc(cc1)C(N)C#N Amb22549048 [0,1,0,0,0,0|1,0,2]=4 1085 B12R1.5 COc1ccc(cc1)C(N)C=O Amb24340481 [0,1,0,0,0,0|1,0,1]=3 1086 B12R1.5 COc1ccc(cc1)C(N)CO Amb19344035 [0,1,0,0,0,0|1,0,1]=3 1087 B12R1.5 COc1ccc(cc1)C(O)C#C Amb25789566 [0,1,0,0,0,0|0,0,3]=4 1088 B12R1.5 COc1ccc(cc1)C(O)C=C Amb22505306 [0,1,0,0,0,0|0,0,3]=4 1089 B12R1.5 COc1ccc(cc1)C(O)C=O Amb25150071 [0,1,0,0,0,0|1,0,1]=3 1090 B12R1.5 COc1ccc(cc1)C(O)CO Amb18563837 [0,1,0,0,0,0|0,0,2]=3 1091 B12R1.5 COc1ccc(cc1)N(C)C#N Amb25304956 [0,1,0,0,0,0|2,0,0]=3 1092 B12R1.5 COc1ccc(cc1)N(C)C=O Amb24323386 [0,1,0,0,0,0|1,0,0]=2 1093 B12R1.5 COc1ccc(cc1)N(C)CO Amb24675430 [0,1,0,0,0,0|1,0,1]=3 1094 B12R1.5 COc1ccc(cc1)N(C)N=O Amb23497759 [0,1,0,0,0,0|1,0,0]=2 1095 B12R1.5 COc1ccc(cc1)[13C](=O)OC Amb17617601 [0,1,0,0,0,0|0,0,0]=1 1096 B12R1.5 COc1ccc(cc1)[C@@H](C)C=O Amb25159562 [0,1,0,0,0,0|0,0,1]=2 1097 B12R1.5 COc1ccc(cc1)[C@@H](F)CO Amb25680636 [0,1,0,0,0,0|1,0,1]=3 1098 B12R1.5 COc1ccc(cc1)[C@@H](N)C#C Amb25312167 [0,1,0,0,0,0|1,0,2]=4 1099 B12R1.5 COc1ccc(cc1)[C@@H](N)C#N Amb25152665 [0,1,0,0,0,0|1,0,2]=4 1100 B12R1.5 COc1ccc(cc1)[C@@H](N)C=C Amb24746732 [0,1,0,0,0,0|1,0,2]=4 1101 B12R1.5 COc1ccc(cc1)[C@@H](N)CF Amb24664191 [0,1,0,0,0,0|1,0,1]=3 1102 B12R1.5 COc1ccc(cc1)[C@@H](N)CN Amb24622464 [0,1,0,0,0,0|1,0,1]=3 1103 B12R1.5 COc1ccc(cc1)[C@@H](N)CO Amb22756885 [0,1,0,0,0,0|1,0,1]=3 1104 B12R1.5 COc1ccc(cc1)[C@@H](O)CBr Amb24419301 [0,1,0,0,0,0|0,0,2]=3 1105 B12R1.5 COc1ccc(cc1)[C@@H](O)CF Amb24412978 [0,1,0,0,0,0|0,0,2]=3 1106 B12R1.5 COc1ccc(cc1)[C@@H](O)CN Amb22746209 [0,1,0,0,0,0|0,0,2]=3 1107 B12R1.5 COc1ccc(cc1)[C@@H](O)CO Amb25734453 [0,1,0,0,0,0|0,0,2]=3 1108 B12R1.5 COc1ccc(cc1)[C@H](N)C#N Amb25856872 [0,1,0,0,0,0|1,0,2]=4 1109 B12R1.5 COc1ccc(cc1)[C@H](N)C=C Amb25791597 [0,1,0,0,0,0|1,0,2]=4 1110 B12R1.5 COc1ccc(cc1)[C@H](N)CF Amb25843933 [0,1,0,0,0,0|1,0,1]=3 1111 B12R1.5 COc1ccc(cc1)[C@H](N)CO Amb25149843 [0,1,0,0,0,0|1,0,1]=3 1112 B12R1.5 COc1ccc(cc1)[C@H](O)C#C Amb24733761 [0,1,0,0,0,0|0,0,3]=4 1113 B12R1.5 COc1ccc(cc1)[C@H](O)C=C Amb25739690 [0,1,0,0,0,0|0,0,3]=4 1114 B12R1.5 COc1ccc(cc1)[C@H](O)C=O Amb24444862 [0,1,0,0,0,0|1,0,1]=3 1115 B12R1.5 COc1ccc(cc1)[C@H](O)CBr Amb25297621 [0,1,0,0,0,0|0,0,2]=3 1116 B12R1.5 COc1ccc(cc1)[C@H](O)CF Amb24372069 [0,1,0,0,0,0|0,0,2]=3 1117 B12R1.5 COc1ccc(cc1)[C@H](O)CN Amb20241484 [0,1,0,0,0,0|0,0,2]=3 1118 B12R1.5 COc1ccc(cc1)\C(=N/O)\C Amb2389864 [0,1,0,0,0,0|0,0,1]=2 1119 B12R1.5 COc1ccc(cc1)\C(=N/O)\Cl Amb10552954 [0,1,0,0,0,0|1,0,1]=3 1120 B12R1.5 COc1ccc(cc1)\C(\N)=C\O Amb25045721 [0,1,0,0,0,0|1,0,1]=3 1121 B12R1.5 COc1ccc(cc1)\C(\N)=N\Cl Amb25751528 [0,1,0,0,0,0|2,0,0]=3 1122 B12R1.5 COc1ccc(cc1)\C(\N)=N\N Amb18788358 [0,1,0,0,0,0|2,0,0]=3 1123 B12R1.5 COc1ccc(cn1)C(=O)OC Amb1211947 [0,1,0,0,0,0|1,0,0]=2 1124 B12R1.5 CSc1ccc(c[n]1)C(=O)CCl Amb24104231 [0,1,0,0,0,0|1,1,0]=3 1125 B12R1.5 CSc1ccc(cc1)C(=O)C#C Amb25284408 [0,1,0,0,0,0|0,1,1]=3 1126 B12R1.5 CSc1ccc(cc1)C(=O)C=C Amb18224623 [0,1,0,0,0,0|0,1,1]=3 1127 B12R1.5 CSc1ccc(cc1)C(=O)C=O Amb21858435 [0,1,0,0,0,0|0,1,1]=3 1128 B12R1.5 CSc1ccc(cc1)C(=O)C=O Amb22059437 [0,1,0,0,0,0|0,1,1]=3 1129 B12R1.5 CSc1ccc(cc1)C(=O)CN Amb18893672 [0,1,0,0,0,0|0,1,0]=2 1130 B12R1.5 CSc1ccc(cc1)C(=O)CO Amb18809765 [0,1,0,0,0,0|0,1,0]=2 1131 B12R1.5 CSc1ccc(cc1)C(C)C=O Amb24682816 [0,1,0,0,0,0|0,1,1]=3 1132 B12R1.5 CSc1ccc(cc1)C(C)CN Amb18243818 [0,1,0,0,0,0|1,1,1]=4 1133 B12R1.5 CSc1ccc(cc1)C(C)CO Amb24564639 [0,1,0,0,0,0|0,1,2]=4 1134 B12R1.5 CSc1ccc(cc1)[C@@H](N)CF Amb24384957 [0,1,0,0,0,0|1,1,1]=4 1135 B12R1.5 CSc1ccc(cc1)[C@@H](N)CO Amb25327555 [0,1,0,0,0,0|1,1,1]=4 1136 B12R1.5 CSc1ccc(cc1)\C(\Cl)=N\O Amb23247559 [0,1,0,0,0,0|1,1,1]=4 1137 B12R1.5 CSc1ccc(cc1)\C(\N)=N\N Amb18791298 [0,1,0,0,0,0|2,1,0]=4 1138 B12R1.5 C\C(=C/Cl)\c1ccc(cc1)OC Amb25322140 [0,1,0,0,0,0|1,0,0]=2 1139 B12R1.5 C\C(=N/N)\c1ccc(cc1)OC Amb25731075 [0,1,0,0,0,0|1,0,0]=2 1140 B12R1.5 C\C(=N/N)\c1ccc(cc1)SC Amb25833945 [0,1,0,0,0,0|1,1,0]=3 1141 B12R1.5 C\C(=N/O)\c1ccc([n]c1)OC Amb25351964 [0,1,0,0,0,0|1,0,1]=3 1142 B12R1.5 C\C(=N/O)\c1ccc(c[n]1)OC Amb24343631 [0,1,0,0,0,0|1,0,1]=3 1143 B12R1.5 C\C(=N/O)\c1ccc(cc1)SC Amb24656966 [0,1,0,0,0,0|0,1,1]=3 1144 B12R1.5 C\C(=N\N)\c1ccc(cc1)C#N Amb25346036 [0,1,0,0,0,0|3,0,0]=4 1145 B12R1.5 ClCC(=O)c1ccc(cc1)C#N Amb17335388 [0,1,0,0,0,0|2,0,0]=3 1146 B12R1.5 ClCC(=O)c1ccc(cc1)CC Amb1103618 [0,1,0,0,0,0|1,0,0]=2 1147 B12R1.5 ClCC(=O)c1ccc(cc1)OC Amb1209344 [0,1,0,0,0,0|0,0,0]=1 1148 B12R1.5 ClCC(=O)c1ccc(cc1)SC Amb2370957 [0,1,0,0,0,0|0,1,0]=2 1149 B12R1.5 ClCC(c1ccc(cc1)CC)C Amb17233971 [0,1,0,0,0,0|2,0,1]=4 1150 B12R1.5 ClCC(c1ccc(cc1)CC)O Amb17194566 [0,1,0,0,0,0|1,0,2]=4 1151 B12R1.5 ClCC(c1ccc(cc1)OC)C Amb17234158 [0,1,0,0,0,0|1,0,1]=3 1152 B12R1.5 ClCC(c1ccc(cc1)OC)O Amb17194584 [0,1,0,0,0,0|0,0,2]=3 1153 B12R1.5 ClC[C@@H](c1ccc(cc1)OC)O Amb16231707 [0,1,0,0,0,0|0,0,2]=3 1154 B12R1.5 ClCc1ccc(cc1)C(=O)OC Amb2371847 [0,1,0,0,0,0|2,0,0]=3 1155 B12R1.5 FCC(=O)c1ccc(cc1)OC Amb10841335 [0,1,0,0,0,0|0,0,0]=1 1156 B12R1.5 FCC(c1ccc(cc1)OC)N Amb2372609 [0,1,0,0,0,0|1,0,1]=3 1157 B12R1.5 N#CC(=O)c1ccc(cc1)C#N Amb25121077 [0,1,0,0,0,0|2,0,1]=4 1158 B12R1.5 N#Cc1c[n]c(cc1)C(=O)CBr Amb25743777 [0,1,0,0,0,0|3,0,0]=4 1159 B12R1.5 N#Cc1ccc(cc1)C(=O)C=O Amb20240831 [0,1,0,0,0,0|2,0,1]=4 1160 B12R1.5 N#Cc1ccc(cc1)C(=O)CI Amb24097661 [0,1,0,0,0,0|2,0,0]=3 1161 B12R1.5 N#Cc1ccc(cc1)C(=O)CO Amb18800498 [0,1,0,0,0,0|2,0,0]=3 1162 B12R1.5 NCC(=O)c1ccc(CF)cc1 Amb25276842 [0,1,0,0,0,0|2,0,0]=3 1163 B12R1.5 NCC(=O)c1ccc(cc1)C#N Amb18951216 [0,1,0,0,0,0|2,0,0]=3 1164 B12R1.5 NCC(=O)c1ccc(cc1)C=O Amb25249455 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.5 NCC(=O)c1ccc(cc1)OC Amb1200635 [0,1,0,0,0,0|0,0,0]=1 1166 B12R1.5 NCC(=O)c1ccc(cc1)OC Amb2502479 [0,1,0,0,0,0|0,0,0]=1 1167 B12R1.5 NCC(c1ccc(cc1)CC)O Amb1108770 [0,1,0,0,0,0|1,0,2]=4 1168 B12R1.5 NCC(c1ccc(cc1)OC)O Amb1108164 [0,1,0,0,0,0|0,0,2]=3 1169 B12R1.5 NCC(c1ccc(cc1)SC)O Amb1108830 [0,1,0,0,0,0|0,1,2]=4 1170 B12R1.5 NCc1ccc(cc1)C(=O)C=O Amb25040804 [0,1,0,0,0,0|2,0,1]=4 1171 B12R1.5 NCc1ccc(cc1)C(=O)CBr Amb25751510 [0,1,0,0,0,0|2,0,0]=3 1172 B12R1.5 NCc1ccc(cc1)C(=O)CCl Amb24086411 [0,1,0,0,0,0|2,0,0]=3 1173 B12R1.5 NCc1ccc(cc1)C(=O)NC Amb10609836 [0,1,0,0,0,0|2,0,0]=3 1174 B12R1.5 NCc1ccc(cc1)C(=O)NC Amb1119850 [0,1,0,0,0,0|2,0,0]=3 1175 B12R1.5 NCc1ccc(cc1)C(=O)OC Amb1103905 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.5 NCc1ccc(cc1)C(=O)OC Amb1203286 [0,1,0,0,0,0|2,0,0]=3 1177 B12R1.5 NNC(=O)c1ccc(CCl)cc1 Amb25340420 [0,1,0,0,0,0|3,0,0]=4 1178 B12R1.5 NNC(=O)c1ccc(cc1)CN Amb1104472 [0,1,0,0,0,0|3,0,0]=4 1179 B12R1.5 NNc1ccc(cc1)C(=O)NN Amb1104499 [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.5 NNc1ccc(cc1)C(=O)OC Amb1920276 [0,1,0,0,0,0|2,0,0]=3 1181 B12R1.5 NOC(=O)c1ccc(cc1)OC Amb10606698 [0,1,0,0,0,0|1,0,0]=2 1182 B12R1.5 NOC(c1ccc(cc1)OC)C Amb17089196 [0,1,0,0,0,0|0,0,2]=3 1183 B12R1.5 O=C(C=O)c1ccc(CCl)cc1 Amb24635708 [0,1,0,0,0,0|2,0,1]=4 1184 B12R1.5 O=C(CBr)c1ccc(CBr)cc1 Amb24065385 [0,1,0,0,0,0|2,0,0]=3 1185 B12R1.5 O=C(CBr)c1ccc(CCl)cc1 Amb24642850 [0,1,0,0,0,0|2,0,0]=3 1186 B12R1.5 O=C(CBr)c1ccc(CI)cc1 Amb24402298 [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.5 O=CC(=O)c1ccc(cc1)C#N Amb10067940 [0,1,0,0,0,0|2,0,1]=4 1188 B12R1.5 OCC(c1ccc(cc1)CC)C Amb17232491 [0,1,0,0,0,0|1,0,2]=4 1189 B12R1.5 OCC(c1ccc(cc1)OC)C Amb17232590 [0,1,0,0,0,0|0,0,2]=3 1190 B12R1.5 OCC(c1ccc(cc1)OC)N Amb2236270 [0,1,0,0,0,0|1,0,1]=3 1191 B12R1.5 OCC(c1ccc(cc1)SC)N Amb2236269 [0,1,0,0,0,0|1,1,1]=4 1192 B12R1.5 OCc1ccc(cc1)C(=O)NC Amb10608257 [0,1,0,0,0,0|2,0,0]=3 1193 B12R1.5 ONC(=O)c1ccc(cc1)OC Amb1907124 [0,1,0,0,0,0|1,0,0]=2 1194 B12R1.5 ONC(c1ccc(cc1)OC)C Amb17089213 [0,1,0,0,0,0|0,0,2]=3 1195 B12R1.5 SCC(=O)c1ccc(cc1)CC Amb17400837 [0,1,0,0,0,0|1,0,0]=2 1196 B12R1.5 SCC(=O)c1ccc(cc1)OC Amb17400926 [0,1,0,0,0,0|0,0,0]=1 1197 B12R1.5 [C-]#[N+]c1ccc(c[n]1)C(=O)OC Amb25239205 [0,1,0,0,0,0|2,0,1]=4 1198 B12R1.5 [Na]OC(=O)c1ccc(cc1)C=O Amb1905627 [0,1,0,0,0,0|3,0,0]=4 1199 B12R1.6 CC(C)(C)c1ccc(cc1)ON Amb25044181 [0,1,0,0,0,0|2,0,1]=4 1200 B12R1.6 CCc1ccc(c[n]1)S(C)(=O)=O Amb25714740 [0,1,0,0,0,0|3,0,0]=4 1201 B12R1.6 CCc1ccc(cc1)C(C)(F)F Amb19894552 [0,1,0,0,0,0|2,0,1]=4 1202 B12R1.6 CCc1ccc(cc1)C(N)(C)C Amb17078778 [0,1,0,0,0,0|2,0,1]=4 1203 B12R1.6 CCc1ccc(cc1)C(O)(C)C Amb17400158 [0,1,0,0,0,0|1,0,2]=4 1204 B12R1.6 CCc1ccc(cc1)S(=O)(=O)Br Amb24419357 [0,1,0,0,0,0|3,0,0]=4 1205 B12R1.6 CCc1ccc(cc1)S(=O)(=O)Cl Amb1691714 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.6 CCc1ccc(cc1)S(=O)(=O)Cl Amb22351698 [0,1,0,0,0,0|3,0,0]=4 1207 B12R1.6 CCc1ccc(cc1)S(=O)(=O)F Amb18564475 [0,1,0,0,0,0|3,0,0]=4 1208 B12R1.6 CCc1ccc(cc1)S(=O)(=O)N Amb1124955 [0,1,0,0,0,0|3,0,0]=4 1209 B12R1.6 CCc1ccc(cc1)S(=O)(=O)O Amb15691692 [0,1,0,0,0,0|3,0,0]=4 1210 B12R1.6 CCc1ccc(cc1)S(O)(=O)=S Amb24086623 [0,1,0,0,0,0|3,0,0]=4 1211 B12R1.6 CCc1ccc(cc1)S([O-])(=O)=O Amb24311940 [0,1,0,0,0,0|3,0,0]=4 1212 B12R1.6 CCc1ccc(cc1)[Si](C)(C)C Amb19886451 [0,1,0,0,0,0|2,1,0]=4 1213 B12R1.6 CNc1c[n]c(cc1)S(C)(=O)=O Amb18967607 [0,1,0,0,0,0|3,0,0]=4 1214 B12R1.6 CNc1ccc(cc1)C(C)(C)N Amb25686452 [0,1,0,0,0,0|2,0,1]=4 1215 B12R1.6 CNc1ccc(cc1)C(C)(F)F Amb25208045 [0,1,0,0,0,0|2,0,1]=4 1216 B12R1.6 CNc1ccc(cc1)S(=O)(=O)F Amb25771880 [0,1,0,0,0,0|3,0,0]=4 1217 B12R1.6 CNc1ccc(cc1)S(C)(=O)=O Amb19958228 [0,1,0,0,0,0|2,0,0]=3 1218 B12R1.6 COc1c[n]c(cc1)C(C)(C)N Amb24725243 [0,1,0,0,0,0|2,0,1]=4 1219 B12R1.6 COc1c[n]c(cc1)S(=O)(=O)Cl Amb24470657 [0,1,0,0,0,0|3,0,0]=4 1220 B12R1.6 COc1c[n]c(cc1)S(N)(=O)=O Amb25101376 [0,1,0,0,0,0|3,0,0]=4 1221 B12R1.6 COc1c[n]c(cc1)[Si](C)(C)C Amb24071519 [0,1,0,0,0,0|2,1,0]=4 1222 B12R1.6 COc1ccc(c[n]1)S(N)(=O)=O Amb23440619 [0,1,0,0,0,0|3,0,0]=4 1223 B12R1.6 COc1ccc(c[n]1)S(O)(=O)=O Amb24689324 [0,1,0,0,0,0|3,0,0]=4 1224 B12R1.6 COc1ccc(cc1)B(O)(O)O Amb25370201 [0,1,0,0,0,0|2,0,1]=4 1225 B12R1.6 COc1ccc(cc1)P(=O)(Cl)Cl Amb22731555 [0,1,0,0,0,0|2,0,0]=3 1226 B12R1.6 COc1ccc(cc1)P(=O)(O)O Amb10571122 [0,1,0,0,0,0|2,0,0]=3 1227 B12R1.6 COc1ccc(cc1)P(=O)(O)[O-] Amb16231114 [0,1,0,0,0,0|2,0,0]=3 1228 B12R1.6 COc1ccc(cc1)S(=O)(=O)Br Amb25354471 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.6 COc1ccc(cc1)S(=O)(=O)C Amb2227679 [0,1,0,0,0,0|1,0,0]=2 1230 B12R1.6 COc1ccc(cc1)S(=O)(=O)Cl Amb1150044 [0,1,0,0,0,0|2,0,0]=3 1231 B12R1.6 COc1ccc(cc1)S(=O)(=O)F Amb18066249 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.6 COc1ccc(cc1)S(=O)(=O)N Amb1130906 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.6 COc1ccc(cc1)S(=O)(=O)[Na] Amb22042323 [0,1,0,0,0,0|2,0,0]=3 1234 B12R1.6 COc1ccc(cc1)S(=O)(=O)[O-] Amb1900144 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.6 COc1ccc(cc1)S(O)(=O)=O Amb18863291 [0,1,0,0,0,0|2,0,0]=3 1236 B12R1.6 COc1ccc(cc1)[N+](C)(C)C Amb10554048 [0,1,0,0,0,0|2,0,0]=3 1237 B12R1.6 COc1ccc(cc1)[N+](C)(C)C Amb10554050 [0,1,0,0,0,0|2,0,0]=3 1238 B12R1.6 COc1ccc(cc1)[Si](C)(C)Cl Amb24350674 [0,1,0,0,0,0|1,1,0]=3 1239 B12R1.6 COc1ccc(cc1)[Si](C)(C)O Amb22167041 [0,1,0,0,0,0|0,1,1]=3 1240 B12R1.6 COc1ccc(cc1)[Te](I)(I)I Amb22360335 [0,1,0,0,0,0|3,0,0]=4 1241 B12R1.6 COc1ccc(cn1)S(=O)(=O)Cl Amb10842161 [0,1,0,0,0,0|3,0,0]=4 1242 B12R1.6 CS(=O)(=O)c1ccc(CI)cc1 Amb25188197 [0,1,0,0,0,0|3,0,0]=4 1243 B12R1.6 CS(=O)(=O)c1ccc(cc1)C#C Amb19944531 [0,1,0,0,0,0|2,0,1]=4 1244 B12R1.6 CS(=O)(=O)c1ccc(cc1)ON Amb24342010 [0,1,0,0,0,0|2,0,0]=3 1245 B12R1.6 CSc1ccc(c[n]1)S(C)(=O)=O Amb25086342 [0,1,0,0,0,0|2,1,0]=4 1246 B12R1.6 CSc1ccc(cc1)C(C)(C)N Amb18863004 [0,1,0,0,0,0|1,1,1]=4 1247 B12R1.6 CSc1ccc(cc1)C(C)(C)O Amb24603858 [0,1,0,0,0,0|0,1,2]=4 1248 B12R1.6 CSc1ccc(cc1)S(=O)(=O)C Amb10553021 [0,1,0,0,0,0|1,1,0]=3 1249 B12R1.6 CSc1ccc(cc1)S(=O)(=O)Cl Amb1139752 [0,1,0,0,0,0|2,1,0]=4 1250 B12R1.6 CSc1ccc(cc1)S(=O)(=O)F Amb18224866 [0,1,0,0,0,0|2,1,0]=4 1251 B12R1.6 CSc1ccc(cc1)[Si](C)(C)C Amb20671360 [0,1,0,0,0,0|1,2,0]=4 1252 B12R1.6 CSc1ccc(cc1)[Si](C)(C)O Amb22167045 [0,1,0,0,0,0|0,2,1]=4 1253 B12R1.6 NS(=O)(=O)c1ccc(cc1)OO Amb24070354 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.6 O=Cc1ccc(cc1)S(=O)(=O)C Amb2228497 [0,1,0,0,0,0|3,0,0]=4 1255 B12R1.6 O=Cc1ccc(cc1)[S+](=O)(C)[O-] Amb10238339 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.6 [2H]C([2H])([2H])c1ccc(cc1)OC Amb22729948 [0,1,0,0,0,0|2,0,1]=4 1257 B12R1.48 C#Cc1ccc(cc1F)C(O)=O Amb24493575 [0,1,0,0,0,0|2,0,1]=4 1258 B12R1.48 C#Cc1ccc(cc1O)C(O)=O Amb24493573 [0,1,0,0,0,0|2,0,1]=4 1259 B12R1.48 C=Cc1ccc(cc1Cl)C(O)=O Amb24400039 [0,1,0,0,0,0|2,0,1]=4 1260 B12R1.48 CC(=C)c1ccc(OC)c(Br)[n]1 Amb25042680 [0,1,0,0,0,0|2,0,0]=3 1261 B12R1.48 CC(=C)c1ccc(OC)c(F)c1 Amb25299000 [0,1,0,0,0,0|1,0,0]=2 1262 B12R1.48 CC(=O)C1=CC=C(C#N)C(=O)N1 Amb24648902 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.48 CC(=O)c1c[n]c(NC)c(Cl)c1 Amb24557397 [0,1,0,0,0,0|2,0,0]=3 1264 B12R1.48 CC(=O)c1c[n]c(OC)c(Cl)c1 Amb24725171 [0,1,0,0,0,0|1,0,0]=2 1265 B12R1.48 CC(=O)c1c[n]c(OC)c(N)c1 Amb24686186 [0,1,0,0,0,0|1,0,0]=2 1266 B12R1.48 CC(=O)c1cc(Br)c(CBr)cc1 Amb24375019 [0,1,0,0,0,0|2,0,0]=3 1267 B12R1.48 CC(=O)c1cc(Br)c(c[n]1)OC Amb24659862 [0,1,0,0,0,0|1,0,0]=2 1268 B12R1.48 CC(=O)c1cc(Br)c(cc1)C#N Amb18134313 [0,1,0,0,0,0|2,0,0]=3 1269 B12R1.48 CC(=O)c1cc(Cl)c(cc1)C#N Amb24105433 [0,1,0,0,0,0|2,0,0]=3 1270 B12R1.48 CC(=O)c1cc(N)c(c[n]1)C=O Amb25687442 [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.48 CC(=O)c1cc(N)c(cc1)C#C Amb25680074 [0,1,0,0,0,0|1,0,1]=3 1272 B12R1.48 CC(=O)c1cc(N)c(cc1)C#N Amb18645299 [0,1,0,0,0,0|2,0,0]=3 1273 B12R1.48 CC(=O)c1cc(O)c(c[n]1)C=O Amb25132836 [0,1,0,0,0,0|3,0,0]=4 1274 B12R1.48 CC(=O)c1cc(O)c(cc1)C#N Amb24091156 [0,1,0,0,0,0|2,0,0]=3 1275 B12R1.48 CC(=O)c1ccc(C=O)c(N)[n]1 Amb25776126 [0,1,0,0,0,0|3,0,0]=4 1276 B12R1.48 CC(=O)c1ccc(C=O)c(O)[n]1 Amb24682221 [0,1,0,0,0,0|3,0,0]=4 1277 B12R1.48 CC(=O)c1ccc(C=O)c(O)c1 Amb18645959 [0,1,0,0,0,0|2,0,0]=3 1278 B12R1.48 CC(=O)c1ccc(CC)c(O)c1 Amb24093917 [0,1,0,0,0,0|1,0,0]=2 1279 B12R1.48 CC(=O)c1ccc(CO)c(Br)c1 Amb24689659 [0,1,0,0,0,0|2,0,0]=3 1280 B12R1.48 CC(=O)c1ccc(NC)c(Cl)c1 Amb23402980 [0,1,0,0,0,0|1,0,0]=2 1281 B12R1.48 CC(=O)c1ccc(NC)c(F)c1 Amb18563795 [0,1,0,0,0,0|1,0,0]=2 1282 B12R1.48 CC(=O)c1ccc(NC)c(I)c1 Amb23402978 [0,1,0,0,0,0|1,0,0]=2 1283 B12R1.48 CC(=O)c1ccc(NC)c(O)c1 Amb18646277 [0,1,0,0,0,0|1,0,0]=2 1284 B12R1.48 CC(=O)c1ccc(OC)c(Cl)[n]1 Amb24726048 [0,1,0,0,0,0|1,0,0]=2 1285 B12R1.48 CC(=O)c1ccc(SC)c(Br)c1 Amb22740122 [0,1,0,0,0,0|0,1,0]=2 1286 B12R1.48 CC(=O)c1ccc(SC)c(Cl)c1 Amb18317002 [0,1,0,0,0,0|0,1,0]=2 1287 B12R1.48 CC(=O)c1ccc(SC)c(F)c1 Amb19057442 [0,1,0,0,0,0|0,1,0]=2 1288 B12R1.48 CCN1C=CC(=CC1=O)C(O)=O Amb19516749 [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.48 CCc1[n]cc(cc1Br)C(N)=O Amb25218771 [0,1,0,0,0,0|3,0,0]=4 1290 B12R1.48 CCc1[n]cc(cc1Cl)C(N)=O Amb24537628 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.48 CCc1[n]cc(cc1F)C(N)=O Amb24379230 [0,1,0,0,0,0|3,0,0]=4 1292 B12R1.48 CCc1[n]cc(cc1F)C(O)=O Amb24357760 [0,1,0,0,0,0|3,0,0]=4 1293 B12R1.48 CCc1[n]cc(cc1O)C(O)=O Amb25829441 [0,1,0,0,0,0|3,0,0]=4 1294 B12R1.48 CCc1c[n]c(cc1Br)C(O)=O Amb25858820 [0,1,0,0,0,0|3,0,0]=4 1295 B12R1.48 CCc1ccc(cc1Br)C(=O)C Amb17193978 [0,1,0,0,0,0|1,0,0]=2 1296 B12R1.48 CCc1ccc(cc1Br)C(=O)Cl Amb23596354 [0,1,0,0,0,0|2,0,0]=3 1297 B12R1.48 CCc1ccc(cc1Br)C(=O)O Amb1060319 [0,1,0,0,0,0|2,0,0]=3 1298 B12R1.48 CCc1ccc(cc1Br)C(C)N Amb24623038 [0,1,0,0,0,0|2,0,1]=4 1299 B12R1.48 CCc1ccc(cc1Br)C(N)=O Amb23492476 [0,1,0,0,0,0|2,0,0]=3 1300 B12R1.48 CCc1ccc(cc1Br)[N+]([O-])=O Amb22228656 [0,1,0,0,0,0|3,0,0]=4 1301 B12R1.48 CCc1ccc(cc1Cl)C(C)N Amb18277507 [0,1,0,0,0,0|2,0,1]=4 1302 B12R1.48 CCc1ccc(cc1Cl)C(N)=O Amb18940421 [0,1,0,0,0,0|2,0,0]=3 1303 B12R1.48 CCc1ccc(cc1Cl)C(O)=O Amb18649029 [0,1,0,0,0,0|2,0,0]=3 1304 B12R1.48 CCc1ccc(cc1F)C(O)=O Amb25697073 [0,1,0,0,0,0|2,0,0]=3 1305 B12R1.48 CCc1ccc(cc1I)C(=O)O Amb16232634 [0,1,0,0,0,0|2,0,0]=3 1306 B12R1.48 CCc1ccc(cc1I)[N+]([O-])=O Amb25362784 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.48 CCc1ccc(cc1N)C(=O)C Amb17138552 [0,1,0,0,0,0|1,0,0]=2 1308 B12R1.48 CCc1ccc(cc1N)N(=O)=O Amb22396486 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.48 CCc1ccc(cc1N)N(C)C Amb17138585 [0,1,0,0,0,0|3,0,0]=4 1310 B12R1.48 CCc1ccc(cc1O)C(C)C Amb24084056 [0,1,0,0,0,0|2,0,1]=4 1311 B12R1.48 CCc1ccc(cc1O)[N+]([O-])=O Amb24084063 [0,1,0,0,0,0|3,0,0]=4 1312 B12R1.48 CCc1ccc(cc1S)C(O)=O Amb25336578 [0,1,0,0,0,0|2,0,0]=3 1313 B12R1.48 CNc1[n]cc(cc1Br)C(N)=O Amb25817219 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.48 CNc1[n]cc(cc1Br)C(O)=O Amb22499477 [0,1,0,0,0,0|3,0,0]=4 1315 B12R1.48 CNc1[n]cc(cc1Cl)C(N)=O Amb18959247 [0,1,0,0,0,0|3,0,0]=4 1316 B12R1.48 CNc1[n]cc(cc1N)C(O)=O Amb18862700 [0,1,0,0,0,0|3,0,0]=4 1317 B12R1.48 CNc1ccc(cc1Br)C(=O)O Amb16232738 [0,1,0,0,0,0|2,0,0]=3 1318 B12R1.48 CNc1ccc(cc1Br)C(N)=N Amb24378222 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.48 CNc1ccc(cc1Br)C(N)=O Amb23437141 [0,1,0,0,0,0|2,0,0]=3 1320 B12R1.48 CNc1ccc(cc1Br)C(N)=S Amb24363960 [0,1,0,0,0,0|2,1,0]=4 1321 B12R1.48 CNc1ccc(cc1Cl)C(N)=N Amb18967584 [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.48 CNc1ccc(cc1Cl)C(N)=O Amb23437139 [0,1,0,0,0,0|2,0,0]=3 1323 B12R1.48 CNc1ccc(cc1Cl)C(N)=S Amb18288674 [0,1,0,0,0,0|2,1,0]=4 1324 B12R1.48 CNc1ccc(cc1Cl)C(O)=O Amb18288675 [0,1,0,0,0,0|2,0,0]=3 1325 B12R1.48 CNc1ccc(cc1F)C(N)=N Amb18284913 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.48 CNc1ccc(cc1F)C(N)=O Amb23437129 [0,1,0,0,0,0|2,0,0]=3 1327 B12R1.48 CNc1ccc(cc1F)C(O)=O Amb18963551 [0,1,0,0,0,0|2,0,0]=3 1328 B12R1.48 CNc1ccc(cc1I)C(=O)O Amb16232739 [0,1,0,0,0,0|2,0,0]=3 1329 B12R1.48 CNc1ccc(cc1I)C(N)=O Amb23437138 [0,1,0,0,0,0|2,0,0]=3 1330 B12R1.48 CNc1ccc(cc1I)[N+](=O)[O-] Amb10552749 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.48 CNc1ccc(cc1N)C(C)C Amb25248628 [0,1,0,0,0,0|2,0,1]=4 1332 B12R1.48 CNc1ccc(cc1N)N(=O)=O Amb20573695 [0,1,0,0,0,0|3,0,0]=4 1333 B12R1.48 CNc1ccc(cc1O)C(N)=O Amb25280585 [0,1,0,0,0,0|2,0,0]=3 1334 B12R1.48 CNc1ccc(cc1O)C(O)=O Amb24438102 [0,1,0,0,0,0|2,0,0]=3 1335 B12R1.48 CNc1ccc(cc1S)C(C)C Amb2433161 [0,1,0,0,0,0|2,0,1]=4 1336 B12R1.48 COC1=CC=C(NC1=O)C(O)=O Amb25127882 [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.48 COC1=CNC(=CC1=O)C(O)=O Amb18384686 [0,1,0,0,0,0|2,0,0]=3 1338 B12R1.48 COC1=COC(=CC1=O)C(O)=O Amb19516805 [0,1,0,0,0,0|2,0,0]=3 1339 B12R1.48 COc1[n]cc(cc1Br)C(N)=O Amb21926816 [0,1,0,0,0,0|2,0,0]=3 1340 B12R1.48 COc1[n]cc(cc1Br)C(O)=O Amb20669700 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.48 COc1[n]cc(cc1Br)N(=O)=O Amb20620500 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.48 COc1[n]cc(cc1Cl)[N+]([O-])=O Amb19516503 [0,1,0,0,0,0|3,0,0]=4 1343 B12R1.48 COc1[n]cc(cc1F)C(O)=O Amb21857151 [0,1,0,0,0,0|2,0,0]=3 1344 B12R1.48 COc1[n]cc(cc1F)[N+]([O-])=O Amb21856988 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.48 COc1[n]cc(cc1N)C(C)N Amb25779266 [0,1,0,0,0,0|2,0,1]=4 1346 B12R1.48 COc1[n]cc(cc1N)C(O)=O Amb24725823 [0,1,0,0,0,0|2,0,0]=3 1347 B12R1.48 COc1[n]cc(cc1N)[C@@H](C)N Amb24484157 [0,1,0,0,0,0|2,0,1]=4 1348 B12R1.48 COc1c[n]c(cc1Br)C(O)=O Amb25249336 [0,1,0,0,0,0|2,0,0]=3 1349 B12R1.48 COc1c[n]c(cc1Cl)C(=O)Cl Amb25364959 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.48 COc1c[n]c(cc1Cl)C(O)=O Amb22750140 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.48 COc1c[n]c(cc1Cl)[N+]([O-])=O Amb25258604 [0,1,0,0,0,0|3,0,0]=4 1352 B12R1.48 COc1c[n]c(cc1O)C(O)=O Amb22587310 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.48 COc1ccc([n]c1Br)C(C)C Amb25825029 [0,1,0,0,0,0|2,0,1]=4 1354 B12R1.48 COc1ccc([n]c1Br)C(N)=N Amb22289529 [0,1,0,0,0,0|3,0,0]=4 1355 B12R1.48 COc1ccc([n]c1Br)[C@H](C)N Amb25224901 [0,1,0,0,0,0|2,0,1]=4 1356 B12R1.48 COc1ccc([n]c1Cl)C(=O)Cl Amb24379892 [0,1,0,0,0,0|2,0,0]=3 1357 B12R1.48 COc1ccc([n]c1Cl)C(C)Cl Amb25133892 [0,1,0,0,0,0|2,0,1]=4 1358 B12R1.48 COc1ccc([n]c1Cl)C(C)O Amb25106044 [0,1,0,0,0,0|1,0,2]=4 1359 B12R1.48 COc1ccc([n]c1Cl)C(N)=N Amb22277057 [0,1,0,0,0,0|3,0,0]=4 1360 B12R1.48 COc1ccc([n]c1Cl)[N+]([O-])=O Amb22000951 [0,1,0,0,0,0|3,0,0]=4 1361 B12R1.48 COc1ccc([n]c1O)[N+]([O-])=O Amb22235741 [0,1,0,0,0,0|3,0,0]=4 1362 B12R1.48 COc1ccc(cc1Br)C(=O)C Amb1056189 [0,1,0,0,0,0|0,0,0]=1 1363 B12R1.48 COc1ccc(cc1Br)C(C)C Amb18246123 [0,1,0,0,0,0|1,0,1]=3 1364 B12R1.48 COc1ccc(cc1Br)C(Cl)Cl Amb25105939 [0,1,0,0,0,0|2,0,1]=4 1365 B12R1.48 COc1ccc(cc1Br)C(F)F Amb24574779 [0,1,0,0,0,0|2,0,1]=4 1366 B12R1.48 COc1ccc(cc1Br)C(N)=N Amb22748969 [0,1,0,0,0,0|2,0,0]=3 1367 B12R1.48 COc1ccc(cc1Br)C(O)C Amb1109911 [0,1,0,0,0,0|0,0,2]=3 1368 B12R1.48 COc1ccc(cc1Br)N(=O)=O Amb20620543 [0,1,0,0,0,0|2,0,0]=3 1369 B12R1.48 COc1ccc(cc1Br)N(C)C Amb17248853 [0,1,0,0,0,0|2,0,0]=3 1370 B12R1.48 COc1ccc(cc1Br)S(=O)Cl Amb24608477 [0,1,0,0,0,0|2,0,0]=3 1371 B12R1.48 COc1ccc(cc1Br)S(O)=O Amb18876758 [0,1,0,0,0,0|2,0,0]=3 1372 B12R1.48 COc1ccc(cc1Br)S([O-])=O Amb25055091 [0,1,0,0,0,0|2,0,0]=3 1373 B12R1.48 COc1ccc(cc1C)C(=O)N Amb17232524 [0,1,0,0,0,0|1,0,0]=2 1374 B12R1.48 COc1ccc(cc1C)C(=S)N Amb17233849 [0,1,0,0,0,0|1,1,0]=3 1375 B12R1.48 COc1ccc(cc1C)C(Br)C Amb17447080 [0,1,0,0,0,0|1,0,1]=3 1376 B12R1.48 COc1ccc(cc1C)C(Cl)C Amb17139099 [0,1,0,0,0,0|1,0,1]=3 1377 B12R1.48 COc1ccc(cc1C)C(O)C Amb17138605 [0,1,0,0,0,0|0,0,2]=3 1378 B12R1.48 COc1ccc(cc1C)[N+](=O)[O-] Amb17617644 [0,1,0,0,0,0|2,0,0]=3 1379 B12R1.48 COc1ccc(cc1Cl)C(=O)C Amb2209369 [0,1,0,0,0,0|0,0,0]=1 1380 B12R1.48 COc1ccc(cc1Cl)C(=O)O Amb2508444 [0,1,0,0,0,0|1,0,0]=2 1381 B12R1.48 COc1ccc(cc1Cl)C(=S)N Amb17237396 [0,1,0,0,0,0|1,1,0]=3 1382 B12R1.48 COc1ccc(cc1Cl)C(C)Br Amb19514795 [0,1,0,0,0,0|1,0,1]=3 1383 B12R1.48 COc1ccc(cc1Cl)C(C)Cl Amb25262035 [0,1,0,0,0,0|1,0,1]=3 1384 B12R1.48 COc1ccc(cc1Cl)C(C)O Amb18034504 [0,1,0,0,0,0|0,0,2]=3 1385 B12R1.48 COc1ccc(cc1Cl)C(F)F Amb24484129 [0,1,0,0,0,0|2,0,1]=4 1386 B12R1.48 COc1ccc(cc1Cl)C(N)=N Amb19045653 [0,1,0,0,0,0|2,0,0]=3 1387 B12R1.48 COc1ccc(cc1Cl)N(=O)=O Amb20620774 [0,1,0,0,0,0|2,0,0]=3 1388 B12R1.48 COc1ccc(cc1Cl)N(C)C Amb18932460 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.48 COc1ccc(cc1Cl)N(N)C Amb17234363 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.48 COc1ccc(cc1Cl)S(=O)Cl Amb18066850 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.48 COc1ccc(cc1Cl)S(O)=O Amb18567838 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.48 COc1ccc(cc1Cl)[C@@H](C)O Amb24454109 [0,1,0,0,0,0|0,0,2]=3 1393 B12R1.48 COc1ccc(cc1Cl)[C@H](C)O Amb20241604 [0,1,0,0,0,0|0,0,2]=3 1394 B12R1.48 COc1ccc(cc1F)B(O)O Amb1814623 [0,1,0,0,0,0|2,0,1]=4 1395 B12R1.48 COc1ccc(cc1F)C(=N)N Amb17577841 [0,1,0,0,0,0|2,0,0]=3 1396 B12R1.48 COc1ccc(cc1F)C(=O)C Amb1655434 [0,1,0,0,0,0|0,0,0]=1 1397 B12R1.48 COc1ccc(cc1F)C(=O)O Amb1214421 [0,1,0,0,0,0|1,0,0]=2 1398 B12R1.48 COc1ccc(cc1F)C(C)C Amb24540932 [0,1,0,0,0,0|1,0,1]=3 1399 B12R1.48 COc1ccc(cc1F)C(C)N Amb20623717 [0,1,0,0,0,0|1,0,1]=3 1400 B12R1.48 COc1ccc(cc1F)C(F)F Amb24432156 [0,1,0,0,0,0|2,0,1]=4 1401 B12R1.48 COc1ccc(cc1F)C(N)C Amb1106104 [0,1,0,0,0,0|1,0,1]=3 1402 B12R1.48 COc1ccc(cc1F)C(O)C Amb1110407 [0,1,0,0,0,0|0,0,2]=3 1403 B12R1.48 COc1ccc(cc1F)N(=O)=O Amb20621314 [0,1,0,0,0,0|2,0,0]=3 1404 B12R1.48 COc1ccc(cc1F)N(C)C Amb18269700 [0,1,0,0,0,0|2,0,0]=3 1405 B12R1.48 COc1ccc(cc1F)S(O)=O Amb18224847 [0,1,0,0,0,0|2,0,0]=3 1406 B12R1.48 COc1ccc(cc1F)S([O-])=O Amb25055417 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.48 COc1ccc(cc1F)[C@@H](C)N Amb22288626 [0,1,0,0,0,0|1,0,1]=3 1408 B12R1.48 COc1ccc(cc1F)[C@@H](C)N Amb22746758 [0,1,0,0,0,0|1,0,1]=3 1409 B12R1.48 COc1ccc(cc1F)[C@H](C)N Amb22008509 [0,1,0,0,0,0|1,0,1]=3 1410 B12R1.48 COc1ccc(cc1F)[C@H](C)N Amb22504243 [0,1,0,0,0,0|1,0,1]=3 1411 B12R1.48 COc1ccc(cc1I)C(=O)Cl Amb19888078 [0,1,0,0,0,0|1,0,0]=2 1412 B12R1.48 COc1ccc(cc1I)C(C)N Amb24695337 [0,1,0,0,0,0|1,0,1]=3 1413 B12R1.48 COc1ccc(cc1I)C(N)=O Amb23491841 [0,1,0,0,0,0|1,0,0]=2 1414 B12R1.48 COc1ccc(cc1I)N(=O)=O Amb20621472 [0,1,0,0,0,0|2,0,0]=3 1415 B12R1.48 COc1ccc(cc1I)[C@H](C)N Amb24382685 [0,1,0,0,0,0|1,0,1]=3 1416 B12R1.48 COc1ccc(cc1N)B(O)O Amb19959636 [0,1,0,0,0,0|2,0,1]=4 1417 B12R1.48 COc1ccc(cc1N)B(O)O Amb19959770 [0,1,0,0,0,0|2,0,1]=4 1418 B12R1.48 COc1ccc(cc1N)C(=O)C Amb1102517 [0,1,0,0,0,0|0,0,0]=1 1419 B12R1.48 COc1ccc(cc1N)C(=O)N Amb1116792 [0,1,0,0,0,0|1,0,0]=2 1420 B12R1.48 COc1ccc(cc1N)C(C)C Amb17203734 [0,1,0,0,0,0|1,0,1]=3 1421 B12R1.48 COc1ccc(cc1N)C(C)N Amb24392939 [0,1,0,0,0,0|1,0,1]=3 1422 B12R1.48 COc1ccc(cc1N)C(N)=N Amb24085811 [0,1,0,0,0,0|2,0,0]=3 1423 B12R1.48 COc1ccc(cc1N)C(O)=O Amb24117566 [0,1,0,0,0,0|1,0,0]=2 1424 B12R1.48 COc1ccc(cc1N)N(=O)=O Amb20621512 [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.48 COc1ccc(cc1N)[C@@H](C)N Amb24623061 [0,1,0,0,0,0|1,0,1]=3 1426 B12R1.48 COc1ccc(cc1N)[C@H](C)N Amb24707711 [0,1,0,0,0,0|1,0,1]=3 1427 B12R1.48 COc1ccc(cc1O)B(O)O Amb20171348 [0,1,0,0,0,0|2,0,1]=4 1428 B12R1.48 COc1ccc(cc1O)C(=N)Cl Amb24535460 [0,1,0,0,0,0|2,0,0]=3 1429 B12R1.48 COc1ccc(cc1O)C(=O)Cl Amb24102243 [0,1,0,0,0,0|1,0,0]=2 1430 B12R1.48 COc1ccc(cc1O)C(=S)N Amb1118278 [0,1,0,0,0,0|1,1,0]=3 1431 B12R1.48 COc1ccc(cc1O)C(C)C Amb17203736 [0,1,0,0,0,0|1,0,1]=3 1432 B12R1.48 COc1ccc(cc1O)C(F)F Amb25828044 [0,1,0,0,0,0|2,0,1]=4 1433 B12R1.48 COc1ccc(cc1O)C([O-])=O Amb22489487 [0,1,0,0,0,0|1,0,0]=2 1434 B12R1.48 COc1ccc(cc1O)N(=O)=O Amb20621527 [0,1,0,0,0,0|2,0,0]=3 1435 B12R1.48 COc1ccc(cc1O)[C@@H](C)N Amb22747730 [0,1,0,0,0,0|1,0,1]=3 1436 B12R1.48 COc1ccc(cc1O)[C@H](C)O Amb24367881 [0,1,0,0,0,0|0,0,2]=3 1437 B12R1.48 COc1ccc(cc1S)C(C)C Amb25159926 [0,1,0,0,0,0|1,0,1]=3 1438 B12R1.48 COc1ccc(cc1S)C(O)=O Amb18648895 [0,1,0,0,0,0|1,0,0]=2 1439 B12R1.48 COc1ccc(cc1S)[N+]([O-])=O Amb24595159 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.48 COc1ccc(nc1C)[N+](=O)[O-] Amb16231946 [0,1,0,0,0,0|3,0,0]=4 1441 B12R1.48 COc1ncc(cc1Cl)C(=O)O Amb1129480 [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.48 CSc1[n]cc(cc1Cl)C(O)=O Amb18281636 [0,1,0,0,0,0|2,1,0]=4 1443 B12R1.48 CSc1[n]cc(cc1N)C(O)=O Amb25674322 [0,1,0,0,0,0|2,1,0]=4 1444 B12R1.48 CSc1ccc([n]c1Cl)C(O)=O Amb25376418 [0,1,0,0,0,0|2,1,0]=4 1445 B12R1.48 CSc1ccc(c[n+]1C)C(N)=O Amb25369504 [0,1,0,0,0,0|2,1,0]=4 1446 B12R1.48 CSc1ccc(cc1Br)C(C)N Amb18287832 [0,1,0,0,0,0|1,1,1]=4 1447 B12R1.48 CSc1ccc(cc1Br)C(C)O Amb25718500 [0,1,0,0,0,0|0,1,2]=4 1448 B12R1.48 CSc1ccc(cc1Br)[C@@H](C)N Amb25832049 [0,1,0,0,0,0|1,1,1]=4 1449 B12R1.48 CSc1ccc(cc1Br)[C@@H](C)O Amb25683879 [0,1,0,0,0,0|0,1,2]=4 1450 B12R1.48 CSc1ccc(cc1Br)[C@H](C)N Amb25851654 [0,1,0,0,0,0|1,1,1]=4 1451 B12R1.48 CSc1ccc(cc1Br)[C@H](C)O Amb24736638 [0,1,0,0,0,0|0,1,2]=4 1452 B12R1.48 CSc1ccc(cc1Br)[N+]([O-])=O Amb24524859 [0,1,0,0,0,0|2,1,0]=4 1453 B12R1.48 CSc1ccc(cc1Cl)C(C)N Amb18287831 [0,1,0,0,0,0|1,1,1]=4 1454 B12R1.48 CSc1ccc(cc1Cl)C(N)=N Amb18317018 [0,1,0,0,0,0|2,1,0]=4 1455 B12R1.48 CSc1ccc(cc1Cl)C(O)=O Amb18967592 [0,1,0,0,0,0|1,1,0]=3 1456 B12R1.48 CSc1ccc(cc1Cl)[C@H](C)N Amb24362946 [0,1,0,0,0,0|1,1,1]=4 1457 B12R1.48 CSc1ccc(cc1Cl)[N+]([O-])=O Amb24065519 [0,1,0,0,0,0|2,1,0]=4 1458 B12R1.48 CSc1ccc(cc1F)C(=O)N Amb10839783 [0,1,0,0,0,0|1,1,0]=3 1459 B12R1.48 CSc1ccc(cc1F)C(C)N Amb18951033 [0,1,0,0,0,0|1,1,1]=4 1460 B12R1.48 CSc1ccc(cc1F)C(N)=N Amb19057448 [0,1,0,0,0,0|2,1,0]=4 1461 B12R1.48 CSc1ccc(cc1F)C(O)=O Amb18963583 [0,1,0,0,0,0|1,1,0]=3 1462 B12R1.48 CSc1ccc(cc1F)[C@@H](C)O Amb24584571 [0,1,0,0,0,0|0,1,2]=4 1463 B12R1.48 CSc1ccc(cc1F)[C@H](C)N Amb24462116 [0,1,0,0,0,0|1,1,1]=4 1464 B12R1.48 CSc1ccc(cc1F)[C@H](C)O Amb24723347 [0,1,0,0,0,0|0,1,2]=4 1465 B12R1.48 CSc1ccc(cc1F)[N+](=O)[O-] Amb16229658 [0,1,0,0,0,0|2,1,0]=4 1466 B12R1.48 CSc1ccc(cc1N)C(N)=O Amb18952933 [0,1,0,0,0,0|1,1,0]=3 1467 B12R1.48 CSc1ccc(cc1N)C(O)=O Amb18281544 [0,1,0,0,0,0|1,1,0]=3 1468 B12R1.48 CSc1ccc(cc1N)N(C)C Amb24517256 [0,1,0,0,0,0|2,1,0]=4 1469 B12R1.48 CSc1ccc(cc1N)[N+]([O-])=O Amb18286181 [0,1,0,0,0,0|2,1,0]=4 1470 B12R1.48 CSc1ccc(cc1O)C(C)C Amb24725228 [0,1,0,0,0,0|1,1,1]=4 1471 B12R1.48 CSc1ccc(cc1O)C(O)=O Amb24378928 [0,1,0,0,0,0|1,1,0]=3 1472 B12R1.48 Cc1[n]c(c[n]c1OC)C(C)=O Amb24663520 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.48 Cc1[n]c(ccc1OC)C(C)=O Amb25108492 [0,1,0,0,0,0|1,0,0]=2 1474 B12R1.48 Cc1cc([n]cc1CC)C(O)=O Amb24071339 [0,1,0,0,0,0|3,0,0]=4 1475 B12R1.48 Cc1cc([n]cc1CCl)C(C)=O Amb25842395 [0,1,0,0,0,0|3,0,0]=4 1476 B12R1.48 Cc1cc([n]cc1OC)C(O)=O Amb18827333 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.48 Cc1cc([n]cc1OC)[N+]([O-])=O Amb25377290 [0,1,0,0,0,0|3,0,0]=4 1478 B12R1.48 Cc1cc(c[n]c1CC)C(O)=O Amb18828411 [0,1,0,0,0,0|3,0,0]=4 1479 B12R1.48 Cc1cc(c[n]c1NC)C(C)=C Amb24616845 [0,1,0,0,0,0|3,0,0]=4 1480 B12R1.48 Cc1cc(c[n]c1NC)C(O)=O Amb23578565 [0,1,0,0,0,0|3,0,0]=4 1481 B12R1.48 Cc1cc(c[n]c1OC)C(C)N Amb23578500 [0,1,0,0,0,0|2,0,1]=4 1482 B12R1.48 Cc1cc(c[n]c1OC)C(C)O Amb23578503 [0,1,0,0,0,0|1,0,2]=4 1483 B12R1.48 Cc1cc(c[n]c1OC)C(N)=O Amb25195217 [0,1,0,0,0,0|2,0,0]=3 1484 B12R1.48 Cc1cc(c[n]c1OC)C(O)=O Amb22174138 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.48 Cc1cc(c[n]c1OC)N(=O)=O Amb20621505 [0,1,0,0,0,0|3,0,0]=4 1486 B12R1.48 Cc1cc(c[n]c1SC)C(N)=O Amb24381571 [0,1,0,0,0,0|2,1,0]=4 1487 B12R1.48 Cc1cc(c[n]c1SC)C(O)=O Amb23578541 [0,1,0,0,0,0|2,1,0]=4 1488 B12R1.48 Cc1cc(ccc1C#N)C(=O)Cl Amb25684160 [0,1,0,0,0,0|3,0,0]=4 1489 B12R1.48 Cc1cc(ccc1C#N)C(N)=O Amb25802352 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.48 Cc1cc(ccc1CBr)C(O)=O Amb25353603 [0,1,0,0,0,0|3,0,0]=4 1491 B12R1.48 Cc1cc(ccc1CC)C(C)N Amb25776879 [0,1,0,0,0,0|2,0,1]=4 1492 B12R1.48 Cc1cc(ccc1CC)C(O)=O Amb24660519 [0,1,0,0,0,0|2,0,0]=3 1493 B12R1.48 Cc1cc(ccc1CF)C(O)=O Amb24402257 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.48 Cc1cc(ccc1CI)C(N)=O Amb25350099 [0,1,0,0,0,0|3,0,0]=4 1495 B12R1.48 Cc1cc(ccc1CI)C(O)=O Amb24382266 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.48 Cc1cc(ccc1CN)C(N)=O Amb25760696 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.48 Cc1cc(ccc1CN)C(O)=O Amb18646312 [0,1,0,0,0,0|3,0,0]=4 1498 B12R1.48 Cc1cc(ccc1CO)C(O)=O Amb25797257 [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.48 Cc1cc(ccc1CS)C(O)=O Amb25139323 [0,1,0,0,0,0|3,0,0]=4 1500 B12R1.48 Cc1cc(ccc1NC)C(C)C Amb24070421 [0,1,0,0,0,0|2,0,1]=4 1501 B12R1.48 Cc1cc(ccc1NC)C(N)=N Amb18284916 [0,1,0,0,0,0|3,0,0]=4 1502 B12R1.48 Cc1cc(ccc1NC)C(N)=O Amb18288739 [0,1,0,0,0,0|2,0,0]=3 1503 B12R1.48 Cc1cc(ccc1NC)C(N)=S Amb18950360 [0,1,0,0,0,0|2,1,0]=4 1504 B12R1.48 Cc1cc(ccc1NC)C(O)=O Amb18963552 [0,1,0,0,0,0|2,0,0]=3 1505 B12R1.48 Cc1cc(ccc1NC)N(C)C Amb18967622 [0,1,0,0,0,0|3,0,0]=4 1506 B12R1.48 Cc1cc(ccc1NO)C(O)=O Amb22753291 [0,1,0,0,0,0|3,0,0]=4 1507 B12R1.48 Cc1cc(ccc1OC)C(=O)Cl Amb21961742 [0,1,0,0,0,0|1,0,0]=2 1508 B12R1.48 Cc1cc(ccc1OC)C(C)N Amb22587421 [0,1,0,0,0,0|1,0,1]=3 1509 B12R1.48 Cc1cc(ccc1OC)C(N)=N Amb18792556 [0,1,0,0,0,0|2,0,0]=3 1510 B12R1.48 Cc1cc(ccc1OC)N(=O)=O Amb20621531 [0,1,0,0,0,0|2,0,0]=3 1511 B12R1.48 Cc1cc(ccc1OC)S(=O)Cl Amb18567175 [0,1,0,0,0,0|2,0,0]=3 1512 B12R1.48 Cc1cc(ccc1OC)S(O)=O Amb18564382 [0,1,0,0,0,0|2,0,0]=3 1513 B12R1.48 Cc1cc(ccc1OC)S([O-])=O Amb25230527 [0,1,0,0,0,0|2,0,0]=3 1514 B12R1.48 Cc1cc(ccc1OC)[C@@H](C)O Amb24546350 [0,1,0,0,0,0|0,0,2]=3 1515 B12R1.48 Cc1cc(ccc1OC)[C@H](C)N Amb24382207 [0,1,0,0,0,0|1,0,1]=3 1516 B12R1.48 Cc1cc(ccc1OC)[C@H](C)O Amb25337353 [0,1,0,0,0,0|0,0,2]=3 1517 B12R1.48 Cc1cc(ccc1SC)C(N)=N Amb18796348 [0,1,0,0,0,0|2,1,0]=4 1518 B12R1.48 Cc1cc(ccc1SC)C(O)=O Amb18963584 [0,1,0,0,0,0|1,1,0]=3 1519 B12R1.48 N#Cc1ccc(cc1Br)C(O)=O Amb21857027 [0,1,0,0,0,0|3,0,0]=4 1520 B12R1.48 N#Cc1ccc(cc1C)C(=O)C Amb10070845 [0,1,0,0,0,0|2,0,0]=3 1521 B12R1.48 N#Cc1ccc(cc1C)C(=O)O Amb16231792 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.48 N#Cc1ccc(cc1F)C(=O)C Amb16191999 [0,1,0,0,0,0|2,0,0]=3 1523 B12R1.48 N#Cc1ccc(cc1F)C(=O)Cl Amb25114750 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.48 N#Cc1ccc(cc1O)C(=O)Cl Amb24650613 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.48 N#[N+]c1ccc(cc1O)C([O-])=O Amb24497184 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.48 NC(=O)c1cc(F)c(cc1)C#N Amb24484271 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.48 NC(=O)c1ccc(CBr)c(Cl)c1 Amb25766222 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.48 NC(=O)c1ccc(NN)c(F)c1 Amb18793274 [0,1,0,0,0,0|3,0,0]=4 1529 B12R1.48 NCc1ccc(cc1Cl)C(O)=O Amb22499603 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.48 NCc1ccc(cc1F)C(O)=O Amb21984594 [0,1,0,0,0,0|3,0,0]=4 1531 B12R1.48 NCc1ccc(cc1F)C(O)=O Amb25149911 [0,1,0,0,0,0|3,0,0]=4 1532 B12R1.48 NCc1ccc(cc1I)C(O)=O Amb25817233 [0,1,0,0,0,0|3,0,0]=4 1533 B12R1.48 NCc1ccc(cc1O)C(O)=O Amb25806241 [0,1,0,0,0,0|3,0,0]=4 1534 B12R1.48 NNc1ccc(cc1I)C(O)=O Amb24346560 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.48 NNc1ccc(cc1O)C(O)=O Amb25248712 [0,1,0,0,0,0|3,0,0]=4 1536 B12R1.48 NOc1ccc(cc1Cl)[N+]([O-])=O Amb25685790 [0,1,0,0,0,0|3,0,0]=4 1537 B12R1.48 Nc1cc(ccc1C=O)C(O)=O Amb25174169 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.48 O=C(Cl)c1ccc(CCl)c(F)c1 Amb24102946 [0,1,0,0,0,0|3,0,0]=4 1539 B12R1.48 O=Cc1ccc(cc1O)C(=O)O Amb10602735 [0,1,0,0,0,0|3,0,0]=4 1540 B12R1.48 OC(=O)c1cc(Cl)c(CCl)cc1 Amb24395224 [0,1,0,0,0,0|3,0,0]=4 1541 B12R1.48 OC(=O)c1ccc(C=O)c(Br)c1 Amb21857331 [0,1,0,0,0,0|3,0,0]=4 1542 B12R1.48 OC(=O)c1ccc(C=O)c(Cl)c1 Amb18649008 [0,1,0,0,0,0|3,0,0]=4 1543 B12R1.48 OC(=O)c1ccc(C=O)c(F)c1 Amb22494636 [0,1,0,0,0,0|3,0,0]=4 1544 B12R1.48 OC(=O)c1ccc(CBr)c(Cl)c1 Amb20620507 [0,1,0,0,0,0|3,0,0]=4 1545 B12R1.48 OC(=O)c1ccc(CBr)c(I)c1 Amb22735959 [0,1,0,0,0,0|3,0,0]=4 1546 B12R1.48 OC(=O)c1ccc(CF)c(Br)c1 Amb25817243 [0,1,0,0,0,0|3,0,0]=4 1547 B12R1.48 OC(=O)c1ccc(CF)c(Cl)c1 Amb25342126 [0,1,0,0,0,0|3,0,0]=4 1548 B12R1.48 OC(=O)c1ccc(CI)c(Br)c1 Amb25783168 [0,1,0,0,0,0|3,0,0]=4 1549 B12R1.48 OC(=O)c1ccc(CO)c(Cl)c1 Amb25281582 [0,1,0,0,0,0|3,0,0]=4 1550 B12R1.48 OC(=O)c1ccc(CO)c(F)c1 Amb18967400 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.48 OC(=O)c1ccc(CS)c(Cl)c1 Amb24441839 [0,1,0,0,0,0|3,0,0]=4 1552 B12R1.48 Oc1cc(ccc1CBr)C(O)=O Amb25682490 [0,1,0,0,0,0|3,0,0]=4 1553 B12R1.48 Oc1cc(ccc1CI)C(O)=O Amb24730825 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.48 Oc1cc(ccc1CO)C(O)=O Amb18646835 [0,1,0,0,0,0|3,0,0]=4 1555 B12R1.48 [C-]#[N+]c1ccc(cc1C)C(O)=O Amb24083056 [0,1,0,0,0,0|2,0,1]=4 1556 B12R1.113 BrCC[n+]1ccc(cc1)C(=O)O Amb2228344 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.113 C#CCc1ccc(cc1)C(O)=O Amb24102775 [0,1,0,0,0,0|2,0,1]=4 1558 B12R1.113 C=C(Cl)c1ccc(CCCl)cc1 Amb24392073 [0,1,0,0,0,0|2,0,1]=4 1559 B12R1.113 C=CCc1ccc(cc1)C(N)=O Amb24091171 [0,1,0,0,0,0|2,0,1]=4 1560 B12R1.113 C=COc1ccc(cc1)C(N)=O Amb25839119 [0,1,0,0,0,0|1,0,1]=3 1561 B12R1.113 C=COc1ccc(cc1)[N+]([O-])=O Amb25152312 [0,1,0,0,0,0|2,0,1]=4 1562 B12R1.113 C=NNc1ccc(cc1)C(O)=O Amb25667040 [0,1,0,0,0,0|2,0,1]=4 1563 B12R1.113 CC#Cc1c[n]c(cc1)C(O)=O Amb25127723 [0,1,0,0,0,0|3,0,0]=4 1564 B12R1.113 CC#Cc1ccc(cc1)C(N)=O Amb24102699 [0,1,0,0,0,0|2,0,0]=3 1565 B12R1.113 CC#Cc1ccc(cc1)C(O)=O Amb24102700 [0,1,0,0,0,0|2,0,0]=3 1566 B12R1.113 CC#Cc1ccc(cc1)N(C)C Amb24072814 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.113 CC(=C)c1ccc(cc1)N=C=O Amb25095823 [0,1,0,0,0,0|2,0,1]=4 1568 B12R1.113 CC(=O)c1c[n]c(CCC)c[n]1 Amb24388624 [0,1,0,0,0,0|3,0,0]=4 1569 B12R1.113 CC(=O)c1c[n]c([n]c1)OCC Amb25245909 [0,1,0,0,0,0|2,0,0]=3 1570 B12R1.113 CC(=O)c1ccc(C=C=C)cc1 Amb25142672 [0,1,0,0,0,0|1,0,1]=3 1571 B12R1.113 CC(=O)c1ccc(CC#C)cc1 Amb24465092 [0,1,0,0,0,0|1,0,1]=3 1572 B12R1.113 CC(=O)c1ccc(CC#N)cc1 Amb18645173 [0,1,0,0,0,0|1,0,1]=3 1573 B12R1.113 CC(=O)c1ccc(CC=C)c[n]1 Amb24583102 [0,1,0,0,0,0|2,0,1]=4 1574 B12R1.113 CC(=O)c1ccc(CC=C)cc1 Amb25359156 [0,1,0,0,0,0|1,0,1]=3 1575 B12R1.113 CC(=O)c1ccc(CC=O)cc1 Amb18645641 [0,1,0,0,0,0|1,0,1]=3 1576 B12R1.113 CC(=O)c1ccc(CCO)[n]c1 Amb25353866 [0,1,0,0,0,0|2,0,0]=3 1577 B12R1.113 CC(=O)c1ccc(COC)[n]c1 Amb25822711 [0,1,0,0,0,0|1,0,0]=2 1578 B12R1.113 CC(=O)c1ccc(COC)cc1 Amb24093968 [0,1,0,0,0,0|0,0,0]=1 1579 B12R1.113 CC(=O)c1ccc(NCC)[n]c1 Amb24450910 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.113 CC(=O)c1ccc([n]c1)OCC Amb22728744 [0,1,0,0,0,0|1,0,0]=2 1581 B12R1.113 CC(=O)c1ccc(\C=C\C)cc1 Amb25334893 [0,1,0,0,0,0|1,0,0]=2 1582 B12R1.113 CC(=O)c1ccc(\C=C\Cl)cc1 Amb25241547 [0,1,0,0,0,0|1,0,1]=3 1583 B12R1.113 CC(=O)c1ccc(\C=N\O)cc1 Amb25667598 [0,1,0,0,0,0|2,0,0]=3 1584 B12R1.113 CC(=O)c1ccc(c[n]1)N=[N+]=[N-] Amb24493151 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.113 CC(=O)c1ccc(cc1)C#CCl Amb25759593 [0,1,0,0,0,0|1,0,1]=3 1586 B12R1.113 CC(=O)c1ccc(cc1)C#CN Amb24520492 [0,1,0,0,0,0|1,0,1]=3 1587 B12R1.113 CC(=O)c1ccc(cc1)N=[N+]=[N-] Amb17608623 [0,1,0,0,0,0|2,0,0]=3 1588 B12R1.113 CC(=O)c1ccc(cc1)OC#N Amb24706948 [0,1,0,0,0,0|0,0,1]=2 1589 B12R1.113 CC(=O)c1ccc(cc1)OC=C Amb25313870 [0,1,0,0,0,0|0,0,1]=2 1590 B12R1.113 CC(=O)c1ccc(cc1)OCCl Amb25151089 [0,1,0,0,0,0|0,0,0]=1 1591 B12R1.113 CC(=O)c1ccc(cc1)OCF Amb22498072 [0,1,0,0,0,0|0,0,0]=1 1592 B12R1.113 CC(C)c1ccc(CCBr)cc1 Amb24063957 [0,1,0,0,0,0|2,0,1]=4 1593 B12R1.113 CC(C)c1ccc(CCCl)cc1 Amb18321798 [0,1,0,0,0,0|2,0,1]=4 1594 B12R1.113 CC(C)c1ccc(CCN)cc1 Amb22347973 [0,1,0,0,0,0|2,0,1]=4 1595 B12R1.113 CC(N)c1ccc(CCBr)cc1 Amb25222723 [0,1,0,0,0,0|2,0,1]=4 1596 B12R1.113 CC(N)c1ccc(CCF)cc1 Amb25179928 [0,1,0,0,0,0|2,0,1]=4 1597 B12R1.113 CC(N)c1ccc(CCN)cc1 Amb24627626 [0,1,0,0,0,0|2,0,1]=4 1598 B12R1.113 CCCc1ccc(c[n]1)C(N)=O Amb25335491 [0,1,0,0,0,0|3,0,0]=4 1599 B12R1.113 CCCc1ccc(c[n]1)C(O)=O Amb25669454 [0,1,0,0,0,0|3,0,0]=4 1600 B12R1.113 CCCc1ccc(cc1)C(=S)N Amb17233645 [0,1,0,0,0,0|2,1,0]=4 1601 B12R1.113 CCCc1ccc(cc1)C(C)C Amb24092687 [0,1,0,0,0,0|2,0,1]=4 1602 B12R1.113 CCCc1ccc(cc1)C(N)=N Amb18893468 [0,1,0,0,0,0|3,0,0]=4 1603 B12R1.113 CCCc1ccc(cc1)C(N)C Amb1112458 [0,1,0,0,0,0|2,0,1]=4 1604 B12R1.113 CCCc1ccc(cc1)C(O)C Amb1109791 [0,1,0,0,0,0|1,0,2]=4 1605 B12R1.113 CCCc1ccc(cc1)N(C)C Amb10565805 [0,1,0,0,0,0|3,0,0]=4 1606 B12R1.113 CCCc1ccc(cc1)S(=O)Cl Amb25319881 [0,1,0,0,0,0|3,0,0]=4 1607 B12R1.113 CCCc1ccc(cc1)S(O)=O Amb18863095 [0,1,0,0,0,0|3,0,0]=4 1608 B12R1.113 CCCc1ccc(cc1)S([O-])=O Amb19944459 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.113 CCCc1ccc(nc1)C(=O)O Amb1788905 [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.113 CCNc1c[n]c(cc1)C(N)=O Amb25308685 [0,1,0,0,0,0|3,0,0]=4 1611 B12R1.113 CCNc1ccc(c[n]1)C(N)=O Amb18986034 [0,1,0,0,0,0|3,0,0]=4 1612 B12R1.113 CCNc1ccc(cc1)C(=O)C Amb17305940 [0,1,0,0,0,0|1,0,0]=2 1613 B12R1.113 CCNc1ccc(cc1)C(N)=N Amb18987291 [0,1,0,0,0,0|3,0,0]=4 1614 B12R1.113 CCNc1ccc(cc1)C(O)=O Amb24066045 [0,1,0,0,0,0|2,0,0]=3 1615 B12R1.113 CCNc1ccc(cc1)[N+]([O-])=O Amb19959925 [0,1,0,0,0,0|3,0,0]=4 1616 B12R1.113 CCNc1ccc(cc1)[P+]([O-])=O Amb24489037 [0,1,0,0,0,0|3,0,0]=4 1617 B12R1.113 CCOc1[n]cc(c[n]1)C(N)=O Amb25133516 [0,1,0,0,0,0|3,0,0]=4 1618 B12R1.113 CCOc1c[n]c(c[n]1)C(=O)Cl Amb24071289 [0,1,0,0,0,0|3,0,0]=4 1619 B12R1.113 CCOc1c[n]c(c[n]1)C(N)=O Amb25765705 [0,1,0,0,0,0|3,0,0]=4 1620 B12R1.113 CCOc1c[n]c(c[n]1)C(O)=O Amb21857005 [0,1,0,0,0,0|3,0,0]=4 1621 B12R1.113 CCOc1c[n]c(cc1)C(N)=S Amb25297690 [0,1,0,0,0,0|2,1,0]=4 1622 B12R1.113 CCOc1c[n]c(cc1)C(O)=O Amb21857022 [0,1,0,0,0,0|2,0,0]=3 1623 B12R1.113 CCOc1ccc(c[n]1)C(C)N Amb23446354 [0,1,0,0,0,0|2,0,1]=4 1624 B12R1.113 CCOc1ccc(c[n]1)C(C)O Amb23446351 [0,1,0,0,0,0|1,0,2]=4 1625 B12R1.113 CCOc1ccc(c[n]1)N(=O)=O Amb20621192 [0,1,0,0,0,0|3,0,0]=4 1626 B12R1.113 CCOc1ccc(c[n]1)N(C)N Amb24697025 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.113 CCOc1ccc(cc1)C(=O)C Amb1212251 [0,1,0,0,0,0|0,0,0]=1 1628 B12R1.113 CCOc1ccc(cc1)C(=O)N Amb1242086 [0,1,0,0,0,0|1,0,0]=2 1629 B12R1.113 CCOc1ccc(cc1)C(C)C Amb24103768 [0,1,0,0,0,0|1,0,1]=3 1630 B12R1.113 CCOc1ccc(cc1)C(Cl)Cl Amb25830458 [0,1,0,0,0,0|2,0,1]=4 1631 B12R1.113 CCOc1ccc(cc1)C(N)C Amb1108749 [0,1,0,0,0,0|1,0,1]=3 1632 B12R1.113 CCOc1ccc(cc1)C(O)C Amb1111434 [0,1,0,0,0,0|0,0,2]=3 1633 B12R1.113 CCOc1ccc(cc1)N(C)C Amb10554040 [0,1,0,0,0,0|2,0,0]=3 1634 B12R1.113 CCOc1ccc(cc1)P(Cl)Cl Amb25851512 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.113 CCOc1ccc(cc1)S(=O)Cl Amb18567178 [0,1,0,0,0,0|2,0,0]=3 1636 B12R1.113 CCOc1ccc(cc1)S(O)=O Amb18066180 [0,1,0,0,0,0|2,0,0]=3 1637 B12R1.113 CCOc1ccc(cc1)[C@@H](C)N Amb22288633 [0,1,0,0,0,0|1,0,1]=3 1638 B12R1.113 CCOc1ccc(cc1)[C@H](C)N Amb22288690 [0,1,0,0,0,0|1,0,1]=3 1639 B12R1.113 CCOc1ccc(cn1)C(=O)N Amb10609183 [0,1,0,0,0,0|2,0,0]=3 1640 B12R1.113 CCOc1ccc(cn1)C(=O)O Amb1127951 [0,1,0,0,0,0|2,0,0]=3 1641 B12R1.113 CCSc1c[n]c(cc1)C(O)=O Amb25088438 [0,1,0,0,0,0|2,1,0]=4 1642 B12R1.113 CCSc1ccc(c[n]1)C(N)=O Amb25246488 [0,1,0,0,0,0|2,1,0]=4 1643 B12R1.113 CCSc1ccc(cc1)C(=O)Cl Amb25045405 [0,1,0,0,0,0|1,1,0]=3 1644 B12R1.113 CCSc1ccc(cc1)C(=O)O Amb1125236 [0,1,0,0,0,0|1,1,0]=3 1645 B12R1.113 CCSc1ccc(cc1)C(N)=O Amb18055255 [0,1,0,0,0,0|1,1,0]=3 1646 B12R1.113 CCSc1ccc(cc1)C(N)=S Amb18244098 [0,1,0,0,0,0|1,2,0]=4 1647 B12R1.113 CCSc1ccc(cc1)C(O)C Amb13882237 [0,1,0,0,0,0|0,1,2]=4 1648 B12R1.113 CCSc1ccc(cc1)N(C)C Amb24487355 [0,1,0,0,0,0|2,1,0]=4 1649 B12R1.113 CCSc1ccc(cc1)S(O)=O Amb18224945 [0,1,0,0,0,0|2,1,0]=4 1650 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N Amb25344087 [0,1,0,0,0,0|1,1,1]=4 1651 B12R1.113 CCSc1ccc(cc1)[C@@H](C)O Amb25319357 [0,1,0,0,0,0|0,1,2]=4 1652 B12R1.113 CCSc1ccc(cc1)[C@H](C)N Amb24457386 [0,1,0,0,0,0|1,1,1]=4 1653 B12R1.113 CN(C)c1ccc(CCN)cc1 Amb19959918 [0,1,0,0,0,0|3,0,0]=4 1654 B12R1.113 CN(C)c1ccc(CCS)cc1 Amb25296806 [0,1,0,0,0,0|3,0,0]=4 1655 B12R1.113 CN(C)c1ccc(CNC)cc1 Amb22495667 [0,1,0,0,0,0|3,0,0]=4 1656 B12R1.113 CNCc1ccc(c[n]1)C(O)=O Amb25299191 [0,1,0,0,0,0|3,0,0]=4 1657 B12R1.113 CNCc1ccc(cc1)C(=O)O Amb2119453 [0,1,0,0,0,0|2,0,0]=3 1658 B12R1.113 CNCc1ccc(cc1)C(C)C Amb1105679 [0,1,0,0,0,0|2,0,1]=4 1659 B12R1.113 CNCc1ccc(cc1)C(N)=S Amb25031589 [0,1,0,0,0,0|2,1,0]=4 1660 B12R1.113 CNCc1ccc(cc1)N(C)C Amb1214551 [0,1,0,0,0,0|3,0,0]=4 1661 B12R1.113 CNCc1ccc(cc1)N(C)C Amb17935661 [0,1,0,0,0,0|3,0,0]=4 1662 B12R1.113 COCc1c[n]c(c[n]1)C(O)=O Amb25309523 [0,1,0,0,0,0|3,0,0]=4 1663 B12R1.113 COCc1ccc(c[n]1)C(O)=O Amb25060084 [0,1,0,0,0,0|2,0,0]=3 1664 B12R1.113 COCc1ccc(cc1)B(O)O Amb2456021 [0,1,0,0,0,0|2,0,1]=4 1665 B12R1.113 COCc1ccc(cc1)C(=O)Cl Amb24103006 [0,1,0,0,0,0|1,0,0]=2 1666 B12R1.113 COCc1ccc(cc1)C(=O)O Amb1215734 [0,1,0,0,0,0|1,0,0]=2 1667 B12R1.113 COCc1ccc(cc1)C(C)N Amb25697134 [0,1,0,0,0,0|1,0,1]=3 1668 B12R1.113 COCc1ccc(cc1)C(C)O Amb24649654 [0,1,0,0,0,0|0,0,2]=3 1669 B12R1.113 COCc1ccc(cc1)[C@@H](C)N Amb25260243 [0,1,0,0,0,0|1,0,1]=3 1670 B12R1.113 COCc1ncc(cn1)C(=O)O Amb17486787 [0,1,0,0,0,0|3,0,0]=4 1671 B12R1.113 CS(=O)c1ccc(CC=O)cc1 Amb25751611 [0,1,0,0,0,0|2,0,1]=4 1672 B12R1.113 CS(=O)c1ccc(CCBr)cc1 Amb24643974 [0,1,0,0,0,0|2,0,0]=3 1673 B12R1.113 CS(=O)c1ccc(CCCl)cc1 Amb24632708 [0,1,0,0,0,0|2,0,0]=3 1674 B12R1.113 CS(=O)c1ccc(CCI)cc1 Amb25100372 [0,1,0,0,0,0|2,0,0]=3 1675 B12R1.113 CS(=O)c1ccc(CNC)cc1 Amb20622368 [0,1,0,0,0,0|2,0,0]=3 1676 B12R1.113 CSCc1ccc(cc1)C(=S)N Amb17498206 [0,1,0,0,0,0|1,2,0]=4 1677 B12R1.113 CSCc1ccc(cc1)C(N)=N Amb18796350 [0,1,0,0,0,0|2,1,0]=4 1678 B12R1.113 C[C@@H](N)c1ccc(CCCl)cc1 Amb25076716 [0,1,0,0,0,0|2,0,1]=4 1679 B12R1.113 C[C@@H](N)c1ccc(CCO)cc1 Amb25714674 [0,1,0,0,0,0|2,0,1]=4 1680 B12R1.113 C\C=C\c1ccc(c[n]1)C(O)=O Amb24497140 [0,1,0,0,0,0|3,0,0]=4 1681 B12R1.113 C\C=C\c1ccc(cc1)[N+](=O)[O-] Amb1780567 [0,1,0,0,0,0|3,0,0]=4 1682 B12R1.113 C\N=C/c1ccc(cc1)C(C)C Amb24433848 [0,1,0,0,0,0|2,0,1]=4 1683 B12R1.113 C\N=C\c1ccc(cc1)[N+](=O)[O-] Amb10564259 [0,1,0,0,0,0|3,0,0]=4 1684 B12R1.113 ClCCc1ccc(cc1)C(=O)C Amb2414329 [0,1,0,0,0,0|1,0,0]=2 1685 B12R1.113 FCCc1ccc(cc1)[N+](=O)[O-] Amb10776172 [0,1,0,0,0,0|3,0,0]=4 1686 B12R1.113 N#CCc1ccc(cc1)C(=O)Cl Amb24102951 [0,1,0,0,0,0|2,0,1]=4 1687 B12R1.113 NC(=N)c1ccc(CCN)cc1 Amb24756566 [0,1,0,0,0,0|3,0,0]=4 1688 B12R1.113 NC(=N)c1ccc(CCO)cc1 Amb25724340 [0,1,0,0,0,0|3,0,0]=4 1689 B12R1.113 NC(=O)c1ccc(CCO)cc1 Amb25195036 [0,1,0,0,0,0|2,0,0]=3 1690 B12R1.113 NC(=O)c1ccc(CNO)cc1 Amb25336009 [0,1,0,0,0,0|3,0,0]=4 1691 B12R1.113 NC(=O)c1ccc(CON)[n]c1 Amb25205134 [0,1,0,0,0,0|3,0,0]=4 1692 B12R1.113 NC(=O)c1ccc(\C=N\N)cc1 Amb25316753 [0,1,0,0,0,0|3,0,0]=4 1693 B12R1.113 NC(=O)c1ccc(cc1)C#CN Amb24102917 [0,1,0,0,0,0|2,0,1]=4 1694 B12R1.113 NC(=O)c1ccc(cc1)NC#N Amb18800502 [0,1,0,0,0,0|2,0,1]=4 1695 B12R1.113 NCCc1ccc(cc1)C(=O)C Amb17101563 [0,1,0,0,0,0|1,0,0]=2 1696 B12R1.113 NCCc1ccc(cc1)C(=O)N Amb17084754 [0,1,0,0,0,0|2,0,0]=3 1697 B12R1.113 NCCc1ccc(cc1)C(=O)O Amb2371255 [0,1,0,0,0,0|2,0,0]=3 1698 B12R1.113 NCCc1ccc(cc1)C(O)C Amb17101676 [0,1,0,0,0,0|1,0,2]=4 1699 B12R1.113 NCCc1ccc(cc1)N(=O)=O Amb20621884 [0,1,0,0,0,0|3,0,0]=4 1700 B12R1.113 NOCc1ccc(c[n]1)C(O)=O Amb25828055 [0,1,0,0,0,0|3,0,0]=4 1701 B12R1.113 NOCc1ccc(cc1)C(C)C Amb17091440 [0,1,0,0,0,0|2,0,1]=4 1702 B12R1.113 N\N=C\c1ccc(cc1)C(O)=O Amb25798906 [0,1,0,0,0,0|3,0,0]=4 1703 B12R1.113 O=C(Cl)c1ccc(CCCl)cc1 Amb25803515 [0,1,0,0,0,0|2,0,0]=3 1704 B12R1.113 O=C(Cl)c1ccc(cc1)N=C=S Amb22274848 [0,1,0,0,0,0|2,0,1]=4 1705 B12R1.113 OB(O)c1ccc(cc1)OCS Amb24723611 [0,1,0,0,0,0|2,0,1]=4 1706 B12R1.113 OC(=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)N=[N+]=[N-] Amb17608627 [0,1,0,0,0,0|3,0,0]=4 1707 B12R1.113 OC(=O)c1ccc(CC=O)cc1 Amb24546252 [0,1,0,0,0,0|2,0,1]=4 1708 B12R1.113 OC(=O)c1ccc(CCO)c[n]1 Amb22015152 [0,1,0,0,0,0|3,0,0]=4 1709 B12R1.113 OC(=O)c1ccc(cc1)C#CBr Amb18102387 [0,1,0,0,0,0|2,0,1]=4 1710 B12R1.113 OC(=O)c1ccc(cc1)N=C=O Amb18645757 [0,1,0,0,0,0|2,0,1]=4 1711 B12R1.113 OCCc1ccc(cc1)C(=O)S Amb24733277 [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.113 OCCc1ccc(cc1)C(C)C Amb17089518 [0,1,0,0,0,0|2,0,1]=4 1713 B12R1.113 O\N=C\c1ccc(cc1)C(=O)O Amb1209776 [0,1,0,0,0,0|3,0,0]=4 1714 B12R1.113 SCCc1ccc(cc1)C(C)C Amb17400845 [0,1,0,0,0,0|2,0,1]=4 1715 B12R1.113 [N-]=[N+]=Nc1ccc(cc1)C(=O)Cl Amb24113126 [0,1,0,0,0,0|3,0,0]=4 1716 B12R1.113 [NH3+]OCc1ccc(cc1)C(=O)O Amb2437212 [0,1,0,0,0,0|2,0,0]=3 1717 B12R1.113 [O-]C(=O)c1cc[n+](CCO)cc1 Amb25156765 [0,1,0,0,0,0|3,0,0]=4 1718 B12R1.113 [O-][N+](=O)c1ccc(CCCl)cc1 Amb22227922 [0,1,0,0,0,0|3,0,0]=4 1719 B12R1.113 [O-][N+](=O)c1ccc(CCI)cc1 Amb24064020 [0,1,0,0,0,0|3,0,0]=4 1720 B12R1.113 [O-][N+](=O)c1ccc(cc1)OCCl Amb24654323 [0,1,0,0,0,0|2,0,0]=3 1721 B12R1.113 [O-][N+](=O)c1ccc(cc1)SCCl Amb24487386 [0,1,0,0,0,0|2,1,0]=4 1722 B12R1.256 CC(=C)c1ccc(c[n]1)C(O)=O Amb24578669 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.256 CC(=C)c1ccc(cc1)B(O)O Amb25741486 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.256 CC(=C)c1ccc(cc1)C(=O)Cl Amb25210673 [0,1,0,0,0,0|2,0,0]=3 1725 B12R1.256 CC(=C)c1ccc(cc1)C(C)O Amb25796379 [0,1,0,0,0,0|2,0,0]=3 1726 B12R1.256 CC(=C)c1ccc(cc1)C(N)=O Amb24070396 [0,1,0,0,0,0|2,0,0]=3 1727 B12R1.256 CC(=O)N1C=CC(C=C1)C(C)=O Amb24648782 [0,1,0,0,0,0|2,0,1]=4 1728 B12R1.256 CC(=O)c1c[n]c(c[n]1)C(C)=O Amb24061010 [0,1,0,0,0,0|3,0,0]=4 1729 B12R1.256 CC(=O)c1c[n]c(c[n]1)C(C)C Amb24619650 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.256 CC(=O)c1c[n]c(cc1)[N+]([O-])=O Amb23437217 [0,1,0,0,0,0|3,0,0]=4 1731 B12R1.256 CC(=O)c1ccc([n][n]1)N(C)C Amb24432241 [0,1,0,0,0,0|3,0,0]=4 1732 B12R1.256 CC(=O)c1ccc([n]c1)N(C)C Amb25337500 [0,1,0,0,0,0|2,0,0]=3 1733 B12R1.256 CC(=O)c1ccc(c[n]1)C(O)=O Amb25064761 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.256 CC(=O)c1ccc(c[n]1)[N+]([O-])=O Amb20241424 [0,1,0,0,0,0|3,0,0]=4 1735 B12R1.256 CC(=O)c1ccc(cc1)C(=O)Cl Amb24092960 [0,1,0,0,0,0|2,0,0]=3 1736 B12R1.256 CC(=O)c1ccc(cc1)C(=O)F Amb24433874 [0,1,0,0,0,0|2,0,0]=3 1737 B12R1.256 CC(=O)c1ccc(cc1)C(C)=C Amb24080538 [0,1,0,0,0,0|1,0,0]=2 1738 B12R1.256 CC(=O)c1ccc(cc1)C(F)F Amb21964276 [0,1,0,0,0,0|2,0,0]=3 1739 B12R1.256 CC(=O)c1ccc(cc1)C(N)=N Amb24091163 [0,1,0,0,0,0|2,0,0]=3 1740 B12R1.256 CC(=O)c1ccc(cc1)C(N)=O Amb22753832 [0,1,0,0,0,0|2,0,0]=3 1741 B12R1.256 CC(=O)c1ccc(cc1)C(N)=S Amb25282148 [0,1,0,0,0,0|2,0,0]=3 1742 B12R1.256 CC(=O)c1ccc(cc1)S(C)=O Amb19149345 [0,1,0,0,0,0|0,1,0]=2 1743 B12R1.256 CC(=O)c1ccc(cc1)[C@@H](C)N Amb22288629 [0,1,0,0,0,0|1,0,0]=2 1744 B12R1.256 CC(=O)c1ccc(cc1)[C@H](C)N Amb22288687 [0,1,0,0,0,0|1,0,0]=2 1745 B12R1.256 CC(=O)c1ccc(nc1)C(=O)O Amb15695152 [0,1,0,0,0,0|3,0,0]=4 1746 B12R1.256 CC(Br)c1ccc(cc1)C(=O)Cl Amb25776139 [0,1,0,0,0,0|2,0,0]=3 1747 B12R1.256 CC(Br)c1ccc(cc1)C(C)Br Amb25359248 [0,1,0,0,0,0|2,0,1]=4 1748 B12R1.256 CC(C)c1ccc(c[n]1)C(O)=O Amb20668502 [0,1,0,0,0,0|3,0,0]=4 1749 B12R1.256 CC(C)c1ccc(c[n]1)C(O)=O Amb24554860 [0,1,0,0,0,0|3,0,0]=4 1750 B12R1.256 CC(C)c1ccc(cc1)C(=O)F Amb24484204 [0,1,0,0,0,0|2,0,0]=3 1751 B12R1.256 CC(C)c1ccc(cc1)C(N)=N Amb19373022 [0,1,0,0,0,0|3,0,0]=4 1752 B12R1.256 CC(C)c1ccc(cc1)C([O-])=O Amb22446730 [0,1,0,0,0,0|2,0,0]=3 1753 B12R1.256 CC(C)c1ccc(cc1)N(C)C Amb24072815 [0,1,0,0,0,0|2,0,1]=4 1754 B12R1.256 CC(C)c1ccc(cc1)S(=O)Cl Amb18066415 [0,1,0,0,0,0|3,0,0]=4 1755 B12R1.256 CC(C)c1ccc(cc1)S(C)=O Amb25182820 [0,1,0,0,0,0|2,0,0]=3 1756 B12R1.256 CC(C)c1ccc(cc1)S(O)=O Amb18564290 [0,1,0,0,0,0|3,0,0]=4 1757 B12R1.256 CC(C)c1ccc(cc1)S([O-])=O Amb19944450 [0,1,0,0,0,0|3,0,0]=4 1758 B12R1.256 CC(C)c1ccc(cc1)[C@@H](C)N Amb22288637 [0,1,0,0,0,0|2,0,1]=4 1759 B12R1.256 CC(C)c1ccc(cc1)[C@H](C)N Amb22288692 [0,1,0,0,0,0|2,0,1]=4 1760 B12R1.256 CC(Cl)c1ccc(cc1)C(=O)Cl Amb24102655 [0,1,0,0,0,0|2,0,0]=3 1761 B12R1.256 CC(Cl)c1ccc(cc1)C(C)Cl Amb24717179 [0,1,0,0,0,0|2,0,1]=4 1762 B12R1.256 CC(Cl)c1ccc(cc1)C(O)=O Amb22753831 [0,1,0,0,0,0|2,0,0]=3 1763 B12R1.256 CC(Cl)c1ccc(cc1)N(C)C Amb19057379 [0,1,0,0,0,0|2,0,1]=4 1764 B12R1.256 CC(F)c1ccc(cc1)C(=O)Cl Amb24497554 [0,1,0,0,0,0|2,0,0]=3 1765 B12R1.256 CC(F)c1ccc(cc1)C(=O)F Amb25854140 [0,1,0,0,0,0|2,0,0]=3 1766 B12R1.256 CC(F)c1ccc(cc1)C(C)O Amb24536119 [0,1,0,0,0,0|1,0,2]=4 1767 B12R1.256 CC(F)c1ccc(cc1)[N+]([O-])=O Amb24625763 [0,1,0,0,0,0|3,0,0]=4 1768 B12R1.256 CC(N)c1c[n]c(cc1)C(O)=O Amb24715831 [0,1,0,0,0,0|3,0,0]=4 1769 B12R1.256 CC(N)c1ccc(cc1)C(C)N Amb25697176 [0,1,0,0,0,0|2,0,1]=4 1770 B12R1.256 CC(N)c1ccc(cc1)C(N)=S Amb25275452 [0,1,0,0,0,0|2,1,0]=4 1771 B12R1.256 CC(N)c1ccc(cc1)C(O)=O Amb22498046 [0,1,0,0,0,0|2,0,0]=3 1772 B12R1.256 CC(N)c1ccc(cc1)[N+]([O-])=O Amb22491547 [0,1,0,0,0,0|3,0,0]=4 1773 B12R1.256 CC(O)c1ccc(c[n]1)C(O)=O Amb24062474 [0,1,0,0,0,0|3,0,0]=4 1774 B12R1.256 CC(O)c1ccc(cc1)C(N)=O Amb22753813 [0,1,0,0,0,0|2,0,0]=3 1775 B12R1.256 CC(S)c1ccc(cc1)N(C)C Amb18181520 [0,1,0,0,0,0|1,1,1]=4 1776 B12R1.256 CC(c1ccc(cc1)C(=O)C)N Amb17101613 [0,1,0,0,0,0|1,0,0]=2 1777 B12R1.256 CC(c1ccc(cc1)C(=O)C)O Amb17594069 [0,1,0,0,0,0|1,0,0]=2 1778 B12R1.256 CC(c1ccc(cc1)C(=O)N)C Amb2140540 [0,1,0,0,0,0|2,0,0]=3 1779 B12R1.256 CC(c1ccc(cc1)C(=O)N)N Amb17084755 [0,1,0,0,0,0|2,0,0]=3 1780 B12R1.256 CC(c1ccc(cc1)C(=O)O)C Amb1397627 [0,1,0,0,0,0|2,0,0]=3 1781 B12R1.256 CC(c1ccc(cc1)C(=O)O)N Amb17084695 [0,1,0,0,0,0|2,0,0]=3 1782 B12R1.256 CC(c1ccc(cc1)C(N)C)C Amb1153014 [0,1,0,0,0,0|2,0,1]=4 1783 B12R1.256 CC(c1ccc(cc1)C(O)C)N Amb17101726 [0,1,0,0,0,0|1,0,2]=4 1784 B12R1.256 CC(c1ccc(cc1)N(C)C)N Amb10606822 [0,1,0,0,0,0|2,0,1]=4 1785 B12R1.256 CC(c1ccc(cc1)N(C)C)N Amb1107905 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.256 CC(c1ccc(cc1)N(C)C)O Amb1110992 [0,1,0,0,0,0|1,0,2]=4 1787 B12R1.256 CC(c1ccc(cc1)N(N)C)C Amb17232507 [0,1,0,0,0,0|2,0,1]=4 1788 B12R1.256 CC(c1ccc(cc1)[N+](=O)[O-])N Amb1108808 [0,1,0,0,0,0|3,0,0]=4 1789 B12R1.256 CC(c1ccc(cc1)[N+](=O)[O-])O Amb1110938 [0,1,0,0,0,0|3,0,0]=4 1790 B12R1.256 CN(C)c1c[n]c(cc1)C(O)=O Amb18646511 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.256 CN(C)c1ccc(c[n]1)C(=O)Cl Amb24071738 [0,1,0,0,0,0|3,0,0]=4 1792 B12R1.256 CN(C)c1ccc(c[n]1)C(O)=O Amb19514739 [0,1,0,0,0,0|3,0,0]=4 1793 B12R1.256 CN(C)c1ccc(cc1)C(=O)Cl Amb23399609 [0,1,0,0,0,0|2,0,0]=3 1794 B12R1.256 CN(C)c1ccc(cc1)C(=O)F Amb25667239 [0,1,0,0,0,0|2,0,0]=3 1795 B12R1.256 CN(C)c1ccc(cc1)C(=O)I Amb24341727 [0,1,0,0,0,0|2,0,0]=3 1796 B12R1.256 CN(N)c1ccc(cc1)C(O)=O Amb24470091 [0,1,0,0,0,0|2,0,0]=3 1797 B12R1.256 CN(c1ccc(cc1)C(=N)N)C Amb17601655 [0,1,0,0,0,0|3,0,0]=4 1798 B12R1.256 CN(c1ccc(cc1)C(=O)C)C Amb1085980 [0,1,0,0,0,0|1,0,0]=2 1799 B12R1.256 CN(c1ccc(cc1)C(=O)N)C Amb1196691 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.256 CN(c1ccc(cc1)C(=O)O)C Amb2582573 [0,1,0,0,0,0|2,0,0]=3 1801 B12R1.256 CN(c1ccc(cc1)C(=S)N)C Amb1154726 [0,1,0,0,0,0|2,1,0]=4 1802 B12R1.256 CP(C)c1ccc(cc1)C(O)=O Amb24398570 [0,1,0,0,0,0|2,0,0]=3 1803 B12R1.256 CS(=O)c1ccc(c[n]1)C(N)=O Amb24519088 [0,1,0,0,0,0|2,1,0]=4 1804 B12R1.256 CS(=O)c1ccc(cc1)C(N)=O Amb24415331 [0,1,0,0,0,0|1,1,0]=3 1805 B12R1.256 C[As](C)c1ccc(cc1)C(O)=O Amb22346984 [0,1,0,0,0,0|2,0,0]=3 1806 B12R1.256 C[C@@H](N)c1ccc(cc1)C(N)=O Amb22745872 [0,1,0,0,0,0|2,0,0]=3 1807 B12R1.256 C[C@@H](N)c1ccc(cc1)C(O)=O Amb22232049 [0,1,0,0,0,0|2,0,0]=3 1808 B12R1.256 C[C@@H](N)c1ccc(cc1)C(O)=O Amb22274559 [0,1,0,0,0,0|2,0,0]=3 1809 B12R1.256 C[C@@H](N)c1ccc(cc1)N(C)C Amb22388615 [0,1,0,0,0,0|2,0,1]=4 1810 B12R1.256 C[C@@H](N)c1ccc(cc1)N(C)C Amb22406376 [0,1,0,0,0,0|2,0,1]=4 1811 B12R1.256 C[C@@H](N)c1ccc(cc1)N(C)C Amb23440343 [0,1,0,0,0,0|2,0,1]=4 1812 B12R1.256 C[C@@H](O)c1ccc(cc1)C(O)=O Amb25201482 [0,1,0,0,0,0|2,0,0]=3 1813 B12R1.256 C[C@@H](O)c1ccc(cc1)N(C)C Amb24483366 [0,1,0,0,0,0|1,0,2]=4 1814 B12R1.256 C[C@@H](O)c1ccc(cc1)[C@H](C)O Amb25816527 [0,1,0,0,0,0|1,0,2]=4 1815 B12R1.256 C[C@@H](c1ccc(cc1)N(C)C)N Amb16233833 [0,1,0,0,0,0|2,0,1]=4 1816 B12R1.256 C[C@@H](c1ccc(cc1)[N+](=O)[O-])N Amb13953014 [0,1,0,0,0,0|3,0,0]=4 1817 B12R1.256 C[C@H](N)c1ccc(c[n]1)C(O)=O Amb25378836 [0,1,0,0,0,0|3,0,0]=4 1818 B12R1.256 C[C@H](N)c1ccc(cc1)C(N)=O Amb25858032 [0,1,0,0,0,0|2,0,0]=3 1819 B12R1.256 C[C@H](N)c1ccc(cc1)C(O)=O Amb19929566 [0,1,0,0,0,0|2,0,0]=3 1820 B12R1.256 C[C@H](N)c1ccc(cc1)N(C)C Amb22406375 [0,1,0,0,0,0|2,0,1]=4 1821 B12R1.256 C[C@H](N)c1ccc(cc1)[C@H](C)N Amb25055734 [0,1,0,0,0,0|2,0,1]=4 1822 B12R1.256 C[C@H](O)c1ccc(cc1)N(C)C Amb25774267 [0,1,0,0,0,0|1,0,2]=4 1823 B12R1.256 C[C@H](c1ccc(cc1)[N+](=O)[O-])N Amb13953024 [0,1,0,0,0,0|3,0,0]=4 1824 B12R1.256 C[C@H](c1ccc(cc1)[N+](=O)[O-])O Amb13952994 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.256 C[S+](C)c1ccc(cc1)C(O)=O Amb25365247 [0,1,0,0,0,0|1,1,0]=3 1826 B12R1.256 C[S+](C)c1ccc(cc1)[S+](C)C Amb17778270 [0,1,0,0,0,0|2,1,0]=4 1827 B12R1.256 C[SiH](C)c1ccc(cc1)C(=O)Cl Amb24102971 [0,1,0,0,0,0|2,0,0]=3 1828 B12R1.256 C[SiH](C)c1ccc(cc1)[SiH](C)C Amb19893599 [0,1,0,0,0,0|2,1,0]=4 1829 B12R1.256 FC(c1ccc(cc1)C(=O)O)F Amb10838554 [0,1,0,0,0,0|3,0,0]=4 1830 B12R1.256 NC(=N)c1ccc(cc1)C(=O)Cl Amb24091352 [0,1,0,0,0,0|3,0,0]=4 1831 B12R1.256 NC(=N)c1ccc(cc1)C(=O)N Amb10807464 [0,1,0,0,0,0|3,0,0]=4 1832 B12R1.256 NC(=N)c1ccc(cc1)C(O)=O Amb22494586 [0,1,0,0,0,0|3,0,0]=4 1833 B12R1.256 NC(=O)c1ccc(cc1)C(=O)Cl Amb25751529 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.256 NC(=O)c1ccc(cc1)C(=O)O Amb1242852 [0,1,0,0,0,0|3,0,0]=4 1835 B12R1.256 NC(=O)c1ccc(cc1)N([O-])=O Amb22281283 [0,1,0,0,0,0|3,0,0]=4 1836 B12R1.256 O=C(Cl)c1ccc(cc1)C(Cl)Cl Amb22347920 [0,1,0,0,0,0|3,0,0]=4 1837 B12R1.256 O=C(Cl)c1ccc(cc1)N(=O)=O Amb20620199 [0,1,0,0,0,0|3,0,0]=4 1838 B12R1.256 O=C(F)c1ccc(cc1)C(=O)F Amb24060685 [0,1,0,0,0,0|3,0,0]=4 1839 B12R1.256 O=C(F)c1ccc(cc1)C(F)F Amb25727328 [0,1,0,0,0,0|3,0,0]=4 1840 B12R1.256 OB(c1ccc(cc1)C(=O)Cl)O Amb16232718 [0,1,0,0,0,0|3,0,0]=4 1841 B12R1.256 OB(c1ccc(cc1)C(=O)N)O Amb2447040 [0,1,0,0,0,0|3,0,0]=4 1842 B12R1.256 OB(c1ccc(cc1)C(=O)O)O Amb1351795 [0,1,0,0,0,0|3,0,0]=4 1843 B12R1.256 OB(c1ccc(cc1)S(=O)C)O Amb2456028 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.256 OC(=O)c1ccc(cc1)C(=O)Cl Amb17477824 [0,1,0,0,0,0|3,0,0]=4 1845 B12R1.256 OC(=O)c1ccc(cc1)C(=O)F Amb24102981 [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.256 OC(=O)c1ccc(cc1)C(=S)N Amb1114224 [0,1,0,0,0,0|3,0,0]=4 1847 B12R1.256 OC(=O)c1ccc(cc1)C(Br)Br Amb25796516 [0,1,0,0,0,0|3,0,0]=4 1848 B12R1.256 OC(=O)c1ccc(cc1)C(Cl)Cl Amb24483698 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.256 OC(=O)c1ccc(cc1)C(O)=O Amb22337041 [0,1,0,0,0,0|3,0,0]=4 1850 B12R1.256 OC(=O)c1ccc(cc1)C(O)=O Amb22337830 [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.256 OC(=O)c1ccc(cc1)C(O)=O Amb22337876 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.256 OC(=O)c1ccc(cc1)C(O)=O Amb22351689 [0,1,0,0,0,0|3,0,0]=4 1853 B12R1.256 OC(=O)c1ccc(cc1)N(O)O Amb24102962 [0,1,0,0,0,0|3,0,0]=4 1854 B12R1.256 OC(=O)c1ccc(cc1)P(O)=O Amb24677684 [0,1,0,0,0,0|3,0,0]=4 1855 B12R1.256 OC(=O)c1ccc(cc1)S(=O)C Amb1107544 [0,1,0,0,0,0|1,1,0]=3 1856 B12R1.256 OC(=O)c1ccc(cc1)S(=O)Cl Amb24544980 [0,1,0,0,0,0|2,1,0]=4 1857 B12R1.256 OC(=O)c1ccc(cc1)S(O)=O Amb25751276 [0,1,0,0,0,0|2,1,0]=4 1858 B12R1.256 OC(=O)c1ccc(cc1)[I](=O)=O Amb10564564 [0,1,0,0,0,0|3,0,0]=4 1859 B12R1.256 O[13C](=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)[13C](O)=O Amb22056207 [0,1,0,0,0,0|3,0,0]=4 1860 B12R1.256 O[13C](=O)c1ccc(cc1)[13C](O)=O Amb22338355 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.256 [O-]C(=O)c1ccc(cc1)C([O-])=O Amb22345553 [0,1,0,0,0,0|3,0,0]=4 1862 B12R1.256 [O-]C(=O)c1ccc(cc1)[N+]([O-])=O Amb20246787 [0,1,0,0,0,0|3,0,0]=4 1863 B12R1.256 [O-]C(=O)c1ccc(cc1)[N+]([O-])=O Amb22479798 [0,1,0,0,0,0|3,0,0]=4 1864 B12R1.256 [O-][N+](=O)c1ccc(cc1)C(=O)Br Amb25313193 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.256 [O-][N+](=O)c1ccc(cc1)C(O)=O Amb22264825 [0,1,0,0,0,0|3,0,0]=4 1866 B12R1.452 BrCc1ccc(c(c1)O)C(=O)O Amb17596329 [0,1,0,0,0,0|3,0,0]=4 1867 B12R1.452 C#Cc1cc(F)c(cc1)C(=O)Cl Amb24091574 [0,1,0,0,0,0|2,0,1]=4 1868 B12R1.452 C#Cc1cc(N)c(cc1)C(O)=O Amb25733575 [0,1,0,0,0,0|2,0,1]=4 1869 B12R1.452 C=Cc1ccc(C(O)=O)c(F)c1 Amb24711366 [0,1,0,0,0,0|2,0,1]=4 1870 B12R1.452 CC(=C)c1ccc(CO)cc1O Amb24497178 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.452 CC(=C)c1ccc(cc1F)OC Amb25133811 [0,1,0,0,0,0|1,0,0]=2 1872 B12R1.452 CC(=O)C1=CN=C(NC1=O)SC Amb19550839 [0,1,0,0,0,0|2,1,0]=4 1873 B12R1.452 CC(=O)c1[n]cc(CC)cc1F Amb25315303 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.452 CC(=O)c1[n]cc(CCl)cc1O Amb25693343 [0,1,0,0,0,0|3,0,0]=4 1875 B12R1.452 CC(=O)c1[n]cc(CO)cc1F Amb24454793 [0,1,0,0,0,0|3,0,0]=4 1876 B12R1.452 CC(=O)c1[n]cc(cc1Br)OC Amb23401607 [0,1,0,0,0,0|1,0,0]=2 1877 B12R1.452 CC(=O)c1[n]cc(cc1C)C=O Amb25755455 [0,1,0,0,0,0|3,0,0]=4 1878 B12R1.452 CC(=O)c1[n]cc(cc1Cl)C#N Amb24560333 [0,1,0,0,0,0|3,0,0]=4 1879 B12R1.452 CC(=O)c1[n]cc(cc1Cl)OC Amb23401612 [0,1,0,0,0,0|1,0,0]=2 1880 B12R1.452 CC(=O)c1[n]cc(cc1F)C#C Amb24472355 [0,1,0,0,0,0|2,0,1]=4 1881 B12R1.452 CC(=O)c1[n]cc(cc1F)C=O Amb24562943 [0,1,0,0,0,0|3,0,0]=4 1882 B12R1.452 CC(=O)c1[n]cc(cc1N)OC Amb25089313 [0,1,0,0,0,0|1,0,0]=2 1883 B12R1.452 CC(=O)c1[n]cc(cc1O)OC Amb25106870 [0,1,0,0,0,0|1,0,0]=2 1884 B12R1.452 CC(=O)c1c[n]c(C=C)cc1O Amb25826196 [0,1,0,0,0,0|2,0,1]=4 1885 B12R1.452 CC(=O)c1c[n]c([n]c1Cl)SC Amb23247892 [0,1,0,0,0,0|2,1,0]=4 1886 B12R1.452 CC(=O)c1c[n]c([n]c1N)SC Amb23439994 [0,1,0,0,0,0|2,1,0]=4 1887 B12R1.452 CC(=O)c1c[n]c([n]c1O)OC Amb25340507 [0,1,0,0,0,0|2,0,0]=3 1888 B12R1.452 CC(=O)c1c[n]c(cc1N)C=O Amb24402380 [0,1,0,0,0,0|3,0,0]=4 1889 B12R1.452 CC(=O)c1ccc(C=C)[n]c1F Amb25141046 [0,1,0,0,0,0|2,0,1]=4 1890 B12R1.452 CC(=O)c1ccc(CCl)cc1O Amb18649020 [0,1,0,0,0,0|2,0,0]=3 1891 B12R1.452 CC(=O)c1ccc(CF)cc1Cl Amb25246938 [0,1,0,0,0,0|2,0,0]=3 1892 B12R1.452 CC(=O)c1ccc([n]c1Cl)OC Amb25097158 [0,1,0,0,0,0|1,0,0]=2 1893 B12R1.452 CC(=O)c1ccc([n]c1F)OC Amb24364658 [0,1,0,0,0,0|1,0,0]=2 1894 B12R1.452 CC(=O)c1ccc([n]c1N)OC Amb25150846 [0,1,0,0,0,0|1,0,0]=2 1895 B12R1.452 CC(=O)c1ccc([n]c1O)OC Amb24702509 [0,1,0,0,0,0|1,0,0]=2 1896 B12R1.452 CC(=O)c1ccc(cc1Br)C#N Amb24057206 [0,1,0,0,0,0|2,0,0]=3 1897 B12R1.452 CC(=O)c1ccc(cc1Br)SC Amb25816492 [0,1,0,0,0,0|0,1,0]=2 1898 B12R1.452 CC(=O)c1ccc(cc1Cl)C#C Amb25196718 [0,1,0,0,0,0|1,0,1]=3 1899 B12R1.452 CC(=O)c1ccc(cc1Cl)C#N Amb24056466 [0,1,0,0,0,0|2,0,0]=3 1900 B12R1.452 CC(=O)c1ccc(cc1Cl)SC Amb22059029 [0,1,0,0,0,0|0,1,0]=2 1901 B12R1.452 CC(=O)c1ccc(cc1I)OC Amb24088421 [0,1,0,0,0,0|0,0,0]=1 1902 B12R1.452 CC(=O)c1ccc(cc1N)OC Amb22490708 [0,1,0,0,0,0|0,0,0]=1 1903 B12R1.452 CC(=O)c1ccc(cc1O)C#N Amb24091158 [0,1,0,0,0,0|2,0,0]=3 1904 B12R1.452 CCc1cc(Cl)c(cc1)C(=O)Cl Amb24104272 [0,1,0,0,0,0|2,0,0]=3 1905 B12R1.452 CCc1cc(O)c(cc1)C(O)=O Amb24372672 [0,1,0,0,0,0|2,0,0]=3 1906 B12R1.452 CCc1ccc(C(C)C)c(O)c1 Amb25244655 [0,1,0,0,0,0|2,0,1]=4 1907 B12R1.452 CCc1ccc(C(C)N)c(F)c1 Amb25138111 [0,1,0,0,0,0|2,0,1]=4 1908 B12R1.452 CCc1ccc(C(N)=O)c(O)c1 Amb25064652 [0,1,0,0,0,0|2,0,0]=3 1909 B12R1.452 CCc1ccc(C(N)=S)c(F)c1 Amb24493023 [0,1,0,0,0,0|2,1,0]=4 1910 B12R1.452 CCc1ccc(C(O)=O)c(Br)c1 Amb25212313 [0,1,0,0,0,0|2,0,0]=3 1911 B12R1.452 CCc1ccc(C(O)=O)c(Cl)[n]1 Amb24541216 [0,1,0,0,0,0|3,0,0]=4 1912 B12R1.452 CCc1ccc(C(O)=O)c(F)[n]1 Amb24417807 [0,1,0,0,0,0|3,0,0]=4 1913 B12R1.452 CCc1ccc(C(O)=O)c(I)c1 Amb24696314 [0,1,0,0,0,0|2,0,0]=3 1914 B12R1.452 CCc1ccc(C(O)=O)c(O)[n]1 Amb25809464 [0,1,0,0,0,0|3,0,0]=4 1915 B12R1.452 CCc1ccc(C(O)=O)c(S)c1 Amb24591490 [0,1,0,0,0,0|2,0,0]=3 1916 B12R1.452 CCc1ccc([C@@H](C)N)c(O)c1 Amb25710293 [0,1,0,0,0,0|2,0,1]=4 1917 B12R1.452 CCc1ccc(c(N)[n]1)C(O)=O Amb24487350 [0,1,0,0,0,0|3,0,0]=4 1918 B12R1.452 CCc1ccc(c(N)c1)C(O)=O Amb18646263 [0,1,0,0,0,0|2,0,0]=3 1919 B12R1.452 CCc1ccc(c(O)c1)[N+]([O-])=O Amb24071324 [0,1,0,0,0,0|3,0,0]=4 1920 B12R1.452 CCc1ccc(c(c1)N)C(C)C Amb17138562 [0,1,0,0,0,0|2,0,1]=4 1921 B12R1.452 CNc1cc(Br)c(cc1)C(N)=S Amb24731144 [0,1,0,0,0,0|2,1,0]=4 1922 B12R1.452 CNc1cc(Br)c(cc1)C(O)=O Amb25156707 [0,1,0,0,0,0|2,0,0]=3 1923 B12R1.452 CNc1cc(Br)c(cc1)[N+]([O-])=O Amb24382998 [0,1,0,0,0,0|3,0,0]=4 1924 B12R1.452 CNc1cc(Cl)c(cc1)C(=O)Cl Amb25054981 [0,1,0,0,0,0|2,0,0]=3 1925 B12R1.452 CNc1cc(Cl)c(cc1)C(N)=N Amb18288000 [0,1,0,0,0,0|3,0,0]=4 1926 B12R1.452 CNc1cc(Cl)c(cc1)C(N)=O Amb18288758 [0,1,0,0,0,0|2,0,0]=3 1927 B12R1.452 CNc1cc(Cl)c(cc1)C(N)=S Amb18287995 [0,1,0,0,0,0|2,1,0]=4 1928 B12R1.452 CNc1cc(Cl)c(cc1)C(O)=O Amb18966084 [0,1,0,0,0,0|2,0,0]=3 1929 B12R1.452 CNc1cc(Cl)c(cc1)N(C)C Amb18288685 [0,1,0,0,0,0|3,0,0]=4 1930 B12R1.452 CNc1cc(Cl)c(cc1)[N+]([O-])=O Amb25066942 [0,1,0,0,0,0|3,0,0]=4 1931 B12R1.452 CNc1cc(F)c(cc1)C(C)C Amb24450919 [0,1,0,0,0,0|2,0,1]=4 1932 B12R1.452 CNc1cc(F)c(cc1)C(O)=O Amb24694010 [0,1,0,0,0,0|2,0,0]=3 1933 B12R1.452 CNc1cc(F)c(cc1)[N+]([O-])=O Amb24377640 [0,1,0,0,0,0|3,0,0]=4 1934 B12R1.452 CNc1cc(I)c(cc1)[N+]([O-])=O Amb24450124 [0,1,0,0,0,0|3,0,0]=4 1935 B12R1.452 CNc1cc(N)c(c[n]1)C(O)=O Amb25159694 [0,1,0,0,0,0|3,0,0]=4 1936 B12R1.452 CNc1cc(N)c(cc1)C(C)C Amb24536092 [0,1,0,0,0,0|2,0,1]=4 1937 B12R1.452 CNc1cc(O)c(cc1)C(O)=O Amb22234274 [0,1,0,0,0,0|2,0,0]=3 1938 B12R1.452 COC1=CC=C(C(O)=O)C(=O)N1 Amb24518725 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.452 COc1[n]c(N)c(c[n]1)C(N)=O Amb25809393 [0,1,0,0,0,0|3,0,0]=4 1940 B12R1.452 COc1[n]cc(C(O)=O)c(Br)[n]1 Amb25825935 [0,1,0,0,0,0|3,0,0]=4 1941 B12R1.452 COc1c[n]c(C(C)C)c(Br)c1 Amb25667568 [0,1,0,0,0,0|2,0,1]=4 1942 B12R1.452 COc1c[n]c(C(C)C)c(O)c1 Amb24407213 [0,1,0,0,0,0|2,0,1]=4 1943 B12R1.452 COc1c[n]c(C(O)=O)c(Br)[n]1 Amb24450144 [0,1,0,0,0,0|3,0,0]=4 1944 B12R1.452 COc1c[n]c(C(O)=O)c(Cl)[n]1 Amb24400607 [0,1,0,0,0,0|3,0,0]=4 1945 B12R1.452 COc1c[n]c(C(O)=O)c(Cl)c1 Amb22235470 [0,1,0,0,0,0|2,0,0]=3 1946 B12R1.452 COc1c[n]c(C(O)=O)c(F)c1 Amb23401532 [0,1,0,0,0,0|2,0,0]=3 1947 B12R1.452 COc1c[n]c(c(F)c1)[N+]([O-])=O Amb25241111 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.452 COc1c[n]c(c(N)[n]1)C(O)=O Amb24355423 [0,1,0,0,0,0|3,0,0]=4 1949 B12R1.452 COc1c[n]c(c(N)c1)[N+]([O-])=O Amb23403513 [0,1,0,0,0,0|3,0,0]=4 1950 B12R1.452 COc1cc(Br)c([n][n]1)C(O)=O Amb25270485 [0,1,0,0,0,0|3,0,0]=4 1951 B12R1.452 COc1cc(Br)c(cc1)C(C)Br Amb24660543 [0,1,0,0,0,0|1,0,1]=3 1952 B12R1.452 COc1cc(Br)c(cc1)C(C)O Amb25131762 [0,1,0,0,0,0|0,0,2]=3 1953 B12R1.452 COc1cc(Br)c(cc1)[C@@H](C)N Amb25669684 [0,1,0,0,0,0|1,0,1]=3 1954 B12R1.452 COc1cc(Br)c(cc1)[C@H](C)N Amb24598693 [0,1,0,0,0,0|1,0,1]=3 1955 B12R1.452 COc1cc(Cl)c([n]c1)C(=O)Cl Amb25778216 [0,1,0,0,0,0|2,0,0]=3 1956 B12R1.452 COc1cc(Cl)c(c[n]1)C(N)=N Amb22292268 [0,1,0,0,0,0|3,0,0]=4 1957 B12R1.452 COc1cc(Cl)c(c[n]1)C(O)=O Amb21926707 [0,1,0,0,0,0|2,0,0]=3 1958 B12R1.452 COc1cc(Cl)c(c[n]1)[N+]([O-])=O Amb22499405 [0,1,0,0,0,0|3,0,0]=4 1959 B12R1.452 COc1cc(Cl)c(cc1)C(C)Cl Amb24625072 [0,1,0,0,0,0|1,0,1]=3 1960 B12R1.452 COc1cc(Cl)c(cc1)C(C)O Amb19058985 [0,1,0,0,0,0|0,0,2]=3 1961 B12R1.452 COc1cc(Cl)c(cc1)C(N)=N Amb19045654 [0,1,0,0,0,0|2,0,0]=3 1962 B12R1.452 COc1cc(Cl)c(cc1)C(N)=O Amb18057458 [0,1,0,0,0,0|1,0,0]=2 1963 B12R1.452 COc1cc(Cl)c(cc1)N(=O)=O Amb20620738 [0,1,0,0,0,0|2,0,0]=3 1964 B12R1.452 COc1cc(Cl)c(cc1)N(C)C Amb23402112 [0,1,0,0,0,0|2,0,0]=3 1965 B12R1.452 COc1cc(Cl)c(cc1)S(O)=O Amb18224859 [0,1,0,0,0,0|2,0,0]=3 1966 B12R1.452 COc1cc(Cl)c(cc1)[C@@H](C)N Amb24746670 [0,1,0,0,0,0|1,0,1]=3 1967 B12R1.452 COc1cc(Cl)c(cc1)[C@@H](C)O Amb25156662 [0,1,0,0,0,0|0,0,2]=3 1968 B12R1.452 COc1cc(F)c(c[n]1)[N+]([O-])=O Amb23400358 [0,1,0,0,0,0|3,0,0]=4 1969 B12R1.452 COc1cc(F)c(cc1)C(C)Br Amb24732643 [0,1,0,0,0,0|1,0,1]=3 1970 B12R1.452 COc1cc(F)c(cc1)C(C)C Amb21858961 [0,1,0,0,0,0|1,0,1]=3 1971 B12R1.452 COc1cc(F)c(cc1)C(C)Cl Amb19060248 [0,1,0,0,0,0|1,0,1]=3 1972 B12R1.452 COc1cc(F)c(cc1)C(C)N Amb22008532 [0,1,0,0,0,0|1,0,1]=3 1973 B12R1.452 COc1cc(F)c(cc1)C(N)=N Amb25062073 [0,1,0,0,0,0|2,0,0]=3 1974 B12R1.452 COc1cc(F)c(cc1)C(N)=S Amb25727549 [0,1,0,0,0,0|1,1,0]=3 1975 B12R1.452 COc1cc(F)c(cc1)N(=O)=O Amb20621312 [0,1,0,0,0,0|2,0,0]=3 1976 B12R1.452 COc1cc(F)c(cc1)N(C)C Amb18931910 [0,1,0,0,0,0|2,0,0]=3 1977 B12R1.452 COc1cc(F)c(cc1)[C@@H](C)N Amb22008534 [0,1,0,0,0,0|1,0,1]=3 1978 B12R1.452 COc1cc(F)c(cc1)[C@@H](C)N Amb24483413 [0,1,0,0,0,0|1,0,1]=3 1979 B12R1.452 COc1cc(F)c(cc1)[C@H](C)N Amb22008535 [0,1,0,0,0,0|1,0,1]=3 1980 B12R1.452 COc1cc(I)c(cc1)C(=O)Cl Amb24367316 [0,1,0,0,0,0|1,0,0]=2 1981 B12R1.452 COc1cc(I)c(cc1)C(N)=O Amb25669648 [0,1,0,0,0,0|1,0,0]=2 1982 B12R1.452 COc1cc(I)c(cc1)C(O)=O Amb19895069 [0,1,0,0,0,0|1,0,0]=2 1983 B12R1.452 COc1cc(I)c(cc1)[C@@H](C)N Amb25769828 [0,1,0,0,0,0|1,0,1]=3 1984 B12R1.452 COc1cc(I)c(cc1)[C@H](C)N Amb25375785 [0,1,0,0,0,0|1,0,1]=3 1985 B12R1.452 COc1cc(N)c([n][n]1)C(O)=O Amb25803472 [0,1,0,0,0,0|3,0,0]=4 1986 B12R1.452 COc1cc(N)c(c[n]1)C(O)=O Amb22728895 [0,1,0,0,0,0|2,0,0]=3 1987 B12R1.452 COc1cc(N)c(cc1)B(O)O Amb25783879 [0,1,0,0,0,0|2,0,1]=4 1988 B12R1.452 COc1cc(N)c(cc1)C(=O)Cl Amb24532776 [0,1,0,0,0,0|1,0,0]=2 1989 B12R1.452 COc1cc(N)c(cc1)C(C)C Amb24635770 [0,1,0,0,0,0|1,0,1]=3 1990 B12R1.452 COc1cc(N)c(cc1)C(F)F Amb25684151 [0,1,0,0,0,0|2,0,1]=4 1991 B12R1.452 COc1cc(N)c(cc1)C(N)=N Amb25057237 [0,1,0,0,0,0|2,0,0]=3 1992 B12R1.452 COc1cc(N)c(cc1)C(N)=S Amb25114159 [0,1,0,0,0,0|1,1,0]=3 1993 B12R1.452 COc1cc(N)c(cc1)N(=O)=O Amb20621841 [0,1,0,0,0,0|2,0,0]=3 1994 B12R1.452 COc1cc(N)c(cc1)[C@H](C)N Amb25279459 [0,1,0,0,0,0|1,0,1]=3 1995 B12R1.452 COc1cc(O)c(cc1)B(O)O Amb23438863 [0,1,0,0,0,0|2,0,1]=4 1996 B12R1.452 COc1cc(O)c(cc1)C([O-])=O Amb21963043 [0,1,0,0,0,0|1,0,0]=2 1997 B12R1.452 COc1cc(O)c(cc1)N(C)C Amb24484350 [0,1,0,0,0,0|2,0,0]=3 1998 B12R1.452 COc1cc(O)c(cc1)[C@@H](C)N Amb25141964 [0,1,0,0,0,0|1,0,1]=3 1999 B12R1.452 COc1cc(O)c(cc1)[C@@H](C)O Amb24701072 [0,1,0,0,0,0|0,0,2]=3 2000 B12R1.452 COc1cc(O)c(cc1)[C@H](C)N Amb25245230 [0,1,0,0,0,0|1,0,1]=3 2001 B12R1.452 COc1cc(O)c(cc1)[C@H](C)O Amb24493043 [0,1,0,0,0,0|0,0,2]=3 2002 B12R1.452 COc1cc(S)c(cc1)C(N)=O Amb25374107 [0,1,0,0,0,0|1,0,0]=2 2003 B12R1.452 COc1cc(S)c(cc1)C(O)=O Amb18648891 [0,1,0,0,0,0|1,0,0]=2 2004 B12R1.452 COc1ccc(C(C)N)c(Cl)[n]1 Amb24356549 [0,1,0,0,0,0|2,0,1]=4 2005 B12R1.452 COc1ccc(C(N)=O)c(Br)[n]1 Amb22495023 [0,1,0,0,0,0|2,0,0]=3 2006 B12R1.452 COc1ccc(C(N)=O)c(Cl)[n]1 Amb21927653 [0,1,0,0,0,0|2,0,0]=3 2007 B12R1.452 COc1ccc(C(O)=O)c(Br)[n]1 Amb22494781 [0,1,0,0,0,0|2,0,0]=3 2008 B12R1.452 COc1ccc(C(O)=O)c(F)[n]1 Amb24102552 [0,1,0,0,0,0|2,0,0]=3 2009 B12R1.452 COc1ccc(c(=O)[nH]1)[N+](=O)[O-] Amb10552570 [0,1,0,0,0,0|3,0,0]=4 2010 B12R1.452 COc1ccc(c(Br)[n]1)[N+]([O-])=O Amb19958622 [0,1,0,0,0,0|3,0,0]=4 2011 B12R1.452 COc1ccc(c(Cl)[n]1)N(=O)=O Amb20620805 [0,1,0,0,0,0|3,0,0]=4 2012 B12R1.452 COc1ccc(c(N)[n]1)C(O)=O Amb22752822 [0,1,0,0,0,0|2,0,0]=3 2013 B12R1.452 COc1ccc(c(O)[n]1)[N+]([O-])=O Amb20246953 [0,1,0,0,0,0|3,0,0]=4 2014 B12R1.452 COc1ccc(c(c1)Br)C(=O)O Amb13952259 [0,1,0,0,0,0|1,0,0]=2 2015 B12R1.452 COc1ccc(c(c1)C)B(O)O Amb2456022 [0,1,0,0,0,0|2,0,1]=4 2016 B12R1.452 COc1ccc(c(c1)F)[C@@H](O)C Amb16185852 [0,1,0,0,0,0|0,0,2]=3 2017 B12R1.452 COc1ccc(c(c1)F)[C@H](O)C Amb16185851 [0,1,0,0,0,0|0,0,2]=3 2018 B12R1.452 COc1ccc(c(c1)N)C(=O)N Amb10240729 [0,1,0,0,0,0|1,0,0]=2 2019 B12R1.452 COc1ccc(c(c1)N)C(=O)O Amb1398841 [0,1,0,0,0,0|1,0,0]=2 2020 B12R1.452 COc1ccc(c(c1)O)C(=O)O Amb1802022 [0,1,0,0,0,0|1,0,0]=2 2021 B12R1.452 COc1ccc(c(n1)Cl)C(=O)O Amb10975782 [0,1,0,0,0,0|2,0,0]=3 2022 B12R1.452 COc1ccc(c(n1)N)N(=O)=O Amb17621771 [0,1,0,0,0,0|3,0,0]=4 2023 B12R1.452 COc1ccc(c(n1)N)[N+](=O)[O-] Amb1088763 [0,1,0,0,0,0|3,0,0]=4 2024 B12R1.452 COc1ncc(c(c1)N)[N+](=O)[O-] Amb16185819 [0,1,0,0,0,0|3,0,0]=4 2025 B12R1.452 CSc1c[n]c(C(O)=O)c(Cl)c1 Amb24539317 [0,1,0,0,0,0|2,1,0]=4 2026 B12R1.452 CSc1cc(Br)c(cc1)C(O)=O Amb25141111 [0,1,0,0,0,0|1,1,0]=3 2027 B12R1.452 CSc1cc(Br)c(cc1)[C@@H](C)N Amb24380038 [0,1,0,0,0,0|1,1,1]=4 2028 B12R1.452 CSc1cc(Br)c(cc1)[C@@H](C)O Amb25720045 [0,1,0,0,0,0|0,1,2]=4 2029 B12R1.452 CSc1cc(Br)c(cc1)[C@H](C)N Amb25816493 [0,1,0,0,0,0|1,1,1]=4 2030 B12R1.452 CSc1cc(Br)c(cc1)[N+]([O-])=O Amb24493196 [0,1,0,0,0,0|2,1,0]=4 2031 B12R1.452 CSc1cc(Cl)c(cc1)C(C)N Amb25151050 [0,1,0,0,0,0|1,1,1]=4 2032 B12R1.452 CSc1cc(Cl)c(cc1)C(C)O Amb25778564 [0,1,0,0,0,0|0,1,2]=4 2033 B12R1.452 CSc1cc(Cl)c(cc1)C(N)=N Amb18317029 [0,1,0,0,0,0|2,1,0]=4 2034 B12R1.452 CSc1cc(Cl)c(cc1)C(O)=O Amb18287959 [0,1,0,0,0,0|1,1,0]=3 2035 B12R1.452 CSc1cc(Cl)c(cc1)[C@H](C)O Amb24525857 [0,1,0,0,0,0|0,1,2]=4 2036 B12R1.452 CSc1cc(F)c(cc1)C(O)=O Amb25693341 [0,1,0,0,0,0|1,1,0]=3 2037 B12R1.452 CSc1cc(F)c(cc1)[N+]([O-])=O Amb22523361 [0,1,0,0,0,0|2,1,0]=4 2038 B12R1.452 CSc1cc(I)c(cc1)C(O)=O Amb24438390 [0,1,0,0,0,0|1,1,0]=3 2039 B12R1.452 CSc1cc(N)c(cc1)[N+]([O-])=O Amb24673823 [0,1,0,0,0,0|2,1,0]=4 2040 B12R1.452 CSc1cc(O)c(cc1)C(=O)Cl Amb25039255 [0,1,0,0,0,0|1,1,0]=3 2041 B12R1.452 CSc1cc(O)c(cc1)C(C)C Amb24485439 [0,1,0,0,0,0|1,1,1]=4 2042 B12R1.452 CSc1cc(O)c(cc1)[N+]([O-])=O Amb25300530 [0,1,0,0,0,0|2,1,0]=4 2043 B12R1.452 CSc1ccc(c(c1)O)C(=O)O Amb10071837 [0,1,0,0,0,0|1,1,0]=3 2044 B12R1.452 CSc1ncc(c(n1)C)C(=O)C Amb2422971 [0,1,0,0,0,0|2,1,0]=4 2045 B12R1.452 Cc1[n]c(CC)[n]cc1C(C)=O Amb18798325 [0,1,0,0,0,0|3,0,0]=4 2046 B12R1.452 Cc1[n]c(CC)ccc1C(O)=O Amb24594927 [0,1,0,0,0,0|3,0,0]=4 2047 B12R1.452 Cc1[n]c(NC)[n]cc1C(C)=O Amb25066848 [0,1,0,0,0,0|3,0,0]=4 2048 B12R1.452 Cc1[n]c([n]cc1C(O)=O)OC Amb22436424 [0,1,0,0,0,0|3,0,0]=4 2049 B12R1.452 Cc1[n]c(c[n]c1C(C)=O)OC Amb24686573 [0,1,0,0,0,0|2,0,0]=3 2050 B12R1.452 Cc1[n]c(c[n]c1C(O)=O)OC Amb25039275 [0,1,0,0,0,0|3,0,0]=4 2051 B12R1.452 Cc1[n]c(ccc1C(C)Br)OC Amb25846960 [0,1,0,0,0,0|2,0,1]=4 2052 B12R1.452 Cc1[n]c(ccc1C(C)N)OC Amb23445491 [0,1,0,0,0,0|2,0,1]=4 2053 B12R1.452 Cc1[n]c(ccc1C(C)O)OC Amb23445487 [0,1,0,0,0,0|1,0,2]=4 2054 B12R1.452 Cc1[n]c(ccc1C(N)=N)OC Amb24393674 [0,1,0,0,0,0|3,0,0]=4 2055 B12R1.452 Cc1[n]c(ccc1C(N)=S)OC Amb25792250 [0,1,0,0,0,0|2,1,0]=4 2056 B12R1.452 Cc1[n]c(ccc1C(O)=O)NC Amb23445544 [0,1,0,0,0,0|3,0,0]=4 2057 B12R1.452 Cc1[n]c(ccc1C(O)=O)OC Amb19895181 [0,1,0,0,0,0|2,0,0]=3 2058 B12R1.452 Cc1[n]c(ccc1C(O)=O)SC Amb23445521 [0,1,0,0,0,0|2,1,0]=4 2059 B12R1.452 Cc1cc(C=C)ccc1C(O)=O Amb25233417 [0,1,0,0,0,0|2,0,1]=4 2060 B12R1.452 Cc1cc(CC)ccc1C(C)=O Amb24531587 [0,1,0,0,0,0|1,0,0]=2 2061 B12R1.452 Cc1cc(CC)ccc1C(C)C Amb24091501 [0,1,0,0,0,0|2,0,1]=4 2062 B12R1.452 Cc1cc(CC)ccc1[N+]([O-])=O Amb25251559 [0,1,0,0,0,0|3,0,0]=4 2063 B12R1.452 Cc1cc(CCl)c[n]c1C(C)=O Amb25050145 [0,1,0,0,0,0|3,0,0]=4 2064 B12R1.452 Cc1cc(CN)ccc1C(O)=O Amb18646311 [0,1,0,0,0,0|3,0,0]=4 2065 B12R1.452 Cc1cc(CO)ccc1C(C)=O Amb25158037 [0,1,0,0,0,0|2,0,0]=3 2066 B12R1.452 Cc1cc(CO)ccc1C(O)=O Amb25226871 [0,1,0,0,0,0|3,0,0]=4 2067 B12R1.452 Cc1cc(NC)[n]cc1C(O)=O Amb23579334 [0,1,0,0,0,0|3,0,0]=4 2068 B12R1.452 Cc1cc([n]cc1C(C)=C)OC Amb24673390 [0,1,0,0,0,0|2,0,0]=3 2069 B12R1.452 Cc1cc([n]cc1C(C)=O)OC Amb24393286 [0,1,0,0,0,0|1,0,0]=2 2070 B12R1.452 Cc1cc([n]cc1C(C)N)OC Amb23579274 [0,1,0,0,0,0|2,0,1]=4 2071 B12R1.452 Cc1cc([n]cc1C(C)O)OC Amb23579269 [0,1,0,0,0,0|1,0,2]=4 2072 B12R1.452 Cc1cc([n]cc1C(O)=O)OC Amb23579262 [0,1,0,0,0,0|2,0,0]=3 2073 B12R1.452 Cc1cc([n]cc1C(O)=O)SC Amb23579313 [0,1,0,0,0,0|2,1,0]=4 2074 B12R1.452 Cc1cc([n]cc1N(=O)=O)OC Amb20621503 [0,1,0,0,0,0|3,0,0]=4 2075 B12R1.452 Cc1cc([n]cc1[C@H](C)N)OC Amb24417711 [0,1,0,0,0,0|2,0,1]=4 2076 B12R1.452 Cc1cc(c[n]c1C(C)=O)OC Amb23403510 [0,1,0,0,0,0|1,0,0]=2 2077 B12R1.452 Cc1cc(c[n]c1C(N)=O)OC Amb23403509 [0,1,0,0,0,0|2,0,0]=3 2078 B12R1.452 Cc1cc(c[n]c1C(O)=O)OC Amb23437554 [0,1,0,0,0,0|2,0,0]=3 2079 B12R1.452 Cc1cc(ccc1C(=O)Cl)C#N Amb24432820 [0,1,0,0,0,0|3,0,0]=4 2080 B12R1.452 Cc1cc(ccc1C(C)=O)C#N Amb24057167 [0,1,0,0,0,0|2,0,0]=3 2081 B12R1.452 Cc1cc(ccc1C(C)C)NC Amb25836831 [0,1,0,0,0,0|2,0,1]=4 2082 B12R1.452 Cc1cc(ccc1C(C)C)ON Amb24413013 [0,1,0,0,0,0|2,0,1]=4 2083 B12R1.452 Cc1cc(ccc1C(C)Cl)OC Amb19057819 [0,1,0,0,0,0|1,0,1]=3 2084 B12R1.452 Cc1cc(ccc1C(C)O)OC Amb18792764 [0,1,0,0,0,0|0,0,2]=3 2085 B12R1.452 Cc1cc(ccc1C(N)=N)SC Amb25098876 [0,1,0,0,0,0|2,1,0]=4 2086 B12R1.452 Cc1cc(ccc1C(N)=O)C#N Amb22495367 [0,1,0,0,0,0|3,0,0]=4 2087 B12R1.452 Cc1cc(ccc1C(N)=O)NC Amb25828772 [0,1,0,0,0,0|2,0,0]=3 2088 B12R1.452 Cc1cc(ccc1C(N)=S)NC Amb24720974 [0,1,0,0,0,0|2,1,0]=4 2089 B12R1.452 Cc1cc(ccc1C(N)=S)OC Amb24571674 [0,1,0,0,0,0|1,1,0]=3 2090 B12R1.452 Cc1cc(ccc1C(O)=O)C#C Amb25111203 [0,1,0,0,0,0|2,0,1]=4 2091 B12R1.452 Cc1cc(ccc1C(O)=O)C#N Amb18645455 [0,1,0,0,0,0|3,0,0]=4 2092 B12R1.452 Cc1cc(ccc1C(O)=O)C=O Amb22586121 [0,1,0,0,0,0|3,0,0]=4 2093 B12R1.452 Cc1cc(ccc1C(O)=O)NC Amb24715209 [0,1,0,0,0,0|2,0,0]=3 2094 B12R1.452 Cc1cc(ccc1C(O)=O)NN Amb25775208 [0,1,0,0,0,0|3,0,0]=4 2095 B12R1.452 Cc1cc(ccc1C(O)=O)NO Amb25732282 [0,1,0,0,0,0|3,0,0]=4 2096 B12R1.452 Cc1cc(ccc1S(=O)Cl)OC Amb18567176 [0,1,0,0,0,0|2,0,0]=3 2097 B12R1.452 Cc1cc(ccc1S(O)=O)OC Amb18066178 [0,1,0,0,0,0|2,0,0]=3 2098 B12R1.452 Cc1cc(ccc1[C@@H](C)N)OC Amb25090371 [0,1,0,0,0,0|1,0,1]=3 2099 B12R1.452 Cc1cc(ccc1[C@H](C)N)OC Amb24453240 [0,1,0,0,0,0|1,0,1]=3 2100 B12R1.452 ClC(=O)c1ccc(B=O)cc1Cl Amb17938146 [0,1,0,0,0,0|3,0,0]=4 2101 B12R1.452 N#Cc1cc(Br)c(cc1)C(=O)Cl Amb25301738 [0,1,0,0,0,0|3,0,0]=4 2102 B12R1.452 N#Cc1cc(Br)c(cc1)C(O)=O Amb22752605 [0,1,0,0,0,0|3,0,0]=4 2103 B12R1.452 N#Cc1cc(Cl)c(cc1)C(=O)Cl Amb24104271 [0,1,0,0,0,0|3,0,0]=4 2104 B12R1.452 N#Cc1cc(Cl)c(cc1)C(O)=O Amb22751095 [0,1,0,0,0,0|3,0,0]=4 2105 B12R1.452 N#Cc1cc(F)c(cc1)C(=O)Cl Amb25839745 [0,1,0,0,0,0|3,0,0]=4 2106 B12R1.452 N#Cc1cc(F)c(cc1)C(=O)F Amb25689692 [0,1,0,0,0,0|3,0,0]=4 2107 B12R1.452 N#Cc1cc(I)c(cc1)C(O)=O Amb21858202 [0,1,0,0,0,0|3,0,0]=4 2108 B12R1.452 N#Cc1cc(O)c(cc1)C(=O)Cl Amb25837305 [0,1,0,0,0,0|3,0,0]=4 2109 B12R1.452 N#Cc1cc(O)c(cc1)C(O)=O Amb22904191 [0,1,0,0,0,0|3,0,0]=4 2110 B12R1.452 N#Cc1cc(S)c(cc1)C(O)=O Amb25156564 [0,1,0,0,0,0|3,0,0]=4 2111 B12R1.452 N#Cc1ccc(c(c1)F)C(=O)O Amb1932045 [0,1,0,0,0,0|3,0,0]=4 2112 B12R1.452 N#[N+]c1cc(O)c(cc1)C(O)=O Amb25209027 [0,1,0,0,0,0|3,0,0]=4 2113 B12R1.452 NC(=O)c1ccc(CN)cc1O Amb25144011 [0,1,0,0,0,0|3,0,0]=4 2114 B12R1.452 NC(=O)c1ccc(cc1Cl)NN Amb24756490 [0,1,0,0,0,0|3,0,0]=4 2115 B12R1.452 NCc1ccc(C(O)=O)c(Cl)c1 Amb25701401 [0,1,0,0,0,0|3,0,0]=4 2116 B12R1.452 NCc1ccc(C(O)=O)c(F)c1 Amb24707163 [0,1,0,0,0,0|3,0,0]=4 2117 B12R1.452 NNc1cc(Cl)c(cc1)C(O)=O Amb23440330 [0,1,0,0,0,0|3,0,0]=4 2118 B12R1.452 NNc1cc(I)c(cc1)C(O)=O Amb24403011 [0,1,0,0,0,0|3,0,0]=4 2119 B12R1.452 NNc1cc(O)c(cc1)C(O)=O Amb25111525 [0,1,0,0,0,0|3,0,0]=4 2120 B12R1.452 Nc1cc(CS)ccc1C(O)=O Amb25255589 [0,1,0,0,0,0|3,0,0]=4 2121 B12R1.452 Nc1cc(ccc1C(N)=O)C#N Amb24106105 [0,1,0,0,0,0|3,0,0]=4 2122 B12R1.452 Nc1cc(ccc1C(N)=O)SCl Amb25742934 [0,1,0,0,0,0|2,1,0]=4 2123 B12R1.452 Nc1cc(ccc1C(O)=O)C#N Amb24057221 [0,1,0,0,0,0|3,0,0]=4 2124 B12R1.452 Nc1cc(ccc1C(O)=O)NN Amb25248795 [0,1,0,0,0,0|3,0,0]=4 2125 B12R1.452 O=Cc1ccc(c(c1)F)C(=O)O Amb10840848 [0,1,0,0,0,0|3,0,0]=4 2126 B12R1.452 OC(=O)c1ccc(CBr)cc1Br Amb22284468 [0,1,0,0,0,0|3,0,0]=4 2127 B12R1.452 OC(=O)c1ccc(CBr)cc1Cl Amb22735955 [0,1,0,0,0,0|3,0,0]=4 2128 B12R1.452 OC(=O)c1ccc(CBr)cc1F Amb22735643 [0,1,0,0,0,0|3,0,0]=4 2129 B12R1.452 OC(=O)c1ccc(CCl)cc1Br Amb24483645 [0,1,0,0,0,0|3,0,0]=4 2130 B12R1.452 OC(=O)c1ccc(CO)cc1Br Amb24057223 [0,1,0,0,0,0|3,0,0]=4 2131 B12R1.452 OC(=O)c1ccc(CO)cc1I Amb24057230 [0,1,0,0,0,0|3,0,0]=4 2132 B12R1.452 OC(=O)c1ccc(cc1Br)C=O Amb24057220 [0,1,0,0,0,0|3,0,0]=4 2133 B12R1.452 OC(=O)c1ccc(cc1Cl)C=O Amb24573665 [0,1,0,0,0,0|3,0,0]=4 2134 B12R1.452 OC(=O)c1ccc(cc1I)C=O Amb24057228 [0,1,0,0,0,0|3,0,0]=4 2135 B12R1.452 OC(=O)c1ccc(cc1O)C=O Amb24057218 [0,1,0,0,0,0|3,0,0]=4 2136 B12R1.452 OCc1ccc(c(c1)F)C(=O)O Amb10839328 [0,1,0,0,0,0|3,0,0]=4 2137 B12R1.452 Oc1cc(CO)ccc1C(O)=O Amb24634102 [0,1,0,0,0,0|3,0,0]=4 2138 B12R1.452 Oc1cc(ccc1C(O)=O)NO Amb22753290 [0,1,0,0,0,0|3,0,0]=4 2139 B12R1.529 COC1=CCC(O)(C=C1)C(O)=O Amb24390868 [0,1,0,0,0,0|1,0,2]=4 2140 B10R0.77 CC(=O)\C=C\C\C(\CC)=C\C Amb24764954 [0,0,1,0,0,0|1,0,2]=4 2141 B10R0.77 CC(C)=C\C=C/C(/C=O)=C\C Amb24668903 [0,0,1,0,0,0|3,0,0]=4 2142 B10R0.77 CO\C(\C=O)=C/C=C/N(C)C Amb25385812 [0,0,1,0,0,0|3,0,0]=4 2143 B10R0.82 CC(=O)C(=O)\C=C\C(=O)OC Amb24764989 [0,0,1,0,0,0|2,0,0]=3 2144 B10R0.82 CC(=O)\C(\C)=C\CC(=O)OC Amb24766642 [0,0,1,0,0,0|1,0,2]=4 2145 B12R2.9 CCc1ccc(cc1)C2CN2 Amb18862481 [0,0,0,1,0,0|2,0,1]=4 2146 B12R2.9 CCc1ccc(cc1)[C@H]2CO2 Amb25136404 [0,0,0,1,0,0|1,0,2]=4 2147 B12R2.9 CNc1ccc(cc1)C2CC2 Amb25073243 [0,0,0,1,0,0|2,0,1]=4 2148 B12R2.9 COc1ccc(c[n]1)C2CC2 Amb25085104 [0,0,0,1,0,0|2,0,1]=4 2149 B12R2.9 COc1ccc(c[n]1)C2CO2 Amb25366283 [0,0,0,1,0,0|1,0,2]=4 2150 B12R2.9 COc1ccc(cc1)C2CN2 Amb18224269 [0,0,0,1,0,0|1,0,1]=3 2151 B12R2.9 COc1ccc(cc1)C2OC2 Amb1137350 [0,0,0,1,0,0|0,0,2]=3 2152 B12R2.9 COc1ccc(cc1)[C@H]2OC2 Amb16231710 [0,0,0,1,0,0|0,0,2]=3 2153 B12R2.9 CSc1ccc(cc1)C2CN2 Amb18862654 [0,0,0,1,0,0|1,1,1]=4 2154 B12R2.9 CSc1ccc(cc1)C2CO2 Amb18862690 [0,0,0,1,0,0|0,1,2]=4 2155 B12R2.1313 O=C1NC(=O)c2ccc1cc2 Amb24441648 [0,0,0,1,0,0|3,0,0]=4 2156 B12R2.1384 NC(=O)c1cc2CCc2cc1 Amb25077153 [0,0,0,1,0,0|2,0,0]=3 2157 B12R2.1384 O=C(Cl)c1cc2CCc2cc1 Amb25684227 [0,0,0,1,0,0|2,0,0]=3 2158 B12R2.1384 OC(=O)c1cc2C=Cc2cc1 Amb22002330 [0,0,0,1,0,0|2,0,1]=4 2159 B12R2.2107 COc1cc2CC(Cl)c2cc1 Amb25059186 [0,0,0,1,0,0|1,0,1]=3 2160 B12R2.2107 COc1cc2CC(O)c2cc1 Amb21948268 [0,0,0,1,0,0|0,0,2]=3 2161 B12R2.2107 COc1ccc2C(=O)Cc2c1 Amb17778718 [0,0,0,1,0,0|0,0,0]=1 2162 B10R1.31 CC(=C)c1c[s]c([n]1)OC Amb24070395 [0,0,0,0,1,0|3,0,0]=4 2163 B10R1.31 CC(=C)c1cc([s]c1)SC Amb25047042 [0,0,0,0,1,0|2,1,0]=4 2164 B10R1.31 CC(=O)C=1CCC(C1)OC Amb25729906 [0,0,0,0,1,0|0,0,3]=4 2165 B10R1.31 CC(=O)[n]1cc(C=O)cc1 Amb18643141 [0,0,0,0,1,0|3,0,0]=4 2166 B10R1.31 CC(=O)c1[n]c(CC)c[s]1 Amb24720995 [0,0,0,0,1,0|3,0,0]=4 2167 B10R1.31 CC(=O)c1[n]cc(CC)[s]1 Amb24387171 [0,0,0,0,1,0|3,0,0]=4 2168 B10R1.31 CC(=O)c1[n]cc(OC)[s]1 Amb18830636 [0,0,0,0,1,0|2,0,0]=3 2169 B10R1.31 CC(=O)c1[n]cc(o1)OC Amb18202771 [0,0,0,0,1,0|2,0,0]=3 2170 B10R1.31 CC(=O)c1c[nH]c(NC)[n]1 Amb24364639 [0,0,0,0,1,0|3,0,0]=4 2171 B10R1.31 CC(=O)c1c[nH]c([n]1)SC Amb22756162 [0,0,0,0,1,0|2,1,0]=4 2172 B10R1.31 CC(=O)c1c[nH]c(c1)C#N Amb18124413 [0,0,0,0,1,0|3,0,0]=4 2173 B10R1.31 CC(=O)c1c[nH]c(c1)C=O Amb18643120 [0,0,0,0,1,0|3,0,0]=4 2174 B10R1.31 CC(=O)c1c[n](CC)c[n]1 Amb23585671 [0,0,0,0,1,0|3,0,0]=4 2175 B10R1.31 CC(=O)c1c[n]c(CC)[s]1 Amb18796863 [0,0,0,0,1,0|3,0,0]=4 2176 B10R1.31 CC(=O)c1c[n]c([s]1)SC Amb19882271 [0,0,0,0,1,0|2,1,0]=4 2177 B10R1.31 CC(=O)c1c[s]c(NC)[n]1 Amb18563470 [0,0,0,0,1,0|3,0,0]=4 2178 B10R1.31 CC(=O)c1c[s]c(c1)C=O Amb18125727 [0,0,0,0,1,0|3,0,0]=4 2179 B10R1.31 CC(=O)c1cc(CBr)c[s]1 Amb24477339 [0,0,0,0,1,0|3,0,0]=4 2180 B10R1.31 CC(=O)c1cc(CC)[n]o1 Amb25794113 [0,0,0,0,1,0|3,0,0]=4 2181 B10R1.31 CC(=O)c1cc(CN)co1 Amb24679267 [0,0,0,0,1,0|3,0,0]=4 2182 B10R1.31 CC(=O)c1cc(CO)co1 Amb25336336 [0,0,0,0,1,0|3,0,0]=4 2183 B10R1.31 CC(=O)c1cc([n]o1)OC Amb18831798 [0,0,0,0,1,0|2,0,0]=3 2184 B10R1.31 CC(=O)c1cc(c[nH]1)C#N Amb18124414 [0,0,0,0,1,0|3,0,0]=4 2185 B10R1.31 CC(=O)c1cc(c[nH]1)C=O Amb21971020 [0,0,0,0,1,0|3,0,0]=4 2186 B10R1.31 CC(=O)c1cc(c[s]1)C#C Amb25679116 [0,0,0,0,1,0|2,0,1]=4 2187 B10R1.31 CC(=O)c1cc(c[s]1)C#N Amb18644467 [0,0,0,0,1,0|3,0,0]=4 2188 B10R1.31 CC(=O)c1cc(c[s]1)OC Amb25088132 [0,0,0,0,1,0|1,0,0]=2 2189 B10R1.31 CC(=O)c1cc(co1)C#N Amb24078745 [0,0,0,0,1,0|3,0,0]=4 2190 B10R1.31 CC(=O)c1cc(co1)SC Amb25146494 [0,0,0,0,1,0|1,1,0]=3 2191 B10R1.31 CC(=O)c1ccc(C#C)[s]1 Amb21962790 [0,0,0,0,1,0|2,0,1]=4 2192 B10R1.31 CC(=O)c1ccc(C#N)o1 Amb21963422 [0,0,0,0,1,0|3,0,0]=4 2193 B10R1.31 CC(=O)c1ccc(CBr)o1 Amb25361923 [0,0,0,0,1,0|3,0,0]=4 2194 B10R1.31 CC(=O)c1ccc(CC)[nH]1 Amb25770545 [0,0,0,0,1,0|2,0,0]=3 2195 B10R1.31 CC(=O)c1ccc(CC)o1 Amb20667621 [0,0,0,0,1,0|2,0,0]=3 2196 B10R1.31 CC(=O)c1ccc(CCl)[s]1 Amb25774932 [0,0,0,0,1,0|3,0,0]=4 2197 B10R1.31 CC(=O)c1ccc(CN)[nH]1 Amb24696867 [0,0,0,0,1,0|3,0,0]=4 2198 B10R1.31 CC(=O)c1ccc(CN)[s]1 Amb18830875 [0,0,0,0,1,0|3,0,0]=4 2199 B10R1.31 CC(=O)c1ccc(CN)o1 Amb18202974 [0,0,0,0,1,0|3,0,0]=4 2200 B10R1.31 CC(=O)c1ccc(CO)[nH]1 Amb24637224 [0,0,0,0,1,0|3,0,0]=4 2201 B10R1.31 CC(=O)c1ccc(CO)o1 Amb20242222 [0,0,0,0,1,0|3,0,0]=4 2202 B10R1.31 CC(=O)c1ccc(NN)[s]1 Amb18830766 [0,0,0,0,1,0|3,0,0]=4 2203 B10R1.31 CC(=O)c1ccc([nH]1)SC Amb18676882 [0,0,0,0,1,0|1,1,0]=3 2204 B10R1.31 CC(=O)c1ccc(o1)OC Amb25347614 [0,0,0,0,1,0|1,0,0]=2 2205 B10R1.31 CC(=O)c1ccc(o1)SC Amb18678411 [0,0,0,0,1,0|1,1,0]=3 2206 B10R1.31 CC(=O)c1coc(CBr)c1 Amb24637997 [0,0,0,0,1,0|3,0,0]=4 2207 B10R1.31 CC(=O)c1coc(CN)c1 Amb24457257 [0,0,0,0,1,0|3,0,0]=4 2208 B10R1.31 CC(=O)c1coc([n]1)OC Amb25178820 [0,0,0,0,1,0|2,0,0]=3 2209 B10R1.31 CC(=O)c1coc(c1)C#N Amb24502319 [0,0,0,0,1,0|3,0,0]=4 2210 B10R1.31 CC(=O)c1coc(c1)C=O Amb25202420 [0,0,0,0,1,0|3,0,0]=4 2211 B10R1.31 CC[n]1cc(cc1)C(O)=O Amb23441090 [0,0,0,0,1,0|3,0,0]=4 2212 B10R1.31 CCc1cc([nH]c1)C(O)=O Amb21971301 [0,0,0,0,1,0|3,0,0]=4 2213 B10R1.31 CCc1cc(c[s]1)C(N)=O Amb24432764 [0,0,0,0,1,0|3,0,0]=4 2214 B10R1.31 CCc1ccc([nH]1)C(N)=O Amb17938797 [0,0,0,0,1,0|3,0,0]=4 2215 B10R1.31 CCc1ccc([nH]1)C(O)=O Amb18832128 [0,0,0,0,1,0|3,0,0]=4 2216 B10R1.31 CCc1ccc(o1)C(=O)Cl Amb24650018 [0,0,0,0,1,0|3,0,0]=4 2217 B10R1.31 CCc1ccc(o1)C(=O)O Amb1071829 [0,0,0,0,1,0|3,0,0]=4 2218 B10R1.31 CCc1ccc(s1)C(=O)C Amb1153988 [0,0,0,0,1,0|2,0,0]=3 2219 B10R1.31 CCc1ccc(s1)C(=O)Cl Amb16186423 [0,0,0,0,1,0|3,0,0]=4 2220 B10R1.31 CCc1ccc(s1)C(=O)O Amb1216581 [0,0,0,0,1,0|3,0,0]=4 2221 B10R1.31 CCc1ncc([nH]1)C(=O)C Amb17593497 [0,0,0,0,1,0|3,0,0]=4 2222 B10R1.31 CCc1scc(c1)C(=O)Cl Amb16230129 [0,0,0,0,1,0|3,0,0]=4 2223 B10R1.31 CCc1scc(c1)C(=O)O Amb1934809 [0,0,0,0,1,0|3,0,0]=4 2224 B10R1.31 CCn1ccc(n1)C(=O)C Amb1945620 [0,0,0,0,1,0|3,0,0]=4 2225 B10R1.31 CCn1ncc(c1)C(=O)C Amb1073679 [0,0,0,0,1,0|3,0,0]=4 2226 B10R1.31 CNc1ccc(o1)C(O)=O Amb18284929 [0,0,0,0,1,0|3,0,0]=4 2227 B10R1.31 CNc1ncc(s1)C(=O)C Amb2436664 [0,0,0,0,1,0|3,0,0]=4 2228 B10R1.31 COc1[nH]cc([n]1)C(O)=O Amb24718264 [0,0,0,0,1,0|3,0,0]=4 2229 B10R1.31 COc1[n]c(co1)C(O)=O Amb25064800 [0,0,0,0,1,0|3,0,0]=4 2230 B10R1.31 COc1[n]cc([s]1)C([O-])=O Amb19651389 [0,0,0,0,1,0|3,0,0]=4 2231 B10R1.31 COc1[n]cc([s]1)C([O-])=O Amb21961512 [0,0,0,0,1,0|3,0,0]=4 2232 B10R1.31 COc1c[nH]c(c1)C(C)N Amb24740953 [0,0,0,0,1,0|2,0,1]=4 2233 B10R1.31 COc1c[nH]c(c1)C(O)=O Amb25338921 [0,0,0,0,1,0|2,0,0]=3 2234 B10R1.31 COc1c[n]([n]c1)C(N)=O Amb25840631 [0,0,0,0,1,0|3,0,0]=4 2235 B10R1.31 COc1c[s]c(c1)C(=O)Cl Amb25182501 [0,0,0,0,1,0|2,0,0]=3 2236 B10R1.31 COc1c[s]c(c1)C(C)N Amb24477115 [0,0,0,0,1,0|2,0,1]=4 2237 B10R1.31 COc1c[s]c(c1)C(C)O Amb25215671 [0,0,0,0,1,0|1,0,2]=4 2238 B10R1.31 COc1cc([n][nH]1)C(O)=O Amb22495539 [0,0,0,0,1,0|3,0,0]=4 2239 B10R1.31 COc1cc([n]o1)C(O)=O Amb25354225 [0,0,0,0,1,0|3,0,0]=4 2240 B10R1.31 COc1cc([s][n]1)C(N)=O Amb24480375 [0,0,0,0,1,0|3,0,0]=4 2241 B10R1.31 COc1cc([s][n]1)C(O)=O Amb24504313 [0,0,0,0,1,0|3,0,0]=4 2242 B10R1.31 COc1cc(c[nH]1)C(C)N Amb25044782 [0,0,0,0,1,0|2,0,1]=4 2243 B10R1.31 COc1cc(c[nH]1)[C@@H](C)N Amb24428104 [0,0,0,0,1,0|2,0,1]=4 2244 B10R1.31 COc1cc(c[s]1)C(C)N Amb25242535 [0,0,0,0,1,0|2,0,1]=4 2245 B10R1.31 COc1cc(c[s]1)[C@@H](C)N Amb24598320 [0,0,0,0,1,0|2,0,1]=4 2246 B10R1.31 COc1cc(o[n]1)C(=O)Cl Amb25114168 [0,0,0,0,1,0|3,0,0]=4 2247 B10R1.31 COc1ccc([nH]1)C(C)N Amb24453647 [0,0,0,0,1,0|2,0,1]=4 2248 B10R1.31 COc1ccc([nH]1)[C@@H](C)N Amb25805836 [0,0,0,0,1,0|2,0,1]=4 2249 B10R1.31 COc1ccc([s]1)C(C)Br Amb25761814 [0,0,0,0,1,0|2,0,1]=4 2250 B10R1.31 COc1ccc([s]1)C(C)N Amb25104933 [0,0,0,0,1,0|2,0,1]=4 2251 B10R1.31 COc1ccc([s]1)C(N)=N Amb25270102 [0,0,0,0,1,0|3,0,0]=4 2252 B10R1.31 COc1ccc([s]1)C(N)=S Amb25242435 [0,0,0,0,1,0|2,1,0]=4 2253 B10R1.31 COc1ccc([s]1)[C@@H](C)O Amb25329342 [0,0,0,0,1,0|1,0,2]=4 2254 B10R1.31 COc1ccc([s]1)[C@H](C)N Amb24418945 [0,0,0,0,1,0|2,0,1]=4 2255 B10R1.31 COc1ccc([s]1)[C@H](C)O Amb24684044 [0,0,0,0,1,0|1,0,2]=4 2256 B10R1.31 COc1ccc([s]1)[N+]([O-])=O Amb21964258 [0,0,0,0,1,0|3,0,0]=4 2257 B10R1.31 COc1ccc(o1)C(C)N Amb24477380 [0,0,0,0,1,0|2,0,1]=4 2258 B10R1.31 COc1ccc(o1)[N+]([O-])=O Amb24628155 [0,0,0,0,1,0|3,0,0]=4 2259 B10R1.31 COc1coc([n]1)C(O)=O Amb18202497 [0,0,0,0,1,0|3,0,0]=4 2260 B10R1.31 COc1coc(c1)C(O)=O Amb18643783 [0,0,0,0,1,0|2,0,0]=3 2261 B10R1.31 COc1noc(c1)C(=O)N Amb10604453 [0,0,0,0,1,0|3,0,0]=4 2262 B10R1.31 COc1noc(c1)C(=O)O Amb2447451 [0,0,0,0,1,0|3,0,0]=4 2263 B10R1.31 COc1scc(c1)C(=O)O Amb1084137 [0,0,0,0,1,0|2,0,0]=3 2264 B10R1.31 CSc1c[nH]c(c1)C(O)=O Amb24692868 [0,0,0,0,1,0|2,1,0]=4 2265 B10R1.31 CSc1c[s]c(c1)C(O)=O Amb18647850 [0,0,0,0,1,0|2,1,0]=4 2266 B10R1.31 CSc1ccc([nH]1)C(O)=O Amb18830632 [0,0,0,0,1,0|2,1,0]=4 2267 B10R1.31 CSc1ccc(o1)C(O)=O Amb18959560 [0,0,0,0,1,0|2,1,0]=4 2268 B10R1.31 CSc1ccc(s1)C(=O)O Amb1102122 [0,0,0,0,1,0|2,1,0]=4 2269 B10R1.31 ClCc1csc(c1)C(=O)C Amb1102125 [0,0,0,0,1,0|3,0,0]=4 2270 B10R1.31 N#Cc1ccc([nH]1)C(=O)C Amb17593411 [0,0,0,0,1,0|3,0,0]=4 2271 B10R1.31 OCc1csc(c1)C(=O)C Amb1102124 [0,0,0,0,1,0|3,0,0]=4 2272 B12R1.4 C#Cc1ccc(CC(O)=O)cc1 Amb24485430 [0,0,0,0,0,1|2,0,1]=4 2273 B12R1.4 C=Cc1ccc(CC(O)=O)cc1 Amb25131633 [0,0,0,0,0,1|2,0,1]=4 2274 B12R1.4 CC(=C)Cc1ccc(CC)cc1 Amb22000374 [0,0,0,0,0,1|2,0,0]=3 2275 B12R1.4 CC(=C)Cc1ccc(cc1)C=C Amb25803324 [0,0,0,0,0,1|2,0,1]=4 2276 B12R1.4 CC(=N)Nc1c[n]c(cc1)OC Amb25148436 [0,0,0,0,0,1|2,0,0]=3 2277 B12R1.4 CC(=N)Nc1ccc(CC)cc1 Amb25851888 [0,0,0,0,0,1|2,0,0]=3 2278 B12R1.4 CC(=N)Nc1ccc(CN)cc1 Amb25771885 [0,0,0,0,0,1|3,0,0]=4 2279 B12R1.4 CC(=N)Nc1ccc(cc1)NN Amb24415572 [0,0,0,0,0,1|3,0,0]=4 2280 B12R1.4 CC(=O)Cc1ccc(C#N)[n]c1 Amb24728545 [0,0,0,0,0,1|3,0,0]=4 2281 B12R1.4 CC(=O)Cc1ccc(C=C)cc1 Amb25366760 [0,0,0,0,0,1|1,0,1]=3 2282 B12R1.4 CC(=O)Cc1ccc(CC)[n]c1 Amb24596665 [0,0,0,0,0,1|2,0,0]=3 2283 B12R1.4 CC(=O)Cc1ccc(CC)c[n]1 Amb24342208 [0,0,0,0,0,1|2,0,0]=3 2284 B12R1.4 CC(=O)Cc1ccc(CF)cc1 Amb25208126 [0,0,0,0,0,1|2,0,0]=3 2285 B12R1.4 CC(=O)Cc1ccc(CN)cc1 Amb18908622 [0,0,0,0,0,1|2,0,0]=3 2286 B12R1.4 CC(=O)Cc1ccc(CO)cc1 Amb24532516 [0,0,0,0,0,1|2,0,0]=3 2287 B12R1.4 CC(=O)Cc1ccc([n][n]1)OC Amb24467593 [0,0,0,0,0,1|2,0,0]=3 2288 B12R1.4 CC(=O)Cc1ccc(cc1)SC Amb18893653 [0,0,0,0,0,1|0,1,0]=2 2289 B12R1.4 CC(=O)Nc1c[n]c(CC)c[n]1 Amb25790619 [0,0,0,0,0,1|3,0,0]=4 2290 B12R1.4 CC(=O)Nc1c[n]c(cc1)C#N Amb23403604 [0,0,0,0,0,1|3,0,0]=4 2291 B12R1.4 CC(=O)Nc1c[n]c(cc1)NC Amb24620240 [0,0,0,0,0,1|2,0,0]=3 2292 B12R1.4 CC(=O)Nc1ccc(C=C)c[n]1 Amb24400546 [0,0,0,0,0,1|2,0,1]=4 2293 B12R1.4 CC(=O)Nc1ccc(C=O)[n]c1 Amb24513770 [0,0,0,0,0,1|3,0,0]=4 2294 B12R1.4 CC(=O)Nc1ccc(CBr)cc1 Amb25058872 [0,0,0,0,0,1|2,0,0]=3 2295 B12R1.4 CC(=O)Nc1ccc(CN)c[n]1 Amb18960369 [0,0,0,0,0,1|3,0,0]=4 2296 B12R1.4 CC(=O)Nc1ccc(CO)c[n]1 Amb18625216 [0,0,0,0,0,1|3,0,0]=4 2297 B12R1.4 CC(=O)Nc1ccc([n][n]1)OC Amb25320224 [0,0,0,0,0,1|2,0,0]=3 2298 B12R1.4 CC(=O)Nc1ccc(c[n]1)C#C Amb23400159 [0,0,0,0,0,1|2,0,1]=4 2299 B12R1.4 CC(=O)Nc1ccc(c[n]1)C#N Amb18180000 [0,0,0,0,0,1|3,0,0]=4 2300 B12R1.4 CC(=O)Nc1ccc(c[n]1)C=O Amb24098449 [0,0,0,0,0,1|3,0,0]=4 2301 B12R1.4 CC(=O)Nc1ccc(c[n]1)OC Amb24738390 [0,0,0,0,0,1|1,0,0]=2 2302 B12R1.4 CC(=O)Nc1ccc(cc1)C#C Amb21964907 [0,0,0,0,0,1|1,0,1]=3 2303 B12R1.4 CC(=O)Nc1ccc(cc1)NN Amb22229618 [0,0,0,0,0,1|2,0,0]=3 2304 B12R1.4 CC(=O)Nc1ccc(cc1)NN Amb25839733 [0,0,0,0,0,1|2,0,0]=3 2305 B12R1.4 CC(=O)Nc1ccc(cc1)NO Amb24343207 [0,0,0,0,0,1|2,0,0]=3 2306 B12R1.4 CC(=O)Nc1ccc(cc1)[Hg]Cl Amb22347642 [0,0,0,0,0,1|2,0,0]=3 2307 B12R1.4 CC(=O)Oc1c[n]c(cc1)OC Amb24370312 [0,0,0,0,0,1|1,0,0]=2 2308 B12R1.4 CC(=O)Oc1ccc(C=C)[n]c1 Amb24684952 [0,0,0,0,0,1|2,0,1]=4 2309 B12R1.4 CC(=O)Oc1ccc(CBr)cc1 Amb22727961 [0,0,0,0,0,1|2,0,0]=3 2310 B12R1.4 CC(=O)Oc1ccc(CI)cc1 Amb22753743 [0,0,0,0,0,1|2,0,0]=3 2311 B12R1.4 CC(=O)Oc1ccc(CN)cc1 Amb18251721 [0,0,0,0,0,1|2,0,0]=3 2312 B12R1.4 CC(=O)Oc1ccc(CO)cc1 Amb24056443 [0,0,0,0,0,1|2,0,0]=3 2313 B12R1.4 CC(=O)Oc1ccc([n][n]1)OC Amb24579162 [0,0,0,0,0,1|2,0,0]=3 2314 B12R1.4 CC(=O)Oc1ccc(cc1)C#C Amb24643490 [0,0,0,0,0,1|1,0,1]=3 2315 B12R1.4 CC(=O)Oc1ccc(cc1)C#N Amb18645448 [0,0,0,0,0,1|2,0,0]=3 2316 B12R1.4 CC(=O)Oc1ccc(cc1)[Zn]I Amb22000486 [0,0,0,0,0,1|2,0,0]=3 2317 B12R1.4 CC(=S)Nc1ccc(CC)cc1 Amb25075620 [0,0,0,0,0,1|1,1,0]=3 2318 B12R1.4 CC(C)=Cc1ccc(C=O)cc1 Amb24102764 [0,0,0,0,0,1|3,0,0]=4 2319 B12R1.4 CCc1ccc(C=C(Br)Br)cc1 Amb18117914 [0,0,0,0,0,1|3,0,0]=4 2320 B12R1.4 CCc1ccc(CC(=C)Br)cc1 Amb19928777 [0,0,0,0,0,1|2,0,1]=4 2321 B12R1.4 CCc1ccc(CC(=C)Cl)cc1 Amb22000366 [0,0,0,0,0,1|2,0,1]=4 2322 B12R1.4 CCc1ccc(CC(=O)Cl)cc1 Amb25762197 [0,0,0,0,0,1|2,0,0]=3 2323 B12R1.4 CCc1ccc(CC(C)Br)cc1 Amb18049385 [0,0,0,0,0,1|2,0,1]=4 2324 B12R1.4 CCc1ccc(CC(O)=O)c[n]1 Amb24635308 [0,0,0,0,0,1|3,0,0]=4 2325 B12R1.4 CCc1ccc(CN(C)N)cc1 Amb18563654 [0,0,0,0,0,1|3,0,0]=4 2326 B12R1.4 CCc1ccc(C[C@@H](C)N)cc1 Amb24729343 [0,0,0,0,0,1|2,0,1]=4 2327 B12R1.4 CCc1ccc(cc1)CC(=O)N Amb17400136 [0,0,0,0,0,1|2,0,0]=3 2328 B12R1.4 CCc1ccc(cc1)CC(=S)N Amb17233641 [0,0,0,0,0,1|2,1,0]=4 2329 B12R1.4 CCc1ccc(cc1)CC(Cl)C Amb17477427 [0,0,0,0,0,1|2,0,1]=4 2330 B12R1.4 CCc1ccc(cc1)CC(O)C Amb17477408 [0,0,0,0,0,1|1,0,2]=4 2331 B12R1.4 CCc1ccc(cc1)NC(=N)Cl Amb24497259 [0,0,0,0,0,1|3,0,0]=4 2332 B12R1.4 CCc1ccc(cc1)NC(=N)N Amb10879732 [0,0,0,0,0,1|3,0,0]=4 2333 B12R1.4 CCc1ccc(cc1)NC(=O)N Amb1134788 [0,0,0,0,0,1|2,0,0]=3 2334 B12R1.4 CCc1ccc(cc1)NC(=S)N Amb2372771 [0,0,0,0,0,1|2,1,0]=4 2335 B12R1.4 CCc1ccc(cc1)OC(C)C Amb25688906 [0,0,0,0,0,1|2,0,1]=4 2336 B12R1.4 CCc1ccc(cc1)OC(N)=O Amb24091565 [0,0,0,0,0,1|2,0,0]=3 2337 B12R1.4 CN(C)Cc1ccc(cc1)NC Amb19002866 [0,0,0,0,0,1|3,0,0]=4 2338 B12R1.4 CN(N)Cc1ccc(cc1)OC Amb18563735 [0,0,0,0,0,1|2,0,0]=3 2339 B12R1.4 CN(N)Cc1ccc(cc1)SC Amb24395352 [0,0,0,0,0,1|2,1,0]=4 2340 B12R1.4 CNc1ccc(C=C(Cl)Cl)cc1 Amb24495377 [0,0,0,0,0,1|3,0,0]=4 2341 B12R1.4 CNc1ccc(CC(C)C)cc1 Amb18563594 [0,0,0,0,0,1|2,0,1]=4 2342 B12R1.4 CNc1ccc(CC(N)=O)cc1 Amb18303217 [0,0,0,0,0,1|2,0,0]=3 2343 B12R1.4 CNc1ccc(CC(O)=O)cc1 Amb18368592 [0,0,0,0,0,1|2,0,0]=3 2344 B12R1.4 CNc1ccc(C[C@@H](C)N)cc1 Amb24760053 [0,0,0,0,0,1|2,0,1]=4 2345 B12R1.4 CNc1ccc(c[n]1)NC(N)=O Amb25135947 [0,0,0,0,0,1|3,0,0]=4 2346 B12R1.4 CNc1ccc(cc1)CC(=O)O Amb17305895 [0,0,0,0,0,1|2,0,0]=3 2347 B12R1.4 CNc1ccc(cc1)NC(N)=N Amb24425381 [0,0,0,0,0,1|3,0,0]=4 2348 B12R1.4 CNc1ccc(cc1)NC(N)=O Amb18288748 [0,0,0,0,0,1|2,0,0]=3 2349 B12R1.4 CNc1ccc(cc1)SC(C)C Amb18554493 [0,0,0,0,0,1|2,0,1]=4 2350 B12R1.4 CNc1ccc(cc1)SC(N)=O Amb25667582 [0,0,0,0,0,1|2,0,0]=3 2351 B12R1.4 COc1c[n]c(CC(O)=O)c[n]1 Amb18826734 [0,0,0,0,0,1|3,0,0]=4 2352 B12R1.4 COc1c[n]c(c[n]1)NC(N)=O Amb25845951 [0,0,0,0,0,1|3,0,0]=4 2353 B12R1.4 COc1c[n]c(cc1)NC(C)C Amb24739336 [0,0,0,0,0,1|2,0,1]=4 2354 B12R1.4 COc1c[n]c(cc1)NC(N)=S Amb24483703 [0,0,0,0,0,1|2,1,0]=4 2355 B12R1.4 COc1c[n]c(cc1)NN(C)C Amb24440515 [0,0,0,0,0,1|3,0,0]=4 2356 B12R1.4 COc1ccc(CC(C)Cl)cc1 Amb19045657 [0,0,0,0,0,1|1,0,1]=3 2357 B12R1.4 COc1ccc(CC(C)S)cc1 Amb25096741 [0,0,0,0,0,1|0,1,1]=3 2358 B12R1.4 COc1ccc(CC(N)=O)c[n]1 Amb25121137 [0,0,0,0,0,1|2,0,0]=3 2359 B12R1.4 COc1ccc(CC(N)=S)c[n]1 Amb25067730 [0,0,0,0,0,1|2,1,0]=4 2360 B12R1.4 COc1ccc(CC(O)=O)[n]c1 Amb22740107 [0,0,0,0,0,1|2,0,0]=3 2361 B12R1.4 COc1ccc(CP(O)=O)cc1 Amb25281728 [0,0,0,0,0,1|2,0,0]=3 2362 B12R1.4 COc1ccc(CS([O-])=O)cc1 Amb24615932 [0,0,0,0,0,1|2,0,0]=3 2363 B12R1.4 COc1ccc(C[C@H](C)N)c[n]1 Amb25313734 [0,0,0,0,0,1|2,0,1]=4 2364 B12R1.4 COc1ccc(C[N+]([O-])=O)cc1 Amb23589322 [0,0,0,0,0,1|2,0,0]=3 2365 B12R1.4 COc1ccc(c[n]1)NC(N)=N Amb18798532 [0,0,0,0,0,1|3,0,0]=4 2366 B12R1.4 COc1ccc(cc1)CC(=O)O Amb1486643 [0,0,0,0,0,1|1,0,0]=2 2367 B12R1.4 COc1ccc(cc1)CC(N)C Amb1089334 [0,0,0,0,0,1|1,0,1]=3 2368 B12R1.4 COc1ccc(cc1)CC(N)C Amb2099800 [0,0,0,0,0,1|1,0,1]=3 2369 B12R1.4 COc1ccc(cc1)CC(O)C Amb1110944 [0,0,0,0,0,1|0,0,2]=3 2370 B12R1.4 COc1ccc(cc1)C[C@@H](N)C Amb13952980 [0,0,0,0,0,1|1,0,1]=3 2371 B12R1.4 COc1ccc(cc1)C[C@@H](O)C Amb13952977 [0,0,0,0,0,1|0,0,2]=3 2372 B12R1.4 COc1ccc(cc1)C[C@H](N)C Amb13952979 [0,0,0,0,0,1|1,0,1]=3 2373 B12R1.4 COc1ccc(cc1)C[C@H](O)C Amb13952978 [0,0,0,0,0,1|0,0,2]=3 2374 B12R1.4 COc1ccc(cc1)NB(O)O Amb25353788 [0,0,0,0,0,1|2,0,1]=4 2375 B12R1.4 COc1ccc(cc1)NC(=N)Cl Amb25103348 [0,0,0,0,0,1|2,0,0]=3 2376 B12R1.4 COc1ccc(cc1)NC(=N)N Amb10075212 [0,0,0,0,0,1|2,0,0]=3 2377 B12R1.4 COc1ccc(cc1)NC(=N)N Amb16231117 [0,0,0,0,0,1|2,0,0]=3 2378 B12R1.4 COc1ccc(cc1)NC(=O)Cl Amb24497092 [0,0,0,0,0,1|1,0,0]=2 2379 B12R1.4 COc1ccc(cc1)NC(=S)C Amb13799915 [0,0,0,0,0,1|0,1,0]=2 2380 B12R1.4 COc1ccc(cc1)NC(=S)N Amb1151845 [0,0,0,0,0,1|1,1,0]=3 2381 B12R1.4 COc1ccc(cc1)NC(=[NH2+])N Amb10560904 [0,0,0,0,0,1|2,0,0]=3 2382 B12R1.4 COc1ccc(cc1)NC(C)C Amb13952774 [0,0,0,0,0,1|1,0,1]=3 2383 B12R1.4 COc1ccc(cc1)NC(N)=N Amb20249362 [0,0,0,0,0,1|2,0,0]=3 2384 B12R1.4 COc1ccc(cc1)NC(O)=O Amb23554942 [0,0,0,0,0,1|1,0,0]=2 2385 B12R1.4 COc1ccc(cc1)NC(S)=S Amb25103310 [0,0,0,0,0,1|1,1,0]=3 2386 B12R1.4 COc1ccc(cc1)OC(C)Cl Amb25108666 [0,0,0,0,0,1|1,0,1]=3 2387 B12R1.4 COc1ccc(cc1)OC(F)F Amb17232990 [0,0,0,0,0,1|2,0,1]=4 2388 B12R1.4 COc1ccc(cc1)SC(C)O Amb24079671 [0,0,0,0,0,1|0,0,2]=3 2389 B12R1.4 COc1ccc(cc1)SC(F)F Amb17234883 [0,0,0,0,0,1|2,0,1]=4 2390 B12R1.4 COc1ccc(cc1)\C=[N+](\C)/[O-] Amb2420793 [0,0,0,0,0,1|1,0,1]=3 2391 B12R1.4 COc1ccc(cn1)NC(=O)C Amb2389760 [0,0,0,0,0,1|1,0,0]=2 2392 B12R1.4 COc1ccc(cn1)NC(=O)N Amb1138810 [0,0,0,0,0,1|2,0,0]=3 2393 B12R1.4 CS(=O)Cc1ccc(CN)cc1 Amb18909344 [0,0,0,0,0,1|3,0,0]=4 2394 B12R1.4 CS(=O)Cc1ccc(cc1)C#N Amb24747694 [0,0,0,0,0,1|3,0,0]=4 2395 B12R1.4 CSc1c[n]c(cc1)NC(N)=O Amb25334629 [0,0,0,0,0,1|2,1,0]=4 2396 B12R1.4 CSc1ccc(C=C(Br)Br)cc1 Amb18116022 [0,0,0,0,0,1|2,1,0]=4 2397 B12R1.4 CSc1ccc(CC(=O)Cl)cc1 Amb25342337 [0,0,0,0,0,1|1,1,0]=3 2398 B12R1.4 CSc1ccc(CC(C)C)cc1 Amb24377627 [0,0,0,0,0,1|1,1,1]=4 2399 B12R1.4 CSc1ccc(CC(C)Cl)cc1 Amb25081458 [0,0,0,0,0,1|1,1,1]=4 2400 B12R1.4 CSc1ccc(CC(N)=O)cc1 Amb18893671 [0,0,0,0,0,1|1,1,0]=3 2401 B12R1.4 CSc1ccc(cc1)CC(N)C Amb17617827 [0,0,0,0,0,1|1,1,1]=4 2402 B12R1.4 CSc1ccc(cc1)NC(=S)N Amb2372777 [0,0,0,0,0,1|1,2,0]=4 2403 B12R1.4 CSc1ccc(cc1)NC(N)=N Amb18805340 [0,0,0,0,0,1|2,1,0]=4 2404 B12R1.4 CSc1ccc(cc1)NC([S-])=S Amb22432988 [0,0,0,0,0,1|1,2,0]=4 2405 B12R1.4 CSc1ccc(cc1)OC(C)C Amb20246782 [0,0,0,0,0,1|1,1,1]=4 2406 B12R1.4 CSc1ccc(cc1)OC(N)=O Amb24537655 [0,0,0,0,0,1|1,1,0]=3 2407 B12R1.4 CSc1ccc(cc1)SC(N)=O Amb24373096 [0,0,0,0,0,1|1,1,0]=3 2408 B12R1.4 C\C(\N)=N\c1ccc(cc1)C#N Amb24382510 [0,0,0,0,0,1|3,0,0]=4 2409 B12R1.4 N#Cc1ccc(CC(=O)Cl)cc1 Amb25084783 [0,0,0,0,0,1|3,0,0]=4 2410 B12R1.4 N#Cc1ccc(cc1)NC(=O)C Amb1240564 [0,0,0,0,0,1|2,0,0]=3 2411 B12R1.4 N#Cc1ccc(cc1)OC(O)=O Amb22753299 [0,0,0,0,0,1|3,0,0]=4 2412 B12R1.4 N#[N+]c1ccc(CC(O)=O)cc1 Amb25065273 [0,0,0,0,0,1|3,0,0]=4 2413 B12R1.4 NC(=O)Cc1ccc(cc1)C#N Amb22059110 [0,0,0,0,0,1|3,0,0]=4 2414 B12R1.4 NC(=O)Cc1ccc(cc1)C=O Amb24373646 [0,0,0,0,0,1|3,0,0]=4 2415 B12R1.4 NC(=O)Nc1ccc(CO)cc1 Amb24573931 [0,0,0,0,0,1|3,0,0]=4 2416 B12R1.4 NC(=O)Oc1ccc(cc1)C#N Amb24679070 [0,0,0,0,0,1|3,0,0]=4 2417 B12R1.4 NC(=O)Sc1ccc(cc1)C#N Amb25360799 [0,0,0,0,0,1|3,0,0]=4 2418 B12R1.4 NCc1ccc(CC(O)=O)cc1 Amb20076037 [0,0,0,0,0,1|3,0,0]=4 2419 B12R1.4 NCc1ccc(cc1)NC(=O)C Amb205591 [0,0,0,0,0,1|2,0,0]=3 2420 B12R1.4 NCc1ccc(cc1)NC(=O)C Amb2371780 [0,0,0,0,0,1|2,0,0]=3 2421 B12R1.4 NNc1ccc(CC(O)=O)cc1 Amb21955783 [0,0,0,0,0,1|3,0,0]=4 2422 B12R1.4 O=C(Cl)Cc1ccc(CBr)cc1 Amb25721969 [0,0,0,0,0,1|3,0,0]=4 2423 B12R1.4 O=C(Cl)Cc1ccc(CCl)cc1 Amb25779327 [0,0,0,0,0,1|3,0,0]=4 2424 B12R1.4 O=Cc1ccc(cc1)SC(=O)C Amb13890380 [0,0,0,0,0,1|2,0,0]=3 2425 B12R1.4 OC(=O)Cc1ccc(cc1)C=O Amb18645972 [0,0,0,0,0,1|3,0,0]=4 2426 B12R1.4 OC(=O)Cc1ccc(cc1)N=O Amb24390894 [0,0,0,0,0,1|3,0,0]=4 2427 B12R1.4 OCc1ccc(cc1)NC(=O)C Amb1110930 [0,0,0,0,0,1|2,0,0]=3 2428 B12R1.4 [13CH3]Oc1ccc(cc1)NC(=O)C Amb17616865 [0,0,0,0,0,1|0,0,0]=1 2429 B12R1.4 [C-]#[N+]c1ccc(cc1)NC(C)=O Amb25326368 [0,0,0,0,0,1|1,0,1]=3 2430 B12R1.4 [C-]#[N+]c1ccc(cc1)OC(=O)Cl Amb24615950 [0,0,0,0,0,1|2,0,1]=4 2431 B12R1.4 [C-]#[N+]c1ccc(cc1)OC(C)=O Amb25786326 [0,0,0,0,0,1|1,0,1]=3 2432 B12R1.1891 CC(=O)C=1C=CCC(=NC1)OC Amb25214052 [0,0,0,0,0,1|1,0,0]=2 2433 B12R1.1891 COC1=CCC(=CC=C1)C(O)=O Amb24731143 [0,0,0,0,0,1|1,0,1]=3 2434 B12R1.1891 COC=1CC=CC(=CC1)C(C)C Amb25707810 [0,0,0,0,0,1|1,0,1]=3 2435 B12R1.1891 COC=1CC=CC(=CC1)C(O)=O Amb25060692 [0,0,0,0,0,1|1,0,0]=2 2436 B9R0.1 CC(=C\C=C\C(C)=O)C#C Amb25313317 [1,0,1,0,0,0|0,0,2]=4 2437 B9R0.1 CC(=O)C=C=CC(=O)OC Amb25187269 [1,0,1,0,0,0|1,0,1]=4 2438 B9R0.1 CC(=O)CC=C=C(C)C=C Amb24432100 [1,0,1,0,0,0|0,0,2]=4 2439 B9R0.1 CC(=O)CC\C=C(/C)\C=C Amb24646563 [1,0,1,0,0,0|0,0,2]=4 2440 B9R0.1 CC(=O)CC\C=C(\C)/C=C Amb24504939 [1,0,1,0,0,0|0,0,2]=4 2441 B9R0.1 CC(=O)C\C=C\C(=O)OC Amb24670506 [1,0,1,0,0,0|1,0,1]=4 2442 B9R0.1 CC(=O)\C=C\CC(=O)OC Amb25205440 [1,0,1,0,0,0|1,0,1]=4 2443 B9R0.1 CC(=O)\C=C\NC(=O)OC Amb25288496 [1,0,1,0,0,0|2,0,0]=4 2444 B9R0.1 CC(C)=CC\C=C(\C)/C=C Amb22731278 [1,0,1,0,0,0|1,0,1]=4 2445 B9R0.1 CC(C)=C\C=C\C(C)=CC Amb25214571 [1,0,1,0,0,0|1,0,1]=4 2446 B9R0.1 CC(O)\C=C\C=C(C)C=C Amb24686034 [1,0,1,0,0,0|0,0,2]=4 2447 B9R0.1 C\C(\C=C)=C/C=C/C(C)=O Amb25146521 [1,0,1,0,0,0|0,0,0]=2 2448 B9R0.1 C\C(\C=C)=C\C=CC(O)=O Amb25340447 [1,0,1,0,0,0|1,0,0]=3 2449 B9R0.1 C\C(\CBr)=C/C=C/C(C)=O Amb25756042 [1,0,1,0,0,0|1,0,1]=4 2450 B9R0.1 C\C(\CC)=C/C=CC(C)=O Amb24691739 [1,0,1,0,0,0|0,0,2]=4 2451 B9R0.1 O=C\C(=C\C=C\C(=O)C)\C Amb10068394 [1,0,1,0,0,0|1,0,0]=3 2452 B9R0.50 CO\C=C\C=C(/C=O)\C#N Amb25103662 [1,0,1,0,0,0|1,0,1]=4 2453 B9R0.7 CC(=C)CCC(=C)C(C)=O Amb25700996 [1,0,1,0,0,0|0,0,2]=4 2454 B9R0.7 CC(=O)C(=C)\C=C\C(C)C Amb24691582 [1,0,1,0,0,0|0,0,2]=4 2455 B9R0.7 CC(C)=CCC(=C)C(C)=O Amb25097065 [1,0,1,0,0,0|0,0,2]=4 2456 B9R0.7 CC(C)=C\C=C(/C)\C(C)=O Amb25116531 [1,0,1,0,0,0|0,0,2]=4 2457 B9R0.13 CC(=O)\C(\CBr)=C\C=C\C Amb25117938 [1,0,1,0,0,0|1,0,1]=4 2458 B9R0.13 CC(=O)\C(\CC)=C/C=C/C Amb25318782 [1,0,1,0,0,0|0,0,2]=4 2459 B9R0.13 CC(=O)\C(\CC)=C/C=CC Amb24617249 [1,0,1,0,0,0|0,0,2]=4 2460 B9R1.1 BrCc1ccc(cc1)O Amb10603714 [2,0,0,0,0,0|1,0,1]=4 2461 B9R1.1 Brc1ccc(cc1)N=O Amb17779258 [2,0,0,0,0,0|2,0,0]=4 2462 B9R1.1 C=C1C=CC(C=C1)=CO Amb25344008 [2,0,0,0,0,0|0,0,2]=4 2463 B9R1.1 C=C[n+]1ccc(cc1)C Amb10552996 [2,0,0,0,0,0|1,0,1]=4 2464 B9R1.1 C=Cc1ccc(I)cc1 Amb22736012 [2,0,0,0,0,0|1,0,1]=4 2465 B9R1.1 C=Cc1ccc(N)cc1 Amb21857763 [2,0,0,0,0,0|1,0,1]=4 2466 B9R1.1 C=Cc1ccc(O)[n]c1 Amb23446716 [2,0,0,0,0,0|1,0,1]=4 2467 B9R1.1 C=Cc1ccc(O)cc1 Amb22367052 [2,0,0,0,0,0|0,0,1]=3 2468 B9R1.1 C=Cc1ccc(cc1)O Amb10603802 [2,0,0,0,0,0|0,0,1]=3 2469 B9R1.1 C=Nc1ccc(cc1)O Amb17593237 [2,0,0,0,0,0|1,0,1]=4 2470 B9R1.1 CC=C1C=CN(C)C=C1 Amb24091559 [2,0,0,0,0,0|1,0,0]=3 2471 B9R1.1 CCC=1C=CC(=O)NC1 Amb19889888 [2,0,0,0,0,0|2,0,0]=4 2472 B9R1.1 CCN1C=CC(=O)C=C1 Amb24473507 [2,0,0,0,0,0|2,0,0]=4 2473 B9R1.1 CCc1ccc(Cl)cc1 Amb17674113 [2,0,0,0,0,0|1,0,1]=4 2474 B9R1.1 CCc1ccc(cc1)O Amb2227602 [2,0,0,0,0,0|0,0,1]=3 2475 B9R1.1 CCc1ccc(cn1)O Amb10573735 [2,0,0,0,0,0|1,0,1]=4 2476 B9R1.1 CCc1ccc(nc1)O Amb10600532 [2,0,0,0,0,0|1,0,1]=4 2477 B9R1.1 CN=C1C=CN(C)C=C1 Amb24725213 [2,0,0,0,0,0|2,0,0]=4 2478 B9R1.1 CNc1ccc(Br)cc1 Amb22236049 [2,0,0,0,0,0|2,0,0]=4 2479 B9R1.1 CNc1ccc(Cl)cc1 Amb22235624 [2,0,0,0,0,0|2,0,0]=4 2480 B9R1.1 CNc1ccc(O)c[n]1 Amb25292007 [2,0,0,0,0,0|2,0,0]=4 2481 B9R1.1 CNc1ccc(O)cc1 Amb22490395 [2,0,0,0,0,0|1,0,0]=3 2482 B9R1.1 CNc1ccc(cc1)I Amb10609625 [2,0,0,0,0,0|2,0,0]=4 2483 B9R1.1 CNc1ccc(cc1)O Amb1146863 [2,0,0,0,0,0|1,0,0]=3 2484 B9R1.1 CNc1ccc(cc1)O Amb2370692 [2,0,0,0,0,0|1,0,0]=3 2485 B9R1.1 COC1=CNC(=O)C=N1 Amb21963257 [2,0,0,0,0,0|2,0,0]=4 2486 B9R1.1 COC=1C=CC(=O)NN1 Amb20662183 [2,0,0,0,0,0|2,0,0]=4 2487 B9R1.1 CON1C=CC(=O)C=C1 Amb24722810 [2,0,0,0,0,0|1,0,0]=3 2488 B9R1.1 CO[n+]1ccc(C)cc1 Amb24727931 [2,0,0,0,0,0|1,0,0]=3 2489 B9R1.1 CO[n+]1ccc(cc1)N Amb10552642 [2,0,0,0,0,0|2,0,0]=4 2490 B9R1.1 COc1c[nH]c(=O)cn1 Amb10602948 [2,0,0,0,0,0|2,0,0]=4 2491 B9R1.1 COc1ccc(Br)c[n]1 Amb22490041 [2,0,0,0,0,0|2,0,0]=4 2492 B9R1.1 COc1ccc(F)[n]c1 Amb21963479 [2,0,0,0,0,0|2,0,0]=4 2493 B9R1.1 COc1ccc(F)c[n]1 Amb22432251 [2,0,0,0,0,0|2,0,0]=4 2494 B9R1.1 COc1ccc(N)[n]c1 Amb19375370 [2,0,0,0,0,0|2,0,0]=4 2495 B9R1.1 COc1ccc(O)[n]c1 Amb18642264 [2,0,0,0,0,0|1,0,1]=4 2496 B9R1.1 COc1ccc([Mg+])cc1 Amb22053738 [2,0,0,0,0,0|1,0,0]=3 2497 B9R1.1 COc1ccc([SiH3])cc1 Amb24658529 [2,0,0,0,0,0|0,1,0]=3 2498 B9R1.1 COc1ccc(cn1)Br Amb2447115 [2,0,0,0,0,0|2,0,0]=4 2499 B9R1.1 COc1ccc(cn1)C Amb15691027 [2,0,0,0,0,0|1,0,0]=3 2500 B9R1.1 COc1ccc(cn1)I Amb10844710 [2,0,0,0,0,0|2,0,0]=4 2501 B9R1.1 COc1ccc(cn1)N Amb1151298 [2,0,0,0,0,0|2,0,0]=4 2502 B9R1.1 COc1ccc(nc1)Br Amb2447553 [2,0,0,0,0,0|2,0,0]=4 2503 B9R1.1 COc1ccc(nc1)Cl Amb15691028 [2,0,0,0,0,0|2,0,0]=4 2504 B9R1.1 COc1ccc(nc1)I Amb2447620 [2,0,0,0,0,0|2,0,0]=4 2505 B9R1.1 CSC=1C=CC(=O)NC1 Amb25253734 [2,0,0,0,0,0|1,1,0]=4 2506 B9R1.1 CSc1ccc(Br)cc1 Amb22499364 [2,0,0,0,0,0|1,1,0]=4 2507 B9R1.1 CSc1ccc(cc1)N Amb1157791 [2,0,0,0,0,0|1,1,0]=4 2508 B9R1.1 Cc1[n]cc(c[n]1)OC Amb23402803 [2,0,0,0,0,0|2,0,0]=4 2509 B9R1.1 Cc1c[n]c([n]c1)OC Amb22498119 [2,0,0,0,0,0|2,0,0]=4 2510 B9R1.1 Cc1c[n]c(c[n]1)OC Amb20621632 [2,0,0,0,0,0|2,0,0]=4 2511 B9R1.1 Cc1c[n]c(cc1)N=O Amb24071566 [2,0,0,0,0,0|2,0,0]=4 2512 B9R1.1 Cc1ccc(C=N)cc1 Amb24063680 [2,0,0,0,0,0|1,0,0]=3 2513 B9R1.1 Cc1ccc(C=S)cc1 Amb22233234 [2,0,0,0,0,0|0,1,0]=3 2514 B9R1.1 Cc1ccc(CC)[n]c1 Amb21963390 [2,0,0,0,0,0|1,0,1]=4 2515 B9R1.1 Cc1ccc(CC)c[n]1 Amb20242167 [2,0,0,0,0,0|1,0,1]=4 2516 B9R1.1 Cc1ccc(CC)c[n]1 Amb22731102 [2,0,0,0,0,0|1,0,1]=4 2517 B9R1.1 Cc1ccc(CF)cc1 Amb24724496 [2,0,0,0,0,0|1,0,1]=4 2518 B9R1.1 Cc1ccc(CI)cc1 Amb25147165 [2,0,0,0,0,0|1,0,1]=4 2519 B9R1.1 Cc1ccc(SCl)cc1 Amb17939009 [2,0,0,0,0,0|1,1,0]=4 2520 B9R1.1 Cc1ccc([Hg]Cl)cc1 Amb17672284 [2,0,0,0,0,0|2,0,0]=4 2521 B9R1.1 Cc1ccc(c[n]1)NC Amb24062226 [2,0,0,0,0,0|2,0,0]=4 2522 B9R1.1 Cc1ccc(cc1)C=C Amb22338256 [2,0,0,0,0,0|0,0,1]=3 2523 B9R1.1 Cc1ccc(cc1)C=C Amb22338285 [2,0,0,0,0,0|0,0,1]=3 2524 B9R1.1 Cc1ccc(cc1)N=O Amb22167394 [2,0,0,0,0,0|1,0,0]=3 2525 B9R1.1 Cc1ccc(cc1)NC Amb22236047 [2,0,0,0,0,0|1,0,0]=3 2526 B9R1.1 Cc1ccc(cc1)NN Amb22489460 [2,0,0,0,0,0|2,0,0]=4 2527 B9R1.1 Cc1ccc(cc1)NO Amb21961957 [2,0,0,0,0,0|1,0,1]=4 2528 B9R1.1 Cc1ccc(cc1)N[NH3+] Amb24113868 [2,0,0,0,0,0|2,0,0]=4 2529 B9R1.1 Cc1ccc(cc1)ON Amb18642101 [2,0,0,0,0,0|1,0,0]=3 2530 B9R1.1 Cc1ccc(cc1)S[Na] Amb22338548 [2,0,0,0,0,0|1,1,0]=4 2531 B9R1.1 Cc1ccc(cc1)S[Tl] Amb22366492 [2,0,0,0,0,0|1,1,0]=4 2532 B9R1.1 Cc1ccc(cc1)[N+]#N Amb24105770 [2,0,0,0,0,0|2,0,0]=4 2533 B9R1.1 Cc1ccc(cc1)[N+]#N Amb25056987 [2,0,0,0,0,0|2,0,0]=4 2534 B9R1.1 Cc1ccc(cc1)[Zn]Br Amb22897846 [2,0,0,0,0,0|2,0,0]=4 2535 B9R1.1 Cc1ccc(cc1)[Zn]I Amb22000447 [2,0,0,0,0,0|2,0,0]=4 2536 B9R1.1 ClCc1ccc(cc1)O Amb10603784 [2,0,0,0,0,0|1,0,1]=4 2537 B9R1.1 Clc1ccc(cc1)N=O Amb17940420 [2,0,0,0,0,0|2,0,0]=4 2538 B9R1.1 N#Cc1ccc(cc1)C Amb1648948 [2,0,0,0,0,0|1,0,1]=4 2539 B9R1.1 N#Cc1ccc(cc1)O Amb1785457 [2,0,0,0,0,0|1,0,1]=4 2540 B9R1.1 N=Cc1ccc(cc1)O Amb17593236 [2,0,0,0,0,0|1,0,0]=3 2541 B9R1.1 NCc1ccc(cc1)O Amb1117538 [2,0,0,0,0,0|1,0,1]=4 2542 B9R1.1 NNc1ccc(O)cc1 Amb22899155 [2,0,0,0,0,0|2,0,0]=4 2543 B9R1.1 NNc1ccc(cc1)C Amb1207920 [2,0,0,0,0,0|2,0,0]=4 2544 B9R1.1 NNc1ccc(cc1)C Amb2370693 [2,0,0,0,0,0|2,0,0]=4 2545 B9R1.1 NOc1ccc(Br)cc1 Amb18649721 [2,0,0,0,0,0|2,0,0]=4 2546 B9R1.1 NOc1ccc(Cl)cc1 Amb18644043 [2,0,0,0,0,0|2,0,0]=4 2547 B9R1.1 NOc1ccc(F)cc1 Amb18642489 [2,0,0,0,0,0|2,0,0]=4 2548 B9R1.1 NOc1ccc(I)cc1 Amb24482010 [2,0,0,0,0,0|2,0,0]=4 2549 B9R1.1 NSc1ccc(O)cc1 Amb25188975 [2,0,0,0,0,0|2,0,0]=4 2550 B9R1.1 Nc1ccc(C=O)[n]c1 Amb23403602 [2,0,0,0,0,0|2,0,0]=4 2551 B9R1.1 Nc1ccc(C=O)c[n]1 Amb20247831 [2,0,0,0,0,0|2,0,0]=4 2552 B9R1.1 Nc1ccc(C=O)c[n]1 Amb22436785 [2,0,0,0,0,0|2,0,0]=4 2553 B9R1.1 Nc1ccc(C=O)cc1 Amb17842945 [2,0,0,0,0,0|1,0,0]=3 2554 B9R1.1 O=C1C=CC(=CN1)C=O Amb18642085 [2,0,0,0,0,0|1,0,1]=4 2555 B9R1.1 O=C1C=CC(=CO1)C=O Amb18124299 [2,0,0,0,0,0|1,0,1]=4 2556 B9R1.1 O=C1C=CC(C=C1)=NCl Amb22732649 [2,0,0,0,0,0|2,0,0]=4 2557 B9R1.1 O=Cc1cc[n+](cc1)C Amb10552785 [2,0,0,0,0,0|1,0,0]=3 2558 B9R1.1 O=Cc1ccc(I)[n]c1 Amb22445889 [2,0,0,0,0,0|2,0,0]=4 2559 B9R1.1 O=Cc1ccc(S)[n]c1 Amb23446588 [2,0,0,0,0,0|1,1,0]=4 2560 B9R1.1 O=Cc1ccc(S)cc1 Amb18643289 [2,0,0,0,0,0|0,1,0]=3 2561 B9R1.1 O=Cc1ccc(cc1)Br Amb1880872 [2,0,0,0,0,0|1,0,0]=3 2562 B9R1.1 O=Cc1ccc(cc1)C Amb2447582 [2,0,0,0,0,0|0,0,0]=2 2563 B9R1.1 O=Cc1ccc(cc1)Cl Amb1881691 [2,0,0,0,0,0|1,0,0]=3 2564 B9R1.1 O=Cc1ccc(cc1)O Amb1873769 [2,0,0,0,0,0|0,0,0]=2 2565 B9R1.1 O=Cc1ccc(cn1)Br Amb2447415 [2,0,0,0,0,0|2,0,0]=4 2566 B9R1.1 O=Cc1ccc(cn1)Cl Amb10975428 [2,0,0,0,0,0|2,0,0]=4 2567 B9R1.1 O=Cc1ccc(cn1)F Amb2447570 [2,0,0,0,0,0|2,0,0]=4 2568 B9R1.1 O=Cc1ccc(nc1)Br Amb2447414 [2,0,0,0,0,0|2,0,0]=4 2569 B9R1.1 O=Cc1ccc(nc1)C Amb10603697 [2,0,0,0,0,0|1,0,0]=3 2570 B9R1.1 O=Cc1ccc(nc1)F Amb2447589 [2,0,0,0,0,0|2,0,0]=4 2571 B9R1.1 O=Nc1ccc(cc1)N Amb17593244 [2,0,0,0,0,0|2,0,0]=4 2572 B9R1.1 O=Nc1ccc(cc1)O Amb10071749 [2,0,0,0,0,0|1,0,0]=3 2573 B9R1.1 O=[13CH]c1ccc(Cl)cc1 Amb22366894 [2,0,0,0,0,0|1,0,0]=3 2574 B9R1.1 O=[13CH]c1ccc(cc1)O Amb17615151 [2,0,0,0,0,0|0,0,0]=2 2575 B9R1.1 O=[As]c1ccc(cc1)N Amb17608246 [2,0,0,0,0,0|2,0,0]=4 2576 B9R1.1 ON=C1C=CC(=O)C=C1 Amb17608819 [2,0,0,0,0,0|2,0,0]=4 2577 B9R1.1 Oc1ccc(CF)cc1 Amb25318920 [2,0,0,0,0,0|1,0,1]=4 2578 B9R1.1 Oc1ccc(CI)cc1 Amb24400412 [2,0,0,0,0,0|1,0,1]=4 2579 B9R1.1 Oc1ccc(CS)cc1 Amb25782030 [2,0,0,0,0,0|0,1,1]=4 2580 B9R1.1 Oc1ccc(cc1)SCl Amb24625833 [2,0,0,0,0,0|2,0,0]=4 2581 B9R1.1 Oc1ccc(cc1)SS Amb25032314 [2,0,0,0,0,0|1,1,0]=4 2582 B9R1.1 Oc1ccc(nn1)C=O Amb10067589 [2,0,0,0,0,0|2,0,0]=4 2583 B9R1.1 SOc1ccc(I)cc1 Amb25243572 [2,0,0,0,0,0|2,0,0]=4 2584 B9R1.1 [N-]=[N+]=C1C=CC(=O)C=C1 Amb24597655 [2,0,0,0,0,0|2,0,0]=4 2585 B9R1.1 [NH3+]Cc1ccc(O)cc1 Amb17943004 [2,0,0,0,0,0|1,0,1]=4 2586 B9R1.1 [O-][n+]1ccc(C=O)cc1 Amb22338213 [2,0,0,0,0,0|1,0,1]=4 2587 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [2,0,0,0,0,0|1,0,1]=4 2588 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [2,0,0,0,0,0|1,0,1]=4 2589 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [2,0,0,0,0,0|2,0,0]=4 2590 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [2,0,0,0,0,0|2,0,0]=4 2591 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [2,0,0,0,0,0|1,0,0]=3 2592 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [2,0,0,0,0,0|1,0,0]=3 2593 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [2,0,0,0,0,0|2,0,0]=4 2594 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [2,0,0,0,0,0|2,0,0]=4 2595 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [2,0,0,0,0,0|1,0,1]=4 2596 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [2,0,0,0,0,0|1,0,1]=4 2597 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [2,0,0,0,0,0|0,0,2]=4 2598 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [2,0,0,0,0,0|1,0,1]=4 2599 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [2,0,0,0,0,0|1,0,0]=3 2600 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [2,0,0,0,0,0|2,0,0]=4 2601 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [2,0,0,0,0,0|2,0,0]=4 2602 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [2,0,0,0,0,0|1,0,0]=3 2603 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [2,0,0,0,0,0|2,0,0]=4 2604 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [2,0,0,0,0,0|1,0,0]=3 2605 B9R1.6 CC(C)c1ccccc1 Amb24052959 [2,0,0,0,0,0|1,0,1]=4 2606 B9R1.6 CC(F)c1ccccc1 Amb24555504 [2,0,0,0,0,0|1,0,1]=4 2607 B9R1.6 CC(I)c1ccccc1 Amb24064714 [2,0,0,0,0,0|1,0,1]=4 2608 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [2,0,0,0,0,0|1,0,1]=4 2609 B9R1.6 CN(C)c1ccccc1 Amb22040069 [2,0,0,0,0,0|2,0,0]=4 2610 B9R1.6 CN(N)c1ccccc1 Amb22346095 [2,0,0,0,0,0|2,0,0]=4 2611 B9R1.6 CN(N)c1ccccc1 Amb22754142 [2,0,0,0,0,0|2,0,0]=4 2612 B9R1.6 CN(c1ccccc1)N Amb1153615 [2,0,0,0,0,0|2,0,0]=4 2613 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [2,0,0,0,0,0|1,0,0]=3 2614 B9R1.6 CP(C)c1ccccc1 Amb22369673 [2,0,0,0,0,0|2,0,0]=4 2615 B9R1.6 CP(C)c1ccccc1 Amb24325382 [2,0,0,0,0,0|2,0,0]=4 2616 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [2,0,0,0,0,0|2,0,0]=4 2617 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [2,0,0,0,0,0|2,0,0]=4 2618 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [2,0,0,0,0,0|2,0,0]=4 2619 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [2,0,0,0,0,0|2,0,0]=4 2620 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [2,0,0,0,0,0|0,0,0]=2 2621 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [2,0,0,0,0,0|1,0,1]=4 2622 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [2,0,0,0,0,0|1,0,1]=4 2623 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [2,0,0,0,0,0|1,0,1]=4 2624 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [2,0,0,0,0,0|1,0,1]=4 2625 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [2,0,0,0,0,0|1,0,1]=4 2626 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [2,0,0,0,0,0|1,0,0]=3 2627 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [2,0,0,0,0,0|1,1,0]=4 2628 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [2,0,0,0,0,0|0,1,0]=3 2629 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [2,0,0,0,0,0|2,0,0]=4 2630 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [2,0,0,0,0,0|2,0,0]=4 2631 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [2,0,0,0,0,0|1,0,0]=3 2632 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [2,0,0,0,0,0|2,0,0]=4 2633 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [2,0,0,0,0,0|2,0,0]=4 2634 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [2,0,0,0,0,0|2,0,0]=4 2635 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [2,0,0,0,0,0|2,0,0]=4 2636 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [2,0,0,0,0,0|2,0,0]=4 2637 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [2,0,0,0,0,0|2,0,0]=4 2638 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [2,0,0,0,0,0|1,0,0]=3 2639 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [2,0,0,0,0,0|2,0,0]=4 2640 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [2,0,0,0,0,0|2,0,0]=4 2641 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [2,0,0,0,0,0|2,0,0]=4 2642 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [2,0,0,0,0,0|2,0,0]=4 2643 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [2,0,0,0,0,0|1,0,0]=3 2644 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [2,0,0,0,0,0|1,0,0]=3 2645 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [2,0,0,0,0,0|1,0,0]=3 2646 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [2,0,0,0,0,0|1,0,0]=3 2647 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [2,0,0,0,0,0|1,0,0]=3 2648 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [2,0,0,0,0,0|1,0,0]=3 2649 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [2,0,0,0,0,0|1,0,0]=3 2650 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [2,0,0,0,0,0|1,0,0]=3 2651 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [2,0,0,0,0,0|1,0,0]=3 2652 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [2,0,0,0,0,0|1,0,0]=3 2653 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [2,0,0,0,0,0|1,0,0]=3 2654 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [2,0,0,0,0,0|1,0,0]=3 2655 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [2,0,0,0,0,0|1,0,0]=3 2656 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [2,0,0,0,0,0|1,0,0]=3 2657 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [2,0,0,0,0,0|2,0,0]=4 2658 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [2,0,0,0,0,0|2,0,0]=4 2659 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [2,0,0,0,0,0|1,0,1]=4 2660 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [2,0,0,0,0,0|2,0,0]=4 2661 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [2,0,0,0,0,0|2,0,0]=4 2662 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [2,0,0,0,0,0|1,0,0]=3 2663 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [2,0,0,0,0,0|1,0,0]=3 2664 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [2,0,0,0,0,0|2,0,0]=4 2665 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [2,0,0,0,0,0|1,0,0]=3 2666 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [2,0,0,0,0,0|1,0,0]=3 2667 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [2,0,0,0,0,0|1,1,0]=4 2668 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [2,0,0,0,0,0|1,1,0]=4 2669 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [2,0,0,0,0,0|0,0,0]=2 2670 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [2,0,0,0,0,0|0,0,2]=4 2671 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [2,0,0,0,0,0|0,0,0]=2 2672 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [2,0,0,0,0,0|2,0,0]=4 2673 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [2,0,0,0,0,0|1,0,0]=3 2674 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [2,0,0,0,0,0|1,0,1]=4 2675 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [2,0,0,0,0,0|1,0,0]=3 2676 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [2,0,0,0,0,0|1,0,0]=3 2677 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [2,0,0,0,0,0|1,0,1]=4 2678 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [2,0,0,0,0,0|2,0,0]=4 2679 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [2,0,0,0,0,0|2,0,0]=4 2680 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [2,0,0,0,0,0|2,0,0]=4 2681 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [2,0,0,0,0,0|2,0,0]=4 2682 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [2,0,0,0,0,0|2,0,0]=4 2683 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [2,0,0,0,0,0|1,0,0]=3 2684 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [2,0,0,0,0,0|1,0,0]=3 2685 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [2,0,0,0,0,0|1,0,0]=3 2686 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [2,0,0,0,0,0|1,0,0]=3 2687 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [2,0,0,0,0,0|1,0,0]=3 2688 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [2,0,0,0,0,0|1,0,0]=3 2689 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [2,0,0,0,0,0|1,0,0]=3 2690 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [2,0,0,0,0,0|1,0,0]=3 2691 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [2,0,0,0,0,0|1,0,0]=3 2692 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [2,0,0,0,0,0|1,0,0]=3 2693 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [2,0,0,0,0,0|1,0,0]=3 2694 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [2,0,0,0,0,0|2,0,0]=4 2695 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [2,0,0,0,0,0|2,0,0]=4 2696 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [2,0,0,0,0,0|2,0,0]=4 2697 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [2,0,0,0,0,0|2,0,0]=4 2698 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [2,0,0,0,0,0|2,0,0]=4 2699 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [2,0,0,0,0,0|2,0,0]=4 2700 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [2,0,0,0,0,0|2,0,0]=4 2701 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [2,0,0,0,0,0|2,0,0]=4 2702 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [2,0,0,0,0,0|2,0,0]=4 2703 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [2,0,0,0,0,0|1,0,0]=3 2704 B11R0.120 COC(=O)\C=C\C(=O)C(=O)OC Amb10071761 [0,1,1,0,0,0|2,0,0]=4 2705 B11R1.83 BrCCc1ccc(cc1)C=O Amb15694785 [1,1,0,0,0,0|1,0,0]=3 2706 B11R1.83 C#CCc1ccc(C=O)cc1 Amb24120418 [1,1,0,0,0,0|1,0,1]=4 2707 B11R1.83 C=C=Cc1ccc(C=O)cc1 Amb24070631 [1,1,0,0,0,0|1,0,1]=4 2708 B11R1.83 C=CCc1ccc(C=O)cc1 Amb18124790 [1,1,0,0,0,0|1,0,1]=4 2709 B11R1.83 C=COc1ccc(C=O)cc1 Amb24103035 [1,1,0,0,0,0|0,0,1]=3 2710 B11R1.83 C=Cc1ccc(CCBr)cc1 Amb25046693 [1,1,0,0,0,0|1,0,1]=4 2711 B11R1.83 C=Cc1ccc(CCN)cc1 Amb18644346 [1,1,0,0,0,0|1,0,1]=4 2712 B11R1.83 C=Cc1ccc(cc1)OCO Amb24068621 [1,1,0,0,0,0|0,0,1]=3 2713 B11R1.83 CC#Cc1ccc(C=O)cc1 Amb24102697 [1,1,0,0,0,0|1,0,0]=3 2714 B11R1.83 CC#Cc1ccc(cc1)OC Amb25844317 [1,1,0,0,0,0|0,0,1]=3 2715 B11R1.83 CCCc1ccc(C=C)cc1 Amb20407515 [1,1,0,0,0,0|1,0,1]=4 2716 B11R1.83 CCCc1ccc(C=O)[n]c1 Amb24672547 [1,1,0,0,0,0|2,0,0]=4 2717 B11R1.83 CCCc1ccc(C=O)c[n]1 Amb18202080 [1,1,0,0,0,0|2,0,0]=4 2718 B11R1.83 CCNc1ccc(C=O)c[n]1 Amb23592248 [1,1,0,0,0,0|2,0,0]=4 2719 B11R1.83 CCNc1ccc(C=O)cc1 Amb18124999 [1,1,0,0,0,0|1,0,0]=3 2720 B11R1.83 CCOc1[n]cc(C=O)c[n]1 Amb23437111 [1,1,0,0,0,0|2,0,0]=4 2721 B11R1.83 CCOc1ccc(C=C)[n]c1 Amb25126890 [1,1,0,0,0,0|1,0,1]=4 2722 B11R1.83 CCOc1ccc(C=C)c[n]1 Amb23446338 [1,1,0,0,0,0|1,0,1]=4 2723 B11R1.83 CCOc1ccc(C=O)[n]c1 Amb22059624 [1,1,0,0,0,0|1,0,0]=3 2724 B11R1.83 CCOc1ccc(CI)cc1 Amb24550390 [1,1,0,0,0,0|1,0,1]=4 2725 B11R1.83 CCOc1ccc(c[n]1)NC Amb25039571 [1,1,0,0,0,0|2,0,0]=4 2726 B11R1.83 CCOc1ccc(cc1)C#N Amb1209421 [1,1,0,0,0,0|1,0,1]=4 2727 B11R1.83 CCOc1ccc(cc1)C=O Amb1351324 [1,1,0,0,0,0|0,0,0]=2 2728 B11R1.83 CCOc1ccc(cc1)CBr Amb1105844 [1,1,0,0,0,0|1,0,1]=4 2729 B11R1.83 CCOc1ccc(cc1)CC Amb15690898 [1,1,0,0,0,0|0,0,1]=3 2730 B11R1.83 CCOc1ccc(cc1)CCl Amb1105731 [1,1,0,0,0,0|1,0,1]=4 2731 B11R1.83 CCOc1ccc(cc1)CN Amb1117462 [1,1,0,0,0,0|1,0,1]=4 2732 B11R1.83 CCOc1ccc(cc1)CN Amb2099457 [1,1,0,0,0,0|1,0,1]=4 2733 B11R1.83 CCOc1ccc(cc1)CO Amb2132302 [1,1,0,0,0,0|0,0,2]=4 2734 B11R1.83 CCOc1ccc(cc1)CS Amb17400288 [1,1,0,0,0,0|0,1,1]=4 2735 B11R1.83 CCOc1ccc(cc1)N=C Amb24621829 [1,1,0,0,0,0|1,0,1]=4 2736 B11R1.83 CCOc1ccc(cc1)NN Amb21955728 [1,1,0,0,0,0|2,0,0]=4 2737 B11R1.83 CCOc1ccc(cc1)SC Amb24484459 [1,1,0,0,0,0|1,0,0]=3 2738 B11R1.83 CCOc1ccc(cc1)[N+]#N Amb25052401 [1,1,0,0,0,0|2,0,0]=4 2739 B11R1.83 CCOc1ccc(cc1)[N+]#[C-] Amb2235908 [1,1,0,0,0,0|1,0,1]=4 2740 B11R1.83 CCOc1ccc(cc1)[Zn]Br Amb22897781 [1,1,0,0,0,0|2,0,0]=4 2741 B11R1.83 CCOc1ccc(cn1)C=O Amb10608220 [1,1,0,0,0,0|1,0,0]=3 2742 B11R1.83 CCSc1ccc(cc1)NC Amb18055231 [1,1,0,0,0,0|1,0,1]=4 2743 B11R1.83 CCc1ccc(C=NO)cc1 Amb24091558 [1,1,0,0,0,0|1,0,1]=4 2744 B11R1.83 CCc1ccc(CC=O)[n]c1 Amb25295225 [1,1,0,0,0,0|2,0,0]=4 2745 B11R1.83 CCc1ccc(CCBr)cc1 Amb19373986 [1,1,0,0,0,0|1,0,1]=4 2746 B11R1.83 CCc1ccc(CCCl)cc1 Amb18799349 [1,1,0,0,0,0|1,0,1]=4 2747 B11R1.83 CCc1ccc(CCN)cc1 Amb24079170 [1,1,0,0,0,0|1,0,1]=4 2748 B11R1.83 CCc1ccc(\C=N\N)cc1 Amb24466011 [1,1,0,0,0,0|2,0,0]=4 2749 B11R1.83 CCc1ccc(cc1)CC=O Amb17089530 [1,1,0,0,0,0|1,0,0]=3 2750 B11R1.83 CCc1ccc(cc1)CON Amb17091441 [1,1,0,0,0,0|1,0,1]=4 2751 B11R1.83 CCc1ccc(cc1)N=S=O Amb22411320 [1,1,0,0,0,0|2,0,0]=4 2752 B11R1.83 CCc1ccc(cc1)OC=C Amb25267482 [1,1,0,0,0,0|0,0,2]=4 2753 B11R1.83 CCc1ccc(cc1)SCCl Amb25776128 [1,1,0,0,0,0|0,1,1]=4 2754 B11R1.83 CCc1ccc(cc1)\C=N\O Amb1152216 [1,1,0,0,0,0|1,0,1]=4 2755 B11R1.83 CNCc1ccc([n]c1)OC Amb18988130 [1,1,0,0,0,0|1,0,1]=4 2756 B11R1.83 CNCc1ccc(cc1)OC Amb10069043 [1,1,0,0,0,0|0,0,1]=3 2757 B11R1.83 CNCc1ccc(cc1)OC Amb2370575 [1,1,0,0,0,0|0,0,1]=3 2758 B11R1.83 CNCc1ccc(cc1)SC Amb1648713 [1,1,0,0,0,0|0,1,1]=4 2759 B11R1.83 CNc1ccc(CCCl)cc1 Amb25077231 [1,1,0,0,0,0|1,0,1]=4 2760 B11R1.83 CNc1ccc(CCN)cc1 Amb18251328 [1,1,0,0,0,0|1,0,1]=4 2761 B11R1.83 CNc1ccc(CCO)cc1 Amb18303233 [1,1,0,0,0,0|1,0,1]=4 2762 B11R1.83 CNc1ccc(COC)c[n]1 Amb18295777 [1,1,0,0,0,0|2,0,0]=4 2763 B11R1.83 COCc1ccc(C=C)c[n]1 Amb25188887 [1,1,0,0,0,0|1,0,1]=4 2764 B11R1.83 COCc1ccc(C=C)cc1 Amb25784900 [1,1,0,0,0,0|0,0,1]=3 2765 B11R1.83 COCc1ccc(C=O)cc1 Amb18125125 [1,1,0,0,0,0|0,0,0]=2 2766 B11R1.83 COCc1ccc(CBr)cc1 Amb25237379 [1,1,0,0,0,0|1,0,1]=4 2767 B11R1.83 COCc1ccc(CCl)cc1 Amb25363392 [1,1,0,0,0,0|1,0,1]=4 2768 B11R1.83 COCc1ccc(CN)cc1 Amb22757338 [1,1,0,0,0,0|1,0,1]=4 2769 B11R1.83 COCc1ccc(CO)cc1 Amb22295888 [1,1,0,0,0,0|0,0,2]=4 2770 B11R1.83 COCc1ccc(CS)cc1 Amb24585620 [1,1,0,0,0,0|0,1,1]=4 2771 B11R1.83 COCc1ccc([n]c1)OC Amb24408777 [1,1,0,0,0,0|1,0,1]=4 2772 B11R1.83 COCc1ccc(cc1)[Mg]Br Amb22047960 [1,1,0,0,0,0|2,0,0]=4 2773 B11R1.83 COCc1ccc(cc1)[Zn]Br Amb22897819 [1,1,0,0,0,0|2,0,0]=4 2774 B11R1.83 COCc1ncc(cn1)C=O Amb10608010 [1,1,0,0,0,0|2,0,0]=4 2775 B11R1.83 COSc1ccc(C=O)cc1 Amb24633326 [1,1,0,0,0,0|0,0,0]=2 2776 B11R1.83 COc1c[n]c(cc1)NN=O Amb25074893 [1,1,0,0,0,0|2,0,0]=4 2777 B11R1.83 COc1c[n]c(cc1)\C=N\O Amb25329853 [1,1,0,0,0,0|1,0,1]=4 2778 B11R1.83 COc1ccc(CC=C)c[n]1 Amb24738377 [1,1,0,0,0,0|1,0,1]=4 2779 B11R1.83 COc1ccc(CCBr)[n]c1 Amb24451089 [1,1,0,0,0,0|1,0,1]=4 2780 B11R1.83 COc1ccc(CCBr)cc1 Amb20671126 [1,1,0,0,0,0|0,0,1]=3 2781 B11R1.83 COc1ccc(CCI)cc1 Amb25151259 [1,1,0,0,0,0|0,0,1]=3 2782 B11R1.83 COc1ccc(CCN)[n]c1 Amb22001708 [1,1,0,0,0,0|1,0,1]=4 2783 B11R1.83 COc1ccc(CCN)[n]c1 Amb22728832 [1,1,0,0,0,0|1,0,1]=4 2784 B11R1.83 COc1ccc(CCN)c[n]1 Amb22886481 [1,1,0,0,0,0|1,0,1]=4 2785 B11R1.83 COc1ccc(CCN)cc1 Amb20621532 [1,1,0,0,0,0|0,0,1]=3 2786 B11R1.83 COc1ccc(CCO)c[n]1 Amb23446273 [1,1,0,0,0,0|1,0,1]=4 2787 B11R1.83 COc1ccc(CC[NH3+])cc1 Amb24123059 [1,1,0,0,0,0|0,0,1]=3 2788 B11R1.83 COc1ccc(CNN)cc1 Amb19515860 [1,1,0,0,0,0|1,0,1]=4 2789 B11R1.83 COc1ccc(CNO)cc1 Amb22233225 [1,1,0,0,0,0|0,0,2]=4 2790 B11R1.83 COc1ccc(CNO)cc1 Amb22235218 [1,1,0,0,0,0|0,0,2]=4 2791 B11R1.83 COc1ccc(CON)cc1 Amb19889167 [1,1,0,0,0,0|0,0,2]=4 2792 B11R1.83 COc1ccc(C[Mg]Cl)cc1 Amb19886362 [1,1,0,0,0,0|1,0,1]=4 2793 B11R1.83 COc1ccc(C[Zn]Cl)cc1 Amb22000454 [1,1,0,0,0,0|1,0,1]=4 2794 B11R1.83 COc1ccc(\C=C\I)cc1 Amb25323773 [1,1,0,0,0,0|0,0,1]=3 2795 B11R1.83 COc1ccc(\C=C\O)cc1 Amb24068817 [1,1,0,0,0,0|0,0,1]=3 2796 B11R1.83 COc1ccc(\C=N\[NH3+])cc1 Amb20661988 [1,1,0,0,0,0|1,0,0]=3 2797 B11R1.83 COc1ccc(c[n]1)N=C=O Amb25238140 [1,1,0,0,0,0|1,0,1]=4 2798 B11R1.83 COc1ccc(c[n]1)NC=O Amb24750206 [1,1,0,0,0,0|1,0,0]=3 2799 B11R1.83 COc1ccc(c[n]1)NN=O Amb24062311 [1,1,0,0,0,0|2,0,0]=4 2800 B11R1.83 COc1ccc(c[n]1)\C=N\O Amb23446260 [1,1,0,0,0,0|1,0,1]=4 2801 B11R1.83 COc1ccc(cc1)C#CF Amb24549684 [1,1,0,0,0,0|0,0,2]=4 2802 B11R1.83 COc1ccc(cc1)C=NO Amb10808559 [1,1,0,0,0,0|0,0,1]=3 2803 B11R1.83 COc1ccc(cc1)CC#N Amb1220313 [1,1,0,0,0,0|0,0,2]=4 2804 B11R1.83 COc1ccc(cc1)CO[NH3+] Amb2424116 [1,1,0,0,0,0|0,0,2]=4 2805 B11R1.83 COc1ccc(cc1)N=S=O Amb22411304 [1,1,0,0,0,0|1,0,0]=3 2806 B11R1.83 COc1ccc(cc1)NC#C Amb24681066 [1,1,0,0,0,0|0,0,2]=4 2807 B11R1.83 COc1ccc(cc1)OCC Amb24689323 [1,1,0,0,0,0|0,0,1]=3 2808 B11R1.83 COc1ccc(cc1)SC=C Amb10808994 [1,1,0,0,0,0|0,0,1]=3 2809 B11R1.83 COc1ccc(cc1)\C=N/O Amb2389991 [1,1,0,0,0,0|0,0,1]=3 2810 B11R1.83 CSc1ccc(CC=O)cc1 Amb18635884 [1,1,0,0,0,0|0,1,0]=3 2811 B11R1.83 CSc1ccc(CCBr)cc1 Amb18227859 [1,1,0,0,0,0|0,1,1]=4 2812 B11R1.83 CSc1ccc(CCCl)cc1 Amb18224819 [1,1,0,0,0,0|0,1,1]=4 2813 B11R1.83 CSc1ccc(CCN)cc1 Amb22395132 [1,1,0,0,0,0|0,1,1]=4 2814 B11R1.83 CSc1ccc(CCO)cc1 Amb18862803 [1,1,0,0,0,0|0,1,1]=4 2815 B11R1.83 CSc1ccc(CCS)cc1 Amb24393359 [1,1,0,0,0,0|0,1,1]=4 2816 B11R1.83 CSc1ccc(cc1)SCC Amb25367194 [1,1,0,0,0,0|0,1,1]=4 2817 B11R1.83 CSc1ccc(cc1)\C=N\O Amb1105508 [1,1,0,0,0,0|0,1,1]=4 2818 B11R1.83 CSc1ccc(cc1)\N=C\N Amb24487968 [1,1,0,0,0,0|1,1,0]=4 2819 B11R1.83 C\C=C/c1ccc(C=O)cc1 Amb24103179 [1,1,0,0,0,0|1,0,0]=3 2820 B11R1.83 C\C=C\c1ccc(C=O)cc1 Amb24518399 [1,1,0,0,0,0|1,0,0]=3 2821 B11R1.83 C\C=C\c1ccc(CC)c[n]1 Amb25233205 [1,1,0,0,0,0|2,0,0]=4 2822 B11R1.83 C\C=C\c1ccc(CO)cc1 Amb25792430 [1,1,0,0,0,0|2,0,0]=4 2823 B11R1.83 C\C=C\c1ccc(cc1)NC Amb25235536 [1,1,0,0,0,0|1,0,0]=3 2824 B11R1.83 C\N=C\c1ccc(cc1)C#N Amb25851356 [1,1,0,0,0,0|2,0,0]=4 2825 B11R1.83 C\N=C\c1ccc(cc1)OC Amb22263162 [1,1,0,0,0,0|0,0,0]=2 2826 B11R1.83 ClCCc1ccc(cc1)OC Amb1210118 [1,1,0,0,0,0|0,0,1]=3 2827 B11R1.83 FCOc1ccc(CCl)cc1 Amb24622836 [1,1,0,0,0,0|1,0,1]=4 2828 B11R1.83 N#CCc1ccc(C=O)cc1 Amb18124734 [1,1,0,0,0,0|1,0,1]=4 2829 B11R1.83 N#Cc1ccc(CC=O)cc1 Amb18124735 [1,1,0,0,0,0|2,0,0]=4 2830 B11R1.83 N#Cc1ccc(cc1)OCCl Amb24447030 [1,1,0,0,0,0|1,0,1]=4 2831 B11R1.83 NCCc1ccc(C=O)cc1 Amb24102725 [1,1,0,0,0,0|1,0,0]=3 2832 B11R1.83 NCc1ccc(cc1)COC Amb1135896 [1,1,0,0,0,0|1,0,1]=4 2833 B11R1.83 NOCc1ccc(C=O)cc1 Amb24103234 [1,1,0,0,0,0|1,0,0]=3 2834 B11R1.83 NOCc1ccc(cc1)OC Amb17091437 [1,1,0,0,0,0|0,0,2]=4 2835 B11R1.83 O=CCc1ccc(cc1)C=O Amb18644358 [1,1,0,0,0,0|1,0,1]=4 2836 B11R1.83 O=CNc1ccc(cc1)C=O Amb24072396 [1,1,0,0,0,0|1,0,1]=4 2837 B11R1.83 O=Cc1ccc(CCCl)cc1 Amb24624691 [1,1,0,0,0,0|1,0,0]=3 2838 B11R1.83 O=Cc1ccc(cc1)N=C=O Amb24070392 [1,1,0,0,0,0|1,0,1]=4 2839 B11R1.83 OCCc1ccc(C=O)cc1 Amb21963895 [1,1,0,0,0,0|1,0,0]=3 2840 B11R1.83 OCCc1ccc(cc1)CC Amb17089517 [1,1,0,0,0,0|1,0,1]=4 2841 B11R1.83 OCNc1ccc(C=O)cc1 Amb24103241 [1,1,0,0,0,0|1,0,0]=3 2842 B11R1.83 OCc1ccc(cc1)NC=O Amb25769716 [1,1,0,0,0,0|2,0,0]=4 2843 B11R1.83 OCc1ccc(cc1)OC=O Amb25343823 [1,1,0,0,0,0|2,0,0]=4 2844 B11R1.83 OCc1ccc(cc1)OCF Amb25847798 [1,1,0,0,0,0|0,0,2]=4 2845 B11R1.83 ON=C1C=CC(=CCCl)C=C1 Amb25202453 [1,1,0,0,0,0|2,0,0]=4 2846 B11R1.83 O\N=C\c1ccc(C=O)cc1 Amb24512886 [1,1,0,0,0,0|2,0,0]=4 2847 B11R1.83 SCCc1ccc(cc1)CC Amb17400221 [1,1,0,0,0,0|1,0,1]=4 2848 B11R1.83 SCCc1ccc(cc1)OC Amb17400287 [1,1,0,0,0,0|0,0,1]=3 2849 B11R1.83 [C-]#[N+]c1ccc(cc1)NC=O Amb24485739 [1,1,0,0,0,0|1,0,1]=4 2850 B11R1.279 C#Cc1ccc(C=O)c(Cl)c1 Amb25151948 [1,1,0,0,0,0|1,0,1]=4 2851 B11R1.279 C#Cc1ccc(C=O)c(F)c1 Amb22735688 [1,1,0,0,0,0|1,0,1]=4 2852 B11R1.279 C#Cc1ccc(C=O)cc1F Amb25072979 [1,1,0,0,0,0|1,0,1]=4 2853 B11R1.279 C=Cc1ccc(C=O)c(Cl)c1 Amb25703421 [1,1,0,0,0,0|1,0,1]=4 2854 B11R1.279 C=Cc1ccc(C=O)c(O)c1 Amb24084366 [1,1,0,0,0,0|1,0,1]=4 2855 B11R1.279 C=Cc1ccc(C=O)cc1Cl Amb25148097 [1,1,0,0,0,0|1,0,1]=4 2856 B11R1.279 C=Cc1ccc(C=O)cc1F Amb24586231 [1,1,0,0,0,0|1,0,1]=4 2857 B11R1.279 CCc1[n]cc(cc1Br)OC Amb24483884 [1,1,0,0,0,0|1,0,1]=4 2858 B11R1.279 CCc1c[n]c(C=O)cc1Br Amb25732405 [1,1,0,0,0,0|2,0,0]=4 2859 B11R1.279 CCc1ccc(C=O)c(F)c1 Amb24416581 [1,1,0,0,0,0|1,0,0]=3 2860 B11R1.279 CCc1ccc(C=O)c(O)c1 Amb24091531 [1,1,0,0,0,0|1,0,0]=3 2861 B11R1.279 CCc1ccc(C=O)cc1Br Amb24085863 [1,1,0,0,0,0|1,0,0]=3 2862 B11R1.279 CCc1ccc(C=O)cc1I Amb24686946 [1,1,0,0,0,0|1,0,0]=3 2863 B11R1.279 CCc1ccc(C=O)cc1O Amb24091549 [1,1,0,0,0,0|1,0,0]=3 2864 B11R1.279 CCc1ccc(CC)cc1Br Amb25259787 [1,1,0,0,0,0|1,0,1]=4 2865 B11R1.279 CCc1ccc(CC)cc1N Amb19375545 [1,1,0,0,0,0|1,0,1]=4 2866 B11R1.279 CCc1ccc(N=O)c(O)c1 Amb24071325 [1,1,0,0,0,0|2,0,0]=4 2867 B11R1.279 CCc1ccc(NC)c(N)c1 Amb24596529 [1,1,0,0,0,0|1,0,1]=4 2868 B11R1.279 CCc1ccc(OC)c(Br)c1 Amb18244006 [1,1,0,0,0,0|0,0,1]=3 2869 B11R1.279 CCc1ccc(OC)c(Cl)c1 Amb23483098 [1,1,0,0,0,0|0,0,1]=3 2870 B11R1.279 CCc1ccc(OC)c(I)c1 Amb22752599 [1,1,0,0,0,0|0,0,1]=3 2871 B11R1.279 CCc1ccc(OC)c(O)c1 Amb18054876 [1,1,0,0,0,0|0,0,1]=3 2872 B11R1.279 CCc1ccc(SC)c(Br)c1 Amb25140291 [1,1,0,0,0,0|0,1,1]=4 2873 B11R1.279 CCc1ccc(SC)c(N)c1 Amb24423846 [1,1,0,0,0,0|0,1,1]=4 2874 B11R1.279 CCc1ccc(c(c1)N)OC Amb17138434 [1,1,0,0,0,0|0,0,1]=3 2875 B11R1.279 CCc1ccc(cc1Br)OC Amb22752642 [1,1,0,0,0,0|0,0,1]=3 2876 B11R1.279 CCc1ccc(cc1Br)SC Amb25279655 [1,1,0,0,0,0|0,1,1]=4 2877 B11R1.279 CCc1ccc(cc1Cl)NC Amb18277496 [1,1,0,0,0,0|1,0,1]=4 2878 B11R1.279 CCc1ccc(cc1Cl)OC Amb25118396 [1,1,0,0,0,0|0,0,1]=3 2879 B11R1.279 CCc1ccc(cc1F)NC Amb25846077 [1,1,0,0,0,0|1,0,1]=4 2880 B11R1.279 CCc1ccc(cc1F)OC Amb25244017 [1,1,0,0,0,0|0,0,1]=3 2881 B11R1.279 CCc1ccc(cc1I)SC Amb25091063 [1,1,0,0,0,0|0,1,1]=4 2882 B11R1.279 CCc1ccc(cc1N)OC Amb25330456 [1,1,0,0,0,0|0,0,1]=3 2883 B11R1.279 CCc1ccc(cc1O)NC Amb25141763 [1,1,0,0,0,0|1,0,1]=4 2884 B11R1.279 CCc1ccc(cc1O)OC Amb18125389 [1,1,0,0,0,0|0,0,1]=3 2885 B11R1.279 CCc1ccc(cc1S)OC Amb25070574 [1,1,0,0,0,0|0,0,1]=3 2886 B11R1.279 CNc1[n]cc(C=O)cc1Br Amb23455610 [1,1,0,0,0,0|2,0,0]=4 2887 B11R1.279 CNc1c[n]c(C=O)c(F)c1 Amb25149211 [1,1,0,0,0,0|2,0,0]=4 2888 B11R1.279 CNc1cc(Br)c(cc1)OC Amb18569901 [1,1,0,0,0,0|1,0,0]=3 2889 B11R1.279 CNc1cc(Cl)c(C=O)c[n]1 Amb25330990 [1,1,0,0,0,0|2,0,0]=4 2890 B11R1.279 CNc1cc(Cl)c(cc1)N=O Amb25828931 [1,1,0,0,0,0|2,0,0]=4 2891 B11R1.279 CNc1cc(F)c(c[n]1)OC Amb25118908 [1,1,0,0,0,0|2,0,0]=4 2892 B11R1.279 CNc1cc(F)c(cc1)SC Amb25097613 [1,1,0,0,0,0|1,1,0]=4 2893 B11R1.279 CNc1cc(N)c(cc1)OC Amb24695596 [1,1,0,0,0,0|1,0,0]=3 2894 B11R1.279 CNc1cc(O)c(cc1)OC Amb18967642 [1,1,0,0,0,0|1,0,0]=3 2895 B11R1.279 CNc1cc(O)c(cc1)SC Amb25806103 [1,1,0,0,0,0|1,1,0]=4 2896 B11R1.279 CNc1ccc(C=O)c(Cl)[n]1 Amb24340528 [1,1,0,0,0,0|2,0,0]=4 2897 B11R1.279 CNc1ccc(C=O)c(F)c1 Amb24084188 [1,1,0,0,0,0|1,0,0]=3 2898 B11R1.279 CNc1ccc(C=O)cc1Br Amb23437135 [1,1,0,0,0,0|1,0,0]=3 2899 B11R1.279 CNc1ccc(C=O)cc1F Amb23437130 [1,1,0,0,0,0|1,0,0]=3 2900 B11R1.279 CNc1ccc(C=O)cc1I Amb23437131 [1,1,0,0,0,0|1,0,0]=3 2901 B11R1.279 CNc1ccc(C=O)cc1N Amb25748991 [1,1,0,0,0,0|1,0,0]=3 2902 B11R1.279 CNc1ccc(C=O)cc1O Amb24509072 [1,1,0,0,0,0|1,0,0]=3 2903 B11R1.279 CNc1ccc([n]c1Br)OC Amb25149315 [1,1,0,0,0,0|2,0,0]=4 2904 B11R1.279 CNc1ccc(cc1Br)OC Amb25123901 [1,1,0,0,0,0|1,0,0]=3 2905 B11R1.279 CNc1ccc(cc1Cl)NC Amb24423876 [1,1,0,0,0,0|2,0,0]=4 2906 B11R1.279 CNc1ccc(cc1Cl)OC Amb18057453 [1,1,0,0,0,0|1,0,0]=3 2907 B11R1.279 CNc1ccc(cc1F)OC Amb18933642 [1,1,0,0,0,0|1,0,0]=3 2908 B11R1.279 CNc1ccc(cc1I)OC Amb24414750 [1,1,0,0,0,0|1,0,0]=3 2909 B11R1.279 CNc1ccc(cc1O)NC Amb25060141 [1,1,0,0,0,0|2,0,0]=4 2910 B11R1.279 CNc1ccc(cc1O)OC Amb25351090 [1,1,0,0,0,0|1,0,0]=3 2911 B11R1.279 CNc1ccc(cc1O)SC Amb25100914 [1,1,0,0,0,0|1,1,0]=4 2912 B11R1.279 COC1=CC=C(C=O)C(=O)N1 Amb24062326 [1,1,0,0,0,0|1,0,0]=3 2913 B11R1.279 COC1=COC(C=O)=CC1=O Amb18125637 [1,1,0,0,0,0|1,0,0]=3 2914 B11R1.279 COC1=COC(CC)=CC1=O Amb24545373 [1,1,0,0,0,0|1,0,1]=4 2915 B11R1.279 COc1[n][n]c(C=O)cc1O Amb25373155 [1,1,0,0,0,0|2,0,0]=4 2916 B11R1.279 COc1[n]cc(C=C)cc1Cl Amb25324659 [1,1,0,0,0,0|1,0,1]=4 2917 B11R1.279 COc1[n]cc(C=O)[n]c1Cl Amb25045592 [1,1,0,0,0,0|2,0,0]=4 2918 B11R1.279 COc1[n]cc(C=O)c(N)[n]1 Amb21964250 [1,1,0,0,0,0|2,0,0]=4 2919 B11R1.279 COc1[n]cc(C=O)cc1Br Amb18132082 [1,1,0,0,0,0|1,0,0]=3 2920 B11R1.279 COc1[n]cc(C=O)cc1Cl Amb20241030 [1,1,0,0,0,0|1,0,0]=3 2921 B11R1.279 COc1[n]cc(C=O)cc1F Amb19959287 [1,1,0,0,0,0|1,0,0]=3 2922 B11R1.279 COc1[n]cc(C=O)cc1I Amb24710744 [1,1,0,0,0,0|1,0,0]=3 2923 B11R1.279 COc1[n]cc(cc1Cl)OC Amb24709233 [1,1,0,0,0,0|2,0,0]=4 2924 B11R1.279 COc1[n]cc(cc1F)OC Amb25759472 [1,1,0,0,0,0|2,0,0]=4 2925 B11R1.279 COc1[n]cc(cc1N)OC Amb23399613 [1,1,0,0,0,0|2,0,0]=4 2926 B11R1.279 COc1c[n]c(C=C)c(F)c1 Amb25326066 [1,1,0,0,0,0|1,0,1]=4 2927 B11R1.279 COc1c[n]c(C=C)c(N)c1 Amb25085103 [1,1,0,0,0,0|1,0,1]=4 2928 B11R1.279 COc1c[n]c(C=O)c(Br)c1 Amb25062251 [1,1,0,0,0,0|1,0,0]=3 2929 B11R1.279 COc1c[n]c(C=O)c(N)[n]1 Amb25705244 [1,1,0,0,0,0|2,0,0]=4 2930 B11R1.279 COc1c[n]c(C=O)cc1Cl Amb24687764 [1,1,0,0,0,0|1,0,0]=3 2931 B11R1.279 COc1cc(Br)c(CBr)cc1 Amb25705712 [1,1,0,0,0,0|1,0,1]=4 2932 B11R1.279 COc1cc(Br)c(cc1)C#N Amb19957934 [1,1,0,0,0,0|1,0,1]=4 2933 B11R1.279 COc1cc(Br)c(cc1)NN Amb21981691 [1,1,0,0,0,0|2,0,0]=4 2934 B11R1.279 COc1cc(Cl)c(c[n]1)OC Amb25834634 [1,1,0,0,0,0|2,0,0]=4 2935 B11R1.279 COc1cc(Cl)c(cc1)C#C Amb25746480 [1,1,0,0,0,0|0,0,2]=4 2936 B11R1.279 COc1cc(Cl)c(cc1)NN Amb18243554 [1,1,0,0,0,0|2,0,0]=4 2937 B11R1.279 COc1cc(Cl)c(cc1)SC Amb25797435 [1,1,0,0,0,0|1,0,0]=3 2938 B11R1.279 COc1cc(Cl)c(cc1)[Mg]Br Amb22897432 [1,1,0,0,0,0|2,0,0]=4 2939 B11R1.279 COc1cc(Cl)c(cc1)[Zn]Br Amb22897978 [1,1,0,0,0,0|2,0,0]=4 2940 B11R1.279 COc1cc(F)c(C=C)c[n]1 Amb25705056 [1,1,0,0,0,0|1,0,1]=4 2941 B11R1.279 COc1cc(F)c(CF)cc1 Amb24659541 [1,1,0,0,0,0|1,0,1]=4 2942 B11R1.279 COc1cc(F)c(cc1)C#C Amb24603734 [1,1,0,0,0,0|0,0,2]=4 2943 B11R1.279 COc1cc(F)c(cc1)NN Amb19958755 [1,1,0,0,0,0|2,0,0]=4 2944 B11R1.279 COc1cc(F)c(cc1)SC Amb25090905 [1,1,0,0,0,0|1,0,0]=3 2945 B11R1.279 COc1cc(I)c(cc1)NN Amb25231276 [1,1,0,0,0,0|2,0,0]=4 2946 B11R1.279 COc1cc(N)c(CN)cc1 Amb18251362 [1,1,0,0,0,0|1,0,1]=4 2947 B11R1.279 COc1cc(N)c(c[n]1)OC Amb25202224 [1,1,0,0,0,0|2,0,0]=4 2948 B11R1.279 COc1cc(N)c(cc1)NN Amb24656395 [1,1,0,0,0,0|2,0,0]=4 2949 B11R1.279 COc1cc(N)c(cc1)SC Amb24634268 [1,1,0,0,0,0|1,0,0]=3 2950 B11R1.279 COc1cc(O)c(C=O)c[n]1 Amb24062337 [1,1,0,0,0,0|1,0,0]=3 2951 B11R1.279 COc1cc(O)c(cc1)C#C Amb25145707 [1,1,0,0,0,0|0,0,2]=4 2952 B11R1.279 COc1cc(O)c(cc1)N=O Amb22304729 [1,1,0,0,0,0|1,0,0]=3 2953 B11R1.279 COc1cc(O)c(cc1)SC Amb25141849 [1,1,0,0,0,0|1,0,0]=3 2954 B11R1.279 COc1cc(S)c(cc1)C#N Amb25235935 [1,1,0,0,0,0|1,0,1]=4 2955 B11R1.279 COc1ccc(C=C)[n]c1N Amb25720884 [1,1,0,0,0,0|1,0,1]=4 2956 B11R1.279 COc1ccc(C=C)c(F)[n]1 Amb25070686 [1,1,0,0,0,0|1,0,1]=4 2957 B11R1.279 COc1ccc(C=C)c(F)c1 Amb25278353 [1,1,0,0,0,0|0,0,1]=3 2958 B11R1.279 COc1ccc(C=C)c(O)c1 Amb24071527 [1,1,0,0,0,0|0,0,1]=3 2959 B11R1.279 COc1ccc(C=C)cc1F Amb24356928 [1,1,0,0,0,0|0,0,1]=3 2960 B11R1.279 COc1ccc(C=C)cc1N Amb18124990 [1,1,0,0,0,0|0,0,1]=3 2961 B11R1.279 COc1ccc(C=O)c(Br)[n]1 Amb21964777 [1,1,0,0,0,0|1,0,0]=3 2962 B11R1.279 COc1ccc(C=O)c(Cl)[n]1 Amb18126850 [1,1,0,0,0,0|1,0,0]=3 2963 B11R1.279 COc1ccc(C=O)c(I)c1 Amb22234352 [1,1,0,0,0,0|0,0,0]=2 2964 B11R1.279 COc1ccc(C=O)c(N)[n]1 Amb24062332 [1,1,0,0,0,0|1,0,0]=3 2965 B11R1.279 COc1ccc(C=O)c(N)c1 Amb22584111 [1,1,0,0,0,0|0,0,0]=2 2966 B11R1.279 COc1ccc(C=O)cc1N Amb24117565 [1,1,0,0,0,0|0,0,0]=2 2967 B11R1.279 COc1ccc(CBr)c(I)c1 Amb24088418 [1,1,0,0,0,0|1,0,1]=4 2968 B11R1.279 COc1ccc(CBr)cc1I Amb24088423 [1,1,0,0,0,0|1,0,1]=4 2969 B11R1.279 COc1ccc(CBr)cc1O Amb18132408 [1,1,0,0,0,0|1,0,1]=4 2970 B11R1.279 COc1ccc(CCl)c(O)c1 Amb25108561 [1,1,0,0,0,0|1,0,1]=4 2971 B11R1.279 COc1ccc(CCl)c(S)c1 Amb24431568 [1,1,0,0,0,0|1,0,1]=4 2972 B11R1.279 COc1ccc(CF)c(Br)c1 Amb24367747 [1,1,0,0,0,0|1,0,1]=4 2973 B11R1.279 COc1ccc(CF)c(I)c1 Amb25077484 [1,1,0,0,0,0|1,0,1]=4 2974 B11R1.279 COc1ccc(CF)c(N)c1 Amb24384019 [1,1,0,0,0,0|1,0,1]=4 2975 B11R1.279 COc1ccc(CF)c(O)c1 Amb25330010 [1,1,0,0,0,0|1,0,1]=4 2976 B11R1.279 COc1ccc(CF)cc1Br Amb24596488 [1,1,0,0,0,0|1,0,1]=4 2977 B11R1.279 COc1ccc(CI)cc1F Amb24471049 [1,1,0,0,0,0|1,0,1]=4 2978 B11R1.279 COc1ccc(CN)c(Br)c1 Amb24358707 [1,1,0,0,0,0|1,0,1]=4 2979 B11R1.279 COc1ccc(CN)c(Cl)c1 Amb18966072 [1,1,0,0,0,0|1,0,1]=4 2980 B11R1.279 COc1ccc(CN)c(Cl)c1 Amb24087326 [1,1,0,0,0,0|1,0,1]=4 2981 B11R1.279 COc1ccc(CN)c(F)c1 Amb18251464 [1,1,0,0,0,0|1,0,1]=4 2982 B11R1.279 COc1ccc(CN)c(F)c1 Amb20668877 [1,1,0,0,0,0|1,0,1]=4 2983 B11R1.279 COc1ccc(CN)c(S)c1 Amb25832434 [1,1,0,0,0,0|1,0,1]=4 2984 B11R1.279 COc1ccc(CN)cc1N Amb18251367 [1,1,0,0,0,0|1,0,1]=4 2985 B11R1.279 COc1ccc(CN)cc1N Amb22499590 [1,1,0,0,0,0|1,0,1]=4 2986 B11R1.279 COc1ccc(CN)cc1N Amb22754631 [1,1,0,0,0,0|1,0,1]=4 2987 B11R1.279 COc1ccc(CO)c(Cl)c1 Amb18862883 [1,1,0,0,0,0|0,0,2]=4 2988 B11R1.279 COc1ccc(CO)c(I)c1 Amb24088427 [1,1,0,0,0,0|0,0,2]=4 2989 B11R1.279 COc1ccc(CO)c(N)c1 Amb22739879 [1,1,0,0,0,0|0,0,2]=4 2990 B11R1.279 COc1ccc(CS)c(Cl)c1 Amb25694215 [1,1,0,0,0,0|0,1,1]=4 2991 B11R1.279 COc1ccc(CS)cc1Br Amb25108883 [1,1,0,0,0,0|0,1,1]=4 2992 B11R1.279 COc1ccc(OC)c(Br)[n]1 Amb19959574 [1,1,0,0,0,0|2,0,0]=4 2993 B11R1.279 COc1ccc(OC)c(Cl)[n]1 Amb25073209 [1,1,0,0,0,0|2,0,0]=4 2994 B11R1.279 COc1ccc(ON)c(Br)c1 Amb25264051 [1,1,0,0,0,0|2,0,0]=4 2995 B11R1.279 COc1ccc(c(c1)Br)C=O Amb10602014 [1,1,0,0,0,0|0,0,0]=2 2996 B11R1.279 COc1ccc(c(c1)Br)CCl Amb17610021 [1,1,0,0,0,0|1,0,1]=4 2997 B11R1.279 COc1ccc(c(c1)C)C#N Amb2445107 [1,1,0,0,0,0|1,0,1]=4 2998 B11R1.279 COc1ccc(c(c1)Cl)C=O Amb1106246 [1,1,0,0,0,0|0,0,0]=2 2999 B11R1.279 COc1ccc(c(c1)Cl)CBr Amb10982517 [1,1,0,0,0,0|1,0,1]=4 3000 B11R1.279 COc1ccc(c(c1)F)CBr Amb16185857 [1,1,0,0,0,0|1,0,1]=4 3001 B11R1.279 COc1ccc(c(c1)F)CO Amb10605692 [1,1,0,0,0,0|0,0,2]=4 3002 B11R1.279 COc1ccc(c(c1)N)OC Amb1829967 [1,1,0,0,0,0|1,0,0]=3 3003 B11R1.279 COc1ccc(c(c1)O)CO Amb16193002 [1,1,0,0,0,0|0,0,2]=4 3004 B11R1.279 COc1ccc(cc1Br)NN Amb18896478 [1,1,0,0,0,0|2,0,0]=4 3005 B11R1.279 COc1ccc(cc1Br)SC Amb25252636 [1,1,0,0,0,0|1,0,0]=3 3006 B11R1.279 COc1ccc(cc1Cl)NN Amb18536989 [1,1,0,0,0,0|2,0,0]=4 3007 B11R1.279 COc1ccc(cc1Cl)[Mg]Br Amb22897503 [1,1,0,0,0,0|2,0,0]=4 3008 B11R1.279 COc1ccc(cc1Cl)[N+]#[C-] Amb2235436 [1,1,0,0,0,0|1,0,1]=4 3009 B11R1.279 COc1ccc(cc1Cl)[Zn]Br Amb22898002 [1,1,0,0,0,0|2,0,0]=4 3010 B11R1.279 COc1ccc(cc1F)C#C Amb18177149 [1,1,0,0,0,0|0,0,2]=4 3011 B11R1.279 COc1ccc(cc1F)SC Amb24484433 [1,1,0,0,0,0|1,0,0]=3 3012 B11R1.279 COc1ccc(cc1F)[Zn]Br Amb22897788 [1,1,0,0,0,0|2,0,0]=4 3013 B11R1.279 COc1ccc(cc1I)C#N Amb17872255 [1,1,0,0,0,0|1,0,1]=4 3014 B11R1.279 COc1ccc(cc1I)NN Amb24438516 [1,1,0,0,0,0|2,0,0]=4 3015 B11R1.279 COc1ccc(cc1I)SC Amb24418661 [1,1,0,0,0,0|1,0,0]=3 3016 B11R1.279 COc1ccc(cc1N)C#C Amb22499205 [1,1,0,0,0,0|0,0,2]=4 3017 B11R1.279 COc1ccc(cc1N)C#N Amb24117567 [1,1,0,0,0,0|1,0,1]=4 3018 B11R1.279 COc1ccc(cc1N)NN Amb25223252 [1,1,0,0,0,0|2,0,0]=4 3019 B11R1.279 COc1ccc(cc1N)SC Amb23537776 [1,1,0,0,0,0|1,0,0]=3 3020 B11R1.279 COc1ccc(cc1N)SCl Amb25764536 [1,1,0,0,0,0|2,0,0]=4 3021 B11R1.279 COc1ccc(cc1O)C#C Amb24575208 [1,1,0,0,0,0|0,0,2]=4 3022 B11R1.279 COc1ccc(cc1O)NN Amb25709875 [1,1,0,0,0,0|2,0,0]=4 3023 B11R1.279 COc1ccc(cc1S)SC Amb19893194 [1,1,0,0,0,0|1,0,0]=3 3024 B11R1.279 CSc1ccc(C=O)c(Br)c1 Amb25808885 [1,1,0,0,0,0|0,1,0]=3 3025 B11R1.279 CSc1ccc(C=O)c(Cl)[n]1 Amb24340518 [1,1,0,0,0,0|1,1,0]=4 3026 B11R1.279 CSc1ccc(C=O)c(F)c1 Amb24271181 [1,1,0,0,0,0|0,1,0]=3 3027 B11R1.279 CSc1ccc(C=O)c(O)c1 Amb18126518 [1,1,0,0,0,0|0,1,0]=3 3028 B11R1.279 CSc1ccc(C=O)cc1Cl Amb25081608 [1,1,0,0,0,0|0,1,0]=3 3029 B11R1.279 CSc1ccc(C=O)cc1O Amb24509258 [1,1,0,0,0,0|0,1,0]=3 3030 B11R1.279 CSc1ccc(SC)c(C)c1 Amb17673056 [1,1,0,0,0,0|1,1,0]=4 3031 B11R1.279 Cc1[n]c(C=O)c[n]c1OC Amb18201413 [1,1,0,0,0,0|2,0,0]=4 3032 B11R1.279 Cc1[n]c(ccc1C=C)OC Amb23445494 [1,1,0,0,0,0|1,0,1]=4 3033 B11R1.279 Cc1[n]c(ccc1C=O)NC Amb23445540 [1,1,0,0,0,0|2,0,0]=4 3034 B11R1.279 Cc1[n]c(ccc1C=O)OC Amb18125249 [1,1,0,0,0,0|1,0,0]=3 3035 B11R1.279 Cc1[n]c(ccc1C=O)SC Amb23445518 [1,1,0,0,0,0|1,1,0]=4 3036 B11R1.279 Cc1[n]c(ccc1OC)OC Amb23535918 [1,1,0,0,0,0|2,0,0]=4 3037 B11R1.279 Cc1cc(C=C)c[n]c1OC Amb23578509 [1,1,0,0,0,0|1,0,1]=4 3038 B11R1.279 Cc1cc(C=C)ccc1C=O Amb24084785 [1,1,0,0,0,0|1,0,1]=4 3039 B11R1.279 Cc1cc(C=O)[n]cc1CC Amb24071338 [1,1,0,0,0,0|2,0,0]=4 3040 B11R1.279 Cc1cc(C=O)c[n]c1NC Amb23578560 [1,1,0,0,0,0|2,0,0]=4 3041 B11R1.279 Cc1cc(C=O)c[n]c1OC Amb22174140 [1,1,0,0,0,0|1,0,0]=3 3042 B11R1.279 Cc1cc(C=O)c[n]c1SC Amb23578537 [1,1,0,0,0,0|1,1,0]=4 3043 B11R1.279 Cc1cc(C=O)ccc1C#N Amb24070287 [1,1,0,0,0,0|2,0,0]=4 3044 B11R1.279 Cc1cc(C=O)ccc1C=C Amb25352865 [1,1,0,0,0,0|1,0,1]=4 3045 B11R1.279 Cc1cc(C=O)ccc1NC Amb24092525 [1,1,0,0,0,0|1,0,0]=3 3046 B11R1.279 Cc1cc(C=O)ccc1NN Amb24712675 [1,1,0,0,0,0|2,0,0]=4 3047 B11R1.279 Cc1cc(C=O)ccc1SC Amb24644719 [1,1,0,0,0,0|0,1,0]=3 3048 B11R1.279 Cc1cc(CC)ccc1C=O Amb25130589 [1,1,0,0,0,0|1,0,0]=3 3049 B11R1.279 Cc1cc(NC)[n]cc1C=O Amb23579330 [1,1,0,0,0,0|2,0,0]=4 3050 B11R1.279 Cc1cc([n]cc1C=C)OC Amb23579271 [1,1,0,0,0,0|1,0,1]=4 3051 B11R1.279 Cc1cc([n]cc1C=O)OC Amb21964438 [1,1,0,0,0,0|1,0,0]=3 3052 B11R1.279 Cc1cc([n]cc1C=O)SC Amb23579267 [1,1,0,0,0,0|1,1,0]=4 3053 B11R1.279 Cc1cc([n]cc1OC)OC Amb23535919 [1,1,0,0,0,0|2,0,0]=4 3054 B11R1.279 Cc1cc(c[n]c1C=C)OC Amb25705055 [1,1,0,0,0,0|1,0,1]=4 3055 B11R1.279 Cc1cc(c[n]c1C=O)OC Amb23437590 [1,1,0,0,0,0|1,0,0]=3 3056 B11R1.279 Cc1cc(c[n]c1OC)OC Amb23535920 [1,1,0,0,0,0|2,0,0]=4 3057 B11R1.279 Cc1cc(ccc1C#C)OC Amb20247143 [1,1,0,0,0,0|0,0,2]=4 3058 B11R1.279 Cc1cc(ccc1C=O)C#N Amb22495366 [1,1,0,0,0,0|2,0,0]=4 3059 B11R1.279 Cc1cc(ccc1C=O)C=O Amb18124886 [1,1,0,0,0,0|2,0,0]=4 3060 B11R1.279 Cc1cc(ccc1C=O)NC Amb24084761 [1,1,0,0,0,0|1,0,0]=3 3061 B11R1.279 Cc1cc(ccc1CC)SC Amb24701276 [1,1,0,0,0,0|0,1,1]=4 3062 B11R1.279 Cc1cc(ccc1CCl)OC Amb22058765 [1,1,0,0,0,0|1,0,1]=4 3063 B11R1.279 Cc1cc(ccc1CN)OC Amb18053836 [1,1,0,0,0,0|1,0,1]=4 3064 B11R1.279 Cc1cc(ccc1CN)OC Amb21959948 [1,1,0,0,0,0|1,0,1]=4 3065 B11R1.279 Cc1cc(ccc1NC)N=O Amb24065772 [1,1,0,0,0,0|2,0,0]=4 3066 B11R1.279 Cc1cc(ccc1NC)NC Amb25694475 [1,1,0,0,0,0|2,0,0]=4 3067 B11R1.279 Cc1cc(ccc1NC)OC Amb18965163 [1,1,0,0,0,0|1,0,0]=3 3068 B11R1.279 Cc1cc(ccc1NN)OC Amb22229810 [1,1,0,0,0,0|2,0,0]=4 3069 B11R1.279 Cc1cc(ccc1N[NH3+])OC Amb24113879 [1,1,0,0,0,0|2,0,0]=4 3070 B11R1.279 Cc1cc(ccc1OC)NC Amb18954815 [1,1,0,0,0,0|1,0,0]=3 3071 B11R1.279 Cc1cc(ccc1OC)NN Amb18179437 [1,1,0,0,0,0|2,0,0]=4 3072 B11R1.279 Cc1cc(ccc1OC)[Zn]Br Amb22897821 [1,1,0,0,0,0|2,0,0]=4 3073 B11R1.279 Cc1cc(ccc1[Mg]Br)OC Amb22000547 [1,1,0,0,0,0|2,0,0]=4 3074 B11R1.279 Cc1cc(ccc1[Zn]Br)OC Amb22897820 [1,1,0,0,0,0|2,0,0]=4 3075 B11R1.279 ClCc1ccc(c(c1)F)OC Amb1104858 [1,1,0,0,0,0|1,0,1]=4 3076 B11R1.279 ClCc1ccc(c(c1)O)OC Amb17477804 [1,1,0,0,0,0|1,0,1]=4 3077 B11R1.279 N#Cc1ccc(C=O)c(Br)c1 Amb21963498 [1,1,0,0,0,0|2,0,0]=4 3078 B11R1.279 N#Cc1ccc(C=O)c(Cl)c1 Amb18126432 [1,1,0,0,0,0|2,0,0]=4 3079 B11R1.279 N#Cc1ccc(C=O)cc1Br Amb22753854 [1,1,0,0,0,0|2,0,0]=4 3080 B11R1.279 N#Cc1ccc(C=O)cc1Cl Amb22292498 [1,1,0,0,0,0|2,0,0]=4 3081 B11R1.279 N#Cc1ccc(C=O)cc1O Amb24070282 [1,1,0,0,0,0|2,0,0]=4 3082 B11R1.279 N#Cc1ccc(c(c1)C)OC Amb13952471 [1,1,0,0,0,0|1,0,1]=4 3083 B11R1.279 N#Cc1ccc(c(c1)F)C=O Amb10602721 [1,1,0,0,0,0|2,0,0]=4 3084 B11R1.279 N#Cc1ccc(c(c1)O)OC Amb1080881 [1,1,0,0,0,0|1,0,1]=4 3085 B11R1.279 NCc1ccc(C=O)c(O)c1 Amb25220260 [1,1,0,0,0,0|2,0,0]=4 3086 B11R1.279 NCc1ccc(c(c1)O)OC Amb1088911 [1,1,0,0,0,0|1,0,1]=4 3087 B11R1.279 NNc1ccc(C=O)c(Br)c1 Amb24727389 [1,1,0,0,0,0|2,0,0]=4 3088 B11R1.279 NNc1ccc(C=O)c(F)c1 Amb24695696 [1,1,0,0,0,0|2,0,0]=4 3089 B11R1.279 NNc1ccc(C=O)cc1F Amb24527813 [1,1,0,0,0,0|2,0,0]=4 3090 B11R1.279 NNc1ccc(C=O)cc1I Amb25278602 [1,1,0,0,0,0|2,0,0]=4 3091 B11R1.279 NNc1ccc(C=O)cc1S Amb24605142 [1,1,0,0,0,0|2,0,0]=4 3092 B11R1.279 NNc1ccc(c(c1)Cl)OC Amb2235170 [1,1,0,0,0,0|2,0,0]=4 3093 B11R1.279 Nc1cc(ccc1C=O)C#N Amb25189376 [1,1,0,0,0,0|2,0,0]=4 3094 B11R1.279 O=Cc1cc(Br)c(CBr)cc1 Amb25063045 [1,1,0,0,0,0|2,0,0]=4 3095 B11R1.279 O=Cc1ccc(CBr)c(F)c1 Amb22735659 [1,1,0,0,0,0|2,0,0]=4 3096 B11R1.279 O=Cc1ccc(CBr)cc1F Amb22739397 [1,1,0,0,0,0|2,0,0]=4 3097 B11R1.279 O=Cc1ccc(CCl)cc1Cl Amb25806236 [1,1,0,0,0,0|2,0,0]=4 3098 B11R1.279 O=Cc1ccc(OF)c(Cl)c1 Amb24690579 [1,1,0,0,0,0|1,0,0]=3 3099 B11R1.279 O=Cc1ccc(c(c1)Br)OC Amb1014103 [1,1,0,0,0,0|0,0,0]=2 3100 B11R1.279 O=Cc1ccc(c(c1)Cl)NC Amb16200006 [1,1,0,0,0,0|1,0,0]=3 3101 B11R1.279 O=Cc1ccc(c(c1)F)OC Amb1658860 [1,1,0,0,0,0|0,0,0]=2 3102 B11R1.279 O=Cc1ccc(c(c1)I)OC Amb1774696 [1,1,0,0,0,0|0,0,0]=2 3103 B11R1.279 O=Cc1ccc(c(c1)N)OC Amb16230439 [1,1,0,0,0,0|0,0,0]=2 3104 B11R1.279 O=Cc1ccc(c(n1)Br)OC Amb10975690 [1,1,0,0,0,0|1,0,0]=3 3105 B11R1.279 O=Cc1ccc(cc1Br)C=O Amb25202261 [1,1,0,0,0,0|2,0,0]=4 3106 B11R1.279 OCc1ccc(C=O)c(F)c1 Amb25222962 [1,1,0,0,0,0|2,0,0]=4 3107 B11R1.279 OCc1ccc(C=O)cc1F Amb22739546 [1,1,0,0,0,0|2,0,0]=4 3108 B11R1.279 OCc1ccc(c(c1)Br)OC Amb1110727 [1,1,0,0,0,0|0,0,2]=4 3109 B11R1.279 OCc1ccc(c(c1)Cl)OC Amb2417048 [1,1,0,0,0,0|0,0,2]=4 3110 B11R1.279 OCc1ccc(c(c1)F)OC Amb1109828 [1,1,0,0,0,0|0,0,2]=4 3111 B11R1.279 OCc1ccc(c(c1)I)OC Amb1880608 [1,1,0,0,0,0|0,0,2]=4 3112 B11R1.279 Oc1cc(C=O)ccc1CBr Amb24340360 [1,1,0,0,0,0|2,0,0]=4 3113 B11R1.279 Oc1cc(C=O)ccc1CO Amb24102239 [1,1,0,0,0,0|2,0,0]=4 3114 B11R1.279 Oc1cc(CBr)ccc1C=O Amb24595884 [1,1,0,0,0,0|2,0,0]=4 3115 B11R1.279 Oc1cc(CCl)ccc1C=O Amb24739819 [1,1,0,0,0,0|2,0,0]=4 3116 B11R1.279 Oc1cc(CO)ccc1C=O Amb24757616 [1,1,0,0,0,0|2,0,0]=4 3117 B11R1.279 SCc1ccc(c(c1)C)OC Amb17400289 [1,1,0,0,0,0|0,1,1]=4 3118 B11R1.279 SCc1ccc(c(c1)Cl)OC Amb17401244 [1,1,0,0,0,0|0,1,1]=4 3119 B11R1.279 [2H]c1cc(C=O)ccc1OC Amb22354027 [1,1,0,0,0,0|0,0,0]=2 3120 B11R1.279 [2H]c1cc(ccc1C=O)OC Amb22354026 [1,1,0,0,0,0|0,0,0]=2 3121 B11R1.279 [C-]#[N+]c1cc(O)c(cc1)OC Amb24721743 [1,1,0,0,0,0|1,0,1]=4 3122 B11R1.279 [C-]#[N+]c1ccc(cc1C)OC Amb24700453 [1,1,0,0,0,0|1,0,1]=4 3123 B11R1.19 CC(C)(C)c1ccc(O)cc1 Amb22369732 [1,1,0,0,0,0|1,0,1]=4 3124 B11R1.19 CC(C)(N)c1ccc(O)cc1 Amb22900900 [1,1,0,0,0,0|1,0,1]=4 3125 B11R1.19 CC(C)(O)c1ccc(O)cc1 Amb18125387 [1,1,0,0,0,0|0,0,2]=4 3126 B11R1.19 CC(C)(S)c1ccc(O)cc1 Amb24360469 [1,1,0,0,0,0|0,1,1]=4 3127 B11R1.19 CC(c1ccc(cc1)O)(N)C Amb17106929 [1,1,0,0,0,0|1,0,1]=4 3128 B11R1.19 CP(C)(=O)c1ccc(Br)cc1 Amb24470596 [1,1,0,0,0,0|2,0,0]=4 3129 B11R1.19 CP(O)(=O)c1ccc(N)cc1 Amb24486502 [1,1,0,0,0,0|2,0,0]=4 3130 B11R1.19 CS(=N)(=O)c1ccc(Br)cc1 Amb24574999 [1,1,0,0,0,0|2,0,0]=4 3131 B11R1.19 CS(=N)(=O)c1ccc(Cl)cc1 Amb24484377 [1,1,0,0,0,0|2,0,0]=4 3132 B11R1.19 CS(=N)(=O)c1ccc(N)cc1 Amb20669012 [1,1,0,0,0,0|2,0,0]=4 3133 B11R1.19 CS(=N)(=O)c1ccc(O)cc1 Amb25708754 [1,1,0,0,0,0|1,0,0]=3 3134 B11R1.19 CS(=O)(=O)c1ccc(N)cc1 Amb20621719 [1,1,0,0,0,0|2,0,0]=4 3135 B11R1.19 CS(=O)(=O)c1ccc(O)[n]c1 Amb24465943 [1,1,0,0,0,0|2,0,0]=4 3136 B11R1.19 CS(=O)(=O)c1ccc(O)c[n]1 Amb25152749 [1,1,0,0,0,0|2,0,0]=4 3137 B11R1.19 C[Si](C)(C)c1ccc(O)cc1 Amb22346796 [1,1,0,0,0,0|1,1,0]=4 3138 B11R1.19 Cc1ccc([n]c1)S(C)(=O)=O Amb20242856 [1,1,0,0,0,0|2,0,0]=4 3139 B11R1.19 Cc1ccc(cc1)C(C)(C)N Amb22586936 [1,1,0,0,0,0|1,0,1]=4 3140 B11R1.19 Cc1ccc(cc1)C(C)(F)F Amb19894540 [1,1,0,0,0,0|1,0,1]=4 3141 B11R1.19 Cc1ccc(cc1)S(=O)(=O)Cl Amb1933718 [1,1,0,0,0,0|2,0,0]=4 3142 B11R1.19 Cc1ccc(cc1)S(=O)(=O)I Amb25145806 [1,1,0,0,0,0|2,0,0]=4 3143 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb10068428 [1,1,0,0,0,0|2,0,0]=4 3144 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb10068429 [1,1,0,0,0,0|2,0,0]=4 3145 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb10601583 [1,1,0,0,0,0|2,0,0]=4 3146 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb10603241 [1,1,0,0,0,0|2,0,0]=4 3147 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb15692583 [1,1,0,0,0,0|2,0,0]=4 3148 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb16231469 [1,1,0,0,0,0|2,0,0]=4 3149 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb17617529 [1,1,0,0,0,0|2,0,0]=4 3150 B11R1.19 Cc1ccc(cc1)S(=O)(=O)O Amb2228431 [1,1,0,0,0,0|2,0,0]=4 3151 B11R1.19 Cc1ccc(cc1)S(=O)(=O)S Amb10601734 [1,1,0,0,0,0|2,0,0]=4 3152 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[NH-] Amb10552786 [1,1,0,0,0,0|2,0,0]=4 3153 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10068734 [1,1,0,0,0,0|2,0,0]=4 3154 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10071180 [1,1,0,0,0,0|2,0,0]=4 3155 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552611 [1,1,0,0,0,0|2,0,0]=4 3156 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552653 [1,1,0,0,0,0|2,0,0]=4 3157 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552654 [1,1,0,0,0,0|2,0,0]=4 3158 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552699 [1,1,0,0,0,0|2,0,0]=4 3159 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552880 [1,1,0,0,0,0|2,0,0]=4 3160 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10552901 [1,1,0,0,0,0|2,0,0]=4 3161 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10554231 [1,1,0,0,0,0|2,0,0]=4 3162 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10554232 [1,1,0,0,0,0|2,0,0]=4 3163 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10554699 [1,1,0,0,0,0|2,0,0]=4 3164 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10555175 [1,1,0,0,0,0|2,0,0]=4 3165 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10559046 [1,1,0,0,0,0|2,0,0]=4 3166 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10560902 [1,1,0,0,0,0|2,0,0]=4 3167 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10560903 [1,1,0,0,0,0|2,0,0]=4 3168 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10561594 [1,1,0,0,0,0|2,0,0]=4 3169 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10561595 [1,1,0,0,0,0|2,0,0]=4 3170 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10561674 [1,1,0,0,0,0|2,0,0]=4 3171 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10562301 [1,1,0,0,0,0|2,0,0]=4 3172 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10562302 [1,1,0,0,0,0|2,0,0]=4 3173 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10562303 [1,1,0,0,0,0|2,0,0]=4 3174 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10572913 [1,1,0,0,0,0|2,0,0]=4 3175 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb10807980 [1,1,0,0,0,0|2,0,0]=4 3176 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb1147297 [1,1,0,0,0,0|2,0,0]=4 3177 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb1395004 [1,1,0,0,0,0|2,0,0]=4 3178 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb1395008 [1,1,0,0,0,0|2,0,0]=4 3179 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb15690993 [1,1,0,0,0,0|2,0,0]=4 3180 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb15695495 [1,1,0,0,0,0|2,0,0]=4 3181 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb16224832 [1,1,0,0,0,0|2,0,0]=4 3182 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb16226570 [1,1,0,0,0,0|2,0,0]=4 3183 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb16226905 [1,1,0,0,0,0|2,0,0]=4 3184 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb1775557 [1,1,0,0,0,0|2,0,0]=4 3185 B11R1.19 Cc1ccc(cc1)S(=O)(=O)[O-] Amb1818891 [1,1,0,0,0,0|2,0,0]=4 3186 B11R1.19 Cc1ccc(cc1)S(N)(=O)=O Amb22730843 [1,1,0,0,0,0|2,0,0]=4 3187 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb19882314 [1,1,0,0,0,0|2,0,0]=4 3188 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb19889647 [1,1,0,0,0,0|2,0,0]=4 3189 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb20171445 [1,1,0,0,0,0|2,0,0]=4 3190 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb20240611 [1,1,0,0,0,0|2,0,0]=4 3191 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb20240786 [1,1,0,0,0,0|2,0,0]=4 3192 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb20242504 [1,1,0,0,0,0|2,0,0]=4 3193 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb20242998 [1,1,0,0,0,0|2,0,0]=4 3194 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb21873340 [1,1,0,0,0,0|2,0,0]=4 3195 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22056344 [1,1,0,0,0,0|2,0,0]=4 3196 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22284771 [1,1,0,0,0,0|2,0,0]=4 3197 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22338446 [1,1,0,0,0,0|2,0,0]=4 3198 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22343633 [1,1,0,0,0,0|2,0,0]=4 3199 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22346152 [1,1,0,0,0,0|2,0,0]=4 3200 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22347476 [1,1,0,0,0,0|2,0,0]=4 3201 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22347478 [1,1,0,0,0,0|2,0,0]=4 3202 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22347825 [1,1,0,0,0,0|2,0,0]=4 3203 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22351692 [1,1,0,0,0,0|2,0,0]=4 3204 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22353047 [1,1,0,0,0,0|2,0,0]=4 3205 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22365204 [1,1,0,0,0,0|2,0,0]=4 3206 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22365208 [1,1,0,0,0,0|2,0,0]=4 3207 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22369428 [1,1,0,0,0,0|2,0,0]=4 3208 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22474097 [1,1,0,0,0,0|2,0,0]=4 3209 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22491485 [1,1,0,0,0,0|2,0,0]=4 3210 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22493675 [1,1,0,0,0,0|2,0,0]=4 3211 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22728685 [1,1,0,0,0,0|2,0,0]=4 3212 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22733915 [1,1,0,0,0,0|2,0,0]=4 3213 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22739023 [1,1,0,0,0,0|2,0,0]=4 3214 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22739024 [1,1,0,0,0,0|2,0,0]=4 3215 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22746138 [1,1,0,0,0,0|2,0,0]=4 3216 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22746555 [1,1,0,0,0,0|2,0,0]=4 3217 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22751386 [1,1,0,0,0,0|2,0,0]=4 3218 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22898818 [1,1,0,0,0,0|2,0,0]=4 3219 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22898829 [1,1,0,0,0,0|2,0,0]=4 3220 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22899496 [1,1,0,0,0,0|2,0,0]=4 3221 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb22900003 [1,1,0,0,0,0|2,0,0]=4 3222 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb23437074 [1,1,0,0,0,0|2,0,0]=4 3223 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24052931 [1,1,0,0,0,0|2,0,0]=4 3224 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24064898 [1,1,0,0,0,0|2,0,0]=4 3225 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24078250 [1,1,0,0,0,0|2,0,0]=4 3226 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24094203 [1,1,0,0,0,0|2,0,0]=4 3227 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24113169 [1,1,0,0,0,0|2,0,0]=4 3228 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24270993 [1,1,0,0,0,0|2,0,0]=4 3229 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24329325 [1,1,0,0,0,0|2,0,0]=4 3230 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24560483 [1,1,0,0,0,0|2,0,0]=4 3231 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb24636976 [1,1,0,0,0,0|2,0,0]=4 3232 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb25024462 [1,1,0,0,0,0|2,0,0]=4 3233 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb25234866 [1,1,0,0,0,0|2,0,0]=4 3234 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb25278693 [1,1,0,0,0,0|2,0,0]=4 3235 B11R1.19 Cc1ccc(cc1)S(O)(=O)=O Amb25376075 [1,1,0,0,0,0|2,0,0]=4 3236 B11R1.19 Cc1ccc(cc1)S([15NH2])(=O)=O Amb22353541 [1,1,0,0,0,0|2,0,0]=4 3237 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb17779280 [1,1,0,0,0,0|2,0,0]=4 3238 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb20671966 [1,1,0,0,0,0|2,0,0]=4 3239 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb21947635 [1,1,0,0,0,0|2,0,0]=4 3240 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22008005 [1,1,0,0,0,0|2,0,0]=4 3241 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22167165 [1,1,0,0,0,0|2,0,0]=4 3242 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22169646 [1,1,0,0,0,0|2,0,0]=4 3243 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22232323 [1,1,0,0,0,0|2,0,0]=4 3244 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22338359 [1,1,0,0,0,0|2,0,0]=4 3245 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22343602 [1,1,0,0,0,0|2,0,0]=4 3246 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22346462 [1,1,0,0,0,0|2,0,0]=4 3247 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22351097 [1,1,0,0,0,0|2,0,0]=4 3248 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22353002 [1,1,0,0,0,0|2,0,0]=4 3249 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22353977 [1,1,0,0,0,0|2,0,0]=4 3250 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22357798 [1,1,0,0,0,0|2,0,0]=4 3251 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22366764 [1,1,0,0,0,0|2,0,0]=4 3252 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22387768 [1,1,0,0,0,0|2,0,0]=4 3253 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22387769 [1,1,0,0,0,0|2,0,0]=4 3254 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22387770 [1,1,0,0,0,0|2,0,0]=4 3255 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22406051 [1,1,0,0,0,0|2,0,0]=4 3256 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22444591 [1,1,0,0,0,0|2,0,0]=4 3257 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22460973 [1,1,0,0,0,0|2,0,0]=4 3258 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22466889 [1,1,0,0,0,0|2,0,0]=4 3259 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22474108 [1,1,0,0,0,0|2,0,0]=4 3260 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22552497 [1,1,0,0,0,0|2,0,0]=4 3261 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22733795 [1,1,0,0,0,0|2,0,0]=4 3262 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22734270 [1,1,0,0,0,0|2,0,0]=4 3263 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb22734774 [1,1,0,0,0,0|2,0,0]=4 3264 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb23401898 [1,1,0,0,0,0|2,0,0]=4 3265 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb24053940 [1,1,0,0,0,0|2,0,0]=4 3266 B11R1.19 Cc1ccc(cc1)S([O-])(=O)=O Amb24325268 [1,1,0,0,0,0|2,0,0]=4 3267 B11R1.19 Cc1ccc(cc1)[As](O)(O)=O Amb17938974 [1,1,0,0,0,0|2,0,0]=4 3268 B11R1.19 Cc1ccc(cc1)[N+](C)(C)C Amb10554049 [1,1,0,0,0,0|2,0,0]=4 3269 B11R1.19 Cc1ccc(cc1)[Si](C)(C)Cl Amb19894078 [1,1,0,0,0,0|1,1,0]=4 3270 B11R1.19 Cc1ccc(cc1)[Si](C)(Cl)Cl Amb19894079 [1,1,0,0,0,0|1,1,0]=4 3271 B11R1.19 Cc1ccc(cc1)[Te](C)(Br)Br Amb22345818 [1,1,0,0,0,0|2,0,0]=4 3272 B11R1.19 Cc1ccc(cc1)[Te](C)(Cl)Cl Amb22345817 [1,1,0,0,0,0|2,0,0]=4 3273 B11R1.19 Clc1ccc(cc1)S(=O)(=O)C Amb1144586 [1,1,0,0,0,0|2,0,0]=4 3274 B11R1.19 Ic1ccc(cc1)S(=O)(=O)C Amb10552746 [1,1,0,0,0,0|2,0,0]=4 3275 B11R1.19 Oc1ccc(cc1)S(O)(=O)=O Amb21961823 [1,1,0,0,0,0|2,0,0]=4 3276 B11R1.19 Oc1ccc(cc1)[As](O)(O)=O Amb17672279 [1,1,0,0,0,0|2,0,0]=4 3277 B11R1.19 [O-]S(=O)(=O)c1ccc(O)cc1 Amb22733490 [1,1,0,0,0,0|2,0,0]=4 3278 B11R1.21 BrC(=O)c1ccc(c(c1)Br)F Amb16232711 [1,1,0,0,0,0|2,0,0]=4 3279 B11R1.21 CC(=C)c1cc(Cl)c(Cl)cc1 Amb25072899 [1,1,0,0,0,0|2,0,0]=4 3280 B11R1.21 CC(=C)c1cc(F)c(F)cc1 Amb25735683 [1,1,0,0,0,0|2,0,0]=4 3281 B11R1.21 CC(=C)c1ccc(c(c1)C)N Amb17107086 [1,1,0,0,0,0|2,0,0]=4 3282 B11R1.21 CC(=O)C1=CC(=O)N(C)C=C1 Amb22490974 [1,1,0,0,0,0|1,0,0]=3 3283 B11R1.21 CC(=O)C1=CC=C(Br)C(=O)N1 Amb25268623 [1,1,0,0,0,0|2,0,0]=4 3284 B11R1.21 CC(=O)C1=CC=C(C)C(=O)O1 Amb24722786 [1,1,0,0,0,0|1,0,0]=3 3285 B11R1.21 CC(=O)c1c[n]c(Cl)c(N)c1 Amb24509633 [1,1,0,0,0,0|2,0,0]=4 3286 B11R1.21 CC(=O)c1c[n]c(F)c(Br)c1 Amb23400019 [1,1,0,0,0,0|2,0,0]=4 3287 B11R1.21 CC(=O)c1c[n]c(F)c(O)c1 Amb24665646 [1,1,0,0,0,0|2,0,0]=4 3288 B11R1.21 CC(=O)c1c[n]c(N)c(Cl)c1 Amb18647456 [1,1,0,0,0,0|2,0,0]=4 3289 B11R1.21 CC(=O)c1c[n]c(O)c(Br)c1 Amb25705194 [1,1,0,0,0,0|1,0,0]=3 3290 B11R1.21 CC(=O)c1c[n]c(O)c(Cl)c1 Amb18647548 [1,1,0,0,0,0|1,0,0]=3 3291 B11R1.21 CC(=O)c1cc(Br)c(F)c[n]1 Amb25800895 [1,1,0,0,0,0|2,0,0]=4 3292 B11R1.21 CC(=O)c1cc(Cl)c(Cl)[n]c1 Amb22264104 [1,1,0,0,0,0|2,0,0]=4 3293 B11R1.21 CC(=O)c1cc(Cl)c(N)c[n]1 Amb25050156 [1,1,0,0,0,0|2,0,0]=4 3294 B11R1.21 CC(=O)c1cc(Cl)c(O)c[n]1 Amb24551462 [1,1,0,0,0,0|1,0,0]=3 3295 B11R1.21 CC(=O)c1cc(F)c(Cl)c[n]1 Amb25841048 [1,1,0,0,0,0|2,0,0]=4 3296 B11R1.21 CC(=O)c1ccc(Br)c(Cl)[n]1 Amb22495292 [1,1,0,0,0,0|2,0,0]=4 3297 B11R1.21 CC(=O)c1ccc(Br)c(Cl)c1 Amb21922906 [1,1,0,0,0,0|1,0,0]=3 3298 B11R1.21 CC(=O)c1ccc(Br)c(O)c1 Amb20407392 [1,1,0,0,0,0|1,0,0]=3 3299 B11R1.21 CC(=O)c1ccc(Cl)c(Br)[n]1 Amb24382043 [1,1,0,0,0,0|2,0,0]=4 3300 B11R1.21 CC(=O)c1ccc(Cl)c(Cl)[n]1 Amb25793603 [1,1,0,0,0,0|2,0,0]=4 3301 B11R1.21 CC(=O)c1ccc(Cl)c(O)c1 Amb18126734 [1,1,0,0,0,0|1,0,0]=3 3302 B11R1.21 CC(=O)c1ccc(F)c(F)[n]1 Amb25173945 [1,1,0,0,0,0|2,0,0]=4 3303 B11R1.21 CC(=O)c1ccc(F)c(O)c1 Amb19944608 [1,1,0,0,0,0|1,0,0]=3 3304 B11R1.21 CC(=O)c1ccc(I)c(Br)c1 Amb24057226 [1,1,0,0,0,0|1,0,0]=3 3305 B11R1.21 CC(=O)c1ccc(I)c(O)c1 Amb23437508 [1,1,0,0,0,0|1,0,0]=3 3306 B11R1.21 CC(=O)c1ccc(N)c(Br)c1 Amb22756351 [1,1,0,0,0,0|1,0,0]=3 3307 B11R1.21 CC(=O)c1ccc(N)c(Cl)[n]1 Amb24486656 [1,1,0,0,0,0|2,0,0]=4 3308 B11R1.21 CC(=O)c1ccc(N)c(I)c1 Amb22169738 [1,1,0,0,0,0|1,0,0]=3 3309 B11R1.21 CC(=O)c1ccc(N)c(S)c1 Amb24391533 [1,1,0,0,0,0|1,0,0]=3 3310 B11R1.21 CC(=O)c1ccc(O)c(Br)c1 Amb20620486 [1,1,0,0,0,0|0,0,0]=2 3311 B11R1.21 CC(=O)c1ccc(O)c(S)c1 Amb18646984 [1,1,0,0,0,0|0,0,0]=2 3312 B11R1.21 CC(=O)c1ccc(S)c(Cl)c1 Amb25047687 [1,1,0,0,0,0|0,1,0]=3 3313 B11R1.21 CC(=O)c1ccc(S)c(O)c1 Amb25032471 [1,1,0,0,0,0|0,1,0]=3 3314 B11R1.21 CC(=O)c1ccc(c(c1)Br)F Amb1233295 [1,1,0,0,0,0|1,0,0]=3 3315 B11R1.21 CC(=O)c1ccc(c(c1)C)N Amb17138423 [1,1,0,0,0,0|1,0,0]=3 3316 B11R1.21 CC(=O)c1ccc(c(c1)C)O Amb2464915 [1,1,0,0,0,0|0,0,0]=2 3317 B11R1.21 CC(=O)c1ccc(c(c1)Cl)C Amb10607161 [1,1,0,0,0,0|0,0,0]=2 3318 B11R1.21 CC(=O)c1ccc(c(c1)Cl)O Amb2209368 [1,1,0,0,0,0|0,0,0]=2 3319 B11R1.21 CC(=O)c1ccc(c(c1)F)F Amb1397747 [1,1,0,0,0,0|1,0,0]=3 3320 B11R1.21 CC(=O)c1ccc(c(c1)N)N Amb17202026 [1,1,0,0,0,0|1,0,0]=3 3321 B11R1.21 CC(=O)c1ccc(c(c1)N)O Amb16186924 [1,1,0,0,0,0|0,0,0]=2 3322 B11R1.21 CC(=O)c1ccc(c(c1)O)C Amb17334297 [1,1,0,0,0,0|0,0,0]=2 3323 B11R1.21 CC(=O)c1ccc(c(c1)O)O Amb1240533 [1,1,0,0,0,0|0,0,0]=2 3324 B11R1.21 CC(C)c1ccc(O)c(Cl)c1 Amb19960714 [1,1,0,0,0,0|1,0,1]=4 3325 B11R1.21 CC(C)c1ccc(O)c(F)c1 Amb24084196 [1,1,0,0,0,0|1,0,1]=4 3326 B11R1.21 CC(C)c1ccc(O)c(P)c1 Amb24532469 [1,1,0,0,0,0|1,0,1]=4 3327 B11R1.21 CC(F)c1ccc(O)c(Br)c1 Amb24664483 [1,1,0,0,0,0|1,0,1]=4 3328 B11R1.21 CC(F)c1ccc(O)c(N)c1 Amb24627925 [1,1,0,0,0,0|1,0,1]=4 3329 B11R1.21 CC(N)c1cc(C)c(C)cc1 Amb24053243 [1,1,0,0,0,0|1,0,1]=4 3330 B11R1.21 CC(N)c1ccc(O)c(Br)c1 Amb18948610 [1,1,0,0,0,0|1,0,1]=4 3331 B11R1.21 CC(N)c1ccc(O)c(Cl)c1 Amb18280719 [1,1,0,0,0,0|1,0,1]=4 3332 B11R1.21 CC(N)c1ccc(O)c(Cl)c1 Amb21984369 [1,1,0,0,0,0|1,0,1]=4 3333 B11R1.21 CC(N)c1ccc(O)c(F)c1 Amb21955770 [1,1,0,0,0,0|1,0,1]=4 3334 B11R1.21 CC(N)c1ccc(O)c(I)c1 Amb25679023 [1,1,0,0,0,0|1,0,1]=4 3335 B11R1.21 CC(O)c1cc(O)c(O)cc1 Amb22229046 [1,1,0,0,0,0|0,0,2]=4 3336 B11R1.21 CC(O)c1ccc(O)c(Br)c1 Amb25352510 [1,1,0,0,0,0|0,0,2]=4 3337 B11R1.21 CC(O)c1ccc(O)c(Cl)c1 Amb21984354 [1,1,0,0,0,0|0,0,2]=4 3338 B11R1.21 CC(c1ccc(c(c1)Br)O)C Amb2189159 [1,1,0,0,0,0|1,0,1]=4 3339 B11R1.21 CC(c1ccc(c(c1)C)C)O Amb1109785 [1,1,0,0,0,0|0,0,2]=4 3340 B11R1.21 CC(c1ccc(c(c1)F)C)N Amb1108115 [1,1,0,0,0,0|1,0,1]=4 3341 B11R1.21 CC(c1ccc(c(c1)N)O)C Amb1088954 [1,1,0,0,0,0|1,0,1]=4 3342 B11R1.21 CC1=CC=C(NC1=O)C(O)=O Amb18125523 [1,1,0,0,0,0|2,0,0]=4 3343 B11R1.21 CC1=CC=C(OC1=O)C(O)=O Amb18644609 [1,1,0,0,0,0|2,0,0]=4 3344 B11R1.21 CN(C)c1cc(O)c(O)cc1 Amb22295912 [1,1,0,0,0,0|2,0,0]=4 3345 B11R1.21 CN(C)c1ccc(C)c(C)c1 Amb17672884 [1,1,0,0,0,0|2,0,0]=4 3346 B11R1.21 CN(C)c1ccc(O)c(F)c1 Amb25122921 [1,1,0,0,0,0|2,0,0]=4 3347 B11R1.21 CN(C)c1ccc(O)c(I)c1 Amb24451708 [1,1,0,0,0,0|2,0,0]=4 3348 B11R1.21 CN(c1ccc(c(c1)Br)C)C Amb17194432 [1,1,0,0,0,0|2,0,0]=4 3349 B11R1.21 CN(c1ccc(c(c1)Br)C)N Amb17241869 [1,1,0,0,0,0|2,0,0]=4 3350 B11R1.21 CN(c1ccc(c(c1)C)C)N Amb17232080 [1,1,0,0,0,0|2,0,0]=4 3351 B11R1.21 CN(c1ccc(c(c1)Cl)C)N Amb17232800 [1,1,0,0,0,0|2,0,0]=4 3352 B11R1.21 CN(c1ccc(c(c1)N)C)C Amb10608315 [1,1,0,0,0,0|2,0,0]=4 3353 B11R1.21 CN1C=CC(=CC1=O)C(N)=O Amb18181708 [1,1,0,0,0,0|2,0,0]=4 3354 B11R1.21 CN1C=CC(=CC1=O)C(O)=O Amb18949290 [1,1,0,0,0,0|2,0,0]=4 3355 B11R1.21 CS(=O)c1c[n]c(O)c(F)c1 Amb25189214 [1,1,0,0,0,0|2,0,0]=4 3356 B11R1.21 CS(=O)c1cc(F)c(O)c[n]1 Amb25224926 [1,1,0,0,0,0|2,0,0]=4 3357 B11R1.21 CS(=O)c1ccc(O)c(Cl)c1 Amb25067872 [1,1,0,0,0,0|1,0,0]=3 3358 B11R1.21 C[C@@H](N)c1cc(C)c(C)cc1 Amb22288622 [1,1,0,0,0,0|1,0,1]=4 3359 B11R1.21 C[C@@H](N)c1cc(O)c(O)cc1 Amb24074554 [1,1,0,0,0,0|1,0,1]=4 3360 B11R1.21 C[C@@H](O)c1cc(O)c(O)cc1 Amb25692329 [1,1,0,0,0,0|0,0,2]=4 3361 B11R1.21 C[C@H](Br)c1cc(C)c(C)cc1 Amb25857430 [1,1,0,0,0,0|1,0,1]=4 3362 B11R1.21 C[C@H](N)c1cc(C)c(C)cc1 Amb22288684 [1,1,0,0,0,0|1,0,1]=4 3363 B11R1.21 C[C@H](N)c1cc(N)c(O)cc1 Amb25714208 [1,1,0,0,0,0|1,0,1]=4 3364 B11R1.21 C[C@H](N)c1cc(O)c(O)cc1 Amb25698263 [1,1,0,0,0,0|1,0,1]=4 3365 B11R1.21 C[C@H](N)c1ccc(O)c(Br)c1 Amb24350682 [1,1,0,0,0,0|1,0,1]=4 3366 B11R1.21 C[C@H](N)c1ccc(O)c(Cl)c1 Amb25191264 [1,1,0,0,0,0|1,0,1]=4 3367 B11R1.21 C[C@H](O)c1cc(O)c(O)cc1 Amb25841624 [1,1,0,0,0,0|0,0,2]=4 3368 B11R1.21 C[C@H](c1ccc(c(c1)Cl)C)N Amb16233855 [1,1,0,0,0,0|1,0,1]=4 3369 B11R1.21 C[n]1ccc(cc1=O)C(=O)Cl Amb22227982 [1,1,0,0,0,0|2,0,0]=4 3370 B11R1.21 Cc1[n]c(ccc1Br)C(C)=O Amb25265646 [1,1,0,0,0,0|2,0,0]=4 3371 B11R1.21 Cc1[n]c(ccc1C)C(O)=O Amb18125242 [1,1,0,0,0,0|2,0,0]=4 3372 B11R1.21 Cc1[n]c(ccc1O)C(C)=O Amb25152809 [1,1,0,0,0,0|1,0,0]=3 3373 B11R1.21 Cc1[n]c(ccc1O)S(C)=O Amb25679627 [1,1,0,0,0,0|2,0,0]=4 3374 B11R1.21 Cc1[n]cc([n]c1C)C(C)=O Amb21857433 [1,1,0,0,0,0|2,0,0]=4 3375 B11R1.21 Cc1[n]cc(cc1Br)C(C)=O Amb24455733 [1,1,0,0,0,0|1,0,0]=3 3376 B11R1.21 Cc1[n]cc(cc1Br)C(N)=O Amb24444265 [1,1,0,0,0,0|2,0,0]=4 3377 B11R1.21 Cc1[n]cc(cc1Br)C(O)=O Amb22234840 [1,1,0,0,0,0|2,0,0]=4 3378 B11R1.21 Cc1[n]cc(cc1C)C(=O)Cl Amb25151379 [1,1,0,0,0,0|2,0,0]=4 3379 B11R1.21 Cc1[n]cc(cc1C)C(N)=O Amb24465077 [1,1,0,0,0,0|2,0,0]=4 3380 B11R1.21 Cc1[n]cc(cc1C)C(O)=O Amb19516857 [1,1,0,0,0,0|2,0,0]=4 3381 B11R1.21 Cc1[n]cc(cc1C)C(O)=O Amb22587378 [1,1,0,0,0,0|2,0,0]=4 3382 B11R1.21 Cc1[n]cc(cc1Cl)C(=O)Cl Amb25850744 [1,1,0,0,0,0|2,0,0]=4 3383 B11R1.21 Cc1[n]cc(cc1Cl)C(C)=O Amb25152808 [1,1,0,0,0,0|1,0,0]=3 3384 B11R1.21 Cc1[n]cc(cc1Cl)C(N)=O Amb25348449 [1,1,0,0,0,0|2,0,0]=4 3385 B11R1.21 Cc1[n]cc(cc1F)C(O)=O Amb18830928 [1,1,0,0,0,0|2,0,0]=4 3386 B11R1.21 Cc1[n]cc(cc1N)C(O)=O Amb23440034 [1,1,0,0,0,0|2,0,0]=4 3387 B11R1.21 Cc1[n]cc(cc1O)C(C)=O Amb25152714 [1,1,0,0,0,0|1,0,0]=3 3388 B11R1.21 Cc1[n]cc(cc1O)C(N)=O Amb18125365 [1,1,0,0,0,0|2,0,0]=4 3389 B11R1.21 Cc1c[n]c(cc1Br)C(N)=O Amb22495200 [1,1,0,0,0,0|2,0,0]=4 3390 B11R1.21 Cc1c[n]c(cc1Br)C(O)=O Amb22497693 [1,1,0,0,0,0|2,0,0]=4 3391 B11R1.21 Cc1c[n]c(cc1Cl)C(C)=O Amb25112168 [1,1,0,0,0,0|1,0,0]=3 3392 B11R1.21 Cc1c[n]c(cc1Cl)C(N)=O Amb25707827 [1,1,0,0,0,0|2,0,0]=4 3393 B11R1.21 Cc1c[n]c(cc1Cl)C(O)=O Amb20670542 [1,1,0,0,0,0|2,0,0]=4 3394 B11R1.21 Cc1c[n]c(cc1N)C(O)=O Amb20248031 [1,1,0,0,0,0|2,0,0]=4 3395 B11R1.21 Cc1c[n]c(cc1O)C(O)=O Amb20248033 [1,1,0,0,0,0|2,0,0]=4 3396 B11R1.21 Cc1c[n]c(cc1O)C(O)=O Amb20667840 [1,1,0,0,0,0|2,0,0]=4 3397 B11R1.21 Cc1cc([n]cc1Br)C(C)=O Amb22756185 [1,1,0,0,0,0|2,0,0]=4 3398 B11R1.21 Cc1cc([n]cc1Cl)C(C)=O Amb25839234 [1,1,0,0,0,0|2,0,0]=4 3399 B11R1.21 Cc1cc([n]cc1N)C(C)=O Amb24436705 [1,1,0,0,0,0|2,0,0]=4 3400 B11R1.21 Cc1cc([n]cc1O)C(O)=O Amb24417626 [1,1,0,0,0,0|2,0,0]=4 3401 B11R1.21 Cc1cc(c[n]c1Br)C(C)=O Amb25147869 [1,1,0,0,0,0|2,0,0]=4 3402 B11R1.21 Cc1cc(c[n]c1C)C(C)=O Amb25347362 [1,1,0,0,0,0|1,0,0]=3 3403 B11R1.21 Cc1cc(c[n]c1Cl)C(C)=O Amb22410823 [1,1,0,0,0,0|2,0,0]=4 3404 B11R1.21 Cc1cc(c[n]c1F)C(C)=O Amb25073920 [1,1,0,0,0,0|2,0,0]=4 3405 B11R1.21 Cc1cc(c[n]c1N)C(C)=O Amb20247772 [1,1,0,0,0,0|2,0,0]=4 3406 B11R1.21 Cc1cc(c[n]c1O)C(N)=O Amb18125359 [1,1,0,0,0,0|2,0,0]=4 3407 B11R1.21 Cc1cc(ccc1C)C(C)=C Amb25760433 [1,1,0,0,0,0|1,0,0]=3 3408 B11R1.21 Cc1cc(ccc1C)C(N)=N Amb22229053 [1,1,0,0,0,0|2,0,0]=4 3409 B11R1.21 Cc1cc(ccc1C)C(N)=S Amb22048109 [1,1,0,0,0,0|1,1,0]=4 3410 B11R1.21 Cc1cc(ccc1C)N(=O)=O Amb20621948 [1,1,0,0,0,0|2,0,0]=4 3411 B11R1.21 Cc1cc(ccc1C)S(=O)Cl Amb18564364 [1,1,0,0,0,0|2,0,0]=4 3412 B11R1.21 Cc1cc(ccc1C)S(C)=O Amb19892211 [1,1,0,0,0,0|1,0,0]=3 3413 B11R1.21 Cc1cc(ccc1C)S(O)=O Amb18065475 [1,1,0,0,0,0|2,0,0]=4 3414 B11R1.21 Cc1cc(ccc1C)S([O-])=O Amb24427010 [1,1,0,0,0,0|2,0,0]=4 3415 B11R1.21 Cc1cc(ccc1Cl)C(=O)Cl Amb19891030 [1,1,0,0,0,0|2,0,0]=4 3416 B11R1.21 Cc1cc(ccc1Cl)C(N)=O Amb18054429 [1,1,0,0,0,0|2,0,0]=4 3417 B11R1.21 Cc1cc(ccc1F)C(C)=C Amb22047758 [1,1,0,0,0,0|2,0,0]=4 3418 B11R1.21 Cc1cc(ccc1I)C(=O)Cl Amb24126325 [1,1,0,0,0,0|2,0,0]=4 3419 B11R1.21 Cc1cc(ccc1I)C(C)=O Amb25273089 [1,1,0,0,0,0|1,0,0]=3 3420 B11R1.21 Cc1cc(ccc1I)C(N)=O Amb20642439 [1,1,0,0,0,0|2,0,0]=4 3421 B11R1.21 Cc1cc(ccc1N)C(=O)Cl Amb24626036 [1,1,0,0,0,0|2,0,0]=4 3422 B11R1.21 Cc1cc(ccc1N)S(C)=O Amb24419238 [1,1,0,0,0,0|2,0,0]=4 3423 B11R1.21 Cc1cc(ccc1O)C(C)=C Amb18124921 [1,1,0,0,0,0|1,0,0]=3 3424 B11R1.21 Cc1cc(ccc1O)C(C)C Amb24083057 [1,1,0,0,0,0|1,0,1]=4 3425 B11R1.21 Cc1cc(ccc1O)C(N)=N Amb18179376 [1,1,0,0,0,0|2,0,0]=4 3426 B11R1.21 Cc1cc(ccc1O)C(N)=O Amb24487721 [1,1,0,0,0,0|1,0,0]=3 3427 B11R1.21 Cc1cc(ccc1O)C(N)=S Amb18792946 [1,1,0,0,0,0|1,1,0]=4 3428 B11R1.21 Cc1cc(ccc1O)N(=O)=O Amb20621679 [1,1,0,0,0,0|2,0,0]=4 3429 B11R1.21 Cc1cc(ccc1O)[C@@H](C)N Amb25189087 [1,1,0,0,0,0|1,0,1]=4 3430 B11R1.21 Cc1cc(ccc1O)[C@H](C)O Amb25763246 [1,1,0,0,0,0|0,0,2]=4 3431 B11R1.21 Cc1cc(ccc1S)C(O)=O Amb18948117 [1,1,0,0,0,0|1,1,0]=4 3432 B11R1.21 Cc1ccc([n]c1Br)C(C)=O Amb22494954 [1,1,0,0,0,0|1,0,0]=3 3433 B11R1.21 Cc1ccc([n]c1Br)C(N)=O Amb22495091 [1,1,0,0,0,0|2,0,0]=4 3434 B11R1.21 Cc1ccc([n]c1Br)C(O)=O Amb20248966 [1,1,0,0,0,0|2,0,0]=4 3435 B11R1.21 Cc1ccc([n]c1C)C(C)=O Amb25152840 [1,1,0,0,0,0|1,0,0]=3 3436 B11R1.21 Cc1ccc([n]c1Cl)C(C)=O Amb24509071 [1,1,0,0,0,0|1,0,0]=3 3437 B11R1.21 Cc1ccc([n]c1Cl)C(O)=O Amb19958043 [1,1,0,0,0,0|2,0,0]=4 3438 B11R1.21 Cc1ccc([n]c1F)C(O)=O Amb22235354 [1,1,0,0,0,0|2,0,0]=4 3439 B11R1.21 Cc1ccc([n]c1N)C(N)=O Amb25301657 [1,1,0,0,0,0|2,0,0]=4 3440 B11R1.21 Cc1ccc([n]c1N)C(O)=O Amb25802260 [1,1,0,0,0,0|2,0,0]=4 3441 B11R1.21 Cc1ccc(c[n+]1[O-])C(O)=O Amb19959235 [1,1,0,0,0,0|2,0,0]=4 3442 B11R1.21 Cc1ccc(cc1Br)C(C)Br Amb25343397 [1,1,0,0,0,0|1,0,1]=4 3443 B11R1.21 Cc1ccc(cc1Br)C(C)C Amb18523219 [1,1,0,0,0,0|1,0,1]=4 3444 B11R1.21 Cc1ccc(cc1Br)C(C)N Amb18866496 [1,1,0,0,0,0|1,0,1]=4 3445 B11R1.21 Cc1ccc(cc1Br)[C@H](C)N Amb24376142 [1,1,0,0,0,0|1,0,1]=4 3446 B11R1.21 Cc1ccc(cc1Br)[C@H](C)O Amb25249611 [1,1,0,0,0,0|0,0,2]=4 3447 B11R1.21 Cc1ccc(cc1Cl)C(=O)Cl Amb19891037 [1,1,0,0,0,0|1,0,0]=3 3448 B11R1.21 Cc1ccc(cc1Cl)C(C)Cl Amb24416068 [1,1,0,0,0,0|1,0,1]=4 3449 B11R1.21 Cc1ccc(cc1Cl)C(C)N Amb18862832 [1,1,0,0,0,0|1,0,1]=4 3450 B11R1.21 Cc1ccc(cc1Cl)C(N)=S Amb25121643 [1,1,0,0,0,0|1,1,0]=4 3451 B11R1.21 Cc1ccc(cc1Cl)C([O-])=O Amb22489468 [1,1,0,0,0,0|1,0,0]=3 3452 B11R1.21 Cc1ccc(cc1Cl)[C@@H](C)N Amb22298524 [1,1,0,0,0,0|1,0,1]=4 3453 B11R1.21 Cc1ccc(cc1Cl)[C@H](C)N Amb22284324 [1,1,0,0,0,0|1,0,1]=4 3454 B11R1.21 Cc1ccc(cc1Cl)[C@H](C)N Amb22298567 [1,1,0,0,0,0|1,0,1]=4 3455 B11R1.21 Cc1ccc(cc1F)C(C)=C Amb25201940 [1,1,0,0,0,0|1,0,0]=3 3456 B11R1.21 Cc1ccc(cc1F)C(C)O Amb18179516 [1,1,0,0,0,0|0,0,2]=4 3457 B11R1.21 Cc1ccc(cc1F)N(=O)=O Amb20621364 [1,1,0,0,0,0|2,0,0]=4 3458 B11R1.21 Cc1ccc(cc1F)N(C)C Amb25290013 [1,1,0,0,0,0|2,0,0]=4 3459 B11R1.21 Cc1ccc(cc1F)S(O)=O Amb25273206 [1,1,0,0,0,0|2,0,0]=4 3460 B11R1.21 Cc1ccc(cc1F)S([O-])=O Amb19944447 [1,1,0,0,0,0|2,0,0]=4 3461 B11R1.21 Cc1ccc(cc1F)[C@@H](C)N Amb24453195 [1,1,0,0,0,0|1,0,1]=4 3462 B11R1.21 Cc1ccc(cc1F)[C@H](C)N Amb25145879 [1,1,0,0,0,0|1,0,1]=4 3463 B11R1.21 Cc1ccc(cc1F)[C@H](C)O Amb25702545 [1,1,0,0,0,0|0,0,2]=4 3464 B11R1.21 Cc1ccc(cc1I)C(=O)Cl Amb24093128 [1,1,0,0,0,0|1,0,0]=3 3465 B11R1.21 Cc1ccc(cc1I)C(C)=O Amb22749806 [1,1,0,0,0,0|0,0,0]=2 3466 B11R1.21 Cc1ccc(cc1I)C(C)Br Amb25080024 [1,1,0,0,0,0|1,0,1]=4 3467 B11R1.21 Cc1ccc(cc1I)C(C)N Amb25738305 [1,1,0,0,0,0|1,0,1]=4 3468 B11R1.21 Cc1ccc(cc1I)C(C)O Amb25802364 [1,1,0,0,0,0|0,0,2]=4 3469 B11R1.21 Cc1ccc(cc1I)[C@@H](C)N Amb24664298 [1,1,0,0,0,0|1,0,1]=4 3470 B11R1.21 Cc1ccc(cc1I)[C@H](C)N Amb25253481 [1,1,0,0,0,0|1,0,1]=4 3471 B11R1.21 Cc1ccc(cc1N)C(C)=O Amb22587627 [1,1,0,0,0,0|0,0,0]=2 3472 B11R1.21 Cc1ccc(cc1N)C(C)C Amb22167212 [1,1,0,0,0,0|1,0,1]=4 3473 B11R1.21 Cc1ccc(cc1N)C(C)F Amb24586619 [1,1,0,0,0,0|1,0,1]=4 3474 B11R1.21 Cc1ccc(cc1N)C(C)O Amb23541079 [1,1,0,0,0,0|0,0,2]=4 3475 B11R1.21 Cc1ccc(cc1N)C(N)=N Amb25081860 [1,1,0,0,0,0|2,0,0]=4 3476 B11R1.21 Cc1ccc(cc1N)N(=O)=O Amb20621651 [1,1,0,0,0,0|2,0,0]=4 3477 B11R1.21 Cc1ccc(cc1N)N(C)C Amb22492367 [1,1,0,0,0,0|2,0,0]=4 3478 B11R1.21 Cc1ccc(cc1N)S(O)=O Amb24522964 [1,1,0,0,0,0|2,0,0]=4 3479 B11R1.21 Cc1ccc(cc1N)[N+]([O-])=O Amb22461435 [1,1,0,0,0,0|2,0,0]=4 3480 B11R1.21 Cc1ccc(cc1O)C(C)=C Amb18124928 [1,1,0,0,0,0|1,0,0]=3 3481 B11R1.21 Cc1ccc(cc1O)C(C)N Amb24485763 [1,1,0,0,0,0|1,0,1]=4 3482 B11R1.21 Cc1ccc(cc1O)C(N)=S Amb25719896 [1,1,0,0,0,0|1,1,0]=4 3483 B11R1.21 Cc1ccc(cc1O)N(=O)=O Amb21837681 [1,1,0,0,0,0|2,0,0]=4 3484 B11R1.21 Cc1ccc(cc1S)C(O)=O Amb24054265 [1,1,0,0,0,0|1,0,0]=3 3485 B11R1.21 ClC(=O)c1ccc(c(c1)Cl)Cl Amb1935253 [1,1,0,0,0,0|2,0,0]=4 3486 B11R1.21 ClC(=O)c1ccc(c(c1)F)Br Amb10841631 [1,1,0,0,0,0|2,0,0]=4 3487 B11R1.21 ClC(=O)c1ccc(c(c1)F)Cl Amb10841240 [1,1,0,0,0,0|2,0,0]=4 3488 B11R1.21 ClC(=O)c1ccc(c(c1)F)N Amb10839974 [1,1,0,0,0,0|2,0,0]=4 3489 B11R1.21 ClC(=O)c1ccc(c(c1)N)C Amb17142912 [1,1,0,0,0,0|1,0,0]=3 3490 B11R1.21 FC(=O)c1ccc(c(c1)Br)F Amb10839204 [1,1,0,0,0,0|2,0,0]=4 3491 B11R1.21 FC(=O)c1ccc(c(c1)Cl)F Amb10839929 [1,1,0,0,0,0|2,0,0]=4 3492 B11R1.21 N=C1C=C(C=CC1=O)C(O)=O Amb24434947 [1,1,0,0,0,0|1,0,1]=4 3493 B11R1.21 N=C1C=CC(=CC1=N)C(O)=O Amb25063156 [1,1,0,0,0,0|2,0,0]=4 3494 B11R1.21 N=C1C=CC(=CC1=O)C(O)=O Amb24669063 [1,1,0,0,0,0|2,0,0]=4 3495 B11R1.21 NC(=N)c1ccc(O)c(Br)c1 Amb24097525 [1,1,0,0,0,0|2,0,0]=4 3496 B11R1.21 NC(=N)c1ccc(O)c(Cl)c1 Amb18177961 [1,1,0,0,0,0|2,0,0]=4 3497 B11R1.21 NC(=O)c1ccc(Br)c(Cl)c1 Amb21856620 [1,1,0,0,0,0|2,0,0]=4 3498 B11R1.21 NC(=O)c1ccc(Br)c(I)c1 Amb19889875 [1,1,0,0,0,0|2,0,0]=4 3499 B11R1.21 NC(=O)c1ccc(Br)c(O)c1 Amb20248961 [1,1,0,0,0,0|2,0,0]=4 3500 B11R1.21 NC(=O)c1ccc(Cl)c(Br)c1 Amb21856659 [1,1,0,0,0,0|2,0,0]=4 3501 B11R1.21 NC(=O)c1ccc(Cl)c(F)c1 Amb21964736 [1,1,0,0,0,0|2,0,0]=4 3502 B11R1.21 NC(=O)c1ccc(Cl)c(O)c1 Amb22501137 [1,1,0,0,0,0|2,0,0]=4 3503 B11R1.21 NC(=O)c1ccc(F)c(Cl)c1 Amb22047550 [1,1,0,0,0,0|2,0,0]=4 3504 B11R1.21 NC(=O)c1ccc(F)c(I)c1 Amb19889876 [1,1,0,0,0,0|2,0,0]=4 3505 B11R1.21 NC(=O)c1ccc(F)c(O)c1 Amb23437519 [1,1,0,0,0,0|2,0,0]=4 3506 B11R1.21 NC(=O)c1ccc(F)c(S)c1 Amb24334696 [1,1,0,0,0,0|2,0,0]=4 3507 B11R1.21 NC(=O)c1ccc(I)c(Cl)c1 Amb21981742 [1,1,0,0,0,0|2,0,0]=4 3508 B11R1.21 NC(=O)c1ccc(I)c(F)c1 Amb20642582 [1,1,0,0,0,0|2,0,0]=4 3509 B11R1.21 NC(=O)c1ccc(S)c(Br)c1 Amb25349482 [1,1,0,0,0,0|1,1,0]=4 3510 B11R1.21 NC(=O)c1ccc(c(c1)Br)F Amb10841333 [1,1,0,0,0,0|2,0,0]=4 3511 B11R1.21 NC(=O)c1ccc(c(c1)Br)I Amb11329100 [1,1,0,0,0,0|2,0,0]=4 3512 B11R1.21 NC(=O)c1ccc(c(c1)C)N Amb1112542 [1,1,0,0,0,0|2,0,0]=4 3513 B11R1.21 NC(=O)c1ccc(c(c1)F)Br Amb11570824 [1,1,0,0,0,0|2,0,0]=4 3514 B11R1.21 NC(=O)c1ccc(c(c1)F)F Amb1224651 [1,1,0,0,0,0|2,0,0]=4 3515 B11R1.21 NC(=O)c1ccc(c(c1)I)Cl Amb11480319 [1,1,0,0,0,0|2,0,0]=4 3516 B11R1.21 NC(=O)c1ccc(c(c1)N)C Amb1113095 [1,1,0,0,0,0|1,0,0]=3 3517 B11R1.21 NC(=O)c1ccc(c(c1)N)Cl Amb1114429 [1,1,0,0,0,0|2,0,0]=4 3518 B11R1.21 NC(=O)c1ccc(c(c1)N)F Amb1125551 [1,1,0,0,0,0|2,0,0]=4 3519 B11R1.21 NC(=O)c1ccc(c(c1)O)I Amb10604518 [1,1,0,0,0,0|2,0,0]=4 3520 B11R1.21 NC(=S)c1ccc(O)c(Cl)c1 Amb19046880 [1,1,0,0,0,0|1,1,0]=4 3521 B11R1.21 NC(=S)c1ccc(c(c1)F)C Amb1121333 [1,1,0,0,0,0|1,1,0]=4 3522 B11R1.21 NC(=S)c1ccc(c(c1)O)O Amb1117602 [1,1,0,0,0,0|1,1,0]=4 3523 B11R1.21 Nc1[n]c(ccc1O)C(O)=O Amb22235554 [1,1,0,0,0,0|2,0,0]=4 3524 B11R1.21 Nc1cc([n]cc1O)C(O)=O Amb25335422 [1,1,0,0,0,0|2,0,0]=4 3525 B11R1.21 Nc1cc(ccc1Br)C(N)=O Amb18944459 [1,1,0,0,0,0|2,0,0]=4 3526 B11R1.21 Nc1cc(ccc1Cl)C(=O)Cl Amb24085803 [1,1,0,0,0,0|2,0,0]=4 3527 B11R1.21 Nc1cc(ccc1F)C(N)=O Amb21897111 [1,1,0,0,0,0|2,0,0]=4 3528 B11R1.21 Nc1cc(ccc1I)C(=O)Cl Amb25082474 [1,1,0,0,0,0|2,0,0]=4 3529 B11R1.21 Nc1cc(ccc1I)C(N)=O Amb24533133 [1,1,0,0,0,0|2,0,0]=4 3530 B11R1.21 Nc1cc(ccc1I)C(O)=O Amb20620266 [1,1,0,0,0,0|2,0,0]=4 3531 B11R1.21 Nc1cc(ccc1N)C(=O)Cl Amb24453862 [1,1,0,0,0,0|2,0,0]=4 3532 B11R1.21 Nc1cc(ccc1O)C(=O)Cl Amb24085809 [1,1,0,0,0,0|1,0,0]=3 3533 B11R1.21 Nc1cc(ccc1O)C(N)=N Amb24634104 [1,1,0,0,0,0|2,0,0]=4 3534 B11R1.21 Nc1cc(ccc1O)S(O)=O Amb24601805 [1,1,0,0,0,0|2,0,0]=4 3535 B11R1.21 Nc1cc(ccc1O)[N+]([O-])=O Amb24106124 [1,1,0,0,0,0|2,0,0]=4 3536 B11R1.21 Nc1cc(ccc1S)C(O)=O Amb18647177 [1,1,0,0,0,0|1,1,0]=4 3537 B11R1.21 Nc1ccc(cc1Br)C(=O)Cl Amb25068003 [1,1,0,0,0,0|2,0,0]=4 3538 B11R1.21 Nc1ccc(cc1Cl)C(=O)Cl Amb24091214 [1,1,0,0,0,0|2,0,0]=4 3539 B11R1.21 Nc1ccc(cc1Cl)C(N)=O Amb24094581 [1,1,0,0,0,0|2,0,0]=4 3540 B11R1.21 Nc1ccc(cc1F)C(N)=O Amb18280403 [1,1,0,0,0,0|2,0,0]=4 3541 B11R1.21 Nc1ccc(cc1I)C(N)=O Amb23402156 [1,1,0,0,0,0|2,0,0]=4 3542 B11R1.21 Nc1ccc(cc1O)C(N)=O Amb23437514 [1,1,0,0,0,0|2,0,0]=4 3543 B11R1.21 Nc1ccc(cc1O)C(O)=O Amb22751271 [1,1,0,0,0,0|2,0,0]=4 3544 B11R1.21 Nc1ccc(cc1S)C(N)=O Amb24477549 [1,1,0,0,0,0|2,0,0]=4 3545 B11R1.21 Nc1ccc(cc1S)C(O)=O Amb20668181 [1,1,0,0,0,0|2,0,0]=4 3546 B11R1.21 O=C(Br)c1cc(Cl)c(Cl)cc1 Amb25755934 [1,1,0,0,0,0|2,0,0]=4 3547 B11R1.21 O=C(Cl)c1cc(Cl)c(Br)cc1 Amb19888027 [1,1,0,0,0,0|2,0,0]=4 3548 B11R1.21 O=C(Cl)c1cc(Cl)c(I)cc1 Amb21981741 [1,1,0,0,0,0|2,0,0]=4 3549 B11R1.21 O=C(Cl)c1cc(I)c(I)cc1 Amb20179402 [1,1,0,0,0,0|2,0,0]=4 3550 B11R1.21 O=C(Cl)c1ccc(Cl)c(Br)c1 Amb19888081 [1,1,0,0,0,0|2,0,0]=4 3551 B11R1.21 O=C(Cl)c1ccc(Cl)c(I)c1 Amb25147886 [1,1,0,0,0,0|2,0,0]=4 3552 B11R1.21 O=C(Cl)c1ccc(F)c(I)c1 Amb25680988 [1,1,0,0,0,0|2,0,0]=4 3553 B11R1.21 O=C(Cl)c1ccc(I)c(F)c1 Amb25147938 [1,1,0,0,0,0|2,0,0]=4 3554 B11R1.21 O=C(F)c1cc(F)c(F)cc1 Amb24552335 [1,1,0,0,0,0|2,0,0]=4 3555 B11R1.21 OC(=O)C1=CC(=O)C(O)=CN1 Amb21962527 [1,1,0,0,0,0|2,0,0]=4 3556 B11R1.21 OC(=O)C1=CC(=O)C(O)=CO1 Amb18125912 [1,1,0,0,0,0|2,0,0]=4 3557 B11R1.21 OC(=O)C1=CC=C(O)C(=O)N1 Amb24179163 [1,1,0,0,0,0|2,0,0]=4 3558 B11R1.21 OC(=O)c1ccc(Br)c(I)c1 Amb21963501 [1,1,0,0,0,0|2,0,0]=4 3559 B11R1.21 OC(=O)c1ccc(Br)c(S)c1 Amb23557914 [1,1,0,0,0,0|2,0,0]=4 3560 B11R1.21 OC(=O)c1ccc(Cl)c(S)c1 Amb18650042 [1,1,0,0,0,0|2,0,0]=4 3561 B11R1.21 OC(=O)c1ccc(F)c(S)c1 Amb19374986 [1,1,0,0,0,0|2,0,0]=4 3562 B11R1.21 OC(=O)c1ccc(I)c(Cl)c1 Amb19888183 [1,1,0,0,0,0|2,0,0]=4 3563 B11R1.21 OC(=O)c1ccc(S)c(F)c1 Amb18280497 [1,1,0,0,0,0|1,1,0]=4 3564 B11R1.21 OC(=O)c1ccc(c(c1)C)C Amb2558202 [1,1,0,0,0,0|1,0,0]=3 3565 B11R1.21 OC(=O)c1ccc(c(c1)C)I Amb1060318 [1,1,0,0,0,0|2,0,0]=4 3566 B11R1.21 OC(=O)c1ccc(c(c1)C)N Amb2371743 [1,1,0,0,0,0|2,0,0]=4 3567 B11R1.21 OC(=O)c1ccc(c(c1)Cl)Br Amb10071603 [1,1,0,0,0,0|2,0,0]=4 3568 B11R1.21 OC(=O)c1ccc(c(c1)Cl)S Amb13952299 [1,1,0,0,0,0|1,1,0]=4 3569 B11R1.21 OC(=O)c1ccc(c(c1)F)C Amb1229910 [1,1,0,0,0,0|1,0,0]=3 3570 B11R1.21 OC(=O)c1ccc(c(c1)F)F Amb1218139 [1,1,0,0,0,0|2,0,0]=4 3571 B11R1.21 OC(=O)c1ccc(c(c1)F)O Amb1810752 [1,1,0,0,0,0|1,0,0]=3 3572 B11R1.21 OC(=O)c1ccc(c(c1)I)C Amb1125694 [1,1,0,0,0,0|1,0,0]=3 3573 B11R1.21 OC(=O)c1ccc(c(c1)I)Cl Amb1135958 [1,1,0,0,0,0|2,0,0]=4 3574 B11R1.21 OC(=O)c1ccc(c(c1)I)F Amb10841793 [1,1,0,0,0,0|2,0,0]=4 3575 B11R1.21 OC(=O)c1ccc(c(c1)I)I Amb15690596 [1,1,0,0,0,0|2,0,0]=4 3576 B11R1.21 OC(=O)c1ccc(c(c1)I)N Amb10070341 [1,1,0,0,0,0|2,0,0]=4 3577 B11R1.21 OC(=O)c1ccc(c(c1)N)F Amb10838541 [1,1,0,0,0,0|2,0,0]=4 3578 B11R1.21 OC(=O)c1ccc(c(c1)N)F Amb1980792 [1,1,0,0,0,0|2,0,0]=4 3579 B11R1.21 OC(=O)c1ccc(c(c1)O)Br Amb10072072 [1,1,0,0,0,0|2,0,0]=4 3580 B11R1.21 OC(=O)c1ccc(c(c1)O)C Amb1229982 [1,1,0,0,0,0|1,0,0]=3 3581 B11R1.21 OC(=O)c1ccc(c(c1)O)O Amb1960218 [1,1,0,0,0,0|1,0,0]=3 3582 B11R1.21 OC(=O)c1cnc(c(c1)O)C Amb13881250 [1,1,0,0,0,0|2,0,0]=4 3583 B11R1.21 Oc1[n]cc(cc1Cl)C(=O)Cl Amb24071191 [1,1,0,0,0,0|2,0,0]=4 3584 B11R1.21 Oc1[n]cc(cc1F)C(=O)F Amb25283530 [1,1,0,0,0,0|2,0,0]=4 3585 B11R1.21 Oc1[n]cc(cc1F)C(O)=O Amb24081511 [1,1,0,0,0,0|2,0,0]=4 3586 B11R1.21 Oc1[n]cc(cc1I)C(O)=O Amb22504600 [1,1,0,0,0,0|2,0,0]=4 3587 B11R1.21 Oc1cc(ccc1Br)C(=O)Cl Amb25769593 [1,1,0,0,0,0|2,0,0]=4 3588 B11R1.21 Oc1cc(ccc1Cl)C(=O)Cl Amb22736494 [1,1,0,0,0,0|2,0,0]=4 3589 B11R1.21 Oc1cc(ccc1O)C(=O)Cl Amb24085498 [1,1,0,0,0,0|1,0,0]=3 3590 B11R1.21 Oc1cc(ccc1O)C(O)=O Amb20242463 [1,1,0,0,0,0|1,0,0]=3 3591 B11R1.21 Oc1cc(ccc1S)C(O)=O Amb24686672 [1,1,0,0,0,0|1,1,0]=4 3592 B11R1.21 Oc1ccc([n]c1Cl)C(O)=O Amb18127134 [1,1,0,0,0,0|2,0,0]=4 3593 B11R1.21 Oc1ccc([n]c1F)C(O)=O Amb24432150 [1,1,0,0,0,0|2,0,0]=4 3594 B11R1.21 Oc1ccc(cc1Br)C(O)=O Amb24061924 [1,1,0,0,0,0|1,0,0]=3 3595 B11R1.21 Oc1ccc(cc1Br)N(=O)=O Amb20620564 [1,1,0,0,0,0|2,0,0]=4 3596 B11R1.21 Oc1ccc(cc1Cl)N(=O)=O Amb20620811 [1,1,0,0,0,0|2,0,0]=4 3597 B11R1.21 Oc1ccc(cc1F)N(=O)=O Amb20621351 [1,1,0,0,0,0|2,0,0]=4 3598 B11R1.21 Oc1ccc(cc1S)C(O)=O Amb18647318 [1,1,0,0,0,0|1,0,0]=3 3599 B11R1.21 [O-]C(=O)c1ccc(c(c1)O)O Amb15690937 [1,1,0,0,0,0|1,0,0]=3 3600 B11R1.21 [O-][N+](=O)c1ccc(c(c1)I)C Amb17908 [1,1,0,0,0,0|2,0,0]=4 3601 B11R1.21 [O-][N+](=O)c1ccc(c(c1)O)C Amb2582781 [1,1,0,0,0,0|2,0,0]=4 3602 B11R1.22 BrCC(=O)c1ccc(cc1)C Amb1981331 [1,1,0,0,0,0|0,0,0]=2 3603 B11R1.22 BrCC(=O)c1ccc(cc1)Cl Amb2505006 [1,1,0,0,0,0|1,0,0]=3 3604 B11R1.22 BrCC(=O)c1ccc(cc1)F Amb1885038 [1,1,0,0,0,0|1,0,0]=3 3605 B11R1.22 BrCC(c1ccc(cc1)C)C Amb17241353 [1,1,0,0,0,0|1,0,1]=4 3606 B11R1.22 BrCC(c1ccc(cc1)C)O Amb17206106 [1,1,0,0,0,0|0,0,2]=4 3607 B11R1.22 C#CC(=O)c1ccc(Cl)cc1 Amb25720663 [1,1,0,0,0,0|1,0,1]=4 3608 B11R1.22 C#CC(=O)c1ccc(F)cc1 Amb24447227 [1,1,0,0,0,0|1,0,1]=4 3609 B11R1.22 C#CC(=O)c1ccc(I)cc1 Amb25106761 [1,1,0,0,0,0|1,0,1]=4 3610 B11R1.22 C#CC(=O)c1ccc(N)cc1 Amb24488157 [1,1,0,0,0,0|1,0,1]=4 3611 B11R1.22 C=C(C=O)c1ccc(O)cc1 Amb24484762 [1,1,0,0,0,0|0,0,1]=3 3612 B11R1.22 C=C(CBr)c1ccc(Br)cc1 Amb25148237 [1,1,0,0,0,0|2,0,0]=4 3613 B11R1.22 C=C(CCl)c1ccc(F)cc1 Amb25279495 [1,1,0,0,0,0|2,0,0]=4 3614 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [1,1,0,0,0,0|2,0,0]=4 3615 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [1,1,0,0,0,0|2,0,0]=4 3616 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [1,1,0,0,0,0|2,0,0]=4 3617 B11R1.22 C=C(CN)c1ccc(I)cc1 Amb25163247 [1,1,0,0,0,0|2,0,0]=4 3618 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [1,1,0,0,0,0|1,0,1]=4 3619 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [1,1,0,0,0,0|1,0,1]=4 3620 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [1,1,0,0,0,0|1,0,1]=4 3621 B11R1.22 C=CC(=O)c1ccc(I)cc1 Amb24567537 [1,1,0,0,0,0|1,0,1]=4 3622 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [1,1,0,0,0,0|0,0,1]=3 3623 B11R1.22 CC(=NO)c1ccc(O)cc1 Amb24324955 [1,1,0,0,0,0|0,0,1]=3 3624 B11R1.22 CC(C=C)c1ccc(O)cc1 Amb18124918 [1,1,0,0,0,0|1,0,1]=4 3625 B11R1.22 CC(C=O)c1ccc(O)cc1 Amb18125109 [1,1,0,0,0,0|0,0,1]=3 3626 B11R1.22 CC(CN)c1ccc(O)cc1 Amb19957319 [1,1,0,0,0,0|1,0,1]=4 3627 B11R1.22 CC(CO)c1ccc(O)cc1 Amb18125400 [1,1,0,0,0,0|0,0,2]=4 3628 B11R1.22 CC(c1ccc(cc1)O)C#N Amb17593672 [1,1,0,0,0,0|1,0,1]=4 3629 B11R1.22 CC=1C=CN(CC1)C(=O)OC Amb24060040 [1,1,0,0,0,0|1,0,1]=4 3630 B11R1.22 CCC(=C)c1ccc(Br)cc1 Amb20668394 [1,1,0,0,0,0|2,0,0]=4 3631 B11R1.22 CCC(=O)N1C=CC(=O)C=C1 Amb25838673 [1,1,0,0,0,0|1,0,1]=4 3632 B11R1.22 CCC(=O)c1ccc(Br)[n]c1 Amb23446252 [1,1,0,0,0,0|2,0,0]=4 3633 B11R1.22 CCC(=O)c1ccc(F)c[n]1 Amb25759749 [1,1,0,0,0,0|2,0,0]=4 3634 B11R1.22 CCC(=O)c1ccc(I)[n]c1 Amb23446977 [1,1,0,0,0,0|2,0,0]=4 3635 B11R1.22 CCC(=O)c1ccc(N)[n]c1 Amb23446324 [1,1,0,0,0,0|2,0,0]=4 3636 B11R1.22 CCC(=O)c1ccc(O)[n]c1 Amb23446708 [1,1,0,0,0,0|1,0,0]=3 3637 B11R1.22 CCC(=O)c1ccc(O)c[n]1 Amb25028212 [1,1,0,0,0,0|1,0,0]=3 3638 B11R1.22 CCC(=O)c1ccc(S)[n]c1 Amb23446721 [1,1,0,0,0,0|1,1,0]=4 3639 B11R1.22 CCC(=O)c1ccc(S)cc1 Amb25273108 [1,1,0,0,0,0|0,1,0]=3 3640 B11R1.22 CCC(=O)c1ccc(cc1)O Amb1336085 [1,1,0,0,0,0|0,0,0]=2 3641 B11R1.22 CCC(=S)c1ccc(O)cc1 Amb25258595 [1,1,0,0,0,0|0,1,0]=3 3642 B11R1.22 CCC(c1ccc(cc1)C)N Amb10778749 [1,1,0,0,0,0|1,0,1]=4 3643 B11R1.22 CCC(c1ccc(cc1)C)O Amb1110039 [1,1,0,0,0,0|0,0,2]=4 3644 B11R1.22 CCC(c1ccc(cc1)O)N Amb1117697 [1,1,0,0,0,0|1,0,1]=4 3645 B11R1.22 CCC(c1ccc(cc1)O)N Amb17622108 [1,1,0,0,0,0|1,0,1]=4 3646 B11R1.22 CCC(c1ccc(cc1)O)O Amb1111179 [1,1,0,0,0,0|0,0,2]=4 3647 B11R1.22 CCS(=O)c1ccc(F)cc1 Amb25771877 [1,1,0,0,0,0|2,0,0]=4 3648 B11R1.22 CCS(=O)c1ccc(N)cc1 Amb18284277 [1,1,0,0,0,0|2,0,0]=4 3649 B11R1.22 CC[C@@H](N)c1ccc(O)cc1 Amb25247808 [1,1,0,0,0,0|1,0,1]=4 3650 B11R1.22 CC[C@@H](O)c1ccc(O)cc1 Amb25345214 [1,1,0,0,0,0|0,0,2]=4 3651 B11R1.22 CC[C@H](N)c1ccc(O)cc1 Amb24758224 [1,1,0,0,0,0|1,0,1]=4 3652 B11R1.22 CN(C=N)c1ccc(O)cc1 Amb24072410 [1,1,0,0,0,0|2,0,0]=4 3653 B11R1.22 CN(C=O)c1ccc(Br)cc1 Amb24444598 [1,1,0,0,0,0|2,0,0]=4 3654 B11R1.22 CN(C=O)c1ccc(Cl)cc1 Amb22731030 [1,1,0,0,0,0|2,0,0]=4 3655 B11R1.22 CN(C=O)c1ccc(F)cc1 Amb24072394 [1,1,0,0,0,0|2,0,0]=4 3656 B11R1.22 CN(N=O)c1ccc(F)cc1 Amb25113471 [1,1,0,0,0,0|2,0,0]=4 3657 B11R1.22 CN(c1ccc(cc1)O)C#N Amb17593690 [1,1,0,0,0,0|2,0,0]=4 3658 B11R1.22 CN=C(N)c1ccc(F)cc1 Amb24070278 [1,1,0,0,0,0|2,0,0]=4 3659 B11R1.22 CN=C(N)c1ccc(N)cc1 Amb24091300 [1,1,0,0,0,0|2,0,0]=4 3660 B11R1.22 CNC(=N)c1ccc(Cl)cc1 Amb24415099 [1,1,0,0,0,0|2,0,0]=4 3661 B11R1.22 CNC(=N)c1ccc(O)cc1 Amb18125142 [1,1,0,0,0,0|1,0,0]=3 3662 B11R1.22 CNC(=O)C1=CNC(=O)C=C1 Amb18799400 [1,1,0,0,0,0|1,0,1]=4 3663 B11R1.22 CNC(=O)c1ccc(Br)[n]c1 Amb19959847 [1,1,0,0,0,0|2,0,0]=4 3664 B11R1.22 CNC(=O)c1ccc(F)[n]c1 Amb24660138 [1,1,0,0,0,0|2,0,0]=4 3665 B11R1.22 CNC(=O)c1ccc(N)[n]c1 Amb18946779 [1,1,0,0,0,0|2,0,0]=4 3666 B11R1.22 CNC(=O)c1ccc(O)c[n]1 Amb19895115 [1,1,0,0,0,0|1,0,0]=3 3667 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [1,1,0,0,0,0|0,1,0]=3 3668 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1232931 [1,1,0,0,0,0|1,0,0]=3 3669 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774478 [1,1,0,0,0,0|1,0,0]=3 3670 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774979 [1,1,0,0,0,0|1,0,0]=3 3671 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1797209 [1,1,0,0,0,0|1,0,0]=3 3672 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1771439 [1,1,0,0,0,0|0,0,0]=2 3673 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1796878 [1,1,0,0,0,0|0,0,0]=2 3674 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1806248 [1,1,0,0,0,0|0,0,0]=2 3675 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1814728 [1,1,0,0,0,0|0,0,0]=2 3676 B11R1.22 CNC(=O)c1ccc(cc1)I Amb1230427 [1,1,0,0,0,0|1,0,0]=3 3677 B11R1.22 CNC(=O)c1ccc(cn1)Br Amb10068169 [1,1,0,0,0,0|2,0,0]=4 3678 B11R1.22 CNC(=O)c1ccc(nc1)Cl Amb2106608 [1,1,0,0,0,0|2,0,0]=4 3679 B11R1.22 CNC(=S)c1ccc(Br)cc1 Amb24528870 [1,1,0,0,0,0|1,1,0]=4 3680 B11R1.22 CNC(c1ccc(cc1)C)C Amb1120227 [1,1,0,0,0,0|1,0,1]=4 3681 B11R1.22 CNC(c1ccc(cc1)O)C Amb1118673 [1,1,0,0,0,0|1,0,1]=4 3682 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [1,1,0,0,0,0|2,0,0]=4 3683 B11R1.22 COC(=C)c1ccc(Br)cc1 Amb25325540 [1,1,0,0,0,0|2,0,0]=4 3684 B11R1.22 COC(=N)c1ccc(Br)cc1 Amb24056401 [1,1,0,0,0,0|2,0,0]=4 3685 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb18180239 [1,1,0,0,0,0|2,0,0]=4 3686 B11R1.22 COC(=N)c1ccc(Cl)cc1 Amb22736537 [1,1,0,0,0,0|2,0,0]=4 3687 B11R1.22 COC(=N)c1ccc(F)cc1 Amb18791533 [1,1,0,0,0,0|2,0,0]=4 3688 B11R1.22 COC(=N)c1ccc(N)cc1 Amb24096140 [1,1,0,0,0,0|2,0,0]=4 3689 B11R1.22 COC(=N)c1ccc(O)cc1 Amb18181685 [1,1,0,0,0,0|1,0,0]=3 3690 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb18182832 [1,1,0,0,0,0|1,0,1]=4 3691 B11R1.22 COC(=O)C1=CNC(=O)C=C1 Amb19372931 [1,1,0,0,0,0|1,0,1]=4 3692 B11R1.22 COC(=O)C1=COC(=O)C=C1 Amb18796753 [1,1,0,0,0,0|1,0,1]=4 3693 B11R1.22 COC(=O)C1C=CN(C)C=C1 Amb24099561 [1,1,0,0,0,0|1,0,1]=4 3694 B11R1.22 COC(=O)C=1C=CN(C)CC1 Amb24099559 [1,1,0,0,0,0|1,0,1]=4 3695 B11R1.22 COC(=O)N1C=CC(C)C=C1 Amb24060187 [1,1,0,0,0,0|1,0,1]=4 3696 B11R1.22 COC(=O)c1[n]cc(O)c[n]1 Amb25697454 [1,1,0,0,0,0|2,0,0]=4 3697 B11R1.22 COC(=O)c1c[n]c(O)[n]c1 Amb18125641 [1,1,0,0,0,0|2,0,0]=4 3698 B11R1.22 COC(=O)c1cc[n+](cc1)C Amb2502553 [1,1,0,0,0,0|1,0,0]=3 3699 B11R1.22 COC(=O)c1ccc(C)nn1 Amb17798484 [1,1,0,0,0,0|2,0,0]=4 3700 B11R1.22 COC(=O)c1ccc(Cl)c[n]1 Amb22751028 [1,1,0,0,0,0|2,0,0]=4 3701 B11R1.22 COC(=O)c1ccc(F)c[n]1 Amb19930069 [1,1,0,0,0,0|2,0,0]=4 3702 B11R1.22 COC(=O)c1ccc(I)[nH+]c1 Amb22474983 [1,1,0,0,0,0|2,0,0]=4 3703 B11R1.22 COC(=O)c1ccc(I)[n]c1 Amb22057831 [1,1,0,0,0,0|2,0,0]=4 3704 B11R1.22 COC(=O)c1ccc(N)[n]c1 Amb24066753 [1,1,0,0,0,0|2,0,0]=4 3705 B11R1.22 COC(=O)c1ccc(N)c[n]1 Amb22751029 [1,1,0,0,0,0|2,0,0]=4 3706 B11R1.22 COC(=O)c1ccc(O)[n][n]1 Amb21811761 [1,1,0,0,0,0|2,0,0]=4 3707 B11R1.22 COC(=O)c1ccc(S)[n]c1 Amb23446717 [1,1,0,0,0,0|1,1,0]=4 3708 B11R1.22 COC(=O)c1ccc(S)c[n]1 Amb25216569 [1,1,0,0,0,0|1,1,0]=4 3709 B11R1.22 COC(=O)c1ccc(cc1)Br Amb1394975 [1,1,0,0,0,0|1,0,0]=3 3710 B11R1.22 COC(=O)c1ccc(cc1)C Amb1210121 [1,1,0,0,0,0|0,0,0]=2 3711 B11R1.22 COC(=O)c1ccc(cc1)F Amb2227542 [1,1,0,0,0,0|1,0,0]=3 3712 B11R1.22 COC(=O)c1ccc(cc1)I Amb2411582 [1,1,0,0,0,0|1,0,0]=3 3713 B11R1.22 COC(=O)c1ccc(cc1)N Amb1215269 [1,1,0,0,0,0|1,0,0]=3 3714 B11R1.22 COC(=O)c1ccc(cn1)Cl Amb15695243 [1,1,0,0,0,0|2,0,0]=4 3715 B11R1.22 COC(=O)c1ccc(cn1)N Amb10603994 [1,1,0,0,0,0|2,0,0]=4 3716 B11R1.22 COC(=O)c1ccc(cn1)O Amb2236633 [1,1,0,0,0,0|1,0,0]=3 3717 B11R1.22 COC(=O)c1ccc(nc1)Cl Amb16207561 [1,1,0,0,0,0|2,0,0]=4 3718 B11R1.22 COC(=O)c1ccc(nc1)N Amb2413102 [1,1,0,0,0,0|2,0,0]=4 3719 B11R1.22 COC(=O)c1cnc(cn1)O Amb1093992 [1,1,0,0,0,0|2,0,0]=4 3720 B11R1.22 COC(=O)c1cnc(nc1)C Amb13892051 [1,1,0,0,0,0|2,0,0]=4 3721 B11R1.22 COC(=S)c1ccc(Br)cc1 Amb25288803 [1,1,0,0,0,0|1,1,0]=4 3722 B11R1.22 COC(=S)c1ccc(Cl)cc1 Amb25300049 [1,1,0,0,0,0|1,1,0]=4 3723 B11R1.22 COC(=S)c1ccc(N)cc1 Amb25758861 [1,1,0,0,0,0|1,1,0]=4 3724 B11R1.22 COC(C)c1ccc(O)cc1 Amb18644512 [1,1,0,0,0,0|0,0,2]=4 3725 B11R1.22 COC(O)c1ccc(O)cc1 Amb25714240 [1,1,0,0,0,0|0,0,2]=4 3726 B11R1.22 COP(=O)c1ccc(O)cc1 Amb25713698 [1,1,0,0,0,0|1,0,0]=3 3727 B11R1.22 COS(=O)c1ccc(cc1)Cl Amb10070067 [1,1,0,0,0,0|2,0,0]=4 3728 B11R1.22 CSC(=O)c1ccc(Cl)cc1 Amb25061919 [1,1,0,0,0,0|1,0,0]=3 3729 B11R1.22 C[C@@H](C=O)c1ccc(F)cc1 Amb24374733 [1,1,0,0,0,0|1,0,1]=4 3730 B11R1.22 C[C@@H](NO)c1ccc(O)cc1 Amb25151826 [1,1,0,0,0,0|0,0,2]=4 3731 B11R1.22 C[C@H](C=O)c1ccc(F)cc1 Amb24486078 [1,1,0,0,0,0|1,0,1]=4 3732 B11R1.22 C[C@H](CN)c1ccc(O)cc1 Amb24486024 [1,1,0,0,0,0|1,0,1]=4 3733 B11R1.22 C[n+]1ccc(cc1)C(=O)CN Amb25276869 [1,1,0,0,0,0|1,0,0]=3 3734 B11R1.22 C[n+]1ccc(cc1)C(=O)NC Amb22475467 [1,1,0,0,0,0|1,0,0]=3 3735 B11R1.22 C\C(=C/C)\c1ccc(N)cc1 Amb25834627 [1,1,0,0,0,0|2,0,0]=4 3736 B11R1.22 C\C(=C/C)\c1ccc(O)cc1 Amb25807631 [1,1,0,0,0,0|1,0,0]=3 3737 B11R1.22 C\C(=C\C)\c1ccc(N)cc1 Amb24574842 [1,1,0,0,0,0|2,0,0]=4 3738 B11R1.22 C\C(=C\Cl)\c1ccc(Cl)cc1 Amb25760820 [1,1,0,0,0,0|2,0,0]=4 3739 B11R1.22 C\C(=C\O)\c1ccc(Cl)cc1 Amb22499026 [1,1,0,0,0,0|1,0,1]=4 3740 B11R1.22 C\C(=N/N)\c1ccc(O)cc1 Amb24378459 [1,1,0,0,0,0|1,0,0]=3 3741 B11R1.22 C\C(=N\N)\c1ccc(Cl)cc1 Amb25130298 [1,1,0,0,0,0|2,0,0]=4 3742 B11R1.22 C\C(=N\N)\c1ccc(F)cc1 Amb25306186 [1,1,0,0,0,0|2,0,0]=4 3743 B11R1.22 C\C(=N\N)\c1ccc(N)cc1 Amb25687644 [1,1,0,0,0,0|2,0,0]=4 3744 B11R1.22 C\C(=N\O)\c1c[n]c(C)cc1 Amb25274407 [1,1,0,0,0,0|1,0,1]=4 3745 B11R1.22 C\C(=N\O)\c1ccc(Cl)cc1 Amb19767547 [1,1,0,0,0,0|1,0,1]=4 3746 B11R1.22 C\C(=N\O)\c1ccc(F)cc1 Amb22735392 [1,1,0,0,0,0|1,0,1]=4 3747 B11R1.22 C\C=C(/Cl)\c1ccc(O)cc1 Amb25371858 [1,1,0,0,0,0|1,0,0]=3 3748 B11R1.22 C\C=C(/O)\c1ccc(F)cc1 Amb24100278 [1,1,0,0,0,0|1,0,1]=4 3749 B11R1.22 C\C=C(\Cl)/c1ccc(O)cc1 Amb24697857 [1,1,0,0,0,0|1,0,0]=3 3750 B11R1.22 Cc1c[n]c([n]c1)C(=O)OC Amb22304676 [1,1,0,0,0,0|2,0,0]=4 3751 B11R1.22 Cc1c[n]c(c[n]1)C(=O)CC Amb24557354 [1,1,0,0,0,0|2,0,0]=4 3752 B11R1.22 Cc1c[n]c(c[n]1)C(=O)CN Amb25732061 [1,1,0,0,0,0|2,0,0]=4 3753 B11R1.22 Cc1c[n]c(c[n]1)C(=O)SC Amb24743703 [1,1,0,0,0,0|2,0,0]=4 3754 B11R1.22 Cc1ccc([n][n]1)C(=O)CBr Amb25223439 [1,1,0,0,0,0|2,0,0]=4 3755 B11R1.22 Cc1ccc([n][n]1)C(=O)CC Amb25376333 [1,1,0,0,0,0|2,0,0]=4 3756 B11R1.22 Cc1ccc([n]c1)C(=C)CO Amb25802855 [1,1,0,0,0,0|2,0,0]=4 3757 B11R1.22 Cc1ccc([n]c1)C(=N)OC Amb24475317 [1,1,0,0,0,0|2,0,0]=4 3758 B11R1.22 Cc1ccc([n]c1)C(=O)CBr Amb24053939 [1,1,0,0,0,0|1,0,0]=3 3759 B11R1.22 Cc1ccc([n]c1)C(=O)CC Amb22898827 [1,1,0,0,0,0|1,0,0]=3 3760 B11R1.22 Cc1ccc([n]c1)C(=O)CCl Amb25189273 [1,1,0,0,0,0|1,0,0]=3 3761 B11R1.22 Cc1ccc([n]c1)C(=O)NC Amb25151403 [1,1,0,0,0,0|1,0,0]=3 3762 B11R1.22 Cc1ccc([n]c1)C(=O)NN Amb25115894 [1,1,0,0,0,0|2,0,0]=4 3763 B11R1.22 Cc1ccc([n]c1)C(=O)NO Amb25115686 [1,1,0,0,0,0|2,0,0]=4 3764 B11R1.22 Cc1ccc([n]c1)C(=O)OC Amb19958650 [1,1,0,0,0,0|1,0,0]=3 3765 B11R1.22 Cc1ccc([n]c1)S(=O)CC Amb24584263 [1,1,0,0,0,0|2,0,0]=4 3766 B11R1.22 Cc1ccc(c[n]1)C(=O)CBr Amb22277086 [1,1,0,0,0,0|1,0,0]=3 3767 B11R1.22 Cc1ccc(c[n]1)C(=O)CCl Amb24104209 [1,1,0,0,0,0|1,0,0]=3 3768 B11R1.22 Cc1ccc(c[n]1)C(=O)NC Amb24072724 [1,1,0,0,0,0|1,0,0]=3 3769 B11R1.22 Cc1ccc(cc1)C(=C)CN Amb18124857 [1,1,0,0,0,0|1,0,0]=3 3770 B11R1.22 Cc1ccc(cc1)C(=N)NN Amb22231277 [1,1,0,0,0,0|2,0,0]=4 3771 B11R1.22 Cc1ccc(cc1)C(=N)OC Amb22269339 [1,1,0,0,0,0|1,0,0]=3 3772 B11R1.22 Cc1ccc(cc1)C(=O)C=C Amb18063916 [1,1,0,0,0,0|0,0,1]=3 3773 B11R1.22 Cc1ccc(cc1)C(=O)CF Amb24084136 [1,1,0,0,0,0|0,0,0]=2 3774 B11R1.22 Cc1ccc(cc1)C(=O)CN Amb22490690 [1,1,0,0,0,0|0,0,0]=2 3775 B11R1.22 Cc1ccc(cc1)C(=O)SC Amb25305675 [1,1,0,0,0,0|0,0,0]=2 3776 B11R1.22 Cc1ccc(cc1)C(=S)NC Amb24739783 [1,1,0,0,0,0|0,1,0]=3 3777 B11R1.22 Cc1ccc(cc1)C(=S)NN Amb25113387 [1,1,0,0,0,0|1,1,0]=4 3778 B11R1.22 Cc1ccc(cc1)C(Br)CO Amb25857366 [1,1,0,0,0,0|1,0,1]=4 3779 B11R1.22 Cc1ccc(cc1)C(C)CC Amb24064768 [1,1,0,0,0,0|1,0,1]=4 3780 B11R1.22 Cc1ccc(cc1)C(Cl)C=O Amb24557831 [1,1,0,0,0,0|1,0,1]=4 3781 B11R1.22 Cc1ccc(cc1)C(N)CF Amb25326298 [1,1,0,0,0,0|1,0,1]=4 3782 B11R1.22 Cc1ccc(cc1)C(O)CN Amb20668083 [1,1,0,0,0,0|0,0,2]=4 3783 B11R1.22 Cc1ccc(cc1)C(O)CO Amb18563446 [1,1,0,0,0,0|0,0,2]=4 3784 B11R1.22 Cc1ccc(cc1)N(C)C#N Amb24687585 [1,1,0,0,0,0|2,0,0]=4 3785 B11R1.22 Cc1ccc(cc1)N(C)C=O Amb24323385 [1,1,0,0,0,0|1,0,0]=3 3786 B11R1.22 Cc1ccc(cc1)N(C)CC Amb25189550 [1,1,0,0,0,0|2,0,0]=4 3787 B11R1.22 Cc1ccc(cc1)N(C)CO Amb25792347 [1,1,0,0,0,0|1,0,1]=4 3788 B11R1.22 Cc1ccc(cc1)N(N)CC Amb18799372 [1,1,0,0,0,0|2,0,0]=4 3789 B11R1.22 Cc1ccc(cc1)N(O)CC Amb24096604 [1,1,0,0,0,0|1,0,1]=4 3790 B11R1.22 Cc1ccc(cc1)S(=O)OC Amb22230928 [1,1,0,0,0,0|1,0,0]=3 3791 B11R1.22 Cc1ccc(cc1)[C@@H](C)CO Amb25847636 [1,1,0,0,0,0|0,0,2]=4 3792 B11R1.22 Cc1ccc(cc1)[C@@H](C)NO Amb25715423 [1,1,0,0,0,0|0,0,2]=4 3793 B11R1.22 Cc1ccc(cc1)[C@@H](N)CC Amb22288701 [1,1,0,0,0,0|1,0,1]=4 3794 B11R1.22 Cc1ccc(cc1)[C@@H](N)CO Amb22756871 [1,1,0,0,0,0|1,0,1]=4 3795 B11R1.22 Cc1ccc(cc1)[C@@H](O)C=O Amb24620161 [1,1,0,0,0,0|1,0,1]=4 3796 B11R1.22 Cc1ccc(cc1)[C@@H](O)CC Amb25289840 [1,1,0,0,0,0|0,0,2]=4 3797 B11R1.22 Cc1ccc(cc1)[C@@H](O)CN Amb24700467 [1,1,0,0,0,0|0,0,2]=4 3798 B11R1.22 Cc1ccc(cc1)[C@@H](O)CO Amb24486772 [1,1,0,0,0,0|0,0,2]=4 3799 B11R1.22 Cc1ccc(cc1)[C@H](C)CN Amb24622476 [1,1,0,0,0,0|1,0,1]=4 3800 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22284758 [1,1,0,0,0,0|1,0,1]=4 3801 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22288651 [1,1,0,0,0,0|1,0,1]=4 3802 B11R1.22 Cc1ccc(cc1)[C@H](N)CF Amb25121578 [1,1,0,0,0,0|1,0,1]=4 3803 B11R1.22 Cc1ccc(cc1)[C@H](N)CN Amb24674173 [1,1,0,0,0,0|1,0,1]=4 3804 B11R1.22 Cc1ccc(cc1)[C@H](N)CO Amb24453198 [1,1,0,0,0,0|1,0,1]=4 3805 B11R1.22 Cc1ccc(cc1)[C@H](O)C=O Amb25718968 [1,1,0,0,0,0|1,0,1]=4 3806 B11R1.22 Cc1ccc(cc1)[C@H](O)CBr Amb25276421 [1,1,0,0,0,0|0,0,2]=4 3807 B11R1.22 Cc1ccc(cc1)[C@H](O)CN Amb20241479 [1,1,0,0,0,0|0,0,2]=4 3808 B11R1.22 Cc1ccc(cc1)[C@H](O)CO Amb25140042 [1,1,0,0,0,0|0,0,2]=4 3809 B11R1.22 Cc1ccc(cc1)[S@@](=O)CF Amb24309140 [1,1,0,0,0,0|1,0,0]=3 3810 B11R1.22 Cc1ccc(cc1)\C(\N)=C\O Amb24698175 [1,1,0,0,0,0|1,0,1]=4 3811 B11R1.22 ClCC(=O)c1ccc(cc1)Br Amb1103620 [1,1,0,0,0,0|1,0,0]=3 3812 B11R1.22 ClCC(=O)c1ccc(cc1)C Amb1105496 [1,1,0,0,0,0|0,0,0]=2 3813 B11R1.22 ClCC(=O)c1ccc(cc1)F Amb1221364 [1,1,0,0,0,0|1,0,0]=3 3814 B11R1.22 ClCC(=O)c1ccc(cc1)O Amb1218323 [1,1,0,0,0,0|0,0,0]=2 3815 B11R1.22 ClCC(c1ccc(cc1)C)C Amb17232692 [1,1,0,0,0,0|1,0,1]=4 3816 B11R1.22 ClCC(c1ccc(cc1)C)O Amb17194483 [1,1,0,0,0,0|0,0,2]=4 3817 B11R1.22 ClCC(c1ccc(cc1)O)O Amb17594337 [1,1,0,0,0,0|0,0,2]=4 3818 B11R1.22 Clc1ccc(cc1)C(=O)C#N Amb17939433 [1,1,0,0,0,0|1,0,1]=4 3819 B11R1.22 FCC(=O)c1ccc(cc1)Cl Amb10603324 [1,1,0,0,0,0|1,0,0]=3 3820 B11R1.22 N#CC(=C)c1ccc(cc1)C Amb17231966 [1,1,0,0,0,0|1,0,1]=4 3821 B11R1.22 N#CC(=O)c1ccc(I)cc1 Amb22495535 [1,1,0,0,0,0|1,0,1]=4 3822 B11R1.22 N#CC(=O)c1ccc(O)cc1 Amb25842027 [1,1,0,0,0,0|0,0,1]=3 3823 B11R1.22 N#CC(=O)c1ccc(cc1)C Amb17231996 [1,1,0,0,0,0|0,0,1]=3 3824 B11R1.22 N#CC(=O)c1ccc(cc1)F Amb17232050 [1,1,0,0,0,0|1,0,1]=4 3825 B11R1.22 NC(=S=O)c1ccc(Cl)cc1 Amb24373813 [1,1,0,0,0,0|2,0,0]=4 3826 B11R1.22 NC(CO)c1ccc(O)cc1 Amb18951204 [1,1,0,0,0,0|1,0,1]=4 3827 B11R1.22 NCC(=N)c1ccc(O)cc1 Amb24102720 [1,1,0,0,0,0|1,0,0]=3 3828 B11R1.22 NCC(=O)c1ccc(Br)[n]c1 Amb25778172 [1,1,0,0,0,0|2,0,0]=4 3829 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb19884070 [1,1,0,0,0,0|1,0,0]=3 3830 B11R1.22 NCC(=O)c1ccc(F)[n]c1 Amb24106028 [1,1,0,0,0,0|2,0,0]=4 3831 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [1,1,0,0,0,0|1,0,0]=3 3832 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [1,1,0,0,0,0|0,0,0]=2 3833 B11R1.22 NCC(=O)c1ccc(S)cc1 Amb25082898 [1,1,0,0,0,0|0,1,0]=3 3834 B11R1.22 NCC(=O)c1ccc(cc1)Br Amb1811968 [1,1,0,0,0,0|1,0,0]=3 3835 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb1208662 [1,1,0,0,0,0|1,0,0]=3 3836 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb2370537 [1,1,0,0,0,0|1,0,0]=3 3837 B11R1.22 NCC(=O)c1ccc(cc1)F Amb1419069 [1,1,0,0,0,0|1,0,0]=3 3838 B11R1.22 NCC(=O)c1ccc(cc1)O Amb17593762 [1,1,0,0,0,0|0,0,0]=2 3839 B11R1.22 NCC(N)c1ccc(O)cc1 Amb24102625 [1,1,0,0,0,0|1,0,1]=4 3840 B11R1.22 NCC(c1ccc(cc1)C)O Amb1108558 [1,1,0,0,0,0|0,0,2]=4 3841 B11R1.22 NCC(c1ccc(cc1)O)O Amb1108209 [1,1,0,0,0,0|0,0,2]=4 3842 B11R1.22 NC[C@@H](O)c1ccc(O)cc1 Amb25027908 [1,1,0,0,0,0|0,0,2]=4 3843 B11R1.22 NC[C@H](N)c1ccc(O)cc1 Amb24411422 [1,1,0,0,0,0|1,0,1]=4 3844 B11R1.22 NNC(=N)c1ccc(O)cc1 Amb24070378 [1,1,0,0,0,0|2,0,0]=4 3845 B11R1.22 NNC(=O)c1ccc(O)[n]c1 Amb22736279 [1,1,0,0,0,0|2,0,0]=4 3846 B11R1.22 NNC(=O)c1ccc(S)cc1 Amb25228454 [1,1,0,0,0,0|1,1,0]=4 3847 B11R1.22 NNC(=O)c1ccc(cc1)Br Amb1207367 [1,1,0,0,0,0|2,0,0]=4 3848 B11R1.22 NNC(=O)c1ccc(cc1)Cl Amb1209335 [1,1,0,0,0,0|2,0,0]=4 3849 B11R1.22 NNC(=O)c1ccc(cc1)F Amb1104475 [1,1,0,0,0,0|2,0,0]=4 3850 B11R1.22 NNC(=O)c1ccc(cc1)I Amb1788092 [1,1,0,0,0,0|2,0,0]=4 3851 B11R1.22 NNC(=O)c1ccc(cc1)O Amb1212100 [1,1,0,0,0,0|1,0,0]=3 3852 B11R1.22 NNC(=O)c1ccc(nc1)C Amb1139431 [1,1,0,0,0,0|2,0,0]=4 3853 B11R1.22 NOC(=O)c1ccc(Cl)cc1 Amb24539350 [1,1,0,0,0,0|2,0,0]=4 3854 B11R1.22 NOC(c1ccc(cc1)C)C Amb17089186 [1,1,0,0,0,0|0,0,2]=4 3855 B11R1.22 N[C@@H](CO)c1ccc(O)cc1 Amb24103158 [1,1,0,0,0,0|1,0,1]=4 3856 B11R1.22 N[C@H](CF)c1ccc(O)cc1 Amb25049371 [1,1,0,0,0,0|1,0,1]=4 3857 B11R1.22 N[C@H](CO)c1ccc(O)cc1 Amb24103172 [1,1,0,0,0,0|1,0,1]=4 3858 B11R1.22 N\N=C(/S)\c1ccc(O)cc1 Amb25730305 [1,1,0,0,0,0|1,1,0]=4 3859 B11R1.22 N\N=C(/c1ccc(cc1)Br)\C Amb10552972 [1,1,0,0,0,0|2,0,0]=4 3860 B11R1.22 Nc1ccc(cc1)C(=O)C#N Amb24068507 [1,1,0,0,0,0|1,0,1]=4 3861 B11R1.22 Nc1ccc(cc1)C(=O)CI Amb25317674 [1,1,0,0,0,0|1,0,0]=3 3862 B11R1.22 Nc1ccc(cc1)C(=O)CN Amb24106018 [1,1,0,0,0,0|1,0,0]=3 3863 B11R1.22 Nc1ccc(cc1)C(=O)CS Amb25169304 [1,1,0,0,0,0|1,0,0]=3 3864 B11R1.22 Nc1ccc(cc1)C(=O)O[Na] Amb22338470 [1,1,0,0,0,0|2,0,0]=4 3865 B11R1.22 Nc1ccc(cc1)C(N)=S=O Amb25761374 [1,1,0,0,0,0|2,0,0]=4 3866 B11R1.22 O=C(CBr)c1ccc(Br)c[n]1 Amb22831861 [1,1,0,0,0,0|2,0,0]=4 3867 B11R1.22 O=C(CBr)c1ccc(Cl)[n]c1 Amb19944611 [1,1,0,0,0,0|2,0,0]=4 3868 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb21858525 [1,1,0,0,0,0|2,0,0]=4 3869 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb22001890 [1,1,0,0,0,0|2,0,0]=4 3870 B11R1.22 O=C(CBr)c1ccc(Cl)c[n]1 Amb22899199 [1,1,0,0,0,0|2,0,0]=4 3871 B11R1.22 O=C(CBr)c1ccc(F)[n]c1 Amb24104044 [1,1,0,0,0,0|2,0,0]=4 3872 B11R1.22 O=C(CBr)c1ccc(F)c[n]1 Amb23412381 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.22 O=C(CCl)c1ccc(Br)c[n]1 Amb24695456 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.22 O=C(CCl)c1ccc(Cl)[n]c1 Amb24104206 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.22 O=C(CCl)c1ccc(Cl)c[n]1 Amb24104200 [1,1,0,0,0,0|2,0,0]=4 3876 B11R1.22 O=C(CCl)c1ccc(F)[n]c1 Amb24104207 [1,1,0,0,0,0|2,0,0]=4 3877 B11R1.22 O=C(CF)c1ccc(F)cc1 Amb22490651 [1,1,0,0,0,0|1,0,0]=3 3878 B11R1.22 O=C(CI)c1ccc(Br)cc1 Amb23579956 [1,1,0,0,0,0|1,0,0]=3 3879 B11R1.22 O=C(CI)c1ccc(Cl)cc1 Amb23579973 [1,1,0,0,0,0|1,0,0]=3 3880 B11R1.22 O=C1C=CN(C=C1)C(=O)CCl Amb24062625 [1,1,0,0,0,0|1,0,1]=4 3881 B11R1.22 O=CC(=O)c1ccc(cc1)Br Amb10067934 [1,1,0,0,0,0|1,0,1]=4 3882 B11R1.22 O=CC(=O)c1ccc(cc1)C Amb10067935 [1,1,0,0,0,0|0,0,1]=3 3883 B11R1.22 O=CC(=O)c1ccc(cc1)Cl Amb10067933 [1,1,0,0,0,0|1,0,1]=4 3884 B11R1.22 O=CC(=O)c1ccc(cc1)O Amb10069044 [1,1,0,0,0,0|0,0,1]=3 3885 B11R1.22 O=CC(c1ccc(cc1)Br)C Amb17140753 [1,1,0,0,0,0|1,0,1]=4 3886 B11R1.22 O=CC(c1ccc(cc1)C)C Amb10844730 [1,1,0,0,0,0|0,0,1]=3 3887 B11R1.22 O=CC(c1ccc(cc1)Cl)C Amb17138645 [1,1,0,0,0,0|1,0,1]=4 3888 B11R1.22 O=CC(c1ccc(cc1)F)C Amb17138438 [1,1,0,0,0,0|1,0,1]=4 3889 B11R1.22 OCC(=O)c1ccc(Cl)[n]c1 Amb25798404 [1,1,0,0,0,0|2,0,0]=4 3890 B11R1.22 OCC(c1ccc(cc1)C)C Amb17232071 [1,1,0,0,0,0|0,0,2]=4 3891 B11R1.22 OCC(c1ccc(cc1)C)N Amb2236213 [1,1,0,0,0,0|1,0,1]=4 3892 B11R1.22 ONC(c1ccc(cc1)C)C Amb17089203 [1,1,0,0,0,0|0,0,2]=4 3893 B11R1.22 O\N=C(\c1ccc(cc1)C)/Cl Amb10569879 [1,1,0,0,0,0|1,0,1]=4 3894 B11R1.22 O\N=C(\c1ccc(cc1)Cl)/C Amb2423966 [1,1,0,0,0,0|1,0,1]=4 3895 B11R1.22 O\N=C(\c1ccc(cc1)O)/N Amb1156668 [1,1,0,0,0,0|1,0,1]=4 3896 B11R1.22 Oc1ccc(cc1)C(=O)CF Amb24084117 [1,1,0,0,0,0|0,0,0]=2 3897 B11R1.22 Oc1ccc(cc1)C(=O)CS Amb24486187 [1,1,0,0,0,0|0,0,0]=2 3898 B11R1.22 Oc1ccc(cc1)C(O)C=O Amb18125348 [1,1,0,0,0,0|1,0,1]=4 3899 B11R1.22 Oc1ccc(cc1)C(O)CF Amb24564100 [1,1,0,0,0,0|0,0,2]=4 3900 B11R1.22 Oc1ccc(cc1)C(O)CO Amb18644612 [1,1,0,0,0,0|0,0,2]=4 3901 B11R1.22 Oc1ccc(cc1)N(O)N=O Amb25713021 [1,1,0,0,0,0|2,0,0]=4 3902 B11R1.22 Oc1ccc(cc1)[C@H](O)CO Amb25335306 [1,1,0,0,0,0|0,0,2]=4 3903 B11R1.22 SCC(=O)c1ccc(cc1)Br Amb17407556 [1,1,0,0,0,0|1,0,0]=3 3904 B11R1.22 SCC(=O)c1ccc(cc1)C Amb17400215 [1,1,0,0,0,0|0,0,0]=2 3905 B11R1.22 SCC(=O)c1ccc(cc1)Cl Amb17401093 [1,1,0,0,0,0|1,0,0]=3 3906 B11R1.22 SCC(=O)c1ccc(cc1)F Amb17400324 [1,1,0,0,0,0|1,0,0]=3 3907 B11R1.22 [15NH2][13CH2][13CH](c1ccc(cc1)O)O Amb17618816 [1,1,0,0,0,0|0,0,2]=4 3908 B11R1.22 [NH3+]CC(=O)c1ccc(Br)cc1 Amb24113825 [1,1,0,0,0,0|1,0,0]=3 3909 B11R1.22 [NH3+]CC(=O)c1ccc(cc1)C Amb10606218 [1,1,0,0,0,0|0,0,0]=2 3910 B11R1.166 Brc1ccc(c(c1)Br)C(=O)C Amb1206776 [1,1,0,0,0,0|1,0,0]=3 3911 B11R1.166 Brc1ccc(c(c1)Br)C(=O)O Amb10069353 [1,1,0,0,0,0|2,0,0]=4 3912 B11R1.166 Brc1ccc(c(c1)C)C(=O)C Amb17339932 [1,1,0,0,0,0|1,0,0]=3 3913 B11R1.166 Brc1ccc(c(c1)F)C(=O)C Amb16185897 [1,1,0,0,0,0|1,0,0]=3 3914 B11R1.166 Brc1ccc(c(c1)F)C(=O)O Amb1229903 [1,1,0,0,0,0|2,0,0]=4 3915 B11R1.166 Brc1ccc(c(c1)I)C(=O)O Amb16231633 [1,1,0,0,0,0|2,0,0]=4 3916 B11R1.166 Brc1ccc(c(c1)N)C(=O)N Amb10240730 [1,1,0,0,0,0|2,0,0]=4 3917 B11R1.166 Brc1ccc(c(c1)O)C(=O)C Amb2508446 [1,1,0,0,0,0|1,0,0]=3 3918 B11R1.166 Brc1cnc(c(c1)F)C(=O)C Amb13889734 [1,1,0,0,0,0|2,0,0]=4 3919 B11R1.166 CC(=C)c1ccc(Br)cc1F Amb24422998 [1,1,0,0,0,0|2,0,0]=4 3920 B11R1.166 CC(=C)c1ccc(Cl)cc1Cl Amb25336900 [1,1,0,0,0,0|2,0,0]=4 3921 B11R1.166 CC(=C)c1ccc(F)cc1F Amb22228333 [1,1,0,0,0,0|2,0,0]=4 3922 B11R1.166 CC(=C)c1ccc(F)cc1N Amb25046860 [1,1,0,0,0,0|2,0,0]=4 3923 B11R1.166 CC(=N)c1ccc(Br)cc1O Amb25830552 [1,1,0,0,0,0|2,0,0]=4 3924 B11R1.166 CC(=O)C1=CC=C(C)NC1=O Amb18538199 [1,1,0,0,0,0|1,0,0]=3 3925 B11R1.166 CC(=O)C1=CNC(=O)C=C1C Amb24452481 [1,1,0,0,0,0|1,0,1]=4 3926 B11R1.166 CC(=O)C=1C=CC(=O)NC1C Amb21927044 [1,1,0,0,0,0|1,0,1]=4 3927 B11R1.166 CC(=O)c1[n]cc(Br)cc1Cl Amb25040649 [1,1,0,0,0,0|2,0,0]=4 3928 B11R1.166 CC(=O)c1[n]cc(Br)cc1N Amb23399911 [1,1,0,0,0,0|2,0,0]=4 3929 B11R1.166 CC(=O)c1[n]cc(Br)cc1O Amb21964926 [1,1,0,0,0,0|2,0,0]=4 3930 B11R1.166 CC(=O)c1[n]cc(Cl)cc1Br Amb24056416 [1,1,0,0,0,0|2,0,0]=4 3931 B11R1.166 CC(=O)c1[n]cc(Cl)cc1Cl Amb22001781 [1,1,0,0,0,0|2,0,0]=4 3932 B11R1.166 CC(=O)c1[n]cc(Cl)cc1F Amb22491644 [1,1,0,0,0,0|2,0,0]=4 3933 B11R1.166 CC(=O)c1[n]cc(Cl)cc1O Amb23401608 [1,1,0,0,0,0|2,0,0]=4 3934 B11R1.166 CC(=O)c1[n]cc(F)cc1Cl Amb24077365 [1,1,0,0,0,0|2,0,0]=4 3935 B11R1.166 CC(=O)c1[n]cc(F)cc1F Amb20242308 [1,1,0,0,0,0|2,0,0]=4 3936 B11R1.166 CC(=O)c1[n]cc(F)cc1O Amb25172783 [1,1,0,0,0,0|2,0,0]=4 3937 B11R1.166 CC(=O)c1[n]cc(O)cc1Br Amb23400097 [1,1,0,0,0,0|1,0,0]=3 3938 B11R1.166 CC(=O)c1[n]cc(O)cc1Cl Amb23401611 [1,1,0,0,0,0|1,0,0]=3 3939 B11R1.166 CC(=O)c1c[n]c(Br)cc1Cl Amb24441703 [1,1,0,0,0,0|2,0,0]=4 3940 B11R1.166 CC(=O)c1c[n]c(Cl)cc1Cl Amb21927452 [1,1,0,0,0,0|2,0,0]=4 3941 B11R1.166 CC(=O)c1c[n]c(F)cc1Cl Amb24601332 [1,1,0,0,0,0|2,0,0]=4 3942 B11R1.166 CC(=O)c1c[n]c(N)cc1N Amb25719758 [1,1,0,0,0,0|2,0,0]=4 3943 B11R1.166 CC(=O)c1c[n]c(N)cc1O Amb24528942 [1,1,0,0,0,0|2,0,0]=4 3944 B11R1.166 CC(=O)c1ccc(Br)[n]c1Br Amb22495298 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.166 CC(=O)c1ccc(Br)[n]c1O Amb25329552 [1,1,0,0,0,0|2,0,0]=4 3946 B11R1.166 CC(=O)c1ccc(Br)cc1N Amb19958083 [1,1,0,0,0,0|1,0,0]=3 3947 B11R1.166 CC(=O)c1ccc(Br)cc1N Amb22273991 [1,1,0,0,0,0|1,0,0]=3 3948 B11R1.166 CC(=O)c1ccc(Cl)[n]c1Cl Amb19957975 [1,1,0,0,0,0|2,0,0]=4 3949 B11R1.166 CC(=O)c1ccc(Cl)cc1N Amb22490706 [1,1,0,0,0,0|1,0,0]=3 3950 B11R1.166 CC(=O)c1ccc(Cl)cc1N Amb22498971 [1,1,0,0,0,0|1,0,0]=3 3951 B11R1.166 CC(=O)c1ccc(F)[n]c1F Amb20241728 [1,1,0,0,0,0|2,0,0]=4 3952 B11R1.166 CC(=O)c1ccc(F)cc1S Amb24737422 [1,1,0,0,0,0|1,0,0]=3 3953 B11R1.166 CC(=O)c1ccc(I)cc1Br Amb24638912 [1,1,0,0,0,0|1,0,0]=3 3954 B11R1.166 CC(=O)c1ccc(I)cc1F Amb24727241 [1,1,0,0,0,0|1,0,0]=3 3955 B11R1.166 CC(=O)c1ccc(I)cc1N Amb22498970 [1,1,0,0,0,0|1,0,0]=3 3956 B11R1.166 CC(=O)c1ccc(I)cc1O Amb22001987 [1,1,0,0,0,0|1,0,0]=3 3957 B11R1.166 CC(=O)c1ccc(N)[n]c1O Amb24367745 [1,1,0,0,0,0|2,0,0]=4 3958 B11R1.166 CC(=O)c1ccc(N)cc1Br Amb25296862 [1,1,0,0,0,0|1,0,0]=3 3959 B11R1.166 CC(=O)c1ccc(N)cc1Cl Amb18126635 [1,1,0,0,0,0|1,0,0]=3 3960 B11R1.166 CC(=O)c1ccc(N)cc1F Amb22232886 [1,1,0,0,0,0|1,0,0]=3 3961 B11R1.166 CC(=O)c1ccc(O)[n]c1O Amb18644551 [1,1,0,0,0,0|1,0,0]=3 3962 B11R1.166 CC(=O)c1ccc(O)cc1N Amb24061068 [1,1,0,0,0,0|0,0,0]=2 3963 B11R1.166 CC(=O)c1ccc(S)cc1O Amb18646985 [1,1,0,0,0,0|0,1,0]=3 3964 B11R1.166 CC(C)c1ccc(O)cc1Br Amb25212334 [1,1,0,0,0,0|1,0,1]=4 3965 B11R1.166 CC(C)c1ccc(O)cc1F Amb24102170 [1,1,0,0,0,0|1,0,1]=4 3966 B11R1.166 CC(F)c1ccc(O)cc1Br Amb25195052 [1,1,0,0,0,0|1,0,1]=4 3967 B11R1.166 CC(N)c1ccc(O)cc1Br Amb25104337 [1,1,0,0,0,0|1,0,1]=4 3968 B11R1.166 CC(N)c1ccc(O)cc1Cl Amb18553697 [1,1,0,0,0,0|1,0,1]=4 3969 B11R1.166 CC(N)c1ccc(O)cc1F Amb24655802 [1,1,0,0,0,0|1,0,1]=4 3970 B11R1.166 CC(N)c1ccc(O)cc1I Amb25147942 [1,1,0,0,0,0|1,0,1]=4 3971 B11R1.166 CC(O)c1ccc(O)cc1Cl Amb18556158 [1,1,0,0,0,0|0,0,2]=4 3972 B11R1.166 CC(O)c1ccc(O)cc1F Amb24102161 [1,1,0,0,0,0|0,0,2]=4 3973 B11R1.166 CC(S)c1ccc(O)cc1F Amb25303310 [1,1,0,0,0,0|0,1,1]=4 3974 B11R1.166 CC1=CC(=O)C(=CN1)C(N)=O Amb24763810 [1,1,0,0,0,0|2,0,0]=4 3975 B11R1.166 CC1=CC(=O)C(=CN1)C(O)=O Amb19516671 [1,1,0,0,0,0|2,0,0]=4 3976 B11R1.166 CC1=CC(=O)C(=CN1)C(O)=O Amb22499681 [1,1,0,0,0,0|2,0,0]=4 3977 B11R1.166 CC1=CC=C(C(=O)Cl)C(=O)O1 Amb25248557 [1,1,0,0,0,0|2,0,0]=4 3978 B11R1.166 CC1=CC=C(C(=S)N1)C(C)=O Amb24087719 [1,1,0,0,0,0|1,0,0]=3 3979 B11R1.166 CC1=CC=C(C(O)=O)C(=O)N1 Amb18529760 [1,1,0,0,0,0|2,0,0]=4 3980 B11R1.166 CC1=CC=C(C(O)=O)C(=S)N1 Amb19747249 [1,1,0,0,0,0|2,0,0]=4 3981 B11R1.166 CC=1C=C\C(\C(=O)C1)=C(/C)\N Amb24538266 [1,1,0,0,0,0|1,0,0]=3 3982 B11R1.166 CC=1OC(C)C=CC1C(C)=O Amb25358881 [1,1,0,0,0,0|1,0,1]=4 3983 B11R1.166 CN(C)c1ccc(O)cc1Br Amb25324880 [1,1,0,0,0,0|2,0,0]=4 3984 B11R1.166 CN(C)c1ccc(O)cc1Cl Amb23402111 [1,1,0,0,0,0|2,0,0]=4 3985 B11R1.166 CS(=O)c1ccc(Cl)cc1Cl Amb24080291 [1,1,0,0,0,0|2,0,0]=4 3986 B11R1.166 CS(=O)c1ccc(Cl)cc1N Amb24692800 [1,1,0,0,0,0|2,0,0]=4 3987 B11R1.166 CS(=O)c1ccc(F)cc1F Amb19892220 [1,1,0,0,0,0|2,0,0]=4 3988 B11R1.166 CS(=O)c1ccc(N)cc1Cl Amb25691050 [1,1,0,0,0,0|2,0,0]=4 3989 B11R1.166 CS(=O)c1ccc(N)cc1F Amb19148840 [1,1,0,0,0,0|2,0,0]=4 3990 B11R1.166 CS(=O)c1ccc(O)cc1Cl Amb24670137 [1,1,0,0,0,0|1,0,0]=3 3991 B11R1.166 CS(=O)c1ccc(O)cc1F Amb21858479 [1,1,0,0,0,0|1,0,0]=3 3992 B11R1.166 C[C@@H](N)c1ccc(O)cc1Br Amb25703938 [1,1,0,0,0,0|1,0,1]=4 3993 B11R1.166 C[C@@H](N)c1ccc(O)cc1Cl Amb25733762 [1,1,0,0,0,0|1,0,1]=4 3994 B11R1.166 C[C@@H](N)c1ccc(O)cc1N Amb25791010 [1,1,0,0,0,0|1,0,1]=4 3995 B11R1.166 C[C@@H](O)c1ccc(O)cc1F Amb24643081 [1,1,0,0,0,0|0,0,2]=4 3996 B11R1.166 C[C@H](N)c1ccc(O)cc1Br Amb24465413 [1,1,0,0,0,0|1,0,1]=4 3997 B11R1.166 C[C@H](N)c1ccc(O)cc1Cl Amb24469695 [1,1,0,0,0,0|1,0,1]=4 3998 B11R1.166 C[C@H](N)c1ccc(O)cc1I Amb25771940 [1,1,0,0,0,0|1,0,1]=4 3999 B11R1.166 C[C@H](N)c1ccc(O)cc1O Amb25328148 [1,1,0,0,0,0|1,0,1]=4 4000 B11R1.166 C[C@H](O)c1ccc(O)cc1F Amb25148125 [1,1,0,0,0,0|0,0,2]=4 4001 B11R1.166 C[C@H](O)c1ccc(O)cc1O Amb24485881 [1,1,0,0,0,0|0,0,2]=4 4002 B11R1.166 C[S+](C)c1ccc(O)cc1O Amb19928694 [1,1,0,0,0,0|2,0,0]=4 4003 B11R1.166 Cc1[n]c(Br)ccc1C(C)=O Amb25278350 [1,1,0,0,0,0|2,0,0]=4 4004 B11R1.166 Cc1[n]c(O)ccc1C(N)=O Amb24685653 [1,1,0,0,0,0|2,0,0]=4 4005 B11R1.166 Cc1[n]c(O)ccc1C(O)=O Amb18125514 [1,1,0,0,0,0|2,0,0]=4 4006 B11R1.166 Cc1[n]cc(C(C)=O)c(C)[n]1 Amb18181667 [1,1,0,0,0,0|2,0,0]=4 4007 B11R1.166 Cc1[n]cc(c(Cl)[n]1)C(C)=O Amb25126054 [1,1,0,0,0,0|2,0,0]=4 4008 B11R1.166 Cc1c[n]c(C(=O)Cl)c(C)c1 Amb25368335 [1,1,0,0,0,0|2,0,0]=4 4009 B11R1.166 Cc1c[n]c(C(C)=O)c(C)c1 Amb25028058 [1,1,0,0,0,0|1,0,0]=3 4010 B11R1.166 Cc1c[n]c(C(N)=O)c(C)c1 Amb24085560 [1,1,0,0,0,0|2,0,0]=4 4011 B11R1.166 Cc1c[n]c(C(N)=O)c(O)c1 Amb23403496 [1,1,0,0,0,0|2,0,0]=4 4012 B11R1.166 Cc1c[n]c(C(O)=O)c(Br)c1 Amb19895186 [1,1,0,0,0,0|2,0,0]=4 4013 B11R1.166 Cc1c[n]c(C(O)=O)c(C)c1 Amb19895227 [1,1,0,0,0,0|2,0,0]=4 4014 B11R1.166 Cc1c[n]c(C(O)=O)c(Cl)c1 Amb22043861 [1,1,0,0,0,0|2,0,0]=4 4015 B11R1.166 Cc1c[n]c(C(O)=O)c(F)c1 Amb22491025 [1,1,0,0,0,0|2,0,0]=4 4016 B11R1.166 Cc1c[n]c(c(F)c1)C(C)=O Amb24665729 [1,1,0,0,0,0|1,0,0]=3 4017 B11R1.166 Cc1c[n]c(c(N)c1)C(O)=O Amb24691597 [1,1,0,0,0,0|2,0,0]=4 4018 B11R1.166 Cc1c[n]c(c(O)c1)C(C)=O Amb23437583 [1,1,0,0,0,0|1,0,0]=3 4019 B11R1.166 Cc1cc(=O)c(c[nH]1)C(=O)O Amb10603774 [1,1,0,0,0,0|2,0,0]=4 4020 B11R1.166 Cc1cc(Br)c(c[n]1)C(N)=O Amb25092351 [1,1,0,0,0,0|2,0,0]=4 4021 B11R1.166 Cc1cc(Br)c(c[n]1)C(O)=O Amb22494598 [1,1,0,0,0,0|2,0,0]=4 4022 B11R1.166 Cc1cc(Br)c[n]c1C(C)=O Amb22499353 [1,1,0,0,0,0|2,0,0]=4 4023 B11R1.166 Cc1cc(C)c(c[n]1)C(O)=O Amb21960081 [1,1,0,0,0,0|2,0,0]=4 4024 B11R1.166 Cc1cc(C)c(cc1)C(C)=C Amb21960893 [1,1,0,0,0,0|1,0,0]=3 4025 B11R1.166 Cc1cc(C)c(cc1)C(C)C Amb25212578 [1,1,0,0,0,0|1,0,1]=4 4026 B11R1.166 Cc1cc(C)c(cc1)N(=O)=O Amb20621126 [1,1,0,0,0,0|2,0,0]=4 4027 B11R1.166 Cc1cc(C)c(cc1)S(=O)Cl Amb18066212 [1,1,0,0,0,0|2,0,0]=4 4028 B11R1.166 Cc1cc(C)c(cc1)S(C)=O Amb25358551 [1,1,0,0,0,0|1,0,0]=3 4029 B11R1.166 Cc1cc(C)c(cc1)S(O)=O Amb18563920 [1,1,0,0,0,0|2,0,0]=4 4030 B11R1.166 Cc1cc(C)c(cc1)S([O-])=O Amb24386169 [1,1,0,0,0,0|2,0,0]=4 4031 B11R1.166 Cc1cc(C)c(cc1)[C@@H](C)N Amb19372884 [1,1,0,0,0,0|1,0,1]=4 4032 B11R1.166 Cc1cc(C)ccc1C(N)=N Amb22732694 [1,1,0,0,0,0|2,0,0]=4 4033 B11R1.166 Cc1cc(Cl)c([n]c1)C(=O)Cl Amb25707889 [1,1,0,0,0,0|2,0,0]=4 4034 B11R1.166 Cc1cc(Cl)c(c[n]1)C(=O)Cl Amb24487672 [1,1,0,0,0,0|2,0,0]=4 4035 B11R1.166 Cc1cc(Cl)c(c[n]1)C(N)=O Amb23592239 [1,1,0,0,0,0|2,0,0]=4 4036 B11R1.166 Cc1cc(Cl)c(c[n]1)C([O-])=O Amb20247083 [1,1,0,0,0,0|2,0,0]=4 4037 B11R1.166 Cc1cc(Cl)c(cn1)C(=O)O Amb10602695 [1,1,0,0,0,0|2,0,0]=4 4038 B11R1.166 Cc1cc(Cl)ccc1C(=O)Cl Amb19888087 [1,1,0,0,0,0|2,0,0]=4 4039 B11R1.166 Cc1cc(Cl)ccc1C(=O)F Amb25114726 [1,1,0,0,0,0|2,0,0]=4 4040 B11R1.166 Cc1cc(F)c(c[n]1)C(C)=O Amb25714637 [1,1,0,0,0,0|1,0,0]=3 4041 B11R1.166 Cc1cc(F)c(c[n]1)C(O)=O Amb22235367 [1,1,0,0,0,0|2,0,0]=4 4042 B11R1.166 Cc1cc(F)ccc1C(C)=O Amb18796669 [1,1,0,0,0,0|1,0,0]=3 4043 B11R1.166 Cc1cc(F)ccc1C(N)=O Amb22738269 [1,1,0,0,0,0|2,0,0]=4 4044 B11R1.166 Cc1cc(I)ccc1C(=O)Cl Amb24668883 [1,1,0,0,0,0|2,0,0]=4 4045 B11R1.166 Cc1cc(I)ccc1C(N)=O Amb25040087 [1,1,0,0,0,0|2,0,0]=4 4046 B11R1.166 Cc1cc(I)ccc1C(O)=O Amb22756850 [1,1,0,0,0,0|2,0,0]=4 4047 B11R1.166 Cc1cc(N)c(c[n]1)C(C)=O Amb21963704 [1,1,0,0,0,0|1,0,0]=3 4048 B11R1.166 Cc1cc(N)c(c[n]1)C(N)=O Amb24655446 [1,1,0,0,0,0|2,0,0]=4 4049 B11R1.166 Cc1cc(N)c(cc1)C(N)=S Amb18946990 [1,1,0,0,0,0|1,1,0]=4 4050 B11R1.166 Cc1cc(N)c(cn1)C(=O)O Amb10602601 [1,1,0,0,0,0|2,0,0]=4 4051 B11R1.166 Cc1cc(N)ccc1C(=O)Cl Amb24091207 [1,1,0,0,0,0|2,0,0]=4 4052 B11R1.166 Cc1cc(N)ccc1C(C)=O Amb18124992 [1,1,0,0,0,0|1,0,0]=3 4053 B11R1.166 Cc1cc(N)ccc1C(N)=O Amb18279467 [1,1,0,0,0,0|2,0,0]=4 4054 B11R1.166 Cc1cc(O)c([n]c1)C(O)=O Amb23400039 [1,1,0,0,0,0|2,0,0]=4 4055 B11R1.166 Cc1cc(O)c(c[n]1)C(=O)Cl Amb24070375 [1,1,0,0,0,0|2,0,0]=4 4056 B11R1.166 Cc1cc(O)c(c[n]1)C(C)=O Amb18201735 [1,1,0,0,0,0|1,0,0]=3 4057 B11R1.166 Cc1cc(O)c[n]c1C(C)=O Amb23403508 [1,1,0,0,0,0|1,0,0]=3 4058 B11R1.166 Cc1cc(O)c[n]c1C(N)=O Amb23403507 [1,1,0,0,0,0|2,0,0]=4 4059 B11R1.166 Cc1cc(O)c[n]c1C(O)=O Amb23437564 [1,1,0,0,0,0|2,0,0]=4 4060 B11R1.166 Cc1cc(O)ccc1C(C)N Amb18055434 [1,1,0,0,0,0|1,0,1]=4 4061 B11R1.166 Cc1cc(O)ccc1C(C)O Amb18055440 [1,1,0,0,0,0|0,0,2]=4 4062 B11R1.166 Cc1cc(O)ccc1C(N)=O Amb18554169 [1,1,0,0,0,0|1,0,0]=3 4063 B11R1.166 Cc1cc(O)ccc1N(=O)=O Amb20621850 [1,1,0,0,0,0|2,0,0]=4 4064 B11R1.166 Cc1cc(O)ccc1S(C)=O Amb24102404 [1,1,0,0,0,0|1,0,0]=3 4065 B11R1.166 Cc1cc(O)ccc1[S+](C)C Amb25035034 [1,1,0,0,0,0|2,0,0]=4 4066 B11R1.166 Cc1cc(S)c(c[n]1)C(O)=O Amb24350933 [1,1,0,0,0,0|2,0,0]=4 4067 B11R1.166 Cc1cc(S)ccc1C(C)=O Amb25059694 [1,1,0,0,0,0|0,1,0]=3 4068 B11R1.166 Cc1ccc(C(=O)Cl)c(=O)[nH]1 Amb24091826 [1,1,0,0,0,0|2,0,0]=4 4069 B11R1.166 Cc1ccc(C(=O)Cl)c(Br)c1 Amb19891062 [1,1,0,0,0,0|1,0,0]=3 4070 B11R1.166 Cc1ccc(C(=O)Cl)c(C)[n]1 Amb18948434 [1,1,0,0,0,0|2,0,0]=4 4071 B11R1.166 Cc1ccc(C(=O)Cl)c(Cl)[n]1 Amb22043442 [1,1,0,0,0,0|2,0,0]=4 4072 B11R1.166 Cc1ccc(C(=O)Cl)c(F)c1 Amb19890528 [1,1,0,0,0,0|1,0,0]=3 4073 B11R1.166 Cc1ccc(C(C)Br)c(Cl)c1 Amb25047751 [1,1,0,0,0,0|1,0,1]=4 4074 B11R1.166 Cc1ccc(C(C)C)c(N)c1 Amb24680909 [1,1,0,0,0,0|1,0,1]=4 4075 B11R1.166 Cc1ccc(C(C)C)c(S)c1 Amb25719527 [1,1,0,0,0,0|1,0,1]=4 4076 B11R1.166 Cc1ccc(C(C)N)c(Cl)c1 Amb25857864 [1,1,0,0,0,0|1,0,1]=4 4077 B11R1.166 Cc1ccc(C(C)N)c(N)c1 Amb25189267 [1,1,0,0,0,0|1,0,1]=4 4078 B11R1.166 Cc1ccc(C(C)O)c(Cl)c1 Amb24453472 [1,1,0,0,0,0|0,0,2]=4 4079 B11R1.166 Cc1ccc(C(Cl)=O)c(C)c1 Amb17773436 [1,1,0,0,0,0|1,0,0]=3 4080 B11R1.166 Cc1ccc(C(N)=N)c(Cl)c1 Amb22756244 [1,1,0,0,0,0|2,0,0]=4 4081 B11R1.166 Cc1ccc(C(N)=N)c(Cl)c1 Amb22831355 [1,1,0,0,0,0|2,0,0]=4 4082 B11R1.166 Cc1ccc(C(N)=N)c(O)c1 Amb18796633 [1,1,0,0,0,0|2,0,0]=4 4083 B11R1.166 Cc1ccc(C(N)=O)c(Cl)c1 Amb19531831 [1,1,0,0,0,0|1,0,0]=3 4084 B11R1.166 Cc1ccc(C(N)=O)c(F)c1 Amb20667845 [1,1,0,0,0,0|1,0,0]=3 4085 B11R1.166 Cc1ccc(C(N)=O)c(I)c1 Amb23001182 [1,1,0,0,0,0|1,0,0]=3 4086 B11R1.166 Cc1ccc(C(N)=O)c(O)[n]1 Amb18125360 [1,1,0,0,0,0|2,0,0]=4 4087 B11R1.166 Cc1ccc(C(N)=S)c(Br)c1 Amb19889455 [1,1,0,0,0,0|1,1,0]=4 4088 B11R1.166 Cc1ccc(C(N)=S)c(F)c1 Amb18183550 [1,1,0,0,0,0|1,1,0]=4 4089 B11R1.166 Cc1ccc(C(N)=S)c(O)c1 Amb18182648 [1,1,0,0,0,0|1,1,0]=4 4090 B11R1.166 Cc1ccc(C(O)=O)c(Br)[n]1 Amb22752846 [1,1,0,0,0,0|2,0,0]=4 4091 B11R1.166 Cc1ccc(C(O)=O)c(Cl)[n]1 Amb22475149 [1,1,0,0,0,0|2,0,0]=4 4092 B11R1.166 Cc1ccc(C(O)=O)c(F)[n]1 Amb24423018 [1,1,0,0,0,0|2,0,0]=4 4093 B11R1.166 Cc1ccc(C(O)=O)c(S)c1 Amb18948052 [1,1,0,0,0,0|1,0,0]=3 4094 B11R1.166 Cc1ccc([C@@H](C)N)c(Br)c1 Amb24451758 [1,1,0,0,0,0|1,0,1]=4 4095 B11R1.166 Cc1ccc([C@@H](C)N)c(Cl)c1 Amb25145705 [1,1,0,0,0,0|1,0,1]=4 4096 B11R1.166 Cc1ccc([C@@H](C)N)c(F)c1 Amb25847232 [1,1,0,0,0,0|1,0,1]=4 4097 B11R1.166 Cc1ccc([C@@H](C)N)c(N)c1 Amb25189299 [1,1,0,0,0,0|1,0,1]=4 4098 B11R1.166 Cc1ccc([C@@H](C)O)c(Br)c1 Amb25100392 [1,1,0,0,0,0|0,0,2]=4 4099 B11R1.166 Cc1ccc([C@@H](C)O)c(F)c1 Amb25040125 [1,1,0,0,0,0|0,0,2]=4 4100 B11R1.166 Cc1ccc([C@@H](C)O)c(O)c1 Amb25135778 [1,1,0,0,0,0|0,0,2]=4 4101 B11R1.166 Cc1ccc([C@H](C)N)c(N)c1 Amb25330871 [1,1,0,0,0,0|1,0,1]=4 4102 B11R1.166 Cc1ccc([C@H](C)O)c(Br)c1 Amb25188633 [1,1,0,0,0,0|0,0,2]=4 4103 B11R1.166 Cc1ccc([C@H](C)O)c(F)c1 Amb25118654 [1,1,0,0,0,0|0,0,2]=4 4104 B11R1.166 Cc1ccc([C@H](C)O)c(O)c1 Amb25191267 [1,1,0,0,0,0|0,0,2]=4 4105 B11R1.166 Cc1ccc(c(Br)c1)S(O)=O Amb24590732 [1,1,0,0,0,0|2,0,0]=4 4106 B11R1.166 Cc1ccc(c(Br)c1)S([O-])=O Amb25292073 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.166 Cc1ccc(c(Cl)[n]1)C(C)=O Amb22750725 [1,1,0,0,0,0|1,0,0]=3 4108 B11R1.166 Cc1ccc(c(Cl)c1)C(C)=O Amb25151553 [1,1,0,0,0,0|0,0,0]=2 4109 B11R1.166 Cc1ccc(c(Cl)c1)N(=O)=O Amb20620833 [1,1,0,0,0,0|2,0,0]=4 4110 B11R1.166 Cc1ccc(c(Cl)c1)S(O)=O Amb24614667 [1,1,0,0,0,0|2,0,0]=4 4111 B11R1.166 Cc1ccc(c(Cl)c1)S([O-])=O Amb24420095 [1,1,0,0,0,0|2,0,0]=4 4112 B11R1.166 Cc1ccc(c(F)c1)N(=O)=O Amb20621363 [1,1,0,0,0,0|2,0,0]=4 4113 B11R1.166 Cc1ccc(c(F)c1)S([O-])=O Amb19944446 [1,1,0,0,0,0|2,0,0]=4 4114 B11R1.166 Cc1ccc(c(I)c1)C(C)=O Amb24696541 [1,1,0,0,0,0|0,0,0]=2 4115 B11R1.166 Cc1ccc(c(I)c1)N(C)C Amb22831658 [1,1,0,0,0,0|2,0,0]=4 4116 B11R1.166 Cc1ccc(c(N)[n]1)C(C)=O Amb23449578 [1,1,0,0,0,0|1,0,0]=3 4117 B11R1.166 Cc1ccc(c(N)c1)C(=O)Cl Amb25106699 [1,1,0,0,0,0|1,0,0]=3 4118 B11R1.166 Cc1ccc(c(N)c1)C(C)=O Amb18124989 [1,1,0,0,0,0|0,0,0]=2 4119 B11R1.166 Cc1ccc(c(N)c1)N(=O)=O Amb20621653 [1,1,0,0,0,0|2,0,0]=4 4120 B11R1.166 Cc1ccc(c(O)c1)C(C)=C Amb18644361 [1,1,0,0,0,0|1,0,0]=3 4121 B11R1.166 Cc1ccc(c(O)c1)N(=O)=O Amb20621809 [1,1,0,0,0,0|2,0,0]=4 4122 B11R1.166 Cc1ccc(c(S)c1)[N+]([O-])=O Amb24071565 [1,1,0,0,0,0|2,0,0]=4 4123 B11R1.166 Cc1ccc(c(c1)Br)C(=O)C Amb17339931 [1,1,0,0,0,0|0,0,0]=2 4124 B11R1.166 Cc1ccc(c(c1)Br)C(=O)N Amb17340166 [1,1,0,0,0,0|1,0,0]=3 4125 B11R1.166 Cc1ccc(c(c1)Br)N(C)C Amb17194437 [1,1,0,0,0,0|2,0,0]=4 4126 B11R1.166 Cc1ccc(c(c1)Br)N(N)C Amb17241870 [1,1,0,0,0,0|2,0,0]=4 4127 B11R1.166 Cc1ccc(c(c1)C)C(N)C Amb1114693 [1,1,0,0,0,0|1,0,1]=4 4128 B11R1.166 Cc1ccc(c(c1)C)C(O)C Amb1110404 [1,1,0,0,0,0|0,0,2]=4 4129 B11R1.166 Cc1ccc(c(c1)C)N(N)C Amb17232078 [1,1,0,0,0,0|2,0,0]=4 4130 B11R1.166 Cc1ccc(c(c1)C)[C@@H](N)C Amb13951232 [1,1,0,0,0,0|1,0,1]=4 4131 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)Cl Amb10070857 [1,1,0,0,0,0|1,0,0]=3 4132 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)O Amb10071244 [1,1,0,0,0,0|1,0,0]=3 4133 B11R1.166 Cc1ccc(c(c1)F)C(=O)C Amb10840624 [1,1,0,0,0,0|0,0,0]=2 4134 B11R1.166 Cc1ccc(c(c1)N)N(C)C Amb17622069 [1,1,0,0,0,0|2,0,0]=4 4135 B11R1.166 Cc1ccc(c(c1)O)C(=O)C Amb1673131 [1,1,0,0,0,0|0,0,0]=2 4136 B11R1.166 Cc1ccc(c(c1)O)C(=O)N Amb1230548 [1,1,0,0,0,0|1,0,0]=3 4137 B11R1.166 Cc1ccc(c(c1)O)[N+](=O)[O-] Amb1042499 [1,1,0,0,0,0|2,0,0]=4 4138 B11R1.166 Cc1ccc(c(n1)N)C(=O)N Amb17065520 [1,1,0,0,0,0|2,0,0]=4 4139 B11R1.166 Cc1cnc(c(c1)N)C(=O)N Amb17621457 [1,1,0,0,0,0|2,0,0]=4 4140 B11R1.166 Cc1cnc(c(n1)C)C(=O)C Amb16232451 [1,1,0,0,0,0|2,0,0]=4 4141 B11R1.166 Cc1nc(Cl)ccc1C(=O)C Amb2432588 [1,1,0,0,0,0|2,0,0]=4 4142 B11R1.166 Cc1ncc(c(c1)Cl)C(=O)C Amb10604371 [1,1,0,0,0,0|1,0,0]=3 4143 B11R1.166 Clc1ccc(c(c1)Br)C(=O)C Amb10576545 [1,1,0,0,0,0|1,0,0]=3 4144 B11R1.166 Clc1ccc(c(c1)C)C(=O)C Amb17334751 [1,1,0,0,0,0|1,0,0]=3 4145 B11R1.166 Clc1ccc(c(c1)C)C(=O)N Amb17334784 [1,1,0,0,0,0|2,0,0]=4 4146 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)O Amb1933216 [1,1,0,0,0,0|2,0,0]=4 4147 B11R1.166 Clc1ccc(c(c1)Cl)C(=O)[O-] Amb16185731 [1,1,0,0,0,0|2,0,0]=4 4148 B11R1.166 Clc1ccc(c(c1)F)C(=O)O Amb1228486 [1,1,0,0,0,0|2,0,0]=4 4149 B11R1.166 Clc1ccc(c(c1)I)C(=O)N Amb11480317 [1,1,0,0,0,0|2,0,0]=4 4150 B11R1.166 Clc1ccc(c(c1)I)C(=O)O Amb1125469 [1,1,0,0,0,0|2,0,0]=4 4151 B11R1.166 Clc1ccc(c(c1)N)C(=O)N Amb1111810 [1,1,0,0,0,0|2,0,0]=4 4152 B11R1.166 Fc1ccc(c(c1)Br)C(=O)O Amb1228455 [1,1,0,0,0,0|2,0,0]=4 4153 B11R1.166 Fc1ccc(c(c1)C)C(=O)Cl Amb10839396 [1,1,0,0,0,0|2,0,0]=4 4154 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)C Amb1661967 [1,1,0,0,0,0|1,0,0]=3 4155 B11R1.166 Fc1ccc(c(c1)Cl)C(=O)N Amb2107852 [1,1,0,0,0,0|2,0,0]=4 4156 B11R1.166 Fc1ccc(c(c1)F)C(=O)C Amb1694905 [1,1,0,0,0,0|1,0,0]=3 4157 B11R1.166 Fc1ccc(c(c1)I)C(=O)N Amb11480321 [1,1,0,0,0,0|2,0,0]=4 4158 B11R1.166 Fc1ccc(c(c1)I)C(=O)O Amb1130134 [1,1,0,0,0,0|2,0,0]=4 4159 B11R1.166 Fc1ccc(c(c1)N)C(=O)C Amb10601949 [1,1,0,0,0,0|1,0,0]=3 4160 B11R1.166 Fc1ccc(c(c1)N)C(=O)N Amb10240726 [1,1,0,0,0,0|2,0,0]=4 4161 B11R1.166 Fc1ccc(c(c1)N)C(=O)O Amb1229908 [1,1,0,0,0,0|2,0,0]=4 4162 B11R1.166 Fc1ccc(c(c1)S)C(=O)O Amb2371919 [1,1,0,0,0,0|2,0,0]=4 4163 B11R1.166 Ic1ccc(c(c1)Br)C(=O)O Amb16231627 [1,1,0,0,0,0|2,0,0]=4 4164 B11R1.166 NC(=N)c1ccc(O)cc1Br Amb24368032 [1,1,0,0,0,0|2,0,0]=4 4165 B11R1.166 NC(=N)c1ccc(O)cc1Cl Amb18177962 [1,1,0,0,0,0|2,0,0]=4 4166 B11R1.166 NC(=N)c1ccc(O)cc1O Amb24101693 [1,1,0,0,0,0|2,0,0]=4 4167 B11R1.166 NC(=O)c1c[n]c(O)cc1O Amb22497015 [1,1,0,0,0,0|2,0,0]=4 4168 B11R1.166 NC(=O)c1ccc(Br)cc1Br Amb23527373 [1,1,0,0,0,0|2,0,0]=4 4169 B11R1.166 NC(=O)c1ccc(Br)cc1I Amb25692684 [1,1,0,0,0,0|2,0,0]=4 4170 B11R1.166 NC(=O)c1ccc(Br)cc1O Amb24065862 [1,1,0,0,0,0|2,0,0]=4 4171 B11R1.166 NC(=O)c1ccc(Cl)cc1Br Amb22467150 [1,1,0,0,0,0|2,0,0]=4 4172 B11R1.166 NC(=O)c1ccc(Cl)cc1S Amb24688534 [1,1,0,0,0,0|2,0,0]=4 4173 B11R1.166 NC(=O)c1ccc(F)cc1O Amb24092577 [1,1,0,0,0,0|2,0,0]=4 4174 B11R1.166 NC(=O)c1ccc(I)cc1Cl Amb23491838 [1,1,0,0,0,0|2,0,0]=4 4175 B11R1.166 NC(=O)c1ccc(I)cc1F Amb25147954 [1,1,0,0,0,0|2,0,0]=4 4176 B11R1.166 NC(=O)c1ccc(I)cc1O Amb24610652 [1,1,0,0,0,0|2,0,0]=4 4177 B11R1.166 NC(=O)c1ccc(O)cc1Cl Amb18057546 [1,1,0,0,0,0|1,0,0]=3 4178 B11R1.166 NC(=O)c1ccc(O)cc1F Amb23402006 [1,1,0,0,0,0|1,0,0]=3 4179 B11R1.166 NC(=O)c1ccc(O)cc1I Amb25148729 [1,1,0,0,0,0|1,0,0]=3 4180 B11R1.166 NC(=O)c1ccc(nc1O)O Amb16226917 [1,1,0,0,0,0|2,0,0]=4 4181 B11R1.166 NC(=S)c1ccc(O)cc1Cl Amb19046881 [1,1,0,0,0,0|1,1,0]=4 4182 B11R1.166 NC(=S)c1ccc(O)cc1F Amb24484738 [1,1,0,0,0,0|1,1,0]=4 4183 B11R1.166 Nc1[n]c(O)ccc1C(O)=O Amb24429544 [1,1,0,0,0,0|2,0,0]=4 4184 B11R1.166 Nc1cc(Br)ccc1C(=O)Cl Amb24664173 [1,1,0,0,0,0|2,0,0]=4 4185 B11R1.166 Nc1cc(Cl)ccc1C(=O)Cl Amb22228567 [1,1,0,0,0,0|2,0,0]=4 4186 B11R1.166 Nc1cc(Cl)ccc1C(=O)Cl Amb22736497 [1,1,0,0,0,0|2,0,0]=4 4187 B11R1.166 Nc1cc(F)ccc1C(O)=O Amb22234003 [1,1,0,0,0,0|2,0,0]=4 4188 B11R1.166 Nc1cc(I)ccc1C(=O)Cl Amb25081036 [1,1,0,0,0,0|2,0,0]=4 4189 B11R1.166 Nc1cc(I)ccc1C(N)=O Amb24382290 [1,1,0,0,0,0|2,0,0]=4 4190 B11R1.166 Nc1cc(N)c(cc1)C(N)=O Amb18278475 [1,1,0,0,0,0|2,0,0]=4 4191 B11R1.166 Nc1cc(O)c(cc1)C(O)=O Amb24094572 [1,1,0,0,0,0|2,0,0]=4 4192 B11R1.166 Nc1cc(O)ccc1C(N)=O Amb24106111 [1,1,0,0,0,0|1,0,0]=3 4193 B11R1.166 Nc1cc(O)ccc1C(O)=O Amb18125508 [1,1,0,0,0,0|1,0,0]=3 4194 B11R1.166 Nc1cc(O)ccc1[N+]([O-])=O Amb22229170 [1,1,0,0,0,0|2,0,0]=4 4195 B11R1.166 Nc1cc(S)ccc1C(O)=O Amb25188874 [1,1,0,0,0,0|1,1,0]=4 4196 B11R1.166 Nc1cc(S)ccc1C([O-])=O Amb22330622 [1,1,0,0,0,0|1,1,0]=4 4197 B11R1.166 Nc1cc(S)ccc1C([O-])=O Amb23496175 [1,1,0,0,0,0|1,1,0]=4 4198 B11R1.166 Nc1ccc(C(O)=O)c(Br)c1 Amb18657903 [1,1,0,0,0,0|2,0,0]=4 4199 B11R1.166 Nc1ccc(C(O)=O)c(N)c1 Amb18944997 [1,1,0,0,0,0|2,0,0]=4 4200 B11R1.166 Nc1ccc(C(O)=O)c(S)c1 Amb22330588 [1,1,0,0,0,0|2,0,0]=4 4201 B11R1.166 Nc1ccc(c(Br)c1)C(N)=O Amb21980127 [1,1,0,0,0,0|2,0,0]=4 4202 B11R1.166 Nc1ccc(c(O)c1)C(=O)Cl Amb25062872 [1,1,0,0,0,0|2,0,0]=4 4203 B11R1.166 Nc1ccc(c(O)c1)C(N)=O Amb22235499 [1,1,0,0,0,0|2,0,0]=4 4204 B11R1.166 Nc1ccc(c(c1)C)C(=C)C Amb17107087 [1,1,0,0,0,0|2,0,0]=4 4205 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)N Amb1112128 [1,1,0,0,0,0|2,0,0]=4 4206 B11R1.166 Nc1ccc(c(c1)Cl)C(=O)O Amb10631465 [1,1,0,0,0,0|2,0,0]=4 4207 B11R1.166 Nc1ccc(c(c1)F)C(=O)N Amb13952695 [1,1,0,0,0,0|2,0,0]=4 4208 B11R1.166 Nc1ccc(c(c1)I)C(=O)O Amb13953193 [1,1,0,0,0,0|2,0,0]=4 4209 B11R1.166 Nc1ccc(c(c1)O)C(=O)O Amb10843173 [1,1,0,0,0,0|2,0,0]=4 4210 B11R1.166 Nc1ccc(c(c1)O)C(=O)O Amb1215242 [1,1,0,0,0,0|2,0,0]=4 4211 B11R1.166 Nc1ccc(c(c1)O)C(=O)[O-] Amb10844625 [1,1,0,0,0,0|2,0,0]=4 4212 B11R1.166 O=C(Cl)c1ccc(Br)cc1Br Amb19890987 [1,1,0,0,0,0|2,0,0]=4 4213 B11R1.166 O=C(Cl)c1ccc(Cl)cc1Br Amb19891049 [1,1,0,0,0,0|2,0,0]=4 4214 B11R1.166 O=C(Cl)c1ccc(Cl)cc1I Amb19889339 [1,1,0,0,0,0|2,0,0]=4 4215 B11R1.166 O=C(Cl)c1ccc(Cl)cc1S Amb24091384 [1,1,0,0,0,0|2,0,0]=4 4216 B11R1.166 O=C(Cl)c1ccc(F)cc1I Amb22738939 [1,1,0,0,0,0|2,0,0]=4 4217 B11R1.166 O=C(Cl)c1ccc(I)cc1Cl Amb24126347 [1,1,0,0,0,0|2,0,0]=4 4218 B11R1.166 O=C(F)c1ccc(F)cc1Cl Amb25311807 [1,1,0,0,0,0|2,0,0]=4 4219 B11R1.166 O=C(F)c1ccc(F)cc1F Amb24090062 [1,1,0,0,0,0|2,0,0]=4 4220 B11R1.166 OC(=O)C1=CC=C(O)NC1=O Amb22235158 [1,1,0,0,0,0|2,0,0]=4 4221 B11R1.166 OC(=O)c1ccc(Br)cc1S Amb20622936 [1,1,0,0,0,0|2,0,0]=4 4222 B11R1.166 OC(=O)c1ccc(Cl)cc1S Amb18280981 [1,1,0,0,0,0|2,0,0]=4 4223 B11R1.166 OC(=O)c1ccc(S)cc1Cl Amb18280754 [1,1,0,0,0,0|1,1,0]=4 4224 B11R1.166 OC(=O)c1ccc(S)cc1F Amb25106908 [1,1,0,0,0,0|1,1,0]=4 4225 B11R1.166 Oc1c[n]c(c(Br)c1)C(O)=O Amb24356225 [1,1,0,0,0,0|2,0,0]=4 4226 B11R1.166 Oc1c[n]c(c(Cl)c1)C(O)=O Amb19895138 [1,1,0,0,0,0|2,0,0]=4 4227 B11R1.166 Oc1cc(Br)c(c[n]1)C(O)=O Amb19958383 [1,1,0,0,0,0|2,0,0]=4 4228 B11R1.166 Oc1cc(Cl)c(c[n]1)C(O)=O Amb21963416 [1,1,0,0,0,0|2,0,0]=4 4229 B11R1.166 Oc1cc(Cl)c(cc1)C(=O)Cl Amb24104277 [1,1,0,0,0,0|1,0,0]=3 4230 B11R1.166 Oc1cc(Cl)ccc1C(=O)S Amb24380846 [1,1,0,0,0,0|2,0,0]=4 4231 B11R1.166 Oc1cc(F)ccc1C(=O)Cl Amb24091598 [1,1,0,0,0,0|2,0,0]=4 4232 B11R1.166 Oc1ccc(C(=O)Cl)c(O)c1 Amb24101694 [1,1,0,0,0,0|1,0,0]=3 4233 B11R1.166 Oc1ccc(C(S)=S)c(O)c1 Amb24690591 [1,1,0,0,0,0|1,1,0]=4 4234 B11R1.166 Oc1ccc(c(Br)c1)C(O)=O Amb22492055 [1,1,0,0,0,0|1,0,0]=3 4235 B11R1.166 Oc1ccc(c(Cl)c1)C(O)=O Amb19894796 [1,1,0,0,0,0|1,0,0]=3 4236 B11R1.166 Oc1ccc(c(F)c1)N(=O)=O Amb20621350 [1,1,0,0,0,0|2,0,0]=4 4237 B11R1.166 Oc1ccc(c(I)c1)C(O)=O Amb25268205 [1,1,0,0,0,0|1,0,0]=3 4238 B11R1.166 Oc1ccc(c(c1)O)C(=N)C Amb17593763 [1,1,0,0,0,0|1,0,0]=3 4239 B11R1.166 Oc1ccc(c(c1)O)C(=O)C Amb1811488 [1,1,0,0,0,0|0,0,0]=2 4240 B11R1.166 Oc1ccc(c(c1)O)C(=O)O Amb1934138 [1,1,0,0,0,0|1,0,0]=3 4241 B11R1.166 Oc1ccc(c(c1)O)C(=S)N Amb1119614 [1,1,0,0,0,0|1,1,0]=4 4242 B11R1.166 Oc1ccc(c(c1)O)C(N)C Amb1112483 [1,1,0,0,0,0|1,0,1]=4 4243 B11R1.166 Oc1ncc(c(c1)N)C(=O)O Amb10602600 [1,1,0,0,0,0|2,0,0]=4 4244 B11R1.166 Sc1ccc(c(c1)Br)C(=O)O Amb17610020 [1,1,0,0,0,0|1,1,0]=4 4245 B11R1.166 [O-][N+](=O)c1ccc(O)cc1I Amb19958234 [1,1,0,0,0,0|2,0,0]=4 4246 B11R1.727 CC(=O)N1C=CC(C)(C)C=C1 Amb24433770 [1,1,0,0,0,0|1,0,1]=4 4247 B11R1.44 CCC(=O)c1cc([n][s]1)OC Amb24711809 [0,1,0,0,1,0|2,0,0]=4 4248 B11R1.44 CCC(=O)c1ccc(CC)o1 Amb18796672 [0,1,0,0,1,0|2,0,0]=4 4249 B11R1.44 CC[n]1cc(cc1)C(=O)CCl Amb24104118 [0,1,0,0,1,0|2,0,0]=4 4250 B11R1.44 CCc1ccc([nH]1)C(=O)OC Amb23153734 [0,1,0,0,1,0|2,0,0]=4 4251 B11R1.44 CCc1ccc([s]1)C(=O)CN Amb18199058 [0,1,0,0,1,0|2,0,0]=4 4252 B11R1.44 CCc1ccc([s]1)C(=O)OC Amb18806549 [0,1,0,0,1,0|2,0,0]=4 4253 B11R1.44 CCc1ccc(o1)C(=O)CCl Amb25821102 [0,1,0,0,1,0|2,0,0]=4 4254 B11R1.44 CCc1ccc(o1)C(=O)CN Amb24106026 [0,1,0,0,1,0|2,0,0]=4 4255 B11R1.44 CNC(=O)[n]1cc(c[n]1)OC Amb24709305 [0,1,0,0,1,0|2,0,0]=4 4256 B11R1.44 CNC(=O)c1cc(c[s]1)OC Amb24433624 [0,1,0,0,1,0|1,0,0]=3 4257 B11R1.44 CNC(=O)c1ccc(NC)[s]1 Amb25370120 [0,1,0,0,1,0|2,0,0]=4 4258 B11R1.44 CNC(=O)c1ccc(o1)SC Amb25807226 [0,1,0,0,1,0|1,1,0]=4 4259 B11R1.44 CNc1cc([nH]c1)C(=O)OC Amb25279588 [0,1,0,0,1,0|2,0,0]=4 4260 B11R1.44 CNc1ccc([s]1)C(=O)OC Amb22494271 [0,1,0,0,1,0|2,0,0]=4 4261 B11R1.44 COC(=O)c1c[nH]c(c1)SC Amb24743576 [0,1,0,0,1,0|1,1,0]=4 4262 B11R1.44 COC(=O)c1cc(c[nH]1)OC Amb24756560 [0,1,0,0,1,0|1,0,0]=3 4263 B11R1.44 COC(=O)c1cc(c[s]1)OC Amb19375542 [0,1,0,0,1,0|1,0,0]=3 4264 B11R1.44 COC(=O)c1cc[n](CC)c1 Amb23555733 [0,1,0,0,1,0|2,0,0]=4 4265 B11R1.44 COC(=O)c1ccc(CC)o1 Amb24460761 [0,1,0,0,1,0|2,0,0]=4 4266 B11R1.44 COc1[n]cc([s]1)C(=O)CN Amb25687100 [0,1,0,0,1,0|2,0,0]=4 4267 B11R1.44 COc1cc([n][nH]1)C(=O)OC Amb25776869 [0,1,0,0,1,0|2,0,0]=4 4268 B11R1.44 COc1cc([s][n]1)C(=O)CN Amb25044987 [0,1,0,0,1,0|2,0,0]=4 4269 B11R1.44 COc1cc(o[n]1)C(=O)CBr Amb24106271 [0,1,0,0,1,0|2,0,0]=4 4270 B11R1.44 COc1cc(o[n]1)C(=O)CC Amb24415118 [0,1,0,0,1,0|2,0,0]=4 4271 B11R1.44 COc1ccc([s]1)C(=O)C=C Amb25751028 [0,1,0,0,1,0|1,0,1]=4 4272 B11R1.44 COc1ccc([s]1)C(=O)CCl Amb24509107 [0,1,0,0,1,0|1,0,0]=3 4273 B11R1.44 COc1ccc([s]1)C(=O)CN Amb25163195 [0,1,0,0,1,0|1,0,0]=3 4274 B11R1.44 COc1cnc(o1)C(=O)OC Amb2416151 [0,1,0,0,1,0|2,0,0]=4 4275 B11R1.44 COc1noc(c1)C(=O)OC Amb10604455 [0,1,0,0,1,0|2,0,0]=4 4276 B11R1.48 CC(=O)c1cc(Br)c(CC)[s]1 Amb22753473 [0,1,0,0,1,0|2,0,0]=4 4277 B11R1.48 CC(=O)c1cc(Cl)c(CC)[s]1 Amb23537637 [0,1,0,0,1,0|2,0,0]=4 4278 B11R1.48 CC(=O)c1cc(N)c([nH]1)SC Amb18141883 [0,1,0,0,1,0|1,1,0]=4 4279 B11R1.48 CC(=O)c1cc(OC)[n](C)[n]1 Amb25776686 [0,1,0,0,1,0|2,0,0]=4 4280 B11R1.48 COc1cc([s]c1Cl)C(O)=O Amb24445552 [0,1,0,0,1,0|2,0,0]=4 4281 B11R1.48 COc1cc([s]c1I)C(O)=O Amb24389267 [0,1,0,0,1,0|2,0,0]=4 4282 B11R1.48 COc1oc(cc1Br)C(O)=O Amb23538047 [0,1,0,0,1,0|2,0,0]=4 4283 B11R1.48 COc1oc(cc1Cl)C(O)=O Amb23538066 [0,1,0,0,1,0|2,0,0]=4 4284 B11R1.48 COc1sc(cc1Br)C(=O)C Amb2439255 [0,1,0,0,1,0|1,0,0]=3 4285 B11R1.48 Cc1cc([s]c1CC)C(C)=O Amb24717758 [0,1,0,0,1,0|2,0,0]=4 4286 B11R1.48 Cc1cc(oc1CC)C(C)=O Amb18685122 [0,1,0,0,1,0|2,0,0]=4 4287 B11R1.50 CC(=O)c1[s]c(CC)cc1Br Amb18743230 [0,1,0,0,1,0|2,0,0]=4 4288 B11R1.50 CC(=O)c1[s]c(CC)cc1N Amb18147957 [0,1,0,0,1,0|2,0,0]=4 4289 B11R1.50 CC(=O)c1[s]c(cc1N)NC Amb25720453 [0,1,0,0,1,0|2,0,0]=4 4290 B11R1.50 CC(=O)c1cc(CC)[s]c1N Amb18522222 [0,1,0,0,1,0|2,0,0]=4 4291 B11R1.50 COc1[n]c(C(C)=O)c(C)o1 Amb25241836 [0,1,0,0,1,0|2,0,0]=4 4292 B11R1.50 Cc1[n]c(OC)[s]c1C(C)=O Amb19861070 [0,1,0,0,1,0|2,0,0]=4 4293 B11R1.50 Cc1cc(CC)[s]c1C(C)=O Amb25373137 [0,1,0,0,1,0|2,0,0]=4 4294 B11R1.124 CC(=O)c1[n]cc(OCC)o1 Amb18200516 [0,1,0,0,1,0|2,0,0]=4 4295 B11R1.124 CC(=O)c1c[n][n](COC)c1 Amb24660133 [0,1,0,0,1,0|2,0,0]=4 4296 B11R1.124 CC(=O)c1c[n]c(COC)[s]1 Amb18183648 [0,1,0,0,1,0|2,0,0]=4 4297 B11R1.124 CC(=O)c1c[s]c(COC)[n]1 Amb18919923 [0,1,0,0,1,0|2,0,0]=4 4298 B11R1.124 CC(=O)c1cc(CCN)c[s]1 Amb18825905 [0,1,0,0,1,0|2,0,0]=4 4299 B11R1.124 CC(=O)c1cc(COC)[n]o1 Amb18200544 [0,1,0,0,1,0|2,0,0]=4 4300 B11R1.124 CC(=O)c1cc[n](CCBr)c1 Amb24459903 [0,1,0,0,1,0|2,0,0]=4 4301 B11R1.124 CC(=O)c1cc[n](CCO)c1 Amb25060426 [0,1,0,0,1,0|2,0,0]=4 4302 B11R1.124 CC(=O)c1ccc(CCN)[s]1 Amb18199049 [0,1,0,0,1,0|2,0,0]=4 4303 B11R1.124 CC(=O)c1ccc(COC)o1 Amb24760610 [0,1,0,0,1,0|1,0,0]=3 4304 B11R1.124 CCCc1ccc(s1)C(=O)C Amb1945409 [0,1,0,0,1,0|2,0,0]=4 4305 B11R1.124 CCOc1c[nH]c(c1)C(N)=O Amb25326229 [0,1,0,0,1,0|2,0,0]=4 4306 B11R1.124 CCOc1cc(co1)C(O)=O Amb25288091 [0,1,0,0,1,0|2,0,0]=4 4307 B11R1.124 CCSc1ccc(s1)C(=O)C Amb17109270 [0,1,0,0,1,0|1,1,0]=4 4308 B11R1.124 COCc1cc(co1)C(O)=O Amb18296182 [0,1,0,0,1,0|2,0,0]=4 4309 B11R1.124 COCc1ccc([s]1)C(=O)Cl Amb19649904 [0,1,0,0,1,0|2,0,0]=4 4310 B11R1.124 COCc1ccc(o1)C(=O)Cl Amb19649903 [0,1,0,0,1,0|2,0,0]=4 4311 B11R1.124 COCc1ccc(o1)C(=O)O Amb1106221 [0,1,0,0,1,0|2,0,0]=4 4312 B11R1.124 COCc1ncc([nH]1)C(=O)C Amb17593847 [0,1,0,0,1,0|2,0,0]=4 4313 B11R1.175 CC(=O)c1cc([nH]c1)C(C)C Amb24485986 [0,1,0,0,1,0|2,0,0]=4 4314 B11R1.175 CC(=O)c1cc(c[nH]1)C(C)C Amb18201643 [0,1,0,0,1,0|2,0,0]=4 4315 B11R1.175 CC(=O)c1cc(c[s]1)C(C)C Amb18199230 [0,1,0,0,1,0|2,0,0]=4 4316 B11R1.175 CC(=O)c1cc(c[s]1)N(C)C Amb18680924 [0,1,0,0,1,0|2,0,0]=4 4317 B11R1.175 CC(=O)c1ccc([nH]1)C(=O)C Amb17593759 [0,1,0,0,1,0|2,0,0]=4 4318 B11R1.175 CC(=O)c1ccc([s]1)C(C)C Amb18199222 [0,1,0,0,1,0|2,0,0]=4 4319 B11R1.175 CC(=O)c1ccc(o1)C(C)C Amb25028194 [0,1,0,0,1,0|2,0,0]=4 4320 B11R1.175 CC(=O)c1ccc(o1)C(C)O Amb24484670 [0,1,0,0,1,0|2,0,0]=4 4321 B11R1.175 CC(=O)c1ccc(o1)N(C)C Amb18682041 [0,1,0,0,1,0|2,0,0]=4 4322 B11R1.175 CC(=O)c1ccc(o1)[C@@H](C)O Amb25143454 [0,1,0,0,1,0|2,0,0]=4 4323 B11R1.175 CC(=O)c1scc(c1)C(=O)C Amb2228073 [0,1,0,0,1,0|2,0,0]=4 4324 B11R1.175 CC(c1ccc([nH]1)C(=O)C)C Amb17593772 [0,1,0,0,1,0|2,0,0]=4 4325 B11R1.473 CC(=O)c1ccc(SC)[n]1C Amb18522215 [0,1,0,0,1,0|1,1,0]=4 4326 B11R1.473 CC(=O)c1occ(OC)c1O Amb24614715 [0,1,0,0,1,0|1,0,0]=3 4327 B11R1.473 COc1[n]oc(C(C)=O)c1C Amb24586572 [0,1,0,0,1,0|2,0,0]=4 4328 B13R1.4 CC(C)(Br)Cc1ccc(cc1)OC Amb18549043 [0,1,0,0,0,1|1,0,1]=4 4329 B13R1.4 CC(C)(C)Cc1ccc(cc1)OC Amb24330199 [0,1,0,0,0,1|1,0,1]=4 4330 B13R1.4 CC(C)(C)Nc1ccc(cc1)OC Amb18269805 [0,1,0,0,0,1|1,0,1]=4 4331 B13R1.4 CCc1ccc(cc1)OP(C)(=O)Cl Amb25800758 [0,1,0,0,0,1|2,0,0]=4 4332 B13R1.4 CCc1ccc(cc1)OP(C)(O)=O Amb25134185 [0,1,0,0,0,1|2,0,0]=4 4333 B13R1.4 CCc1ccc(cc1)OS(C)(=O)=O Amb25802585 [0,1,0,0,0,1|2,0,0]=4 4334 B13R1.4 COc1ccc(CS(=O)(=O)Cl)cc1 Amb22292459 [0,1,0,0,0,1|2,0,0]=4 4335 B13R1.4 COc1ccc(CS(N)(=O)=O)cc1 Amb18334025 [0,1,0,0,0,1|2,0,0]=4 4336 B13R1.4 COc1ccc(CS(O)(=O)=O)cc1 Amb22296318 [0,1,0,0,0,1|2,0,0]=4 4337 B13R1.4 COc1ccc(cc1)CC(O)(C)C Amb17102030 [0,1,0,0,0,1|0,0,2]=4 4338 B13R1.4 COc1ccc(cc1)CP(=O)(O)O Amb10068660 [0,1,0,0,0,1|2,0,0]=4 4339 B13R1.4 COc1ccc(cc1)NS(=O)(=O)Cl Amb24434764 [0,1,0,0,0,1|2,0,0]=4 4340 B13R1.4 COc1ccc(cc1)NS(N)(=O)=O Amb24072419 [0,1,0,0,0,1|2,0,0]=4 4341 B13R1.4 COc1ccc(cc1)OC(C)(C)C Amb20622051 [0,1,0,0,0,1|1,0,1]=4 4342 B13R1.4 COc1ccc(cc1)OP(=O)(Cl)Cl Amb25801061 [0,1,0,0,0,1|2,0,0]=4 4343 B13R1.4 COc1ccc(cc1)OP(=O)(N)N Amb1625486 [0,1,0,0,0,1|2,0,0]=4 4344 B13R1.4 COc1ccc(cc1)OP(=O)(O)C Amb1144687 [0,1,0,0,0,1|1,0,0]=3 4345 B13R1.4 COc1ccc(cc1)OS(=O)(=O)Cl Amb25286958 [0,1,0,0,0,1|2,0,0]=4 4346 B13R1.4 COc1ccc(cc1)OS(N)(=O)=O Amb25205121 [0,1,0,0,0,1|2,0,0]=4 4347 B13R1.4 COc1ccc(cn1)NS(=O)(=O)C Amb16776516 [0,1,0,0,0,1|2,0,0]=4 4348 B13R1.4 CS(=O)(=O)Oc1ccc(cc1)SC Amb22474316 [0,1,0,0,0,1|1,1,0]=4 4349 B13R1.5 BrCC(=O)Nc1ccc(cc1)CC Amb17330480 [0,1,0,0,0,1|1,0,0]=3 4350 B13R1.5 BrCC(Oc1ccc(cc1)OC)C Amb17257500 [0,1,0,0,0,1|1,0,1]=4 4351 B13R1.5 BrCc1ccc(cc1)CC(=O)OC Amb10071259 [0,1,0,0,0,1|2,0,0]=4 4352 B13R1.5 CCC(=O)Cc1ccc(cc1)C#N Amb24737376 [0,1,0,0,0,1|2,0,0]=4 4353 B13R1.5 CCC(=O)Cc1ccc(cc1)OC Amb17138854 [0,1,0,0,0,1|0,0,0]=2 4354 B13R1.5 CCC(=O)Nc1c[n]c([n]c1)OC Amb25173116 [0,1,0,0,0,1|2,0,0]=4 4355 B13R1.5 CCC(=O)Nc1ccc(CBr)cc1 Amb25332871 [0,1,0,0,0,1|2,0,0]=4 4356 B13R1.5 CCC(=O)Nc1ccc(CCl)cc1 Amb25130120 [0,1,0,0,0,1|2,0,0]=4 4357 B13R1.5 CCC(=O)Nc1ccc(c[n]1)SC Amb25855659 [0,1,0,0,0,1|1,1,0]=4 4358 B13R1.5 CCC(=O)Nc1ccc(cc1)C#C Amb25064758 [0,1,0,0,0,1|1,0,1]=4 4359 B13R1.5 CCC(=O)Nc1ccc(cc1)CN Amb1113129 [0,1,0,0,0,1|2,0,0]=4 4360 B13R1.5 CCC(=O)Oc1ccc(CCl)cc1 Amb20667898 [0,1,0,0,0,1|2,0,0]=4 4361 B13R1.5 CCC(=O)Oc1ccc(CO)cc1 Amb24102996 [0,1,0,0,0,1|2,0,0]=4 4362 B13R1.5 CCC(=O)Oc1ccc(cc1)C#N Amb18127399 [0,1,0,0,0,1|2,0,0]=4 4363 B13R1.5 CCC(=O)Oc1ccc(cc1)C=C Amb16231186 [0,1,0,0,0,1|1,0,1]=4 4364 B13R1.5 CCC(O)Cc1ccc(cc1)OC Amb18791137 [0,1,0,0,0,1|0,0,2]=4 4365 B13R1.5 CCc1ccc(CC(=N)OC)cc1 Amb18065704 [0,1,0,0,0,1|2,0,0]=4 4366 B13R1.5 CCc1ccc(CC(=O)CO)cc1 Amb18564079 [0,1,0,0,0,1|1,0,0]=3 4367 B13R1.5 CCc1ccc(CC(=O)NC)cc1 Amb19557312 [0,1,0,0,0,1|1,0,0]=3 4368 B13R1.5 CCc1ccc(CC(=O)NO)cc1 Amb24335102 [0,1,0,0,0,1|2,0,0]=4 4369 B13R1.5 CCc1ccc(cc1)CC(=O)NN Amb1921794 [0,1,0,0,0,1|2,0,0]=4 4370 B13R1.5 CCc1ccc(cc1)NC(=O)C#C Amb24335145 [0,1,0,0,0,1|1,0,1]=4 4371 B13R1.5 CCc1ccc(cc1)NC(=S)SC Amb23469650 [0,1,0,0,0,1|1,1,0]=4 4372 B13R1.5 CCc1ccc(cc1)OC(=O)NC Amb25725883 [0,1,0,0,0,1|1,0,0]=3 4373 B13R1.5 CCc1ccc(cc1)\C=C(\C=O)/C Amb17334992 [0,1,0,0,0,1|1,0,0]=3 4374 B13R1.5 CCc1ccc(cc1)\N=C(\N)/SC Amb25232623 [0,1,0,0,0,1|2,0,0]=4 4375 B13R1.5 CNC(=N)Cc1ccc([n]c1)OC Amb24610391 [0,1,0,0,0,1|2,0,0]=4 4376 B13R1.5 CNC(=N)Nc1c[n]c(cc1)OC Amb18184723 [0,1,0,0,0,1|2,0,0]=4 4377 B13R1.5 CNC(=N)Nc1ccc(CC)cc1 Amb18804670 [0,1,0,0,0,1|2,0,0]=4 4378 B13R1.5 CNC(=N)Nc1ccc(cc1)OC Amb18184508 [0,1,0,0,0,1|1,0,0]=3 4379 B13R1.5 CNC(=N)Nc1ccc(cc1)SC Amb18324905 [0,1,0,0,0,1|1,1,0]=4 4380 B13R1.5 CNC(=O)Cc1ccc(cc1)C#N Amb22584211 [0,1,0,0,0,1|2,0,0]=4 4381 B13R1.5 CNC(=O)Cc1ccc(cc1)NC Amb18303213 [0,1,0,0,0,1|1,0,0]=3 4382 B13R1.5 CNC(=O)Cc1ccc(cc1)SC Amb25344417 [0,1,0,0,0,1|0,1,0]=3 4383 B13R1.5 CNC(=O)Nc1[n]cc(c[n]1)OC Amb24525477 [0,1,0,0,0,1|2,0,0]=4 4384 B13R1.5 CNC(=O)Nc1c[n]c([n]c1)OC Amb25173042 [0,1,0,0,0,1|2,0,0]=4 4385 B13R1.5 CNC(=O)Nc1ccc(CC)cc1 Amb24664056 [0,1,0,0,0,1|1,0,0]=3 4386 B13R1.5 CNC(=O)Nc1ccc(CCl)cc1 Amb24400673 [0,1,0,0,0,1|2,0,0]=4 4387 B13R1.5 CNC(=O)Nc1ccc([n][n]1)OC Amb24631334 [0,1,0,0,0,1|2,0,0]=4 4388 B13R1.5 CNC(=O)Nc1ccc(c[n]1)SC Amb25206967 [0,1,0,0,0,1|1,1,0]=4 4389 B13R1.5 CNC(=O)Nc1ccc(cc1)NC Amb18967644 [0,1,0,0,0,1|1,0,0]=3 4390 B13R1.5 CNC(=O)Oc1ccc(CCl)cc1 Amb24443098 [0,1,0,0,0,1|2,0,0]=4 4391 B13R1.5 CNC(=O)Oc1ccc(cc1)C#N Amb25075570 [0,1,0,0,0,1|2,0,0]=4 4392 B13R1.5 CNC(=O)Oc1ccc(cc1)C=O Amb25326082 [0,1,0,0,0,1|2,0,0]=4 4393 B13R1.5 CNC(=S)Nc1ccc(cc1)CC Amb1824857 [0,1,0,0,0,1|1,1,0]=4 4394 B13R1.5 CNC(C)Cc1ccc(cc1)OC Amb22055711 [0,1,0,0,0,1|1,0,1]=4 4395 B13R1.5 CNc1ccc(CC(=O)OC)cc1 Amb25211326 [0,1,0,0,0,1|1,0,0]=3 4396 B13R1.5 CNc1ccc(c[n]1)NC(=O)CC Amb25371042 [0,1,0,0,0,1|2,0,0]=4 4397 B13R1.5 CNc1ccc(c[n]1)NC(=O)OC Amb25713943 [0,1,0,0,0,1|2,0,0]=4 4398 B13R1.5 CNc1ccc(cc1)NC(=O)CC Amb19002863 [0,1,0,0,0,1|1,0,0]=3 4399 B13R1.5 CNc1ccc(cc1)NC(=O)OC Amb18303227 [0,1,0,0,0,1|1,0,0]=3 4400 B13R1.5 COC(=C)Nc1ccc(cc1)OC Amb24409699 [0,1,0,0,0,1|1,0,0]=3 4401 B13R1.5 COC(=O)Cc1ccc([n][n]1)OC Amb23586411 [0,1,0,0,0,1|2,0,0]=4 4402 B13R1.5 COC(=O)Cc1ccc(cc1)C=O Amb22002624 [0,1,0,0,0,1|2,0,0]=4 4403 B13R1.5 COC(=O)Cc1ccc(cc1)NN Amb24613154 [0,1,0,0,0,1|2,0,0]=4 4404 B13R1.5 COC(=O)Cc1ccc(cc1)SC Amb18942911 [0,1,0,0,0,1|0,1,0]=3 4405 B13R1.5 COC(=O)Nc1c[n]c(cc1)SC Amb25144253 [0,1,0,0,0,1|1,1,0]=4 4406 B13R1.5 COC(=O)Nc1ccc(CO)cc1 Amb22295889 [0,1,0,0,0,1|2,0,0]=4 4407 B13R1.5 COC(=O)Nc1ccc(c[n]1)OC Amb24631038 [0,1,0,0,0,1|1,0,0]=3 4408 B13R1.5 COC(=O)Nc1ccc(c[n]1)SC Amb25668576 [0,1,0,0,0,1|1,1,0]=4 4409 B13R1.5 COC(=O)Nc1ccc(cc1)C=O Amb18648222 [0,1,0,0,0,1|2,0,0]=4 4410 B13R1.5 COC(=O)Nc1ccc(cc1)N=O Amb24095879 [0,1,0,0,0,1|2,0,0]=4 4411 B13R1.5 COC(=O)Nc1ccc(cc1)SC Amb22476342 [0,1,0,0,0,1|0,1,0]=3 4412 B13R1.5 COC(=O)Oc1ccc(cc1)C#N Amb16498350 [0,1,0,0,0,1|2,0,0]=4 4413 B13R1.5 COc1[n]cc(c[n]1)NC(=O)CBr Amb25173055 [0,1,0,0,0,1|2,0,0]=4 4414 B13R1.5 COc1[n]cc(c[n]1)NC(=O)CCl Amb25173054 [0,1,0,0,0,1|2,0,0]=4 4415 B13R1.5 COc1[n]cc(c[n]1)NC(=O)CS Amb24594599 [0,1,0,0,0,1|2,0,0]=4 4416 B13R1.5 COc1[n]cc(c[n]1)NC(=O)OC Amb24625603 [0,1,0,0,0,1|2,0,0]=4 4417 B13R1.5 COc1c[n]c(cc1)NC(=O)C#C Amb24403696 [0,1,0,0,0,1|1,0,1]=4 4418 B13R1.5 COc1ccc(CC(=N)NO)cc1 Amb22494629 [0,1,0,0,0,1|1,0,1]=4 4419 B13R1.5 COc1ccc(CC(=O)C#C)c[n]1 Amb24389062 [0,1,0,0,0,1|1,0,1]=4 4420 B13R1.5 COc1ccc(CC(=O)CO)cc1 Amb18065902 [0,1,0,0,0,1|0,0,0]=2 4421 B13R1.5 COc1ccc(CC(=O)NN)c[n]1 Amb25322270 [0,1,0,0,0,1|2,0,0]=4 4422 B13R1.5 COc1ccc(C[C@H](N)CO)cc1 Amb22233153 [0,1,0,0,0,1|1,0,1]=4 4423 B13R1.5 COc1ccc(C\C(\Cl)=N\O)cc1 Amb25694096 [0,1,0,0,0,1|1,0,1]=4 4424 B13R1.5 COc1ccc(C\C(\N)=N\N)cc1 Amb18178697 [0,1,0,0,0,1|2,0,0]=4 4425 B13R1.5 COc1ccc([n][n]1)OC(=O)NC Amb24490482 [0,1,0,0,0,1|2,0,0]=4 4426 B13R1.5 COc1ccc(\C=C(\F)/C=O)cc1 Amb24568011 [0,1,0,0,0,1|1,0,0]=3 4427 B13R1.5 COc1ccc(\C=C(\F)/CO)cc1 Amb25120005 [0,1,0,0,0,1|1,0,0]=3 4428 B13R1.5 COc1ccc(c[n]1)NC(=O)C#C Amb25204547 [0,1,0,0,0,1|1,0,1]=4 4429 B13R1.5 COc1ccc(c[n]1)NC(=O)SC Amb24097113 [0,1,0,0,0,1|1,0,0]=3 4430 B13R1.5 COc1ccc(c[n]1)NC(=S)OC Amb24529619 [0,1,0,0,0,1|1,1,0]=4 4431 B13R1.5 COc1ccc(cc1)CC(C=O)Cl Amb17204379 [0,1,0,0,0,1|1,0,1]=4 4432 B13R1.5 COc1ccc(cc1)N=C(N)SC Amb22478204 [0,1,0,0,0,1|1,0,0]=3 4433 B13R1.5 COc1ccc(cc1)NC(=O)C=O Amb24534421 [0,1,0,0,0,1|0,0,1]=3 4434 B13R1.5 COc1ccc(cc1)NC(=S)SN Amb24440987 [0,1,0,0,0,1|1,1,0]=4 4435 B13R1.5 COc1ccc(cc1)NC(C#N)C Amb17400555 [0,1,0,0,0,1|1,0,1]=4 4436 B13R1.5 COc1ccc(cc1)NC(C)C#C Amb24072151 [0,1,0,0,0,1|1,0,1]=4 4437 B13R1.5 COc1ccc(cc1)NC(C)CO Amb19008880 [0,1,0,0,0,1|0,0,2]=4 4438 B13R1.5 COc1ccc(cc1)NC(N)=NO Amb18186798 [0,1,0,0,0,1|1,0,1]=4 4439 B13R1.5 COc1ccc(cc1)N[C@@H](C)C=C Amb24072916 [0,1,0,0,0,1|1,0,1]=4 4440 B13R1.5 COc1ccc(cc1)N[C@@H](C)CO Amb25060119 [0,1,0,0,0,1|0,0,2]=4 4441 B13R1.5 COc1ccc(cc1)N[C@H](C)C=C Amb24382076 [0,1,0,0,0,1|1,0,1]=4 4442 B13R1.5 COc1ccc(cc1)OC(=O)CCl Amb22524634 [0,1,0,0,0,1|0,0,0]=2 4443 B13R1.5 COc1ccc(cc1)OC(=O)NC Amb25290168 [0,1,0,0,0,1|0,0,0]=2 4444 B13R1.5 COc1ccc(cc1)OC(=O)NN Amb25779623 [0,1,0,0,0,1|1,0,0]=3 4445 B13R1.5 COc1ccc(cc1)OC(C)CN Amb22503858 [0,1,0,0,0,1|1,0,1]=4 4446 B13R1.5 COc1ccc(cc1)OC(N)=S=O Amb25187709 [0,1,0,0,0,1|1,0,0]=3 4447 B13R1.5 COc1ccc(cc1)SC(C)C#N Amb18330410 [0,1,0,0,0,1|1,0,1]=4 4448 B13R1.5 COc1ccc(cc1)\C=C(\C=O)/C Amb17335115 [0,1,0,0,0,1|0,0,0]=2 4449 B13R1.5 COc1ccc(cc1)\N=C(\S)/SC Amb21953089 [0,1,0,0,0,1|0,1,0]=3 4450 B13R1.5 CSC(=O)Nc1ccc(cc1)SC Amb25799035 [0,1,0,0,0,1|0,1,0]=3 4451 B13R1.5 CSC(=S)Nc1ccc(cc1)OC Amb2237585 [0,1,0,0,0,1|0,1,0]=3 4452 B13R1.5 CS\C(\N)=N\c1ccc(cc1)SC Amb25704132 [0,1,0,0,0,1|1,1,0]=4 4453 B13R1.5 CSc1c[n]c(cc1)NC(=O)CCl Amb24408232 [0,1,0,0,0,1|1,1,0]=4 4454 B13R1.5 CSc1ccc(CC(=O)NN)cc1 Amb24643948 [0,1,0,0,0,1|1,1,0]=4 4455 B13R1.5 CSc1ccc(cc1)NC(=O)CBr Amb24703318 [0,1,0,0,0,1|0,1,0]=3 4456 B13R1.5 CSc1ccc(cc1)NC(=O)CO Amb25059292 [0,1,0,0,0,1|0,1,0]=3 4457 B13R1.5 CSc1ccc(cc1)NC(=O)CS Amb25856298 [0,1,0,0,0,1|0,1,0]=3 4458 B13R1.5 CSc1ccc(cc1)OC(=O)C#C Amb24369930 [0,1,0,0,0,1|0,1,1]=4 4459 B13R1.5 CSc1ccc(cc1)SC(=O)NC Amb25738060 [0,1,0,0,0,1|0,1,0]=3 4460 B13R1.5 C\C(=C/C)\Nc1ccc(cc1)OC Amb25122765 [0,1,0,0,0,1|1,0,0]=3 4461 B13R1.5 C\C(=C\c1ccc(cc1)C=O)\C=O Amb24573486 [0,1,0,0,0,1|2,0,0]=4 4462 B13R1.5 C\C(\C=O)=C/c1ccc(cc1)C#N Amb25289231 [0,1,0,0,0,1|2,0,0]=4 4463 B13R1.5 C\C(\C=O)=C\c1ccc(CC)cc1 Amb25670370 [0,1,0,0,0,1|1,0,0]=3 4464 B13R1.5 C\C(\C=O)=C\c1ccc(cc1)SC Amb25074312 [0,1,0,0,0,1|0,1,0]=3 4465 B13R1.5 C\C(\CBr)=C\c1ccc(CC)cc1 Amb24448375 [0,1,0,0,0,1|2,0,0]=4 4466 B13R1.5 C\C(\CBr)=C\c1ccc(cc1)SC Amb25369686 [0,1,0,0,0,1|1,1,0]=4 4467 B13R1.5 C\C(\CCl)=C\c1ccc(CC)cc1 Amb25296641 [0,1,0,0,0,1|2,0,0]=4 4468 B13R1.5 C\C(\CCl)=C\c1ccc(cc1)SC Amb25299985 [0,1,0,0,0,1|1,1,0]=4 4469 B13R1.5 C\C(\CN)=C\c1ccc([n]c1)OC Amb25272628 [0,1,0,0,0,1|2,0,0]=4 4470 B13R1.5 C\C(\CN)=C\c1ccc(cc1)SC Amb24441233 [0,1,0,0,0,1|1,1,0]=4 4471 B13R1.5 C\C(\CO)=C\c1ccc([n]c1)OC Amb25373005 [0,1,0,0,0,1|1,0,1]=4 4472 B13R1.5 C\C(\CO)=C\c1ccc(cc1)OC Amb24643557 [0,1,0,0,0,1|0,0,1]=3 4473 B13R1.5 C\C(\CO)=C\c1ccc(cc1)SC Amb25282354 [0,1,0,0,0,1|0,1,1]=4 4474 B13R1.5 C\C(\Cc1ccc(cc1)OC)=N/N Amb24352791 [0,1,0,0,0,1|1,0,0]=3 4475 B13R1.5 C\C(\Cc1ccc(cc1)SC)=N/O Amb25689148 [0,1,0,0,0,1|0,1,1]=4 4476 B13R1.5 C\C(\Nc1ccc(cc1)OC)=N/O Amb24424043 [0,1,0,0,0,1|0,0,1]=3 4477 B13R1.5 ClCC(=O)Nc1ccc(nc1)OC Amb10608963 [0,1,0,0,0,1|1,0,0]=3 4478 B13R1.5 ClCC(=O)Nc1ccc(nc1)OC Amb2304367 [0,1,0,0,0,1|1,0,0]=3 4479 B13R1.5 ClCC(Oc1ccc(cc1)OC)C Amb17237197 [0,1,0,0,0,1|1,0,1]=4 4480 B13R1.5 N#Cc1ccc(CC(=O)CCl)cc1 Amb18130052 [0,1,0,0,0,1|2,0,0]=4 4481 B13R1.5 N#Cc1ccc(CC(=O)CO)cc1 Amb18127395 [0,1,0,0,0,1|2,0,0]=4 4482 B13R1.5 N#Cc1ccc(cc1)NC(=O)CS Amb25077113 [0,1,0,0,0,1|2,0,0]=4 4483 B13R1.5 N#Cc1ccc(cc1)OC(=O)CO Amb25316719 [0,1,0,0,0,1|2,0,0]=4 4484 B13R1.5 NCC(=O)Nc1ccc(CN)cc1 Amb18295011 [0,1,0,0,0,1|2,0,0]=4 4485 B13R1.5 NCC(=O)Nc1ccc(cc1)OC Amb10767129 [0,1,0,0,0,1|0,0,0]=2 4486 B13R1.5 NCC(=O)Oc1ccc(cc1)CC Amb17335319 [0,1,0,0,0,1|1,0,0]=3 4487 B13R1.5 NCC(=O)Oc1ccc(cc1)OC Amb17335477 [0,1,0,0,0,1|0,0,0]=2 4488 B13R1.5 NCC(Cc1ccc(cc1)OC)O Amb17233808 [0,1,0,0,0,1|0,0,2]=4 4489 B13R1.5 NCC(Nc1ccc(cc1)OC)C Amb17226672 [0,1,0,0,0,1|1,0,1]=4 4490 B13R1.5 NCc1ccc(cc1)NC(=O)CCl Amb24356026 [0,1,0,0,0,1|2,0,0]=4 4491 B13R1.5 NNC(=S)Nc1ccc(cc1)OC Amb1104547 [0,1,0,0,0,1|1,1,0]=4 4492 B13R1.5 O=C(CCl)Nc1ccc(cc1)C=O Amb25772817 [0,1,0,0,0,1|2,0,0]=4 4493 B13R1.5 OCC(=O)Nc1ccc(nc1)OC Amb1111009 [0,1,0,0,0,1|1,0,0]=3 4494 B13R1.5 OCC(Cc1ccc(cc1)OC)N Amb17062693 [0,1,0,0,0,1|1,0,1]=4 4495 B13R1.5 OCC(Oc1ccc(cc1)OC)C Amb17233900 [0,1,0,0,0,1|0,0,2]=4 4496 B13R1.5 OCc1ccc(cc1)NC(=O)CBr Amb24591401 [0,1,0,0,0,1|2,0,0]=4 4497 B13R1.5 SCC(=O)Nc1ccc(cc1)CC Amb1394873 [0,1,0,0,0,1|1,0,0]=3 4498 B13R1.35 CC(=N)Nc1cc(Br)c(cc1)OC Amb24381580 [0,1,0,0,0,1|1,0,0]=3 4499 B13R1.35 CC(=N)Nc1cc(Cl)c(cc1)OC Amb25280643 [0,1,0,0,0,1|1,0,0]=3 4500 B13R1.35 CC(=O)Cc1cc(Br)c(CO)cc1 Amb24536902 [0,1,0,0,0,1|2,0,0]=4 4501 B13R1.35 CC(=O)Cc1cc(Cl)c(CF)cc1 Amb25253342 [0,1,0,0,0,1|2,0,0]=4 4502 B13R1.35 CC(=O)Cc1cc(I)c(CO)cc1 Amb25224731 [0,1,0,0,0,1|2,0,0]=4 4503 B13R1.35 CC(=O)Cc1ccc(C#N)c(Cl)c1 Amb25253275 [0,1,0,0,0,1|2,0,0]=4 4504 B13R1.35 CC(=O)Cc1ccc(C#N)c(S)c1 Amb24656446 [0,1,0,0,0,1|2,0,0]=4 4505 B13R1.35 CC(=O)Cc1ccc(C=O)c(O)c1 Amb25247662 [0,1,0,0,0,1|2,0,0]=4 4506 B13R1.35 CC(=O)Cc1ccc(C=O)c(S)c1 Amb24528034 [0,1,0,0,0,1|2,0,0]=4 4507 B13R1.35 CC(=O)Cc1ccc(CC)c(F)c1 Amb25352209 [0,1,0,0,0,1|1,0,0]=3 4508 B13R1.35 CC(=O)Cc1ccc(CC)c(O)c1 Amb24628198 [0,1,0,0,0,1|1,0,0]=3 4509 B13R1.35 CC(=O)Cc1ccc(SC)c(N)c1 Amb24727769 [0,1,0,0,0,1|0,1,0]=3 4510 B13R1.35 CC(=O)Cc1ccc(SC)c(S)c1 Amb24572869 [0,1,0,0,0,1|0,1,0]=3 4511 B13R1.35 CC(=O)Nc1c[n]c(OC)c(N)c1 Amb24072485 [0,1,0,0,0,1|1,0,0]=3 4512 B13R1.35 CC(=O)Nc1cc(F)c(cc1)C#N Amb24401668 [0,1,0,0,0,1|2,0,0]=4 4513 B13R1.35 CC(=O)Nc1cc(F)c(cc1)OC Amb22757127 [0,1,0,0,0,1|0,0,0]=2 4514 B13R1.35 CC(=O)Nc1cc(O)c(cc1)C#N Amb24560886 [0,1,0,0,0,1|2,0,0]=4 4515 B13R1.35 CC(=O)Nc1ccc(C=O)c(Cl)c1 Amb25759047 [0,1,0,0,0,1|2,0,0]=4 4516 B13R1.35 CC(=O)Nc1ccc(C=O)c(F)c1 Amb24072170 [0,1,0,0,0,1|2,0,0]=4 4517 B13R1.35 CC(=O)Nc1ccc(C=O)c(O)c1 Amb18648220 [0,1,0,0,0,1|2,0,0]=4 4518 B13R1.35 CC(=O)Nc1ccc(CC)c(O)c1 Amb25102735 [0,1,0,0,0,1|1,0,0]=3 4519 B13R1.35 CC(=O)Nc1ccc(CN)c(F)c1 Amb24443206 [0,1,0,0,0,1|2,0,0]=4 4520 B13R1.35 CC(=O)Nc1ccc(CO)c(Cl)c1 Amb24309245 [0,1,0,0,0,1|2,0,0]=4 4521 B13R1.35 CC(=O)Oc1cc(Br)c(cc1)SC Amb25343316 [0,1,0,0,0,1|0,1,0]=3 4522 B13R1.35 CC(=O)Oc1cc(C)c(cc1)C=O Amb18128126 [0,1,0,0,0,1|2,0,0]=4 4523 B13R1.35 CC(=O)Oc1cc(Cl)c(cc1)C#N Amb24458381 [0,1,0,0,0,1|2,0,0]=4 4524 B13R1.35 CC(=O)Oc1cc(Cl)c(cc1)SC Amb25826086 [0,1,0,0,0,1|0,1,0]=3 4525 B13R1.35 CC(=O)Oc1cc(F)c(cc1)C#N Amb25847564 [0,1,0,0,0,1|2,0,0]=4 4526 B13R1.35 CC(=O)Oc1cc(F)c(cc1)OC Amb25855849 [0,1,0,0,0,1|0,0,0]=2 4527 B13R1.35 CC(=O)Oc1cc(I)c(cc1)SC Amb24494707 [0,1,0,0,0,1|0,1,0]=3 4528 B13R1.35 CC(=O)Oc1cc(O)c(cc1)SC Amb24341327 [0,1,0,0,0,1|0,1,0]=3 4529 B13R1.35 CC(=O)Oc1ccc(C=O)c(O)c1 Amb18128535 [0,1,0,0,0,1|2,0,0]=4 4530 B13R1.35 CC(=O)Oc1ccc(CC)c(O)c1 Amb25834390 [0,1,0,0,0,1|1,0,0]=3 4531 B13R1.35 CC(=O)Oc1ccc(CO)c(F)c1 Amb24598811 [0,1,0,0,0,1|2,0,0]=4 4532 B13R1.35 CC(=O)Sc1cc(F)c(cc1)OC Amb25109554 [0,1,0,0,0,1|0,0,0]=2 4533 B13R1.35 CCc1ccc(CC(O)=O)cc1Br Amb25198699 [0,1,0,0,0,1|2,0,0]=4 4534 B13R1.35 CCc1ccc(CC(O)=O)cc1Cl Amb18277503 [0,1,0,0,0,1|2,0,0]=4 4535 B13R1.35 CCc1ccc(CC(O)=O)cc1I Amb25793631 [0,1,0,0,0,1|2,0,0]=4 4536 B13R1.35 CCc1ccc(cc1Cl)NC(N)=O Amb24678858 [0,1,0,0,0,1|2,0,0]=4 4537 B13R1.35 CCc1ccc(cc1F)NC(N)=O Amb24334974 [0,1,0,0,0,1|2,0,0]=4 4538 B13R1.35 CN(C)Cc1ccc(OC)c(Br)c1 Amb19649534 [0,1,0,0,0,1|2,0,0]=4 4539 B13R1.35 CN(C)Cc1ccc(OC)c(O)c1 Amb18128894 [0,1,0,0,0,1|2,0,0]=4 4540 B13R1.35 CN(N)Cc1ccc(OC)c(Cl)c1 Amb18066547 [0,1,0,0,0,1|2,0,0]=4 4541 B13R1.35 CN(N)Cc1ccc(OC)c(F)c1 Amb18564282 [0,1,0,0,0,1|2,0,0]=4 4542 B13R1.35 CNc1ccc(CC(O)=O)cc1F Amb18066097 [0,1,0,0,0,1|2,0,0]=4 4543 B13R1.35 COc1[n]cc(CC(O)=O)cc1Cl Amb25363922 [0,1,0,0,0,1|2,0,0]=4 4544 B13R1.35 COc1[n]cc(CC(O)=O)cc1F Amb25682721 [0,1,0,0,0,1|2,0,0]=4 4545 B13R1.35 COc1c[n]c(CC(O)=O)cc1Cl Amb25827959 [0,1,0,0,0,1|2,0,0]=4 4546 B13R1.35 COc1c[n]c(CC(O)=O)cc1O Amb24729326 [0,1,0,0,0,1|2,0,0]=4 4547 B13R1.35 COc1ccc(C=C(Br)Br)cc1F Amb24659068 [0,1,0,0,0,1|2,0,0]=4 4548 B13R1.35 COc1ccc(CC(=O)Cl)cc1F Amb25738463 [0,1,0,0,0,1|1,0,0]=3 4549 B13R1.35 COc1ccc(CC(=O)Cl)cc1O Amb25347539 [0,1,0,0,0,1|1,0,0]=3 4550 B13R1.35 COc1ccc(CC(C)Cl)cc1F Amb25853082 [0,1,0,0,0,1|1,0,1]=4 4551 B13R1.35 COc1ccc(CC(C)N)cc1Cl Amb19086089 [0,1,0,0,0,1|1,0,1]=4 4552 B13R1.35 COc1ccc(CC(C)N)cc1F Amb19068203 [0,1,0,0,0,1|1,0,1]=4 4553 B13R1.35 COc1ccc(CC(C)N)cc1I Amb25255419 [0,1,0,0,0,1|1,0,1]=4 4554 B13R1.35 COc1ccc(CC(C)O)cc1F Amb19068698 [0,1,0,0,0,1|0,0,2]=4 4555 B13R1.35 COc1ccc(CC(N)=N)cc1Cl Amb18066495 [0,1,0,0,0,1|2,0,0]=4 4556 B13R1.35 COc1ccc(CC(N)=N)cc1F Amb19343861 [0,1,0,0,0,1|2,0,0]=4 4557 B13R1.35 COc1ccc(CC(O)=O)[n]c1Cl Amb25805219 [0,1,0,0,0,1|2,0,0]=4 4558 B13R1.35 COc1ccc(CC(O)=O)cc1N Amb19001507 [0,1,0,0,0,1|1,0,0]=3 4559 B13R1.35 COc1ccc(CC(O)=O)cc1S Amb18652884 [0,1,0,0,0,1|1,0,0]=3 4560 B13R1.35 COc1ccc(C[C@@H](C)N)cc1Br Amb24712481 [0,1,0,0,0,1|1,0,1]=4 4561 B13R1.35 COc1ccc(C[C@@H](C)N)cc1F Amb25034365 [0,1,0,0,0,1|1,0,1]=4 4562 B13R1.35 COc1ccc(C[C@@H](C)N)cc1I Amb25756709 [0,1,0,0,0,1|1,0,1]=4 4563 B13R1.35 COc1ccc(C[C@@H](C)O)cc1Br Amb24472277 [0,1,0,0,0,1|0,0,2]=4 4564 B13R1.35 COc1ccc(C[C@H](C)N)cc1F Amb24729345 [0,1,0,0,0,1|1,0,1]=4 4565 B13R1.35 COc1ccc(C[C@H](C)N)cc1I Amb24376169 [0,1,0,0,0,1|1,0,1]=4 4566 B13R1.35 COc1ccc(cc1Br)CC(=O)N Amb17410953 [0,1,0,0,0,1|1,0,0]=3 4567 B13R1.35 COc1ccc(cc1Br)CC(=O)O Amb2542765 [0,1,0,0,0,1|1,0,0]=3 4568 B13R1.35 COc1ccc(cc1Br)NC(C)C Amb18246604 [0,1,0,0,0,1|1,0,1]=4 4569 B13R1.35 COc1ccc(cc1Br)NC(N)=N Amb18246515 [0,1,0,0,0,1|2,0,0]=4 4570 B13R1.35 COc1ccc(cc1Br)NC(N)=O Amb18246419 [0,1,0,0,0,1|1,0,0]=3 4571 B13R1.35 COc1ccc(cc1Br)NC(N)=S Amb25841774 [0,1,0,0,0,1|1,1,0]=4 4572 B13R1.35 COc1ccc(cc1Br)OC(C)C Amb24536199 [0,1,0,0,0,1|1,0,1]=4 4573 B13R1.35 COc1ccc(cc1C)CC(=O)C Amb16193027 [0,1,0,0,0,1|0,0,0]=2 4574 B13R1.35 COc1ccc(cc1C)CC(=O)N Amb17400716 [0,1,0,0,0,1|1,0,0]=3 4575 B13R1.35 COc1ccc(cc1C)CC(=O)O Amb1830256 [0,1,0,0,0,1|1,0,0]=3 4576 B13R1.35 COc1ccc(cc1Cl)CC(=O)N Amb17402323 [0,1,0,0,0,1|1,0,0]=3 4577 B13R1.35 COc1ccc(cc1Cl)CC(=O)O Amb1102441 [0,1,0,0,0,1|1,0,0]=3 4578 B13R1.35 COc1ccc(cc1Cl)NC(=N)N Amb10879726 [0,1,0,0,0,1|2,0,0]=4 4579 B13R1.35 COc1ccc(cc1F)CC(=O)O Amb1216490 [0,1,0,0,0,1|1,0,0]=3 4580 B13R1.35 COc1ccc(cc1F)NC(C)C Amb13952323 [0,1,0,0,0,1|1,0,1]=4 4581 B13R1.35 COc1ccc(cc1F)NC(N)=N Amb18325744 [0,1,0,0,0,1|2,0,0]=4 4582 B13R1.35 COc1ccc(cc1N)CC(C)C Amb17138908 [0,1,0,0,0,1|1,0,1]=4 4583 B13R1.35 COc1ccc(cc1N)NC(=O)C Amb2196479 [0,1,0,0,0,1|0,0,0]=2 4584 B13R1.35 COc1ccc(cc1N)NC(C)O Amb24710235 [0,1,0,0,0,1|0,0,2]=4 4585 B13R1.35 COc1ccc(cc1N)NC(N)=N Amb25226866 [0,1,0,0,0,1|2,0,0]=4 4586 B13R1.35 COc1ccc(cc1N)OC(C)C Amb18554915 [0,1,0,0,0,1|1,0,1]=4 4587 B13R1.35 COc1ccc(cc1N)OC(N)=O Amb24752789 [0,1,0,0,0,1|1,0,0]=3 4588 B13R1.35 COc1ccc(cc1N)SC(C)C Amb23537930 [0,1,0,0,0,1|1,0,1]=4 4589 B13R1.35 COc1ccc(cc1O)NC(N)=O Amb24489143 [0,1,0,0,0,1|1,0,0]=3 4590 B13R1.35 COc1ccc(cc1O)OC(C)C Amb18554905 [0,1,0,0,0,1|1,0,1]=4 4591 B13R1.35 CS(=O)Cc1ccc(OC)c(Cl)c1 Amb25669008 [0,1,0,0,0,1|1,0,0]=3 4592 B13R1.35 CS(=O)Cc1ccc(OC)c(N)c1 Amb18974595 [0,1,0,0,0,1|1,0,0]=3 4593 B13R1.35 CSc1ccc(CC(O)=O)cc1F Amb24445369 [0,1,0,0,0,1|1,1,0]=4 4594 B13R1.35 CSc1ccc(CC(O)=O)cc1N Amb25786368 [0,1,0,0,0,1|1,1,0]=4 4595 B13R1.35 CSc1ccc(cc1Cl)CC(=O)O Amb16231617 [0,1,0,0,0,1|1,1,0]=4 4596 B13R1.35 CSc1ccc(cc1O)NC(N)=O Amb25826724 [0,1,0,0,0,1|1,1,0]=4 4597 B13R1.35 Cc1cc(CC(=O)Cl)ccc1OC Amb22642138 [0,1,0,0,0,1|1,0,0]=3 4598 B13R1.35 Cc1cc(CC(C)=O)ccc1CBr Amb25364406 [0,1,0,0,0,1|2,0,0]=4 4599 B13R1.35 Cc1cc(CC(C)Br)ccc1OC Amb18048813 [0,1,0,0,0,1|1,0,1]=4 4600 B13R1.35 Cc1cc(CC(C)Cl)ccc1OC Amb18049835 [0,1,0,0,0,1|1,0,1]=4 4601 B13R1.35 Cc1cc(CC(C)N)ccc1OC Amb18180985 [0,1,0,0,0,1|1,0,1]=4 4602 B13R1.35 Cc1cc(CC(O)=O)[n]cc1OC Amb24695900 [0,1,0,0,0,1|2,0,0]=4 4603 B13R1.35 Cc1cc(CC(O)=O)c[n]c1OC Amb25245218 [0,1,0,0,0,1|2,0,0]=4 4604 B13R1.35 Cc1cc(CC(O)=O)ccc1CC Amb25109302 [0,1,0,0,0,1|2,0,0]=4 4605 B13R1.35 Cc1cc(CN(C)N)ccc1OC Amb18065947 [0,1,0,0,0,1|2,0,0]=4 4606 B13R1.35 Cc1cc(C[C@@H](C)N)ccc1OC Amb25034184 [0,1,0,0,0,1|1,0,1]=4 4607 B13R1.35 Cc1cc(C[C@H](C)N)ccc1OC Amb25069461 [0,1,0,0,0,1|1,0,1]=4 4608 B13R1.35 Cc1cc(ccc1CC)NC(C)=N Amb25735320 [0,1,0,0,0,1|2,0,0]=4 4609 B13R1.35 Cc1cc(ccc1CC)NC(C)=O Amb22348040 [0,1,0,0,0,1|1,0,0]=3 4610 B13R1.35 Cc1cc(ccc1CC)NC(N)=O Amb25830385 [0,1,0,0,0,1|2,0,0]=4 4611 B13R1.35 Cc1cc(ccc1CN)NC(C)=O Amb18909058 [0,1,0,0,0,1|2,0,0]=4 4612 B13R1.35 Cc1cc(ccc1OC)NC(C)=N Amb25830275 [0,1,0,0,0,1|1,0,0]=3 4613 B13R1.35 Cc1cc(ccc1OC)NC(C)C Amb18292455 [0,1,0,0,0,1|1,0,1]=4 4614 B13R1.35 Cc1cc(ccc1OC)NC(N)=N Amb18184511 [0,1,0,0,0,1|2,0,0]=4 4615 B13R1.35 Cc1cc(ccc1OC)NC(N)=O Amb18181069 [0,1,0,0,0,1|1,0,0]=3 4616 B13R1.35 Cc1cc(ccc1OC)NC(N)=S Amb18321475 [0,1,0,0,0,1|1,1,0]=4 4617 B13R1.35 Cc1cc(ccc1OC)OC(C)C Amb24490639 [0,1,0,0,0,1|1,0,1]=4 4618 B13R1.35 Cc1cc(ccc1SC)OC(C)=O Amb24063552 [0,1,0,0,0,1|0,1,0]=3 4619 B13R1.35 O=Cc1ccc(cc1Cl)OC(=O)C Amb16205012 [0,1,0,0,0,1|2,0,0]=4 4620 B13R1.36 CC(=C)C(=O)c1c[n]c(cc1)OC Amb25740747 [0,1,0,0,0,1|2,0,0]=4 4621 B13R1.36 CC(=C)C(=O)c1ccc(CC)cc1 Amb18065533 [0,1,0,0,0,1|2,0,0]=4 4622 B13R1.36 CC(=C)C(=O)c1ccc(cc1)OC Amb18065612 [0,1,0,0,0,1|1,0,0]=3 4623 B13R1.36 CC(=C)C(N)c1ccc(cc1)OC Amb25141455 [0,1,0,0,0,1|1,0,0]=3 4624 B13R1.36 CC(=C)C(N)c1ccc(cc1)SC Amb24603761 [0,1,0,0,0,1|1,1,0]=4 4625 B13R1.36 CC(=C)C(O)c1ccc(CC)cc1 Amb24385674 [0,1,0,0,0,1|2,0,0]=4 4626 B13R1.36 CC(=C)[C@@H](O)c1ccc(cc1)OC Amb24403874 [0,1,0,0,0,1|1,0,0]=3 4627 B13R1.36 CC(=N)N(C)c1ccc(CC)cc1 Amb25099673 [0,1,0,0,0,1|2,0,0]=4 4628 B13R1.36 CC(=O)C(=O)c1ccc(cc1)C#N Amb24380754 [0,1,0,0,0,1|2,0,0]=4 4629 B13R1.36 CC(=O)C(Br)c1ccc(CBr)cc1 Amb25268031 [0,1,0,0,0,1|2,0,0]=4 4630 B13R1.36 CC(=O)C(Br)c1ccc(cc1)C#N Amb25793120 [0,1,0,0,0,1|2,0,0]=4 4631 B13R1.36 CC(=O)C(Br)c1ccc(cc1)OC Amb25808940 [0,1,0,0,0,1|0,0,0]=2 4632 B13R1.36 CC(=O)C(C)c1ccc(CC)cc1 Amb24674553 [0,1,0,0,0,1|1,0,0]=3 4633 B13R1.36 CC(=O)C(C)c1ccc(cc1)C#N Amb25093684 [0,1,0,0,0,1|2,0,0]=4 4634 B13R1.36 CC(=O)C(C)c1ccc(cc1)NC Amb25362298 [0,1,0,0,0,1|1,0,0]=3 4635 B13R1.36 CC(=O)C(C)c1ccc(cc1)OC Amb20623437 [0,1,0,0,0,1|0,0,0]=2 4636 B13R1.36 CC(=O)C(Cl)c1ccc(cc1)OC Amb21864785 [0,1,0,0,0,1|0,0,0]=2 4637 B13R1.36 CC(=O)C(N)c1c[n]c(cc1)OC Amb24346927 [0,1,0,0,0,1|1,0,0]=3 4638 B13R1.36 CC(=O)C(N)c1ccc(cc1)OC Amb25104735 [0,1,0,0,0,1|0,0,0]=2 4639 B13R1.36 CC(=O)C(O)c1ccc(CC)cc1 Amb24513834 [0,1,0,0,0,1|1,0,0]=3 4640 B13R1.36 CC(=O)N(C)c1c[n]c(cc1)OC Amb24354028 [0,1,0,0,0,1|1,0,0]=3 4641 B13R1.36 CC(=O)N(C)c1ccc(CCl)cc1 Amb25360989 [0,1,0,0,0,1|2,0,0]=4 4642 B13R1.36 CC(=O)N(C)c1ccc(c[n]1)OC Amb24421770 [0,1,0,0,0,1|1,0,0]=3 4643 B13R1.36 CC(=O)N(C)c1ccc(cc1)C#N Amb18178102 [0,1,0,0,0,1|2,0,0]=4 4644 B13R1.36 CC(=O)N(C)c1ccc(cc1)NC Amb25850228 [0,1,0,0,0,1|1,0,0]=3 4645 B13R1.36 CC(=O)N(C)c1ccc(cc1)NN Amb25224921 [0,1,0,0,0,1|2,0,0]=4 4646 B13R1.36 CC(=O)N(C)c1ccc(cc1)SC Amb24466671 [0,1,0,0,0,1|0,1,0]=3 4647 B13R1.36 CC(=O)N(N)c1ccc(CC)cc1 Amb18065789 [0,1,0,0,0,1|1,0,0]=3 4648 B13R1.36 CC(=O)N(N)c1ccc(cc1)OC Amb18065921 [0,1,0,0,0,1|0,0,0]=2 4649 B13R1.36 CC(=O)[C@@H](C)c1ccc(cc1)OC Amb25735741 [0,1,0,0,0,1|0,0,0]=2 4650 B13R1.36 CC(=O)[C@H](C)c1ccc(cc1)OC Amb24706776 [0,1,0,0,0,1|0,0,0]=2 4651 B13R1.36 CC(=O)[C@H](O)c1ccc(CC)cc1 Amb24735130 [0,1,0,0,0,1|1,0,0]=3 4652 B13R1.36 CC(=O)[C@H](O)c1ccc(cc1)OC Amb25800996 [0,1,0,0,0,1|0,0,0]=2 4653 B13R1.36 CC(C(C)Cl)c1ccc(cc1)OC Amb24634047 [0,1,0,0,0,1|1,0,1]=4 4654 B13R1.36 CC(C(C)N)c1ccc(cc1)OC Amb20623521 [0,1,0,0,0,1|1,0,1]=4 4655 B13R1.36 CC(C(C)O)c1ccc(cc1)OC Amb25256844 [0,1,0,0,0,1|0,0,2]=4 4656 B13R1.36 CC(C)C(Br)c1ccc(cc1)OC Amb25069818 [0,1,0,0,0,1|1,0,1]=4 4657 B13R1.36 CC(C)C(N)c1ccc(cc1)OC Amb21912551 [0,1,0,0,0,1|1,0,1]=4 4658 B13R1.36 CC(C)[C@@H](N)c1ccc(cc1)OC Amb24594966 [0,1,0,0,0,1|1,0,1]=4 4659 B13R1.36 CC(C)[C@@H](O)c1ccc(cc1)OC Amb25792382 [0,1,0,0,0,1|1,0,1]=4 4660 B13R1.36 CC(C)[C@H](N)c1ccc(cc1)OC Amb25732877 [0,1,0,0,0,1|1,0,1]=4 4661 B13R1.36 CC(F)C(O)c1ccc(cc1)OC Amb25105914 [0,1,0,0,0,1|1,0,1]=4 4662 B13R1.36 CC(N)C(O)c1ccc(cc1)OC Amb22095427 [0,1,0,0,0,1|1,0,1]=4 4663 B13R1.36 CC(O)C(Cl)c1ccc(cc1)OC Amb25835732 [0,1,0,0,0,1|0,0,2]=4 4664 B13R1.36 CC(O)[C@@H](N)c1ccc(cc1)OC Amb25221925 [0,1,0,0,0,1|0,0,2]=4 4665 B13R1.36 CCc1ccc(cc1)C(=C)C(O)=O Amb18065610 [0,1,0,0,0,1|2,0,0]=4 4666 B13R1.36 CCc1ccc(cc1)C(=O)C(=O)C Amb17400547 [0,1,0,0,0,1|1,0,0]=3 4667 B13R1.36 CCc1ccc(cc1)C(C(=O)C)Cl Amb17477474 [0,1,0,0,0,1|1,0,0]=3 4668 B13R1.36 CCc1ccc(cc1)C(C(=O)N)N Amb17335243 [0,1,0,0,0,1|2,0,0]=4 4669 B13R1.36 CCc1ccc(cc1)C(C(=O)O)Cl Amb17236827 [0,1,0,0,0,1|2,0,0]=4 4670 B13R1.36 CCc1ccc(cc1)C(C(=O)O)N Amb2234602 [0,1,0,0,0,1|2,0,0]=4 4671 B13R1.36 CCc1ccc(cc1)C(C(=O)O)O Amb17233663 [0,1,0,0,0,1|2,0,0]=4 4672 B13R1.36 CCc1ccc(cc1)C(C)C(O)=O Amb18024212 [0,1,0,0,0,1|2,0,0]=4 4673 B13R1.36 CCc1ccc(cc1)C(Cl)C(N)=O Amb18330990 [0,1,0,0,0,1|2,0,0]=4 4674 B13R1.36 CCc1ccc(cc1)C(F)C(O)=O Amb25067644 [0,1,0,0,0,1|2,0,0]=4 4675 B13R1.36 CCc1ccc(cc1)C(O)C(N)=O Amb18186333 [0,1,0,0,0,1|2,0,0]=4 4676 B13R1.36 CCc1ccc(cc1)N(C)C(=O)Cl Amb25774029 [0,1,0,0,0,1|2,0,0]=4 4677 B13R1.36 CCc1ccc(cc1)N(C)C(N)=O Amb18790946 [0,1,0,0,0,1|2,0,0]=4 4678 B13R1.36 CCc1ccc(cc1)[C@@H](N)C(O)=O Amb25834862 [0,1,0,0,0,1|2,0,0]=4 4679 B13R1.36 CNc1ccc(cc1)C(=O)C(O)=O Amb24648972 [0,1,0,0,0,1|2,0,0]=4 4680 B13R1.36 COc1c[n]c(cc1)C(C)C(O)=O Amb25670597 [0,1,0,0,0,1|2,0,0]=4 4681 B13R1.36 COc1ccc(c[n]1)C(Cl)C(N)=O Amb25059510 [0,1,0,0,0,1|2,0,0]=4 4682 B13R1.36 COc1ccc(c[n]1)C(N)C(O)=O Amb25117952 [0,1,0,0,0,1|2,0,0]=4 4683 B13R1.36 COc1ccc(c[n]1)[C@H](N)C(O)=O Amb25772440 [0,1,0,0,0,1|2,0,0]=4 4684 B13R1.36 COc1ccc(cc1)C(=C)C(=O)O Amb17322171 [0,1,0,0,0,1|1,0,0]=3 4685 B13R1.36 COc1ccc(cc1)C(=C)C(C)Cl Amb25074660 [0,1,0,0,0,1|1,0,1]=4 4686 B13R1.36 COc1ccc(cc1)C(=C)C(N)=O Amb25180921 [0,1,0,0,0,1|1,0,0]=3 4687 B13R1.36 COc1ccc(cc1)C(=N)N(C)C Amb24362124 [0,1,0,0,0,1|2,0,0]=4 4688 B13R1.36 COc1ccc(cc1)C(=O)C(=C)F Amb25336398 [0,1,0,0,0,1|1,0,1]=4 4689 B13R1.36 COc1ccc(cc1)C(=O)C(=O)C Amb17400649 [0,1,0,0,0,1|0,0,0]=2 4690 B13R1.36 COc1ccc(cc1)C(=O)C(=O)Cl Amb24068581 [0,1,0,0,0,1|1,0,0]=3 4691 B13R1.36 COc1ccc(cc1)C(=O)C(Br)C Amb1885042 [0,1,0,0,0,1|1,0,1]=4 4692 B13R1.36 COc1ccc(cc1)C(=O)C(C)F Amb24084135 [0,1,0,0,0,1|1,0,1]=4 4693 B13R1.36 COc1ccc(cc1)C(=O)C(C)N Amb22499341 [0,1,0,0,0,1|1,0,1]=4 4694 B13R1.36 COc1ccc(cc1)C(=O)C(Cl)C Amb1105700 [0,1,0,0,0,1|1,0,1]=4 4695 B13R1.36 COc1ccc(cc1)C(=O)N(C)N Amb25815277 [0,1,0,0,0,1|2,0,0]=4 4696 B13R1.36 COc1ccc(cc1)C(=O)[C@@H](C)Cl Amb24068211 [0,1,0,0,0,1|1,0,1]=4 4697 B13R1.36 COc1ccc(cc1)C(=O)[C@@H](C)F Amb24068214 [0,1,0,0,0,1|1,0,1]=4 4698 B13R1.36 COc1ccc(cc1)C(=O)[C@H](C)Cl Amb25189801 [0,1,0,0,0,1|1,0,1]=4 4699 B13R1.36 COc1ccc(cc1)C(=O)[C@H](C)O Amb24583762 [0,1,0,0,0,1|0,0,2]=4 4700 B13R1.36 COc1ccc(cc1)C(=S)N(C)C Amb1078626 [0,1,0,0,0,1|2,0,0]=4 4701 B13R1.36 COc1ccc(cc1)C(Br)C(O)=O Amb18135477 [0,1,0,0,0,1|1,0,0]=3 4702 B13R1.36 COc1ccc(cc1)C(C(=O)N)N Amb17335409 [0,1,0,0,0,1|1,0,0]=3 4703 B13R1.36 COc1ccc(cc1)C(C(=O)O)C Amb10565407 [0,1,0,0,0,1|1,0,0]=3 4704 B13R1.36 COc1ccc(cc1)C(C(=O)O)Cl Amb17237175 [0,1,0,0,0,1|1,0,0]=3 4705 B13R1.36 COc1ccc(cc1)C(C(=O)O)N Amb1203273 [0,1,0,0,0,1|1,0,0]=3 4706 B13R1.36 COc1ccc(cc1)C(C(C)C)Cl Amb17139738 [0,1,0,0,0,1|1,0,1]=4 4707 B13R1.36 COc1ccc(cc1)C(C(C)C)O Amb17138971 [0,1,0,0,0,1|1,0,1]=4 4708 B13R1.36 COc1ccc(cc1)C(C(O)C)O Amb15770134 [0,1,0,0,0,1|0,0,2]=4 4709 B13R1.36 COc1ccc(cc1)C(C)C(=O)Cl Amb25134814 [0,1,0,0,0,1|1,0,0]=3 4710 B13R1.36 COc1ccc(cc1)C(Cl)C(=O)Cl Amb24668984 [0,1,0,0,0,1|1,0,0]=3 4711 B13R1.36 COc1ccc(cc1)C(Cl)C(N)=O Amb19090069 [0,1,0,0,0,1|1,0,0]=3 4712 B13R1.36 COc1ccc(cc1)C(N)C(N)=S Amb24433880 [0,1,0,0,0,1|1,1,0]=4 4713 B13R1.36 COc1ccc(cc1)C(N)N(C)C Amb25314385 [0,1,0,0,0,1|2,0,0]=4 4714 B13R1.36 COc1ccc(cc1)C(N)P(O)=O Amb25131190 [0,1,0,0,0,1|2,0,0]=4 4715 B13R1.36 COc1ccc(cc1)C(O)C(=C)Cl Amb24495967 [0,1,0,0,0,1|1,0,1]=4 4716 B13R1.36 COc1ccc(cc1)C(O)C(N)=N Amb24084345 [0,1,0,0,0,1|2,0,0]=4 4717 B13R1.36 COc1ccc(cc1)C(O)C(N)=O Amb18186779 [0,1,0,0,0,1|1,0,0]=3 4718 B13R1.36 COc1ccc(cc1)C(O)N(C)C Amb24353071 [0,1,0,0,0,1|2,0,0]=4 4719 B13R1.36 COc1ccc(cc1)N(C(=O)C)C Amb2583264 [0,1,0,0,0,1|0,0,0]=2 4720 B13R1.36 COc1ccc(cc1)N(C)C(=O)Cl Amb24641134 [0,1,0,0,0,1|1,0,0]=3 4721 B13R1.36 COc1ccc(cc1)N(C)C(N)=N Amb18178707 [0,1,0,0,0,1|2,0,0]=4 4722 B13R1.36 COc1ccc(cc1)N(C)C(N)=O Amb18178819 [0,1,0,0,0,1|1,0,0]=3 4723 B13R1.36 COc1ccc(cc1)N(C)C(N)=S Amb18318091 [0,1,0,0,0,1|1,1,0]=4 4724 B13R1.36 COc1ccc(cc1)P(Cl)N(C)C Amb25738638 [0,1,0,0,0,1|2,0,0]=4 4725 B13R1.36 COc1ccc(cc1)[C@@H](N)C(N)=O Amb20670558 [0,1,0,0,0,1|1,0,0]=3 4726 B13R1.36 COc1ccc(cc1)[C@@H](N)C(O)=O Amb22750711 [0,1,0,0,0,1|1,0,0]=3 4727 B13R1.36 COc1ccc(cc1)[C@H](C(=O)O)O Amb16231635 [0,1,0,0,0,1|1,0,0]=3 4728 B13R1.36 COc1ccc(cc1)[C@H](C)C(O)=O Amb24382725 [0,1,0,0,0,1|1,0,0]=3 4729 B13R1.36 COc1ccc(cc1)[C@H](O)C(O)=O Amb20240718 [0,1,0,0,0,1|1,0,0]=3 4730 B13R1.36 CSc1ccc(cc1)C(=O)C(O)=O Amb18864062 [0,1,0,0,0,1|1,1,0]=4 4731 B13R1.36 CSc1ccc(cc1)C(C(=O)O)N Amb1839379 [0,1,0,0,0,1|1,1,0]=4 4732 B13R1.36 CSc1ccc(cc1)C(C)C(O)=O Amb18894546 [0,1,0,0,0,1|1,1,0]=4 4733 B13R1.36 CSc1ccc(cc1)C(Cl)C(O)=O Amb18225593 [0,1,0,0,0,1|1,1,0]=4 4734 B13R1.36 CSc1ccc(cc1)C(F)C(O)=O Amb25315970 [0,1,0,0,0,1|1,1,0]=4 4735 B13R1.36 CSc1ccc(cc1)C(N)C(N)=O Amb18292744 [0,1,0,0,0,1|1,1,0]=4 4736 B13R1.36 CSc1ccc(cc1)C(O)C(N)=O Amb18330837 [0,1,0,0,0,1|1,1,0]=4 4737 B13R1.36 CSc1ccc(cc1)C(O)C(O)=O Amb18973697 [0,1,0,0,0,1|1,1,0]=4 4738 B13R1.36 C[C@@H](F)C(O)c1ccc(cc1)OC Amb25852947 [0,1,0,0,0,1|1,0,1]=4 4739 B13R1.36 C[C@@H](N)[C@@H](O)c1ccc(cc1)OC Amb25775010 [0,1,0,0,0,1|1,0,1]=4 4740 B13R1.36 C[C@@H](O)[C@H](N)c1ccc(cc1)OC Amb25674754 [0,1,0,0,0,1|0,0,2]=4 4741 B13R1.36 C[C@@H](O)[C@H](O)c1ccc(cc1)OC Amb25739688 [0,1,0,0,0,1|0,0,2]=4 4742 B13R1.36 C[C@@H]([C@H](C)O)c1ccc(cc1)OC Amb25077935 [0,1,0,0,0,1|0,0,2]=4 4743 B13R1.36 C[C@H](N)[C@@H](N)c1ccc(cc1)OC Amb25242651 [0,1,0,0,0,1|1,0,1]=4 4744 B13R1.36 C[C@H](O)[C@@H](N)c1ccc(cc1)OC Amb24351156 [0,1,0,0,0,1|0,0,2]=4 4745 B13R1.36 C[C@H](O)[C@@H](O)c1ccc(cc1)OC Amb25792444 [0,1,0,0,0,1|0,0,2]=4 4746 B13R1.36 C[C@H](O)[C@H](N)c1ccc(cc1)OC Amb24426833 [0,1,0,0,0,1|0,0,2]=4 4747 B13R1.36 C[C@H]([C@@H](C)O)c1ccc(cc1)OC Amb24495547 [0,1,0,0,0,1|0,0,2]=4 4748 B13R1.142 CC(=N)Nc1c[n]c(cc1)OCC Amb25704066 [0,1,0,0,0,1|2,0,0]=4 4749 B13R1.142 CC(=N)Nc1ccc(COC)cc1 Amb25673752 [0,1,0,0,0,1|1,0,0]=3 4750 B13R1.142 CC(=N)Nc1ccc(cc1)OCC Amb25187702 [0,1,0,0,0,1|1,0,0]=3 4751 B13R1.142 CC(=O)Cc1ccc(CCC)cc1 Amb18893607 [0,1,0,0,0,1|1,0,0]=3 4752 B13R1.142 CC(=O)Cc1ccc(cc1)NCC Amb24358004 [0,1,0,0,0,1|1,0,0]=3 4753 B13R1.142 CC(=O)Cc1ccc(cc1)SCC Amb18894441 [0,1,0,0,0,1|0,1,0]=3 4754 B13R1.142 CC(=O)Nc1c[n]c(cc1)SCC Amb25072354 [0,1,0,0,0,1|1,1,0]=4 4755 B13R1.142 CC(=O)Nc1ccc(C=C=C)cc1 Amb24434963 [0,1,0,0,0,1|1,0,1]=4 4756 B13R1.142 CC(=O)Nc1ccc(CC=C)cc1 Amb25277281 [0,1,0,0,0,1|1,0,1]=4 4757 B13R1.142 CC(=O)Nc1ccc(CCBr)cc1 Amb18049148 [0,1,0,0,0,1|1,0,0]=3 4758 B13R1.142 CC(=O)Nc1ccc(CCC)[n]c1 Amb24716749 [0,1,0,0,0,1|2,0,0]=4 4759 B13R1.142 CC(=O)Nc1ccc(CCCl)cc1 Amb18049561 [0,1,0,0,0,1|1,0,0]=3 4760 B13R1.142 CC(=O)Nc1ccc(COC)cc1 Amb25375669 [0,1,0,0,0,1|0,0,0]=2 4761 B13R1.142 CC(=O)Nc1ccc(c[n]1)OCC Amb24741727 [0,1,0,0,0,1|1,0,0]=3 4762 B13R1.142 CC(=O)Nc1ccc(cc1)N=[N+]=[N-] Amb24117467 [0,1,0,0,0,1|2,0,0]=4 4763 B13R1.142 CC(=O)Nc1ccc(cc1)NC#N Amb18185885 [0,1,0,0,0,1|1,0,1]=4 4764 B13R1.142 CC(=O)Nc1ccc(cc1)OC#N Amb25192463 [0,1,0,0,0,1|0,0,1]=3 4765 B13R1.142 CC(=O)Nc1ccc(cc1)OC=C Amb24073213 [0,1,0,0,0,1|0,0,1]=3 4766 B13R1.142 CC(=O)Nc1ccc(cc1)OC=O Amb24599433 [0,1,0,0,0,1|0,0,1]=3 4767 B13R1.142 CC(=O)Nc1ccc(cc1)OCCl Amb24610389 [0,1,0,0,0,1|0,0,0]=2 4768 B13R1.142 CC(=O)Nc1ccc(cc1)OC[13CH3] Amb22338414 [0,1,0,0,0,1|0,0,0]=2 4769 B13R1.142 CC(=O)Nc1ccc(cc1)O[13CH2]C Amb22353355 [0,1,0,0,0,1|0,0,0]=2 4770 B13R1.142 CC(=O)Nc1ccc(cc1)SC#N Amb24639090 [0,1,0,0,0,1|0,1,1]=4 4771 B13R1.142 CC(=O)Nc1ccc(cc1)SCC Amb25760777 [0,1,0,0,0,1|0,1,0]=3 4772 B13R1.142 CC(=O)Nc1ccc(cc1)SCCl Amb25231392 [0,1,0,0,0,1|0,1,0]=3 4773 B13R1.142 CC(=O)Nc1ccc(cc1)SSC Amb25772934 [0,1,0,0,0,1|0,1,0]=3 4774 B13R1.142 CC(=O)Oc1ccc(CC#N)cc1 Amb25052631 [0,1,0,0,0,1|1,0,1]=4 4775 B13R1.142 CC(=O)Oc1ccc(cc1)C#[N+][O-] Amb24103256 [0,1,0,0,0,1|2,0,0]=4 4776 B13R1.142 CC(=O)Oc1ccc(cc1)N=[N+]=[N-] Amb25276559 [0,1,0,0,0,1|2,0,0]=4 4777 B13R1.142 CC(=O)Oc1ccc(cc1)NC#N Amb25275255 [0,1,0,0,0,1|1,0,1]=4 4778 B13R1.142 CC(=S)Nc1ccc(cc1)OCC Amb25326132 [0,1,0,0,0,1|0,1,0]=3 4779 B13R1.142 CCCc1ccc(cc1)CC(=O)N Amb17400622 [0,1,0,0,0,1|2,0,0]=4 4780 B13R1.142 CCNc1ccc(cc1)CC(=O)O Amb17305894 [0,1,0,0,0,1|2,0,0]=4 4781 B13R1.142 CCOc1ccc(C=C(Br)Br)cc1 Amb18117917 [0,1,0,0,0,1|2,0,0]=4 4782 B13R1.142 CCOc1ccc(CC(C)Br)cc1 Amb18048899 [0,1,0,0,0,1|1,0,1]=4 4783 B13R1.142 CCOc1ccc(CC(C)[*])cc1 Amb24107715 [0,1,0,0,0,1|1,0,1]=4 4784 B13R1.142 CCOc1ccc(CC(N)=N)cc1 Amb21972128 [0,1,0,0,0,1|2,0,0]=4 4785 B13R1.142 CCOc1ccc(CC(O)=O)[n]c1 Amb19516380 [0,1,0,0,0,1|2,0,0]=4 4786 B13R1.142 CCOc1ccc(CC(O)=O)c[n]1 Amb19889822 [0,1,0,0,0,1|2,0,0]=4 4787 B13R1.142 CCOc1ccc(CN(C)N)cc1 Amb18065946 [0,1,0,0,0,1|2,0,0]=4 4788 B13R1.142 CCOc1ccc(cc1)CC(=O)Cl Amb17143206 [0,1,0,0,0,1|1,0,0]=3 4789 B13R1.142 CCOc1ccc(cc1)CC(=O)O Amb1205936 [0,1,0,0,0,1|1,0,0]=3 4790 B13R1.142 CCOc1ccc(cc1)CC(O)C Amb17477405 [0,1,0,0,0,1|0,0,2]=4 4791 B13R1.142 CCOc1ccc(cc1)NC(=N)Cl Amb24444897 [0,1,0,0,0,1|2,0,0]=4 4792 B13R1.142 CCOc1ccc(cc1)NC(=N)N Amb10879738 [0,1,0,0,0,1|2,0,0]=4 4793 B13R1.142 CCOc1ccc(cc1)NC(=O)C Amb1286082 [0,1,0,0,0,1|0,0,0]=2 4794 B13R1.142 CCOc1ccc(cc1)NC(=O)Cl Amb25290270 [0,1,0,0,0,1|1,0,0]=3 4795 B13R1.142 CCOc1ccc(cc1)NC(=O)N Amb1195896 [0,1,0,0,0,1|1,0,0]=3 4796 B13R1.142 CCOc1ccc(cc1)NC(=S)N Amb1638123 [0,1,0,0,0,1|1,1,0]=4 4797 B13R1.142 CCOc1ccc(cc1)NC(N)=N Amb23521681 [0,1,0,0,0,1|2,0,0]=4 4798 B13R1.142 CCOc1ccc(cc1)NC(O)=S Amb25322488 [0,1,0,0,0,1|1,0,1]=4 4799 B13R1.142 CCOc1ccc(cc1)NC(S)=S Amb24068551 [0,1,0,0,0,1|1,1,0]=4 4800 B13R1.142 CCSc1ccc(CC(N)=O)cc1 Amb18894402 [0,1,0,0,0,1|1,1,0]=4 4801 B13R1.142 CCSc1ccc(cc1)NC(N)=O Amb18894549 [0,1,0,0,0,1|1,1,0]=4 4802 B13R1.142 CNCc1ccc(cc1)NC(=O)C Amb1119302 [0,1,0,0,0,1|1,0,0]=3 4803 B13R1.142 CNCc1ccc(cc1)NC(N)=O Amb24380457 [0,1,0,0,0,1|2,0,0]=4 4804 B13R1.142 CNCc1ccc(cc1)NS(C)=O Amb25359765 [0,1,0,0,0,1|2,0,0]=4 4805 B13R1.142 COCc1ccc(C=C(Br)Br)cc1 Amb25803775 [0,1,0,0,0,1|2,0,0]=4 4806 B13R1.142 COCc1ccc(cc1)NC(N)=O Amb25711739 [0,1,0,0,0,1|1,0,0]=3 4807 B13R1.142 CS(=O)Nc1ccc(CCO)cc1 Amb25177421 [0,1,0,0,0,1|2,0,0]=4 4808 B13R1.142 NC(=O)Nc1ccc(CCN)cc1 Amb18296238 [0,1,0,0,0,1|2,0,0]=4 4809 B13R1.142 NC(=O)Nc1ccc(CCO)cc1 Amb18178810 [0,1,0,0,0,1|2,0,0]=4 4810 B13R1.142 NCCc1ccc(CC(O)=O)cc1 Amb19367425 [0,1,0,0,0,1|2,0,0]=4 4811 B13R1.142 NCCc1ccc(CC(O)=O)cc1 Amb21811886 [0,1,0,0,0,1|2,0,0]=4 4812 B13R1.142 NOCc1ccc(CC(O)=O)cc1 Amb22896551 [0,1,0,0,0,1|2,0,0]=4 4813 B13R1.585 CC(=C)c1ccc(CC(O)=O)cc1 Amb25716298 [0,1,0,0,0,1|2,0,0]=4 4814 B13R1.585 CC(=C)c1ccc(cc1)OC(=O)Cl Amb24518818 [0,1,0,0,0,1|2,0,0]=4 4815 B13R1.585 CC(=O)C[n+]1ccc(cc1)N(C)C Amb25722234 [0,1,0,0,0,1|2,0,0]=4 4816 B13R1.585 CC(=O)Cc1ccc(cc1)B(O)O Amb24437716 [0,1,0,0,0,1|2,0,0]=4 4817 B13R1.585 CC(=O)Cc1ccc(cc1)C(=O)Cl Amb24102768 [0,1,0,0,0,1|2,0,0]=4 4818 B13R1.585 CC(=O)Cc1ccc(cc1)C(F)F Amb25228043 [0,1,0,0,0,1|2,0,0]=4 4819 B13R1.585 CC(=O)Nc1ccc(c[n]1)C(C)=O Amb25063719 [0,1,0,0,0,1|2,0,0]=4 4820 B13R1.585 CC(=O)Nc1ccc(c[n]1)N(C)C Amb25103259 [0,1,0,0,0,1|2,0,0]=4 4821 B13R1.585 CC(=O)Nc1ccc(c[n]1)[C@@H](C)N Amb25094496 [0,1,0,0,0,1|2,0,0]=4 4822 B13R1.585 CC(=O)Nc1ccc(c[n]1)[C@H](C)N Amb25073441 [0,1,0,0,0,1|2,0,0]=4 4823 B13R1.585 CC(=O)Nc1ccc(cc1)C(=C)Br Amb24092429 [0,1,0,0,0,1|1,0,1]=4 4824 B13R1.585 CC(=O)Nc1ccc(cc1)C(=O)O Amb1212283 [0,1,0,0,0,1|2,0,0]=4 4825 B13R1.585 CC(=O)Nc1ccc(cc1)C(C)N Amb22754663 [0,1,0,0,0,1|1,0,0]=3 4826 B13R1.585 CC(=O)Nc1ccc(cc1)C(N)=N Amb22049816 [0,1,0,0,0,1|2,0,0]=4 4827 B13R1.585 CC(=O)Nc1ccc(cc1)S(=O)Cl Amb18067148 [0,1,0,0,0,1|1,1,0]=4 4828 B13R1.585 CC(=O)Nc1ccc(cc1)S(O)=O Amb22274124 [0,1,0,0,0,1|1,1,0]=4 4829 B13R1.585 CC(=O)Nc1ccc(cc1)[C@@H](C)N Amb22831142 [0,1,0,0,0,1|1,0,0]=3 4830 B13R1.585 CC(=O)Nc1ccc(cc1)[C@@H](C)O Amb25125803 [0,1,0,0,0,1|1,0,0]=3 4831 B13R1.585 CC(=O)Nc1ccc(cc1)[C@H](C)O Amb24409684 [0,1,0,0,0,1|1,0,0]=3 4832 B13R1.585 CC(=O)Nc1ccc(cc1)[N+](=O)[O-] Amb1771585 [0,1,0,0,0,1|2,0,0]=4 4833 B13R1.585 CC(=O)Oc1ccc(cc1)C(C)=C Amb24496161 [0,1,0,0,0,1|1,0,0]=3 4834 B13R1.585 CC(=O)Oc1ccc(cc1)C(O)C Amb17594613 [0,1,0,0,0,1|1,0,0]=3 4835 B13R1.585 CC(=O)Oc1ccc(cc1)[C@H](C)N Amb24763679 [0,1,0,0,0,1|1,0,0]=3 4836 B13R1.585 CC(=O)Sc1ccc(cc1)C(=O)C Amb17595109 [0,1,0,0,0,1|1,0,0]=3 4837 B13R1.585 CC(=O)Sc1ccc(cc1)C(=O)Cl Amb25797807 [0,1,0,0,0,1|2,0,0]=4 4838 B13R1.585 CC(=O)Sc1ccc(cc1)C(O)=O Amb25214138 [0,1,0,0,0,1|2,0,0]=4 4839 B13R1.585 CC(=O)c1ccc(CC(=O)Cl)cc1 Amb25045485 [0,1,0,0,0,1|2,0,0]=4 4840 B13R1.585 CC(=O)c1ccc(CC(C)=O)cc1 Amb24491401 [0,1,0,0,0,1|1,0,0]=3 4841 B13R1.585 CC(=O)c1ccc(c[n]1)NC(C)=O Amb25303418 [0,1,0,0,0,1|2,0,0]=4 4842 B13R1.585 CC(=O)c1ccc(cc1)OC(=O)Cl Amb25330647 [0,1,0,0,0,1|2,0,0]=4 4843 B13R1.585 CC(=S)Nc1ccc(cc1)C(C)C Amb24490203 [0,1,0,0,0,1|1,1,0]=4 4844 B13R1.585 CC(=S)Nc1ccc(cc1)N(C)C Amb25828379 [0,1,0,0,0,1|1,1,0]=4 4845 B13R1.585 CC(C)c1ccc(CC(=O)Cl)cc1 Amb22642150 [0,1,0,0,0,1|2,0,0]=4 4846 B13R1.585 CC(C)c1ccc(cc1)NC(=O)Cl Amb24566150 [0,1,0,0,0,1|2,0,0]=4 4847 B13R1.585 CC(C)c1ccc(cc1)OC(N)=O Amb25794459 [0,1,0,0,0,1|2,0,0]=4 4848 B13R1.585 CC(Cl)c1ccc(CC(O)=O)cc1 Amb24433916 [0,1,0,0,0,1|2,0,0]=4 4849 B13R1.585 CC(N)c1ccc(CC(O)=O)cc1 Amb25116638 [0,1,0,0,0,1|2,0,0]=4 4850 B13R1.585 CC(O)c1ccc(CC(O)=O)cc1 Amb25053903 [0,1,0,0,0,1|2,0,0]=4 4851 B13R1.585 CC(c1ccc(cc1)CC(=O)N)C Amb17400617 [0,1,0,0,0,1|2,0,0]=4 4852 B13R1.585 CC(c1ccc(cc1)CC(=O)O)C Amb2209373 [0,1,0,0,0,1|2,0,0]=4 4853 B13R1.585 CN(C)c1ccc(CC(=O)Cl)cc1 Amb24496088 [0,1,0,0,0,1|2,0,0]=4 4854 B13R1.585 CS(=O)Cc1ccc(cc1)C(C)C Amb25215637 [0,1,0,0,0,1|2,0,0]=4 4855 B13R1.585 C[C@@H](N)c1ccc(CC(O)=O)cc1 Amb24513539 [0,1,0,0,0,1|2,0,0]=4 4856 B13R1.585 C[C@@H](N)c1ccc(cc1)NC(N)=O Amb24435528 [0,1,0,0,0,1|2,0,0]=4 4857 B13R1.585 C[C@@H](O)c1ccc(cc1)NC(N)=O Amb24763757 [0,1,0,0,0,1|2,0,0]=4 4858 B13R1.585 C[C@H](N)c1ccc(CC(O)=O)cc1 Amb25667710 [0,1,0,0,0,1|2,0,0]=4 4859 B13R1.585 C[C@H](N)c1ccc(cc1)NC(N)=O Amb24346826 [0,1,0,0,0,1|2,0,0]=4 4860 B13R1.585 NC(=O)Nc1ccc(cc1)C(N)C Amb1141666 [0,1,0,0,0,1|2,0,0]=4 4861 B13R1.585 OB(c1ccc(cc1)NC(=O)C)O Amb2455621 [0,1,0,0,0,1|2,0,0]=4 4862 B13R1.585 OB(c1ccc(cc1)OC(=O)C)O Amb10071109 [0,1,0,0,0,1|2,0,0]=4 4863 B13R1.653 CC(=C)Cc1ccc(cc1O)OC Amb24090222 [0,1,0,0,0,1|1,0,0]=3 4864 B13R1.653 CC(=O)Cc1ccc(CBr)cc1O Amb24638192 [0,1,0,0,0,1|2,0,0]=4 4865 B13R1.653 CC(=O)Cc1ccc(CBr)cc1S Amb25238844 [0,1,0,0,0,1|2,0,0]=4 4866 B13R1.653 CC(=O)Cc1ccc(CC)cc1Br Amb24549325 [0,1,0,0,0,1|1,0,0]=3 4867 B13R1.653 CC(=O)Cc1ccc(CC)cc1Cl Amb24610838 [0,1,0,0,0,1|1,0,0]=3 4868 B13R1.653 CC(=O)Cc1ccc(CCl)cc1Cl Amb25223420 [0,1,0,0,0,1|2,0,0]=4 4869 B13R1.653 CC(=O)Cc1ccc(CCl)cc1N Amb25268346 [0,1,0,0,0,1|2,0,0]=4 4870 B13R1.653 CC(=O)Cc1ccc(CF)cc1Br Amb25223433 [0,1,0,0,0,1|2,0,0]=4 4871 B13R1.653 CC(=O)Cc1ccc(CO)cc1I Amb24669594 [0,1,0,0,0,1|2,0,0]=4 4872 B13R1.653 CC(=O)Cc1ccc(CO)cc1O Amb24527819 [0,1,0,0,0,1|2,0,0]=4 4873 B13R1.653 CC(=O)Cc1ccc(cc1Cl)C=O Amb24656418 [0,1,0,0,0,1|2,0,0]=4 4874 B13R1.653 CC(=O)Cc1ccc(cc1Cl)OC Amb18894606 [0,1,0,0,0,1|0,0,0]=2 4875 B13R1.653 CC(=O)Cc1ccc(cc1I)C#N Amb25309702 [0,1,0,0,0,1|2,0,0]=4 4876 B13R1.653 CC(=O)Cc1ccc(cc1I)C=O Amb24611585 [0,1,0,0,0,1|2,0,0]=4 4877 B13R1.653 CC(=O)Cc1ccc(cc1N)SC Amb24638310 [0,1,0,0,0,1|0,1,0]=3 4878 B13R1.653 CC(=O)Cc1ccc(cc1O)C#N Amb25216232 [0,1,0,0,0,1|2,0,0]=4 4879 B13R1.653 CC(=O)Cc1ccc(cc1O)OC Amb22002281 [0,1,0,0,0,1|0,0,0]=2 4880 B13R1.653 CC(=O)Nc1ccc(CC)cc1Br Amb25265326 [0,1,0,0,0,1|1,0,0]=3 4881 B13R1.653 CC(=O)Nc1ccc(CC)cc1Cl Amb24534422 [0,1,0,0,0,1|1,0,0]=3 4882 B13R1.653 CC(=O)Nc1ccc(CC)cc1N Amb25225916 [0,1,0,0,0,1|1,0,0]=3 4883 B13R1.653 CC(=O)Nc1ccc(CO)cc1I Amb23402163 [0,1,0,0,0,1|2,0,0]=4 4884 B13R1.653 CC(=O)Nc1ccc(cc1Br)OC Amb19959126 [0,1,0,0,0,1|0,0,0]=2 4885 B13R1.653 CC(=O)Nc1ccc(cc1C)C=O Amb24408964 [0,1,0,0,0,1|2,0,0]=4 4886 B13R1.653 CC(=O)Nc1ccc(cc1C)N=O Amb25689492 [0,1,0,0,0,1|2,0,0]=4 4887 B13R1.653 CC(=O)Nc1ccc(cc1Cl)C=O Amb21864777 [0,1,0,0,0,1|2,0,0]=4 4888 B13R1.653 CC(=O)Nc1ccc(cc1Cl)N=O Amb24490347 [0,1,0,0,0,1|2,0,0]=4 4889 B13R1.653 CC(=O)Nc1ccc(cc1Cl)NC Amb18288693 [0,1,0,0,0,1|1,0,0]=3 4890 B13R1.653 CC(=O)Nc1ccc(cc1Cl)OC Amb22456309 [0,1,0,0,0,1|0,0,0]=2 4891 B13R1.653 CC(=O)Nc1ccc(cc1Cl)SC Amb20665880 [0,1,0,0,0,1|0,1,0]=3 4892 B13R1.653 CC(=O)Nc1ccc(cc1F)C#C Amb19944468 [0,1,0,0,0,1|1,0,1]=4 4893 B13R1.653 CC(=O)Nc1ccc(cc1F)C#N Amb18128064 [0,1,0,0,0,1|2,0,0]=4 4894 B13R1.653 CC(=O)Nc1ccc(cc1F)C=O Amb18128806 [0,1,0,0,0,1|2,0,0]=4 4895 B13R1.653 CC(=O)Nc1ccc(cc1F)OC Amb24071990 [0,1,0,0,0,1|0,0,0]=2 4896 B13R1.653 CC(=O)Nc1ccc(cc1F)SC Amb25258903 [0,1,0,0,0,1|0,1,0]=3 4897 B13R1.653 CC(=O)Nc1ccc(cc1I)C#N Amb23402164 [0,1,0,0,0,1|2,0,0]=4 4898 B13R1.653 CC(=O)Nc1ccc(cc1N)C#N Amb25160603 [0,1,0,0,0,1|2,0,0]=4 4899 B13R1.653 CC(=O)Nc1ccc(cc1O)SC Amb24073132 [0,1,0,0,0,1|0,1,0]=3 4900 B13R1.653 CC(=O)Oc1ccc(CCl)cc1Cl Amb25287254 [0,1,0,0,0,1|2,0,0]=4 4901 B13R1.653 CC(=O)Oc1ccc(cc1Br)C#N Amb18136405 [0,1,0,0,0,1|2,0,0]=4 4902 B13R1.653 CC(=O)Oc1ccc(cc1Br)C=O Amb24728269 [0,1,0,0,0,1|2,0,0]=4 4903 B13R1.653 CC(=O)Oc1ccc(cc1Br)OC Amb20242653 [0,1,0,0,0,1|0,0,0]=2 4904 B13R1.653 CC(=O)Oc1ccc(cc1C)C=O Amb24529603 [0,1,0,0,0,1|2,0,0]=4 4905 B13R1.653 CC(=O)Oc1ccc(cc1F)OC Amb25349774 [0,1,0,0,0,1|0,0,0]=2 4906 B13R1.653 CC(=O)Oc1ccc(cc1F)SC Amb24492072 [0,1,0,0,0,1|0,1,0]=3 4907 B13R1.653 CC(=O)Oc1ccc(cc1I)C#N Amb24505645 [0,1,0,0,0,1|2,0,0]=4 4908 B13R1.653 CC(=O)Oc1ccc(cc1O)C=O Amb24070286 [0,1,0,0,0,1|2,0,0]=4 4909 B13R1.653 CC(=O)Oc1ccc(cc1O)SC Amb25281634 [0,1,0,0,0,1|0,1,0]=3 4910 B13R1.653 CC(C)=Cc1ccc(cc1N)OC Amb24071518 [0,1,0,0,0,1|1,0,0]=3 4911 B13R1.653 CCc1cc(Br)c(CC(O)=O)cc1 Amb25112182 [0,1,0,0,0,1|2,0,0]=4 4912 B13R1.653 CCc1cc(N)c(CC(O)=O)cc1 Amb25244094 [0,1,0,0,0,1|2,0,0]=4 4913 B13R1.653 CCc1cc(N)c(cc1)OC(N)=O Amb25172471 [0,1,0,0,0,1|2,0,0]=4 4914 B13R1.653 CNc1cc(O)c(cc1)NC(N)=O Amb25376960 [0,1,0,0,0,1|2,0,0]=4 4915 B13R1.653 CNc1ccc(NC(C)=O)c(C)c1 Amb18288713 [0,1,0,0,0,1|1,0,0]=3 4916 B13R1.653 COc1cc(Br)c(cc1)NC(N)=O Amb24386614 [0,1,0,0,0,1|1,0,0]=3 4917 B13R1.653 COc1cc(Br)c(cc1)OC(=O)Cl Amb24701049 [0,1,0,0,0,1|1,0,0]=3 4918 B13R1.653 COc1cc(Br)c(cc1)OC(=S)Cl Amb24061151 [0,1,0,0,0,1|1,1,0]=4 4919 B13R1.653 COc1cc(Cl)c(CC(=O)Cl)cc1 Amb25180211 [0,1,0,0,0,1|1,0,0]=3 4920 B13R1.653 COc1cc(Cl)c(cc1)NC(C)C Amb18244108 [0,1,0,0,0,1|1,0,1]=4 4921 B13R1.653 COc1cc(Cl)c(cc1)NC(N)=N Amb18244102 [0,1,0,0,0,1|2,0,0]=4 4922 B13R1.653 COc1cc(Cl)c(cc1)NC(N)=O Amb18894706 [0,1,0,0,0,1|1,0,0]=3 4923 B13R1.653 COc1cc(Cl)c(cc1)NC(N)=S Amb25329644 [0,1,0,0,0,1|1,1,0]=4 4924 B13R1.653 COc1cc(F)c(cc1)NC(C)C Amb18933608 [0,1,0,0,0,1|1,0,1]=4 4925 B13R1.653 COc1cc(F)c(cc1)NC(N)=S Amb25782934 [0,1,0,0,0,1|1,1,0]=4 4926 B13R1.653 COc1cc(I)c(cc1)NC(C)C Amb25235511 [0,1,0,0,0,1|1,0,1]=4 4927 B13R1.653 COc1cc(I)c(cc1)NC(N)=S Amb25134022 [0,1,0,0,0,1|1,1,0]=4 4928 B13R1.653 COc1cc(N)c(C[C@H](C)N)cc1 Amb25278346 [0,1,0,0,0,1|1,0,1]=4 4929 B13R1.653 COc1cc(N)c(cc1)NN(C)C Amb25669243 [0,1,0,0,0,1|2,0,0]=4 4930 B13R1.653 COc1cc(N)c(cc1)SC(C)C Amb24641254 [0,1,0,0,0,1|1,0,1]=4 4931 B13R1.653 COc1cc(O)c(CC(C)O)cc1 Amb18648599 [0,1,0,0,0,1|0,0,2]=4 4932 B13R1.653 COc1cc(O)c(cc1)NC(N)=O Amb18128999 [0,1,0,0,0,1|1,0,0]=3 4933 B13R1.653 COc1cc(O)c(cc1)NC(N)=S Amb25712893 [0,1,0,0,0,1|1,1,0]=4 4934 B13R1.653 COc1ccc(CC(=O)Cl)c(Br)c1 Amb24662571 [0,1,0,0,0,1|1,0,0]=3 4935 B13R1.653 COc1ccc(CC(C)N)c(Br)c1 Amb24358100 [0,1,0,0,0,1|1,0,1]=4 4936 B13R1.653 COc1ccc(CC(C)N)c(Cl)c1 Amb18894641 [0,1,0,0,0,1|1,0,1]=4 4937 B13R1.653 COc1ccc(CC(C)N)c(F)c1 Amb18823325 [0,1,0,0,0,1|1,0,1]=4 4938 B13R1.653 COc1ccc(CC(C)N)c(I)c1 Amb24398704 [0,1,0,0,0,1|1,0,1]=4 4939 B13R1.653 COc1ccc(CC(C)N)c(O)c1 Amb18179044 [0,1,0,0,0,1|1,0,1]=4 4940 B13R1.653 COc1ccc(CC(N)=N)c(F)c1 Amb24644729 [0,1,0,0,0,1|2,0,0]=4 4941 B13R1.653 COc1ccc(CC(N)=O)c(Cl)c1 Amb18894639 [0,1,0,0,0,1|1,0,0]=3 4942 B13R1.653 COc1ccc(CC(O)=O)c(Cl)[n]1 Amb25155111 [0,1,0,0,0,1|2,0,0]=4 4943 B13R1.653 COc1ccc(CC(O)=O)c(I)c1 Amb25308188 [0,1,0,0,0,1|1,0,0]=3 4944 B13R1.653 COc1ccc(CC(O)=O)c(N)c1 Amb24081057 [0,1,0,0,0,1|1,0,0]=3 4945 B13R1.653 COc1ccc(CC(O)=O)c(S)c1 Amb25715827 [0,1,0,0,0,1|1,0,0]=3 4946 B13R1.653 COc1ccc(CN(C)C)c(F)c1 Amb24398296 [0,1,0,0,0,1|2,0,0]=4 4947 B13R1.653 COc1ccc(CN(C)C)c(N)c1 Amb24358401 [0,1,0,0,0,1|2,0,0]=4 4948 B13R1.653 COc1ccc(CN(C)C)c(O)c1 Amb25121734 [0,1,0,0,0,1|2,0,0]=4 4949 B13R1.653 COc1ccc(C[C@@H](C)N)c(Br)c1 Amb25075743 [0,1,0,0,0,1|1,0,1]=4 4950 B13R1.653 COc1ccc(C[C@@H](C)N)c(F)c1 Amb25339187 [0,1,0,0,0,1|1,0,1]=4 4951 B13R1.653 COc1ccc(C[C@@H](C)N)c(O)c1 Amb25756645 [0,1,0,0,0,1|1,0,1]=4 4952 B13R1.653 COc1ccc(C[C@H](C)N)c(Cl)c1 Amb24494207 [0,1,0,0,0,1|1,0,1]=4 4953 B13R1.653 COc1ccc(C[C@H](C)N)c(F)c1 Amb25062442 [0,1,0,0,0,1|1,0,1]=4 4954 B13R1.653 COc1ccc(C[C@H](C)N)c(O)c1 Amb24744114 [0,1,0,0,0,1|1,0,1]=4 4955 B13R1.653 COc1ccc(NC(N)=O)c(Br)[n]1 Amb24529984 [0,1,0,0,0,1|2,0,0]=4 4956 B13R1.653 COc1ccc(NC(N)=O)c(Cl)[n]1 Amb25725172 [0,1,0,0,0,1|2,0,0]=4 4957 B13R1.653 COc1ccc(OC(C)C)c(Br)c1 Amb24638978 [0,1,0,0,0,1|1,0,1]=4 4958 B13R1.653 COc1ccc(OC(C)C)c(Cl)c1 Amb24436840 [0,1,0,0,0,1|1,0,1]=4 4959 B13R1.653 COc1ccc(OC(C)C)c(O)c1 Amb18129026 [0,1,0,0,0,1|1,0,1]=4 4960 B13R1.653 COc1ccc(c(c1)Br)CC(=O)O Amb2235303 [0,1,0,0,0,1|1,0,0]=3 4961 B13R1.653 COc1ccc(c(c1)C)NC(=O)C Amb1205555 [0,1,0,0,0,1|0,0,0]=2 4962 B13R1.653 COc1ccc(c(c1)F)OC(C)C Amb10841526 [0,1,0,0,0,1|1,0,1]=4 4963 B13R1.653 COc1ccc(c(c1)N)NC(=O)C Amb1115696 [0,1,0,0,0,1|0,0,0]=2 4964 B13R1.653 COc1ccc(c(c1)N)NC(=O)N Amb1119039 [0,1,0,0,0,1|1,0,0]=3 4965 B13R1.653 COc1ccc(c(c1)N)OC(C)C Amb1140517 [0,1,0,0,0,1|1,0,1]=4 4966 B13R1.653 COc1ccc(c(c1)O)CC(=O)O Amb13884834 [0,1,0,0,0,1|1,0,0]=3 4967 B13R1.653 CSc1ccc(CC(O)=O)c(Cl)c1 Amb25250724 [0,1,0,0,0,1|1,1,0]=4 4968 B13R1.653 CSc1ccc(CC(O)=O)c(F)c1 Amb24494546 [0,1,0,0,0,1|1,1,0]=4 4969 B13R1.653 Cc1[n]c(ccc1NC(C)=O)OC Amb24098451 [0,1,0,0,0,1|1,0,0]=3 4970 B13R1.653 Cc1cc(CC)ccc1NC(C)=O Amb24682771 [0,1,0,0,0,1|1,0,0]=3 4971 B13R1.653 Cc1cc(CO)ccc1OC(C)=O Amb25057801 [0,1,0,0,0,1|2,0,0]=4 4972 B13R1.653 Cc1cc([n]cc1NC(C)=O)OC Amb20171425 [0,1,0,0,0,1|1,0,0]=3 4973 B13R1.653 Cc1cc(ccc1CC(=O)Cl)OC Amb24733925 [0,1,0,0,0,1|1,0,0]=3 4974 B13R1.653 Cc1cc(ccc1CC(N)=O)OC Amb25097099 [0,1,0,0,0,1|1,0,0]=3 4975 B13R1.653 Cc1cc(ccc1CC(O)=O)SC Amb25308146 [0,1,0,0,0,1|1,1,0]=4 4976 B13R1.653 Cc1cc(ccc1C[C@@H](C)N)OC Amb24341260 [0,1,0,0,0,1|1,0,1]=4 4977 B13R1.653 Cc1cc(ccc1NC(C)=O)SC Amb25290165 [0,1,0,0,0,1|0,1,0]=3 4978 B13R1.653 Cc1cc(ccc1NC(C)C)OC Amb18998985 [0,1,0,0,0,1|1,0,1]=4 4979 B13R1.653 Cc1cc(ccc1NC(N)=N)OC Amb18796136 [0,1,0,0,0,1|2,0,0]=4 4980 B13R1.653 Cc1cc(ccc1NC(N)=O)OC Amb18181083 [0,1,0,0,0,1|1,0,0]=3 4981 B13R1.653 Cc1cc(ccc1NC(N)=S)OC Amb18321483 [0,1,0,0,0,1|1,1,0]=4 4982 B13R1.653 Cc1cc(ccc1OC(C)=O)C#N Amb25367989 [0,1,0,0,0,1|2,0,0]=4 4983 B13R1.653 Cc1cc(ccc1OC(C)=O)SC Amb25034431 [0,1,0,0,0,1|0,1,0]=3 4984 B13R1.653 N#Cc1ccc(c(c1)Br)NC(=O)C Amb10071237 [0,1,0,0,0,1|2,0,0]=4 4985 B13R1.653 N#Cc1ccc(c(c1)Cl)NC(=O)C Amb10071243 [0,1,0,0,0,1|2,0,0]=4 4986 B13R1.5946 CC(=O)N=C1C=CC(O)(C=C1)OC Amb24072404 [0,1,0,0,0,1|0,0,1]=3 4987 B13R1.2176 COC1=CC=CC(=CC1=O)C(C)Cl Amb25361110 [0,1,0,0,0,1|1,0,1]=4 4988 B13R1.2176 COC1=CC=CC(=CC1=O)C(C)O Amb25129803 [0,1,0,0,0,1|0,0,2]=4 4989 B13R1.3094 CC(=C)C1=CC=C(OC)C(=O)C=C1 Amb25128965 [0,1,0,0,0,1|1,0,0]=3 4990 B13R1.3094 COC1=CC=C(C=CC1=O)N(=O)=O Amb22554215 [0,1,0,0,0,1|2,0,0]=4 4991 B13R1.3094 COC1=CC=C(C=CC1=O)[N+]([O-])=O Amb21870064 [0,1,0,0,0,1|2,0,0]=4 4992 B13R1.39 CCC(c1ccc(cc1)OC)C=O Amb17138859 [0,2,0,0,0,0|0,0,1]=3 4993 B13R1.39 CCC(c1ccc(cc1)OC)CBr Amb17256437 [0,2,0,0,0,0|1,0,1]=4 4994 B13R1.39 CCC(c1ccc(cc1)OC)CCl Amb17236866 [0,2,0,0,0,0|1,0,1]=4 4995 B13R1.39 CCC(c1ccc(cc1)OC)CO Amb17233695 [0,2,0,0,0,0|0,0,2]=4 4996 B13R1.39 CCC(c1ccc(cc1)OC)NC Amb1119701 [0,2,0,0,0,0|1,0,1]=4 4997 B13R1.39 CCN(C#N)c1ccc(cc1)OC Amb24719383 [0,2,0,0,0,0|2,0,0]=4 4998 B13R1.39 CC\C(=N\O)\c1ccc(cc1)OC Amb25109813 [0,2,0,0,0,0|0,0,1]=3 4999 B13R1.39 CCc1ccc(cc1)C(C=O)CC Amb17138788 [0,2,0,0,0,0|1,0,1]=4 5000 B13R1.39 CCc1ccc(cc1)\C(\NC)=N/N Amb18178426 [0,2,0,0,0,0|2,0,0]=4 5001 B13R1.39 CNC(C#C)c1ccc(cc1)OC Amb25091435 [0,2,0,0,0,0|1,0,1]=4 5002 B13R1.39 CNC(C#N)c1ccc(cc1)OC Amb22736549 [0,2,0,0,0,0|1,0,1]=4 5003 B13R1.39 CNC(CF)c1ccc(cc1)OC Amb23443832 [0,2,0,0,0,0|1,0,1]=4 5004 B13R1.39 CNC(CN)c1ccc(cc1)OC Amb18186663 [0,2,0,0,0,0|1,0,1]=4 5005 B13R1.39 CNC(c1ccc(cc1)OC)CO Amb17233806 [0,2,0,0,0,0|0,0,2]=4 5006 B13R1.39 CN\C(=N\N)\c1ccc(cc1)OC Amb18178689 [0,2,0,0,0,0|1,0,0]=3 5007 B13R1.39 CN\C(=N\N)\c1ccc(cc1)SC Amb24388680 [0,2,0,0,0,0|1,1,0]=4 5008 B13R1.39 CO\C(=C\Cl)\c1ccc(cc1)OC Amb24634020 [0,2,0,0,0,0|1,0,0]=3 5009 B13R1.39 COc1c[n]c(cc1)\C(\CC)=N/N Amb25235515 [0,2,0,0,0,0|2,0,0]=4 5010 B13R1.39 COc1ccc(cc1)C(=CO)C=O Amb24062091 [0,2,0,0,0,0|0,0,1]=3 5011 B13R1.39 COc1ccc(cc1)C(CC)CC Amb22904241 [0,2,0,0,0,0|1,0,1]=4 5012 B13R1.39 COc1ccc(cc1)C(CN)=NO Amb24080999 [0,2,0,0,0,0|0,0,1]=3 5013 B13R1.39 COc1ccc(cc1)C(CN)CN Amb18065943 [0,2,0,0,0,0|1,0,1]=4 5014 B13R1.39 COc1ccc(cc1)C(CN)CO Amb18066030 [0,2,0,0,0,0|0,0,2]=4 5015 B13R1.39 COc1ccc(cc1)C(CN)OC Amb17335493 [0,2,0,0,0,0|0,0,2]=4 5016 B13R1.39 COc1ccc(cc1)C(OC)CC Amb2228259 [0,2,0,0,0,0|0,0,2]=4 5017 B13R1.39 COc1ccc(cc1)\C(=C/[O-])\C#N Amb20407759 [0,2,0,0,0,0|0,0,2]=4 5018 B13R1.39 COc1ccc(cc1)\C(=C/[O-])\C#N Amb22436162 [0,2,0,0,0,0|0,0,2]=4 5019 B13R1.39 COc1ccc(cc1)\C(=C\N)\C#N Amb24656070 [0,2,0,0,0,0|1,0,1]=4 5020 B13R1.39 COc1ccc(cc1)\C(\CBr)=N\O Amb24693476 [0,2,0,0,0,0|0,0,1]=3 5021 B13R1.39 COc1ccc(cc1)\C(\CO)=C\Cl Amb25339761 [0,2,0,0,0,0|1,0,0]=3 5022 B13R1.39 COc1ccc(cc1)\C(\CO)=N\O Amb25235704 [0,2,0,0,0,0|0,0,1]=3 5023 B13R1.39 C\C=C(\C=O)/c1ccc(cc1)OC Amb25827194 [0,2,0,0,0,0|0,0,0]=2 5024 B13R1.39 C\C=C(\c1ccc(cc1)CC)/C#N Amb17232824 [0,2,0,0,0,0|2,0,0]=4 5025 B13R1.39 C\C=C(\c1ccc(cc1)OC)/C#N Amb17232945 [0,2,0,0,0,0|1,0,0]=3 5026 B13R1.39 NC\C(=N/O)\c1ccc(cc1)OC Amb10606190 [0,2,0,0,0,0|0,0,1]=3 5027 B13R1.39 OCC(c1ccc(cc1)OC)CO Amb17335535 [0,2,0,0,0,0|0,0,2]=4 5028 B13R1.39 O\C=C(\c1ccc(cc1)CC)/C=O Amb17335124 [0,2,0,0,0,0|1,0,1]=4 5029 B13R1.39 [C-]#[N+]C(CF)c1ccc(cc1)OC Amb24578620 [0,2,0,0,0,0|1,0,1]=4 5030 B13R1.95 CCC(=O)c1ccc(CBr)cc1Cl Amb25312278 [0,2,0,0,0,0|2,0,0]=4 5031 B13R1.95 CCC(=O)c1ccc(CBr)cc1N Amb24536961 [0,2,0,0,0,0|2,0,0]=4 5032 B13R1.95 CCC(=O)c1ccc(CC)cc1Br Amb24537028 [0,2,0,0,0,0|1,0,0]=3 5033 B13R1.95 CCC(=O)c1ccc(CC)cc1O Amb24631659 [0,2,0,0,0,0|1,0,0]=3 5034 B13R1.95 CCC(=O)c1ccc(CC)cc1S Amb25309699 [0,2,0,0,0,0|1,0,0]=3 5035 B13R1.95 CCC(=O)c1ccc(CCl)cc1Br Amb25312360 [0,2,0,0,0,0|2,0,0]=4 5036 B13R1.95 CCC(=O)c1ccc(CCl)cc1N Amb25270506 [0,2,0,0,0,0|2,0,0]=4 5037 B13R1.95 CCC(=O)c1ccc(CF)cc1Br Amb25248669 [0,2,0,0,0,0|2,0,0]=4 5038 B13R1.95 CCC(=O)c1ccc(CO)cc1Cl Amb24651196 [0,2,0,0,0,0|2,0,0]=4 5039 B13R1.95 CCC(=O)c1ccc(CO)cc1O Amb25223359 [0,2,0,0,0,0|2,0,0]=4 5040 B13R1.95 CCC(=O)c1ccc(CO)cc1S Amb24696723 [0,2,0,0,0,0|2,0,0]=4 5041 B13R1.95 CCC(=O)c1ccc(cc1Br)C=O Amb25223854 [0,2,0,0,0,0|2,0,0]=4 5042 B13R1.95 CCC(=O)c1ccc(cc1I)C=O Amb25338385 [0,2,0,0,0,0|2,0,0]=4 5043 B13R1.95 CCC(=O)c1ccc(cc1N)OC Amb25363227 [0,2,0,0,0,0|0,0,0]=2 5044 B13R1.95 CCC(=O)c1ccc(cc1O)C=O Amb25270405 [0,2,0,0,0,0|2,0,0]=4 5045 B13R1.95 CCC(=O)c1ccc(cc1S)C#N Amb24727425 [0,2,0,0,0,0|2,0,0]=4 5046 B13R1.95 CCC(Br)c1ccc(cc1Cl)OC Amb25674508 [0,2,0,0,0,0|1,0,1]=4 5047 B13R1.95 CCC(Cl)c1ccc(cc1Br)OC Amb25363885 [0,2,0,0,0,0|1,0,1]=4 5048 B13R1.95 CCC(N)c1ccc(cc1Br)OC Amb18999246 [0,2,0,0,0,0|1,0,1]=4 5049 B13R1.95 CCC(N)c1ccc(cc1I)OC Amb24376131 [0,2,0,0,0,0|1,0,1]=4 5050 B13R1.95 CCC(N)c1ccc(cc1O)OC Amb25211339 [0,2,0,0,0,0|1,0,1]=4 5051 B13R1.95 CCC(O)c1ccc(cc1Cl)OC Amb19049023 [0,2,0,0,0,0|0,0,2]=4 5052 B13R1.95 CCC(O)c1ccc(cc1F)OC Amb19057437 [0,2,0,0,0,0|0,0,2]=4 5053 B13R1.95 CC[C@@H](N)c1ccc(cc1O)OC Amb24612387 [0,2,0,0,0,0|1,0,1]=4 5054 B13R1.95 CC[C@@H](O)c1ccc(cc1Br)OC Amb24367610 [0,2,0,0,0,0|0,0,2]=4 5055 B13R1.95 CC[C@@H](O)c1ccc(cc1F)OC Amb24432790 [0,2,0,0,0,0|0,0,2]=4 5056 B13R1.95 CC[C@H](N)c1ccc(cc1Br)OC Amb25751953 [0,2,0,0,0,0|1,0,1]=4 5057 B13R1.95 CC[C@H](N)c1ccc(cc1Cl)OC Amb24533900 [0,2,0,0,0,0|1,0,1]=4 5058 B13R1.95 CC[C@H](O)c1ccc(cc1Br)OC Amb25103242 [0,2,0,0,0,0|0,0,2]=4 5059 B13R1.95 CC[C@H](O)c1ccc(cc1F)OC Amb25798482 [0,2,0,0,0,0|0,0,2]=4 5060 B13R1.95 CCc1cc(Cl)c(cc1)C(=O)CBr Amb25190397 [0,2,0,0,0,0|1,0,0]=3 5061 B13R1.95 CCc1ccc(C(=O)CBr)c(Br)c1 Amb25714658 [0,2,0,0,0,0|1,0,0]=3 5062 B13R1.95 CCc1ccc(C(=O)OC)c(S)c1 Amb24702373 [0,2,0,0,0,0|1,0,0]=3 5063 B13R1.95 CCc1ccc(c(N)c1)C(=O)OC Amb22490335 [0,2,0,0,0,0|1,0,0]=3 5064 B13R1.95 CCc1ccc(c(O)c1)C(=O)NN Amb25240100 [0,2,0,0,0,0|2,0,0]=4 5065 B13R1.95 CNC(=O)c1ccc(cc1Cl)C#N Amb24358134 [0,2,0,0,0,0|2,0,0]=4 5066 B13R1.95 CNC(=O)c1ccc(cc1F)NN Amb25375048 [0,2,0,0,0,0|2,0,0]=4 5067 B13R1.95 CNC(=O)c1ccc(cc1N)OC Amb18128673 [0,2,0,0,0,0|0,0,0]=2 5068 B13R1.95 CNC(=O)c1ccc(cc1O)C#N Amb25144016 [0,2,0,0,0,0|2,0,0]=4 5069 B13R1.95 CNC(=O)c1ccc(cc1O)C=O Amb25806259 [0,2,0,0,0,0|2,0,0]=4 5070 B13R1.95 CNC(=O)c1ccc(cc1O)SC Amb24707818 [0,2,0,0,0,0|0,1,0]=3 5071 B13R1.95 CNC(C)c1ccc(cc1Br)OC Amb18968123 [0,2,0,0,0,0|1,0,1]=4 5072 B13R1.95 CNC(C)c1ccc(cc1N)OC Amb24462650 [0,2,0,0,0,0|1,0,1]=4 5073 B13R1.95 CN[C@H](C)c1ccc(cc1N)OC Amb25342068 [0,2,0,0,0,0|1,0,1]=4 5074 B13R1.95 CNc1c[n]c(C(=O)OC)c(Cl)c1 Amb25858922 [0,2,0,0,0,0|2,0,0]=4 5075 B13R1.95 CNc1cc(F)c(cc1)C(=O)OC Amb24649861 [0,2,0,0,0,0|1,0,0]=3 5076 B13R1.95 CNc1ccc(C(=O)OC)c(Cl)[n]1 Amb25775686 [0,2,0,0,0,0|2,0,0]=4 5077 B13R1.95 CNc1ccc(C(=O)OC)c(F)[n]1 Amb25376892 [0,2,0,0,0,0|2,0,0]=4 5078 B13R1.95 COC(=N)c1ccc(cc1Br)OC Amb25191540 [0,2,0,0,0,0|1,0,0]=3 5079 B13R1.95 COC(=O)C1=CN=C(NC1=O)OC Amb21939287 [0,2,0,0,0,0|2,0,0]=4 5080 B13R1.95 COC(=O)c1[n]cc(cc1Cl)OC Amb25363952 [0,2,0,0,0,0|1,0,0]=3 5081 B13R1.95 COC(=O)c1[n]cc(cc1F)OC Amb23401492 [0,2,0,0,0,0|1,0,0]=3 5082 B13R1.95 COC(=O)c1c[n]c([n]c1N)OC Amb22755325 [0,2,0,0,0,0|2,0,0]=4 5083 B13R1.95 COC(=O)c1c[n]c([n]c1[O-])OC Amb22436151 [0,2,0,0,0,0|2,0,0]=4 5084 B13R1.95 COC(=O)c1ccc(CBr)cc1F Amb20668009 [0,2,0,0,0,0|2,0,0]=4 5085 B13R1.95 COC(=O)c1ccc(CF)cc1N Amb25123249 [0,2,0,0,0,0|2,0,0]=4 5086 B13R1.95 COC(=O)c1ccc(CN)cc1Cl Amb25844658 [0,2,0,0,0,0|2,0,0]=4 5087 B13R1.95 COC(=O)c1ccc(CO)cc1Cl Amb25304226 [0,2,0,0,0,0|2,0,0]=4 5088 B13R1.95 COC(=O)c1ccc(CO)cc1F Amb24088834 [0,2,0,0,0,0|2,0,0]=4 5089 B13R1.95 COC(=O)c1ccc(CO)cc1N Amb24693848 [0,2,0,0,0,0|2,0,0]=4 5090 B13R1.95 COC(=O)c1ccc(CS)cc1N Amb24364794 [0,2,0,0,0,0|2,0,0]=4 5091 B13R1.95 COC(=O)c1ccc(c[n+]1C)SC Amb24309115 [0,2,0,0,0,0|1,1,0]=4 5092 B13R1.95 COC(=O)c1ccc(cc1Br)C#N Amb24057225 [0,2,0,0,0,0|2,0,0]=4 5093 B13R1.95 COC(=O)c1ccc(cc1Br)C=O Amb24057224 [0,2,0,0,0,0|2,0,0]=4 5094 B13R1.95 COC(=O)c1ccc(cc1Br)OC Amb19888272 [0,2,0,0,0,0|0,0,0]=2 5095 B13R1.95 COC(=O)c1ccc(cc1Cl)C#C Amb22886996 [0,2,0,0,0,0|1,0,1]=4 5096 B13R1.95 COC(=O)c1ccc(cc1Cl)C#N Amb22000931 [0,2,0,0,0,0|2,0,0]=4 5097 B13R1.95 COC(=O)c1ccc(cc1Cl)C=O Amb22754752 [0,2,0,0,0,0|2,0,0]=4 5098 B13R1.95 COC(=O)c1ccc(cc1F)C#N Amb22002671 [0,2,0,0,0,0|2,0,0]=4 5099 B13R1.95 COC(=O)c1ccc(cc1F)C=O Amb19959113 [0,2,0,0,0,0|2,0,0]=4 5100 B13R1.95 COC(=O)c1ccc(cc1I)C#N Amb24057238 [0,2,0,0,0,0|2,0,0]=4 5101 B13R1.95 COC(=O)c1ccc(cc1I)C=O Amb24057241 [0,2,0,0,0,0|2,0,0]=4 5102 B13R1.95 COC(=O)c1ccc(cc1I)NN Amb25841032 [0,2,0,0,0,0|2,0,0]=4 5103 B13R1.95 COC(=O)c1ccc(cc1I)OC Amb24077353 [0,2,0,0,0,0|0,0,0]=2 5104 B13R1.95 COC(=O)c1ccc(cc1I)SC Amb25850065 [0,2,0,0,0,0|0,1,0]=3 5105 B13R1.95 COC(=O)c1ccc(cc1N)C#N Amb22750822 [0,2,0,0,0,0|2,0,0]=4 5106 B13R1.95 COC(=O)c1ccc(cc1O)C#N Amb24057232 [0,2,0,0,0,0|2,0,0]=4 5107 B13R1.95 COC(=O)c1ccc(cc1O)C=O Amb24057217 [0,2,0,0,0,0|2,0,0]=4 5108 B13R1.95 COC(=O)c1ccc(cc1O)NN Amb25230151 [0,2,0,0,0,0|2,0,0]=4 5109 B13R1.95 COC(=O)c1ccc(cc1O)SC Amb18130470 [0,2,0,0,0,0|0,1,0]=3 5110 B13R1.95 COC(=O)c1ccc(cc1S)C#N Amb25711381 [0,2,0,0,0,0|2,0,0]=4 5111 B13R1.95 COC(=O)c1ccc(cc1S)NN Amb24528085 [0,2,0,0,0,0|2,0,0]=4 5112 B13R1.95 COC(=O)c1ccc(cc1S)OC Amb24425405 [0,2,0,0,0,0|0,0,0]=2 5113 B13R1.95 COc1c[n]c(c(N)[n]1)C(=O)OC Amb25836727 [0,2,0,0,0,0|2,0,0]=4 5114 B13R1.95 COc1cc(Br)c(cc1)C(=O)C=C Amb25762371 [0,2,0,0,0,0|0,0,1]=3 5115 B13R1.95 COc1cc(Br)c(cc1)C(=O)CBr Amb25836620 [0,2,0,0,0,0|0,0,0]=2 5116 B13R1.95 COc1cc(Br)c(cc1)C(=O)CCl Amb25836621 [0,2,0,0,0,0|0,0,0]=2 5117 B13R1.95 COc1cc(Br)c(cc1)C(=O)NN Amb25689677 [0,2,0,0,0,0|1,0,0]=3 5118 B13R1.95 COc1cc(Br)c(cc1)C(N)CN Amb24490781 [0,2,0,0,0,0|1,0,1]=4 5119 B13R1.95 COc1cc(Br)c(cc1)[C@H](N)CN Amb24490819 [0,2,0,0,0,0|1,0,1]=4 5120 B13R1.95 COc1cc(Cl)c(c[n]1)C(=O)OC Amb25155293 [0,2,0,0,0,0|1,0,0]=3 5121 B13R1.95 COc1cc(Cl)c(cc1)C(=O)C=C Amb18066410 [0,2,0,0,0,0|0,0,1]=3 5122 B13R1.95 COc1cc(Cl)c(cc1)C(=O)CN Amb18066506 [0,2,0,0,0,0|0,0,0]=2 5123 B13R1.95 COc1cc(Cl)c(cc1)C(=O)CO Amb18566283 [0,2,0,0,0,0|0,0,0]=2 5124 B13R1.95 COc1cc(Cl)c(cc1)C(C)CN Amb18066528 [0,2,0,0,0,0|1,0,1]=4 5125 B13R1.95 COc1cc(Cl)c(cc1)C(C)NN Amb18225070 [0,2,0,0,0,0|1,0,1]=4 5126 B13R1.95 COc1cc(Cl)c(cc1)C(Cl)CC Amb25681015 [0,2,0,0,0,0|1,0,1]=4 5127 B13R1.95 COc1cc(Cl)c(cc1)C(N)=NO Amb18317153 [0,2,0,0,0,0|1,0,1]=4 5128 B13R1.95 COc1cc(Cl)c(cc1)C(N)CN Amb24394379 [0,2,0,0,0,0|1,0,1]=4 5129 B13R1.95 COc1cc(Cl)c(cc1)C(N)CO Amb18066560 [0,2,0,0,0,0|1,0,1]=4 5130 B13R1.95 COc1cc(Cl)c(cc1)C(O)CN Amb18566445 [0,2,0,0,0,0|0,0,2]=4 5131 B13R1.95 COc1cc(Cl)c(cc1)C(O)CO Amb18566627 [0,2,0,0,0,0|0,0,2]=4 5132 B13R1.95 COc1cc(Cl)c(cc1)[C@@H](N)CN Amb24696540 [0,2,0,0,0,0|1,0,1]=4 5133 B13R1.95 COc1cc(Cl)c(cc1)[C@@H](N)CO Amb25191836 [0,2,0,0,0,0|1,0,1]=4 5134 B13R1.95 COc1cc(F)c(cc1)C(=O)C=C Amb25056104 [0,2,0,0,0,0|0,0,1]=3 5135 B13R1.95 COc1cc(F)c(cc1)C(=O)CN Amb18823415 [0,2,0,0,0,0|0,0,0]=2 5136 B13R1.95 COc1cc(F)c(cc1)C(C)CN Amb18191984 [0,2,0,0,0,0|1,0,1]=4 5137 B13R1.95 COc1cc(F)c(cc1)C(C)NO Amb24717366 [0,2,0,0,0,0|0,0,2]=4 5138 B13R1.95 COc1cc(F)c(cc1)C(F)CN Amb24669662 [0,2,0,0,0,0|1,0,1]=4 5139 B13R1.95 COc1cc(F)c(cc1)C(N)CF Amb25715406 [0,2,0,0,0,0|1,0,1]=4 5140 B13R1.95 COc1cc(F)c(cc1)C(N)CO Amb25077178 [0,2,0,0,0,0|1,0,1]=4 5141 B13R1.95 COc1cc(F)c(cc1)C(O)CN Amb18822545 [0,2,0,0,0,0|0,0,2]=4 5142 B13R1.95 COc1cc(F)c(cc1)[C@@H](N)CF Amb24490834 [0,2,0,0,0,0|1,0,1]=4 5143 B13R1.95 COc1cc(F)c(cc1)[C@@H](N)CO Amb25836762 [0,2,0,0,0,0|1,0,1]=4 5144 B13R1.95 COc1cc(F)c(cc1)[C@H](C)NO Amb24490741 [0,2,0,0,0,0|0,0,2]=4 5145 B13R1.95 COc1cc(F)c(cc1)[C@H](N)CF Amb25720195 [0,2,0,0,0,0|1,0,1]=4 5146 B13R1.95 COc1cc(F)c(cc1)[C@H](N)CO Amb24346741 [0,2,0,0,0,0|1,0,1]=4 5147 B13R1.95 COc1cc(I)c(cc1)C(N)CO Amb24394964 [0,2,0,0,0,0|1,0,1]=4 5148 B13R1.95 COc1cc(I)c(cc1)[C@@H](N)CO Amb25737516 [0,2,0,0,0,0|1,0,1]=4 5149 B13R1.95 COc1cc(N)c(c[n]1)C(=O)OC Amb25840307 [0,2,0,0,0,0|1,0,0]=3 5150 B13R1.95 COc1cc(N)c(cc1)C(=O)C#C Amb24446663 [0,2,0,0,0,0|0,0,1]=3 5151 B13R1.95 COc1cc(N)c(cc1)C(=O)CCl Amb18130634 [0,2,0,0,0,0|0,0,0]=2 5152 B13R1.95 COc1cc(N)c(cc1)C(N)CC Amb25683370 [0,2,0,0,0,0|1,0,1]=4 5153 B13R1.95 COc1cc(N)c(cc1)C(N)CN Amb24385274 [0,2,0,0,0,0|1,0,1]=4 5154 B13R1.95 COc1cc(N)c(cc1)C(O)CCl Amb18130817 [0,2,0,0,0,0|0,0,2]=4 5155 B13R1.95 COc1cc(N)c(cc1)[C@@H](N)CC Amb25698930 [0,2,0,0,0,0|1,0,1]=4 5156 B13R1.95 COc1cc(N)c(cc1)[C@@H](N)CO Amb24587135 [0,2,0,0,0,0|1,0,1]=4 5157 B13R1.95 COc1cc(N)c(cc1)[C@H](N)CN Amb25034399 [0,2,0,0,0,0|1,0,1]=4 5158 B13R1.95 COc1cc(N)c(cc1)[C@H](N)CO Amb24587123 [0,2,0,0,0,0|1,0,1]=4 5159 B13R1.95 COc1cc(N)c(cc1)\C(\N)=N\O Amb25757953 [0,2,0,0,0,0|1,0,1]=4 5160 B13R1.95 COc1cc(O)c(cc1)C(=O)C=C Amb24583614 [0,2,0,0,0,0|0,0,1]=3 5161 B13R1.95 COc1cc(O)c(cc1)C(=O)CN Amb25253272 [0,2,0,0,0,0|0,0,0]=2 5162 B13R1.95 COc1cc(O)c(cc1)C(=O)SC Amb24691732 [0,2,0,0,0,0|0,0,0]=2 5163 B13R1.95 COc1cc(O)c(cc1)C(C)NN Amb24555331 [0,2,0,0,0,0|1,0,1]=4 5164 B13R1.95 COc1cc(O)c(cc1)C(N)CF Amb24490709 [0,2,0,0,0,0|1,0,1]=4 5165 B13R1.95 COc1cc(O)c(cc1)[C@H](N)CN Amb25354023 [0,2,0,0,0,0|1,0,1]=4 5166 B13R1.95 COc1ccc(C(=O)OC)c(Br)[n]1 Amb22495296 [0,2,0,0,0,0|1,0,0]=3 5167 B13R1.95 COc1ccc(C(=O)OC)c(F)[n]1 Amb19516194 [0,2,0,0,0,0|1,0,0]=3 5168 B13R1.95 COc1ccc(c(Br)c1)\C(\N)=N\N Amb25191769 [0,2,0,0,0,0|2,0,0]=4 5169 B13R1.95 COc1ccc(c(F)c1)\C(\N)=N\N Amb24405372 [0,2,0,0,0,0|2,0,0]=4 5170 B13R1.95 COc1ccc(c(N)[n]1)C(=O)OC Amb24443205 [0,2,0,0,0,0|1,0,0]=3 5171 B13R1.95 COc1ccc(c(c1)N)C(=O)OC Amb13884836 [0,2,0,0,0,0|0,0,0]=2 5172 B13R1.95 COc1ccc(c(c1)O)C(=O)OC Amb1233205 [0,2,0,0,0,0|0,0,0]=2 5173 B13R1.95 COc1ccc(c(n1)Cl)C(=O)OC Amb10975245 [0,2,0,0,0,0|1,0,0]=3 5174 B13R1.95 COc1ncc(c(n1)C)C(=O)OC Amb10605120 [0,2,0,0,0,0|2,0,0]=4 5175 B13R1.95 COc1ncc(c(n1)O)C(=O)OC Amb16735052 [0,2,0,0,0,0|2,0,0]=4 5176 B13R1.95 CSc1cc(O)c(cc1)C(=O)CCl Amb18132171 [0,2,0,0,0,0|0,1,0]=3 5177 B13R1.95 C\C(=N/N)\c1ccc(cc1Br)OC Amb24673287 [0,2,0,0,0,0|1,0,0]=3 5178 B13R1.95 C\C(=N/N)\c1ccc(cc1O)OC Amb25202615 [0,2,0,0,0,0|1,0,0]=3 5179 B13R1.95 C\C(=N/O)\c1ccc(CC)cc1O Amb25180752 [0,2,0,0,0,0|1,0,1]=4 5180 B13R1.95 C\C(=N/O)\c1ccc(cc1O)OC Amb24192766 [0,2,0,0,0,0|0,0,1]=3 5181 B13R1.95 C\C(=N\O)\c1ccc(cc1F)OC Amb25707793 [0,2,0,0,0,0|0,0,1]=3 5182 B13R1.95 Cc1[n]c(ccc1C(=O)CC)NC Amb23445547 [0,2,0,0,0,0|2,0,0]=4 5183 B13R1.95 Cc1[n]c(ccc1C(=O)CC)OC Amb23445484 [0,2,0,0,0,0|1,0,0]=3 5184 B13R1.95 Cc1[n]c(ccc1C(=O)CC)SC Amb23445524 [0,2,0,0,0,0|1,1,0]=4 5185 B13R1.95 Cc1[n]c(ccc1C(=O)NN)OC Amb24341230 [0,2,0,0,0,0|2,0,0]=4 5186 B13R1.95 Cc1[n]c(ccc1C(=O)OC)NC Amb23445537 [0,2,0,0,0,0|2,0,0]=4 5187 B13R1.95 Cc1[n]c(ccc1C(=O)OC)OC Amb23445481 [0,2,0,0,0,0|1,0,0]=3 5188 B13R1.95 Cc1[n]c(ccc1C(=O)OC)SC Amb23445520 [0,2,0,0,0,0|1,1,0]=4 5189 B13R1.95 Cc1cc(CBr)ccc1C(=O)OC Amb24183613 [0,2,0,0,0,0|2,0,0]=4 5190 B13R1.95 Cc1cc(CC)c[n]c1C(=O)OC Amb24494475 [0,2,0,0,0,0|2,0,0]=4 5191 B13R1.95 Cc1cc(CC)ccc1C(=O)CBr Amb24360553 [0,2,0,0,0,0|1,0,0]=3 5192 B13R1.95 Cc1cc(CC)ccc1C(=O)OC Amb24644504 [0,2,0,0,0,0|1,0,0]=3 5193 B13R1.95 Cc1cc(CN)ccc1C(=O)OC Amb25135425 [0,2,0,0,0,0|2,0,0]=4 5194 B13R1.95 Cc1cc(NC)[n]cc1C(=O)CC Amb23579337 [0,2,0,0,0,0|2,0,0]=4 5195 B13R1.95 Cc1cc(NC)[n]cc1C(=O)OC Amb23579332 [0,2,0,0,0,0|2,0,0]=4 5196 B13R1.95 Cc1cc([n]cc1C(=O)CC)OC Amb23579265 [0,2,0,0,0,0|1,0,0]=3 5197 B13R1.95 Cc1cc([n]cc1C(=O)CC)SC Amb23579316 [0,2,0,0,0,0|1,1,0]=4 5198 B13R1.95 Cc1cc([n]cc1C(=O)OC)OC Amb23579258 [0,2,0,0,0,0|1,0,0]=3 5199 B13R1.95 Cc1cc([n]cc1C(=O)OC)SC Amb23579309 [0,2,0,0,0,0|1,1,0]=4 5200 B13R1.95 Cc1cc(c[n]c1C(=O)OC)OC Amb23437552 [0,2,0,0,0,0|1,0,0]=3 5201 B13R1.95 Cc1cc(ccc1C(=O)C#N)OC Amb24492537 [0,2,0,0,0,0|0,0,1]=3 5202 B13R1.95 Cc1cc(ccc1C(=O)CBr)OC Amb25327183 [0,2,0,0,0,0|0,0,0]=2 5203 B13R1.95 Cc1cc(ccc1C(=O)CC)OC Amb18554203 [0,2,0,0,0,0|0,0,0]=2 5204 B13R1.95 Cc1cc(ccc1C(=O)CC)SC Amb24578664 [0,2,0,0,0,0|0,1,0]=3 5205 B13R1.95 Cc1cc(ccc1C(=O)CCl)OC Amb18554205 [0,2,0,0,0,0|0,0,0]=2 5206 B13R1.95 Cc1cc(ccc1C(=O)CCl)SC Amb24104216 [0,2,0,0,0,0|0,1,0]=3 5207 B13R1.95 Cc1cc(ccc1C(=O)CO)OC Amb24353110 [0,2,0,0,0,0|0,0,0]=2 5208 B13R1.95 Cc1cc(ccc1C(=O)NC)NN Amb24449685 [0,2,0,0,0,0|2,0,0]=4 5209 B13R1.95 Cc1cc(ccc1C(=O)NN)OC Amb22436439 [0,2,0,0,0,0|1,0,0]=3 5210 B13R1.95 Cc1cc(ccc1C(=O)NO)OC Amb24613321 [0,2,0,0,0,0|1,0,0]=3 5211 B13R1.95 Cc1cc(ccc1C(=O)OC)C#N Amb22002164 [0,2,0,0,0,0|2,0,0]=4 5212 B13R1.95 Cc1cc(ccc1C(=O)OC)NC Amb25065183 [0,2,0,0,0,0|1,0,0]=3 5213 B13R1.95 Cc1cc(ccc1C(=O)OC)SC Amb24341350 [0,2,0,0,0,0|0,1,0]=3 5214 B13R1.95 Cc1cc(ccc1C(Br)CC)OC Amb24697287 [0,2,0,0,0,0|1,0,1]=4 5215 B13R1.95 Cc1cc(ccc1C(C)CN)OC Amb25062695 [0,2,0,0,0,0|1,0,1]=4 5216 B13R1.95 Cc1cc(ccc1C(Cl)CC)OC Amb18322131 [0,2,0,0,0,0|1,0,1]=4 5217 B13R1.95 Cc1cc(ccc1C(N)CN)OC Amb25849304 [0,2,0,0,0,0|1,0,1]=4 5218 B13R1.95 Cc1cc(ccc1C(O)CC)OC Amb18796267 [0,2,0,0,0,0|0,0,2]=4 5219 B13R1.95 Cc1cc(ccc1C(O)CN)OC Amb24652164 [0,2,0,0,0,0|0,0,2]=4 5220 B13R1.95 Cc1cc(ccc1[C@@H](O)CC)OC Amb24661223 [0,2,0,0,0,0|0,0,2]=4 5221 B13R1.95 Cc1cc(ccc1[C@H](N)CC)OC Amb25703136 [0,2,0,0,0,0|1,0,1]=4 5222 B13R1.95 Cc1cc(ccc1[C@H](N)CN)OC Amb25327552 [0,2,0,0,0,0|1,0,1]=4 5223 B13R1.95 Cc1cc(ccc1[C@H](O)CC)OC Amb24421607 [0,2,0,0,0,0|0,0,2]=4 5224 B13R1.95 Cc1cc(ccc1\C(\N)=N\O)OC Amb24689254 [0,2,0,0,0,0|1,0,1]=4 5225 B13R1.95 ClCC(=O)c1ccc(cc1O)OC Amb1922212 [0,2,0,0,0,0|0,0,0]=2 5226 B13R1.95 NCC(=O)c1ccc(CF)cc1Cl Amb25243411 [0,2,0,0,0,0|2,0,0]=4 5227 B13R1.95 NNC(=O)c1ccc(cc1O)OC Amb1921675 [0,2,0,0,0,0|1,0,0]=3 5228 B13R1.95 O=C(CBr)c1ccc(cc1F)C=O Amb24638387 [0,2,0,0,0,0|2,0,0]=4 5229 B13R1.95 O=CC(=O)c1ccc(cc1F)OC Amb10838622 [0,2,0,0,0,0|0,0,1]=3 5230 B13R1.95 [C-]#[N+]c1cc(F)c(cc1)C(=O)OC Amb25245244 [0,2,0,0,0,0|1,0,1]=4 5231 B13R1.139 BrC#Cc1ccc(cc1)C(=O)OC Amb16233245 [0,2,0,0,0,0|1,0,1]=4 5232 B13R1.139 BrCCc1ccc(cc1)C(=O)OC Amb13883610 [0,2,0,0,0,0|1,0,0]=3 5233 B13R1.139 BrCOc1ccc(cc1)C(=O)NC Amb17332658 [0,2,0,0,0,0|0,0,0]=2 5234 B13R1.139 CC#Cc1c[n]c(cc1)C(=O)OC Amb25241732 [0,2,0,0,0,0|2,0,0]=4 5235 B13R1.139 CCC(=O)c1c[n]c(cc1)OCC Amb23446349 [0,2,0,0,0,0|1,0,0]=3 5236 B13R1.139 CCC(=O)c1ccc(cc1)N=C=O Amb25217833 [0,2,0,0,0,0|1,0,1]=4 5237 B13R1.139 CCC(=O)c1ccc(cc1)N=C=S Amb24432666 [0,2,0,0,0,0|1,0,1]=4 5238 B13R1.139 CCC(=O)c1ccc(cc1)N=[N+]=[N-] Amb25139572 [0,2,0,0,0,0|2,0,0]=4 5239 B13R1.139 CCC(=O)c1ccc(cc1)NCC Amb18564060 [0,2,0,0,0,0|1,0,0]=3 5240 B13R1.139 CCC(N)c1ccc(cc1)OCC Amb19959921 [0,2,0,0,0,0|1,0,1]=4 5241 B13R1.139 CCCc1ccc(cc1)C(=O)C=C Amb18065537 [0,2,0,0,0,0|1,0,1]=4 5242 B13R1.139 CCCc1ccc(cc1)C(=O)CC Amb2221565 [0,2,0,0,0,0|1,0,0]=3 5243 B13R1.139 CCCc1ccc(cc1)C(=O)CCl Amb1103668 [0,2,0,0,0,0|1,0,0]=3 5244 B13R1.139 CCCc1ccc(cc1)C(=O)CN Amb17194513 [0,2,0,0,0,0|1,0,0]=3 5245 B13R1.139 CCCc1ccc(cc1)C(=O)CS Amb17401974 [0,2,0,0,0,0|1,0,0]=3 5246 B13R1.139 CCCc1ccc(cc1)C(=O)NC Amb25326210 [0,2,0,0,0,0|1,0,0]=3 5247 B13R1.139 CCCc1ccc(cc1)C(=O)NN Amb25663518 [0,2,0,0,0,0|2,0,0]=4 5248 B13R1.139 CCCc1ccc(cc1)C(=O)OC Amb22494799 [0,2,0,0,0,0|1,0,0]=3 5249 B13R1.139 CCCc1ccc(cc1)C(C=O)C Amb17194502 [0,2,0,0,0,0|1,0,1]=4 5250 B13R1.139 CCNc1ccc(c[n]1)C(=O)OC Amb24081674 [0,2,0,0,0,0|2,0,0]=4 5251 B13R1.139 CCOc1c[n]c(c[n]1)C(=O)NC Amb25797007 [0,2,0,0,0,0|2,0,0]=4 5252 B13R1.139 CCOc1ccc(c[n]1)C(=O)CN Amb24086415 [0,2,0,0,0,0|1,0,0]=3 5253 B13R1.139 CCOc1ccc(c[n]1)C(=O)NO Amb24388181 [0,2,0,0,0,0|2,0,0]=4 5254 B13R1.139 CCOc1ccc(cc1)C(=C)C#N Amb17232950 [0,2,0,0,0,0|1,0,1]=4 5255 B13R1.139 CCOc1ccc(cc1)C(=O)C#C Amb25158834 [0,2,0,0,0,0|0,0,1]=3 5256 B13R1.139 CCOc1ccc(cc1)C(=O)C#N Amb22285203 [0,2,0,0,0,0|0,0,1]=3 5257 B13R1.139 CCOc1ccc(cc1)C(=O)C=C Amb18065617 [0,2,0,0,0,0|0,0,1]=3 5258 B13R1.139 CCOc1ccc(cc1)C(=O)C=O Amb10608663 [0,2,0,0,0,0|0,0,1]=3 5259 B13R1.139 CCOc1ccc(cc1)C(=O)C=O Amb20242726 [0,2,0,0,0,0|0,0,1]=3 5260 B13R1.139 CCOc1ccc(cc1)C(=O)CBr Amb1107391 [0,2,0,0,0,0|0,0,0]=2 5261 B13R1.139 CCOc1ccc(cc1)C(=O)CN Amb1419037 [0,2,0,0,0,0|0,0,0]=2 5262 B13R1.139 CCOc1ccc(cc1)C(=O)CN Amb17194535 [0,2,0,0,0,0|0,0,0]=2 5263 B13R1.139 CCOc1ccc(cc1)C(=O)CS Amb17402132 [0,2,0,0,0,0|0,0,0]=2 5264 B13R1.139 CCOc1ccc(cc1)C(=O)NN Amb1640388 [0,2,0,0,0,0|1,0,0]=3 5265 B13R1.139 CCOc1ccc(cc1)C(C=O)C Amb17194523 [0,2,0,0,0,0|0,0,1]=3 5266 B13R1.139 CCOc1ccc(cc1)C(CBr)C Amb17256445 [0,2,0,0,0,0|1,0,1]=4 5267 B13R1.139 CCOc1ccc(cc1)C(CBr)O Amb17206122 [0,2,0,0,0,0|0,0,2]=4 5268 B13R1.139 CCOc1ccc(cc1)C(CC)N Amb1140909 [0,2,0,0,0,0|1,0,1]=4 5269 B13R1.139 CCOc1ccc(cc1)C(CCl)C Amb17236877 [0,2,0,0,0,0|1,0,1]=4 5270 B13R1.139 CCOc1ccc(cc1)C(CCl)O Amb17194820 [0,2,0,0,0,0|0,0,2]=4 5271 B13R1.139 CCOc1ccc(cc1)C(CN)O Amb1108594 [0,2,0,0,0,0|0,0,2]=4 5272 B13R1.139 CCOc1ccc(cc1)C(CO)C Amb17233708 [0,2,0,0,0,0|0,0,2]=4 5273 B13R1.139 CCOc1ccc(cc1)C(CO)N Amb2236218 [0,2,0,0,0,0|1,0,1]=4 5274 B13R1.139 CCOc1ccc(cc1)C(NC)C Amb1114303 [0,2,0,0,0,0|1,0,1]=4 5275 B13R1.139 CCOc1ccc(cc1)C(NC)C Amb17622336 [0,2,0,0,0,0|1,0,1]=4 5276 B13R1.139 CCOc1ccc(cc1)C(O)CO Amb18066068 [0,2,0,0,0,0|0,0,2]=4 5277 B13R1.139 CCOc1ccc(cc1)[C@@H](N)CO Amb24117188 [0,2,0,0,0,0|1,0,1]=4 5278 B13R1.139 CCOc1ccc(cc1)\C(=N\O)\N Amb1118946 [0,2,0,0,0,0|1,0,1]=4 5279 B13R1.139 CCOc1ccc(cc1)\C(\Cl)=C\O Amb25859228 [0,2,0,0,0,0|1,0,1]=4 5280 B13R1.139 CCOc1ccc(cc1)\C(\N)=N\C Amb25328930 [0,2,0,0,0,0|1,0,0]=3 5281 B13R1.139 CCOc1ccc(cc1)\C(\N)=N\N Amb18178696 [0,2,0,0,0,0|2,0,0]=4 5282 B13R1.139 CCSc1ccc(cc1)C(=O)C=C Amb18224877 [0,2,0,0,0,0|0,1,1]=4 5283 B13R1.139 CCSc1ccc(cc1)C(=O)CBr Amb18229847 [0,2,0,0,0,0|0,1,0]=3 5284 B13R1.139 CCSc1ccc(cc1)C(=O)CN Amb18894529 [0,2,0,0,0,0|0,1,0]=3 5285 B13R1.139 CCSc1ccc(cc1)C(=O)OC Amb18277207 [0,2,0,0,0,0|0,1,0]=3 5286 B13R1.139 CCSc1ccc(cc1)C(=S)NC Amb25779382 [0,2,0,0,0,0|0,2,0]=4 5287 B13R1.139 CNC(=O)c1c[n]c(cc1)NCC Amb18986099 [0,2,0,0,0,0|2,0,0]=4 5288 B13R1.139 CNC(=O)c1ccc(CCN)cc1 Amb23441992 [0,2,0,0,0,0|1,0,0]=3 5289 B13R1.139 CNC(=O)c1ccc(\C=N/C)cc1 Amb24447108 [0,2,0,0,0,0|1,0,0]=3 5290 B13R1.139 CNC(=O)c1ccc(\C=N\N)cc1 Amb24388297 [0,2,0,0,0,0|2,0,0]=4 5291 B13R1.139 CNC(=O)c1ccc(\C=N\O)cc1 Amb25115899 [0,2,0,0,0,0|2,0,0]=4 5292 B13R1.139 CNC(=O)c1ccc(cc1)NC=O Amb24496808 [0,2,0,0,0,0|1,0,1]=4 5293 B13R1.139 CNCc1ccc(cc1)C(=O)NC Amb2371270 [0,2,0,0,0,0|1,0,0]=3 5294 B13R1.139 CNCc1ccc(cc1)C(=O)OC Amb1141123 [0,2,0,0,0,0|1,0,0]=3 5295 B13R1.139 COC(=O)c1c[n]c(CCO)cc1 Amb24056393 [0,2,0,0,0,0|2,0,0]=4 5296 B13R1.139 COC(=O)c1c[n]c(cc1)OCC Amb23536528 [0,2,0,0,0,0|1,0,0]=3 5297 B13R1.139 COC(=O)c1ccc(CC#C)cc1 Amb25760065 [0,2,0,0,0,0|1,0,1]=4 5298 B13R1.139 COC(=O)c1ccc(CC=O)cc1 Amb18117874 [0,2,0,0,0,0|1,0,1]=4 5299 B13R1.139 COC(=O)c1ccc(CCCl)cc1 Amb20667760 [0,2,0,0,0,0|1,0,0]=3 5300 B13R1.139 COC(=O)c1ccc(CCO)cc1 Amb24056383 [0,2,0,0,0,0|1,0,0]=3 5301 B13R1.139 COC(=O)c1ccc(CON)cc1 Amb21929147 [0,2,0,0,0,0|1,0,0]=3 5302 B13R1.139 COC(=O)c1ccc(\C=C\I)cc1 Amb25233178 [0,2,0,0,0,0|1,0,1]=4 5303 B13R1.139 COC(=O)c1ccc(c[n]1)OCC Amb21857309 [0,2,0,0,0,0|1,0,0]=3 5304 B13R1.139 COC(=O)c1ccc(cc1)N=[N+]=[N-] Amb24117476 [0,2,0,0,0,0|2,0,0]=4 5305 B13R1.139 COC(=O)c1ccc(cc1)NC#N Amb24409636 [0,2,0,0,0,0|1,0,1]=4 5306 B13R1.139 COCc1ccc(c[n]1)C(=O)NN Amb25678382 [0,2,0,0,0,0|2,0,0]=4 5307 B13R1.139 COCc1ccc(cc1)C(=O)NO Amb25072274 [0,2,0,0,0,0|1,0,0]=3 5308 B13R1.139 COCc1ccc(cc1)\C(\Cl)=N\O Amb25141367 [0,2,0,0,0,0|1,0,1]=4 5309 B13R1.139 CSCc1ccc(cc1)C(=O)NO Amb25358425 [0,2,0,0,0,0|1,1,0]=4 5310 B13R1.139 C\C(=N/N)\c1ccc(cc1)SCC Amb24354045 [0,2,0,0,0,0|1,1,0]=4 5311 B13R1.139 C\C(=N\O)\c1ccc(CCC)cc1 Amb22735760 [0,2,0,0,0,0|1,0,1]=4 5312 B13R1.139 C\C(=N\O)\c1ccc(CCO)cc1 Amb25788944 [0,2,0,0,0,0|1,0,1]=4 5313 B13R1.139 N#CCc1ccc(cc1)C(=O)CCl Amb18130050 [0,2,0,0,0,0|1,0,1]=4 5314 B13R1.139 N#CCc1ccc(cc1)C(=O)NC Amb17499095 [0,2,0,0,0,0|1,0,1]=4 5315 B13R1.139 NCCc1ccc(cc1)C(=O)CC Amb17101564 [0,2,0,0,0,0|1,0,0]=3 5316 B13R1.139 NCCc1ccc(cc1)C(=O)NO Amb25160746 [0,2,0,0,0,0|2,0,0]=4 5317 B13R1.139 O=C(CBr)c1ccc(cc1)N=C=S Amb21955424 [0,2,0,0,0,0|1,0,1]=4 5318 B13R1.139 O=C(CCl)c1ccc(CCCl)cc1 Amb24104222 [0,2,0,0,0,0|1,0,0]=3 5319 B13R1.139 O=C(CCl)c1ccc(cc1)NC=O Amb24440845 [0,2,0,0,0,0|1,0,1]=4 5320 B13R1.139 OCCc1ccc(cc1)C(=O)CCl Amb24104223 [0,2,0,0,0,0|1,0,0]=3 5321 B13R1.139 O\N=C\c1ccc(cc1)C(=O)OC Amb1208796 [0,2,0,0,0,0|2,0,0]=4 5322 B13R1.139 [C-]#[N+]Cc1ccc(cc1)C(=O)OC Amb25789548 [0,2,0,0,0,0|1,0,1]=4 5323 B13R1.139 [N-]=[N+]=Nc1ccc(cc1)C(=O)CCl Amb25803479 [0,2,0,0,0,0|2,0,0]=4 5324 B13R1.139 [N-]=[N+]=Nc1ccc(cc1)[14C](=O)CBr Amb17608707 [0,2,0,0,0,0|2,0,0]=4 5325 B13R1.187 BrCC(c1ccc(cc1)OC)(C)C Amb17256428 [0,2,0,0,0,0|1,0,1]=4 5326 B13R1.187 CCS(=O)(=O)c1ccc(CC)cc1 Amb24334977 [0,2,0,0,0,0|2,0,0]=4 5327 B13R1.187 CC[C@@](C)(N)c1ccc(cc1)OC Amb25034388 [0,2,0,0,0,0|1,0,1]=4 5328 B13R1.187 CCc1ccc(cc1)C(C)(O)C=O Amb25363724 [0,2,0,0,0,0|1,0,1]=4 5329 B13R1.187 CCc1ccc(cc1)C(C=O)(C)C Amb17233206 [0,2,0,0,0,0|1,0,1]=4 5330 B13R1.187 CNC(C)(C)c1ccc(cc1)OC Amb18564104 [0,2,0,0,0,0|1,0,1]=4 5331 B13R1.187 CNS(=O)(=O)c1c[n]c(cc1)OC Amb25343461 [0,2,0,0,0,0|2,0,0]=4 5332 B13R1.187 COS(=O)(=O)c1ccc(cc1)OC Amb24081956 [0,2,0,0,0,0|1,0,0]=3 5333 B13R1.187 COc1ccc(cc1)C(C#N)(N)C Amb1132181 [0,2,0,0,0,0|1,0,1]=4 5334 B13R1.187 COc1ccc(cc1)C(C)(F)CN Amb24459963 [0,2,0,0,0,0|1,0,1]=4 5335 B13R1.187 COc1ccc(cc1)C(C)(N)CF Amb25824683 [0,2,0,0,0,0|1,0,1]=4 5336 B13R1.187 COc1ccc(cc1)C(C)(N)CN Amb25322115 [0,2,0,0,0,0|1,0,1]=4 5337 B13R1.187 COc1ccc(cc1)C(C)(N)CO Amb18290220 [0,2,0,0,0,0|0,0,2]=4 5338 B13R1.187 COc1ccc(cc1)C(C)(N)CS Amb24520901 [0,2,0,0,0,0|0,1,1]=4 5339 B13R1.187 COc1ccc(cc1)C(C)(O)C#C Amb24644412 [0,2,0,0,0,0|0,0,2]=4 5340 B13R1.187 COc1ccc(cc1)C(C)(O)CO Amb24453657 [0,2,0,0,0,0|0,0,2]=4 5341 B13R1.187 COc1ccc(cc1)C(C=O)(C)C Amb17233406 [0,2,0,0,0,0|0,0,1]=3 5342 B13R1.187 COc1ccc(cc1)C(F)(F)C=O Amb25800078 [0,2,0,0,0,0|1,0,1]=4 5343 B13R1.187 COc1ccc(cc1)C(F)(F)CO Amb22325292 [0,2,0,0,0,0|1,0,1]=4 5344 B13R1.187 COc1ccc(cc1)S(=O)(=O)CCl Amb24586228 [0,2,0,0,0,0|1,0,0]=3 5345 B13R1.187 COc1ccc(cc1)S(=O)(=O)NC Amb1152950 [0,2,0,0,0,0|1,0,0]=3 5346 B13R1.187 COc1ccc(cc1)S(=O)(=O)NN Amb22469886 [0,2,0,0,0,0|2,0,0]=4 5347 B13R1.187 COc1ccc(cc1)S(=O)(=O)[N-]Cl Amb21811984 [0,2,0,0,0,0|2,0,0]=4 5348 B13R1.187 COc1ccc(cc1)[C@@](C)(N)C#N Amb24490681 [0,2,0,0,0,0|1,0,1]=4 5349 B13R1.187 COc1ccc(cc1)[C@@](C)(N)CF Amb24378104 [0,2,0,0,0,0|1,0,1]=4 5350 B13R1.187 COc1ccc(cc1)[Si](C)(C)C=C Amb19893937 [0,2,0,0,0,0|1,1,0]=4 5351 B13R1.187 ClCC(c1ccc(cc1)OC)(C)C Amb17236856 [0,2,0,0,0,0|1,0,1]=4 5352 B13R1.187 NCC(c1ccc(cc1)OC)(C)C Amb13951508 [0,2,0,0,0,0|1,0,1]=4 5353 B13R1.187 NCC(c1ccc(cc1)OC)(O)C Amb1993838 [0,2,0,0,0,0|0,0,2]=4 5354 B13R1.187 NCC(c1ccc(cc1)OC)(O)C Amb1993964 [0,2,0,0,0,0|0,0,2]=4 5355 B13R1.187 OCC(c1ccc(cc1)OC)(C)C Amb17400792 [0,2,0,0,0,0|0,0,2]=4 5356 B13R1.187 ONS(=O)(=O)c1ccc(cc1)OC Amb17237608 [0,2,0,0,0,0|2,0,0]=4 5357 B13R1.452 BrCCC(=O)c1ccc(cc1)CC Amb17437863 [0,2,0,0,0,0|1,0,0]=3 5358 B13R1.452 BrCCC(c1ccc(cc1)OC)C Amb17256438 [0,2,0,0,0,0|1,0,1]=4 5359 B13R1.452 C#CCC(=O)c1ccc(CN)cc1 Amb24621730 [0,2,0,0,0,0|2,0,0]=4 5360 B13R1.452 C#CCC(=O)c1ccc(cc1)C#N Amb25263105 [0,2,0,0,0,0|2,0,0]=4 5361 B13R1.452 C#Cc1ccc(cc1)C(=O)CC#N Amb25343008 [0,2,0,0,0,0|1,0,1]=4 5362 B13R1.452 C=CCC(=O)c1ccc(cc1)C#N Amb24645400 [0,2,0,0,0,0|2,0,0]=4 5363 B13R1.452 C=Cc1ccc(cc1)C(=O)NCO Amb24440977 [0,2,0,0,0,0|1,0,1]=4 5364 B13R1.452 CC#CC(=O)c1ccc(cc1)OC Amb25116500 [0,2,0,0,0,0|0,0,0]=2 5365 B13R1.452 CCCC(=O)c1ccc(cc1)C#N Amb17334930 [0,2,0,0,0,0|2,0,0]=4 5366 B13R1.452 CCCC(=O)c1ccc(cc1)SC Amb17481545 [0,2,0,0,0,0|0,1,0]=3 5367 B13R1.452 CCCC(c1ccc(cc1)OC)Cl Amb17139740 [0,2,0,0,0,0|1,0,1]=4 5368 B13R1.452 CCNC(=N)c1ccc(CC)cc1 Amb24474410 [0,2,0,0,0,0|2,0,0]=4 5369 B13R1.452 CCNC(=N)c1ccc(cc1)OC Amb24513800 [0,2,0,0,0,0|1,0,0]=3 5370 B13R1.452 CCNC(=O)c1[n]cc(c[n]1)OC Amb24353518 [0,2,0,0,0,0|2,0,0]=4 5371 B13R1.452 CCNC(=O)c1c[n]c(cc1)OC Amb25323090 [0,2,0,0,0,0|1,0,0]=3 5372 B13R1.452 CCNC(=O)c1ccc(CN)cc1 Amb21988247 [0,2,0,0,0,0|2,0,0]=4 5373 B13R1.452 CCNC(=O)c1ccc([n][n]1)OC Amb25345611 [0,2,0,0,0,0|2,0,0]=4 5374 B13R1.452 CCNC(=O)c1ccc(c[n]1)OC Amb25057416 [0,2,0,0,0,0|1,0,0]=3 5375 B13R1.452 CCNC(=O)c1ccc(cc1)C=O Amb18648034 [0,2,0,0,0,0|2,0,0]=4 5376 B13R1.452 CCNC(=O)c1ccc(cc1)CBr Amb17330983 [0,2,0,0,0,0|2,0,0]=4 5377 B13R1.452 CCNC(=O)c1ccc(cc1)CN Amb1121471 [0,2,0,0,0,0|2,0,0]=4 5378 B13R1.452 CCNC(=O)c1ccc(cc1)CO Amb16182967 [0,2,0,0,0,0|2,0,0]=4 5379 B13R1.452 CCNC(=O)c1ccc(cc1)NN Amb18809198 [0,2,0,0,0,0|2,0,0]=4 5380 B13R1.452 CCNC(=O)c1ccc(cc1)SC Amb25285776 [0,2,0,0,0,0|0,1,0]=3 5381 B13R1.452 CCNC(=S)c1ccc(cc1)OC Amb25359994 [0,2,0,0,0,0|0,1,0]=3 5382 B13R1.452 CCOC(=O)c1ccc(cc1)C#C Amb22411554 [0,2,0,0,0,0|1,0,1]=4 5383 B13R1.452 CCOC(=O)c1ccc(cc1)C#N Amb1770679 [0,2,0,0,0,0|2,0,0]=4 5384 B13R1.452 CCOC(=O)c1ccc(cc1)C=O Amb18128103 [0,2,0,0,0,0|2,0,0]=4 5385 B13R1.452 CCOC(=O)c1ccc(cc1)CCl Amb16231654 [0,2,0,0,0,0|2,0,0]=4 5386 B13R1.452 CCOC(=O)c1ccc(cc1)NC Amb17305788 [0,2,0,0,0,0|1,0,0]=3 5387 B13R1.452 CCOC(=O)c1ccc(cc1)NO Amb22753287 [0,2,0,0,0,0|2,0,0]=4 5388 B13R1.452 CCOC(=O)c1ccc(cc1)SC Amb18942913 [0,2,0,0,0,0|0,1,0]=3 5389 B13R1.452 CCOC(=O)c1ccc(cc1)[Zn]Br Amb22337141 [0,2,0,0,0,0|2,0,0]=4 5390 B13R1.452 CCOC(=O)c1ccc(cc1)[Zn]I Amb22000408 [0,2,0,0,0,0|2,0,0]=4 5391 B13R1.452 CCOC(=O)c1ccc(cn1)OC Amb2386889 [0,2,0,0,0,0|1,0,0]=3 5392 B13R1.452 CCSC(=N)c1ccc(cc1)OC Amb24095600 [0,2,0,0,0,0|1,0,0]=3 5393 B13R1.452 CCc1ccc(cc1)C(=CC=O)Cl Amb17236122 [0,2,0,0,0,0|2,0,0]=4 5394 B13R1.452 CCc1ccc(cc1)C(=O)C=C[O-] Amb19319451 [0,2,0,0,0,0|1,0,1]=4 5395 B13R1.452 CCc1ccc(cc1)C(=O)C=[N+]=[N-] Amb25180485 [0,2,0,0,0,0|1,0,1]=4 5396 B13R1.452 CCc1ccc(cc1)C(=O)CC#C Amb18185726 [0,2,0,0,0,0|1,0,0]=3 5397 B13R1.452 CCc1ccc(cc1)C(=O)CC=C Amb17334993 [0,2,0,0,0,0|1,0,0]=3 5398 B13R1.452 CCc1ccc(cc1)C(=O)CCO Amb18065757 [0,2,0,0,0,0|1,0,0]=3 5399 B13R1.452 CCc1ccc(cc1)C(=O)N=C=O Amb25690343 [0,2,0,0,0,0|1,0,1]=4 5400 B13R1.452 CCc1ccc(cc1)C(=O)N=C=S Amb1116368 [0,2,0,0,0,0|1,0,1]=4 5401 B13R1.452 CCc1ccc(cc1)C(=O)NC#N Amb24655552 [0,2,0,0,0,0|1,0,1]=4 5402 B13R1.452 CCc1ccc(cc1)C(=O)\C=C\[O-] Amb24271263 [0,2,0,0,0,0|1,0,1]=4 5403 B13R1.452 CCc1ccc(cc1)C(=O)\C=N\N Amb24589143 [0,2,0,0,0,0|1,0,1]=4 5404 B13R1.452 CCc1ccc(cc1)\C(\Cl)=C\C=O Amb25046161 [0,2,0,0,0,0|2,0,0]=4 5405 B13R1.452 CCc1ccc(cc1)\C(\N)=N\OC Amb18224609 [0,2,0,0,0,0|2,0,0]=4 5406 B13R1.452 CNCC(=O)c1ccc(cc1)CC Amb17233277 [0,2,0,0,0,0|1,0,0]=3 5407 B13R1.452 CNCC(=O)c1ccc(cc1)OC Amb17233534 [0,2,0,0,0,0|0,0,0]=2 5408 B13R1.452 CNCC(=O)c1ccc(cc1)SC Amb18894528 [0,2,0,0,0,0|0,1,0]=3 5409 B13R1.452 CNCC(c1ccc(cc1)OC)C Amb17233590 [0,2,0,0,0,0|1,0,1]=4 5410 B13R1.452 CNNC(=O)c1ccc(cc1)OC Amb24070474 [0,2,0,0,0,0|0,0,0]=2 5411 B13R1.452 CNc1ccc([n]c1)C(=O)NCC Amb24388932 [0,2,0,0,0,0|2,0,0]=4 5412 B13R1.452 CNc1ccc(c[n]1)C(=O)NCC Amb18986989 [0,2,0,0,0,0|2,0,0]=4 5413 B13R1.452 COC1=CCN(C=C1)C(=O)OCC Amb24060039 [0,2,0,0,0,0|1,0,1]=4 5414 B13R1.452 CONC(=O)c1ccc(CBr)cc1 Amb25833070 [0,2,0,0,0,0|2,0,0]=4 5415 B13R1.452 CONC(=O)c1ccc(CN)cc1 Amb25237192 [0,2,0,0,0,0|2,0,0]=4 5416 B13R1.452 CONC(=O)c1ccc(c[n]1)OC Amb24463442 [0,2,0,0,0,0|1,0,0]=3 5417 B13R1.452 CONC(=O)c1ccc(cc1)C#N Amb10693925 [0,2,0,0,0,0|2,0,0]=4 5418 B13R1.452 CONC(=O)c1ccc(cc1)C=O Amb24557067 [0,2,0,0,0,0|2,0,0]=4 5419 B13R1.452 CONC(=O)c1ccc(cc1)OC Amb10703357 [0,2,0,0,0,0|0,0,0]=2 5420 B13R1.452 CONC(=O)c1ccc(cc1)SC Amb24623502 [0,2,0,0,0,0|0,1,0]=3 5421 B13R1.452 COc1c[n]c(c[n]1)C(=O)CC#N Amb24663445 [0,2,0,0,0,0|2,0,0]=4 5422 B13R1.452 COc1c[n]c(c[n]1)C(=O)OCC Amb21857364 [0,2,0,0,0,0|2,0,0]=4 5423 B13R1.452 COc1ccc([n][n]1)C(=O)NOC Amb24335071 [0,2,0,0,0,0|2,0,0]=4 5424 B13R1.452 COc1ccc(c[n]1)C(=O)CC#C Amb24430115 [0,2,0,0,0,0|1,0,0]=3 5425 B13R1.452 COc1ccc(c[n]1)C(=O)NC#N Amb24699854 [0,2,0,0,0,0|1,0,1]=4 5426 B13R1.452 COc1ccc(cc1)C(=C)NC=O Amb25771912 [0,2,0,0,0,0|0,0,1]=3 5427 B13R1.452 COc1ccc(cc1)C(=C)\C=N/O Amb24100307 [0,2,0,0,0,0|0,0,2]=4 5428 B13R1.452 COc1ccc(cc1)C(=C)\C=N\O Amb25725494 [0,2,0,0,0,0|0,0,2]=4 5429 B13R1.452 COc1ccc(cc1)C(=CC#N)Cl Amb13951926 [0,2,0,0,0,0|1,0,1]=4 5430 B13R1.452 COc1ccc(cc1)C(=CC=O)Cl Amb17236494 [0,2,0,0,0,0|1,0,0]=3 5431 B13R1.452 COc1ccc(cc1)C(=N)OCC Amb18796121 [0,2,0,0,0,0|1,0,0]=3 5432 B13R1.452 COc1ccc(cc1)C(=N)OCC Amb20673136 [0,2,0,0,0,0|1,0,0]=3 5433 B13R1.452 COc1ccc(cc1)C(=O)C=[N+]=[N-] Amb17594469 [0,2,0,0,0,0|0,0,1]=3 5434 B13R1.452 COc1ccc(cc1)C(=O)CC#C Amb18808306 [0,2,0,0,0,0|0,0,0]=2 5435 B13R1.452 COc1ccc(cc1)C(=O)CC#N Amb1210622 [0,2,0,0,0,0|0,0,0]=2 5436 B13R1.452 COc1ccc(cc1)C(=O)CC=C Amb17335116 [0,2,0,0,0,0|0,0,0]=2 5437 B13R1.452 COc1ccc(cc1)C(=O)CCO Amb18065906 [0,2,0,0,0,0|0,0,0]=2 5438 B13R1.452 COc1ccc(cc1)C(=O)N=C=O Amb17233238 [0,2,0,0,0,0|0,0,1]=3 5439 B13R1.452 COc1ccc(cc1)C(=O)NC#N Amb25816871 [0,2,0,0,0,0|0,0,1]=3 5440 B13R1.452 COc1ccc(cc1)C(=O)\C=C/N Amb24364695 [0,2,0,0,0,0|0,0,1]=3 5441 B13R1.452 COc1ccc(cc1)C(=O)\C=C\N Amb25375165 [0,2,0,0,0,0|0,0,1]=3 5442 B13R1.452 COc1ccc(cc1)C(=O)\C=N/O Amb24309298 [0,2,0,0,0,0|0,0,1]=3 5443 B13R1.452 COc1ccc(cc1)C(=O)\C=N\N Amb25179537 [0,2,0,0,0,0|0,0,1]=3 5444 B13R1.452 COc1ccc(cc1)C(=S)NCO Amb24696445 [0,2,0,0,0,0|0,1,0]=3 5445 B13R1.452 COc1ccc(cc1)C(C)N=C=O Amb25113538 [0,2,0,0,0,0|0,0,1]=3 5446 B13R1.452 COc1ccc(cc1)C(CC#N)O Amb1110174 [0,2,0,0,0,0|0,0,2]=4 5447 B13R1.452 COc1ccc(cc1)C(F)N=C=O Amb24533457 [0,2,0,0,0,0|1,0,1]=4 5448 B13R1.452 COc1ccc(cc1)C(N)CC#C Amb18987801 [0,2,0,0,0,0|1,0,1]=4 5449 B13R1.452 COc1ccc(cc1)C(N)CC#N Amb18065623 [0,2,0,0,0,0|1,0,1]=4 5450 B13R1.452 COc1ccc(cc1)C(O)CC#C Amb18808850 [0,2,0,0,0,0|0,0,2]=4 5451 B13R1.452 COc1ccc(cc1)C(O)CCN Amb21984557 [0,2,0,0,0,0|0,0,2]=4 5452 B13R1.452 COc1ccc(cc1)C(O)CCO Amb18066065 [0,2,0,0,0,0|0,0,2]=4 5453 B13R1.452 COc1ccc(cc1)N(C)CC#C Amb18178191 [0,2,0,0,0,0|2,0,0]=4 5454 B13R1.452 COc1ccc(cc1)N(CC#N)C Amb17335145 [0,2,0,0,0,0|2,0,0]=4 5455 B13R1.452 COc1ccc(cc1)S(=O)CC#N Amb25699783 [0,2,0,0,0,0|1,0,0]=3 5456 B13R1.452 COc1ccc(cc1)[C@@H](C)N=[N+]=[N-] Amb25367950 [0,2,0,0,0,0|1,0,1]=4 5457 B13R1.452 COc1ccc(cc1)[C@@H](C)NC=O Amb25788597 [0,2,0,0,0,0|0,0,1]=3 5458 B13R1.452 COc1ccc(cc1)[C@@H](N)CC#N Amb24493905 [0,2,0,0,0,0|1,0,1]=4 5459 B13R1.452 COc1ccc(cc1)[C@@H](N)CC=C Amb22831154 [0,2,0,0,0,0|1,0,1]=4 5460 B13R1.452 COc1ccc(cc1)[C@@H](N)CCO Amb19888393 [0,2,0,0,0,0|1,0,1]=4 5461 B13R1.452 COc1ccc(cc1)[C@H](C)N=C=O Amb22045304 [0,2,0,0,0,0|0,0,1]=3 5462 B13R1.452 COc1ccc(cc1)[C@H](C)N=C=S Amb22045327 [0,2,0,0,0,0|0,1,1]=4 5463 B13R1.452 COc1ccc(cc1)[C@H](C)NC=S Amb25346644 [0,2,0,0,0,0|0,1,1]=4 5464 B13R1.452 COc1ccc(cc1)[C@H](N)CCO Amb19887685 [0,2,0,0,0,0|1,0,1]=4 5465 B13R1.452 COc1ccc(cc1)[C@H](O)CC#N Amb25043130 [0,2,0,0,0,0|0,0,2]=4 5466 B13R1.452 COc1ccc(cc1)\C(=C\C#N)\Cl Amb1649115 [0,2,0,0,0,0|1,0,1]=4 5467 B13R1.452 COc1ccc(cc1)\C(=C\C=O)\C Amb17594483 [0,2,0,0,0,0|0,0,0]=2 5468 B13R1.452 COc1ccc(cc1)\C(=N\C#N)\N Amb1144994 [0,2,0,0,0,0|1,0,1]=4 5469 B13R1.452 COc1ccc(cc1)\C(\Cl)=C/C=O Amb24571146 [0,2,0,0,0,0|1,0,0]=3 5470 B13R1.452 COc1ccc(cc1)\C(\Cl)=C\C=O Amb25094081 [0,2,0,0,0,0|1,0,0]=3 5471 B13R1.452 COc1ccc(cc1)\C(\N)=C\C#N Amb18127261 [0,2,0,0,0,0|1,0,1]=4 5472 B13R1.452 COc1ccc(cc1)\C(\N)=C\C=O Amb25264392 [0,2,0,0,0,0|1,0,0]=3 5473 B13R1.452 COc1ccc(cc1)\C(\N)=N\OC Amb18224674 [0,2,0,0,0,0|1,0,0]=3 5474 B13R1.452 CSCC(=O)c1ccc(cc1)C#N Amb19050196 [0,2,0,0,0,0|2,0,0]=4 5475 B13R1.452 CSc1ccc(cc1)C(=O)C=[N+]=[N-] Amb24747185 [0,2,0,0,0,0|0,1,1]=4 5476 B13R1.452 CSc1ccc(cc1)C(=O)CCN Amb18244070 [0,2,0,0,0,0|0,1,0]=3 5477 B13R1.452 CSc1ccc(cc1)C(=O)N=C=O Amb25850232 [0,2,0,0,0,0|0,1,1]=4 5478 B13R1.452 CSc1ccc(cc1)C(=O)N=[N+]=[N-] Amb25778319 [0,2,0,0,0,0|1,1,0]=4 5479 B13R1.452 CSc1ccc(cc1)C(C)N=C=O Amb25755260 [0,2,0,0,0,0|0,1,1]=4 5480 B13R1.452 CSc1ccc(cc1)\C(\Cl)=C\C=O Amb25793244 [0,2,0,0,0,0|1,1,0]=4 5481 B13R1.452 C\C(=C/CN)\c1ccc(CC)cc1 Amb25208913 [0,2,0,0,0,0|2,0,0]=4 5482 B13R1.452 C\C(=C/CN)\c1ccc(cc1)OC Amb25827271 [0,2,0,0,0,0|1,0,0]=3 5483 B13R1.452 C\C(=C\C=O)\c1ccc(cc1)OC Amb25779365 [0,2,0,0,0,0|0,0,0]=2 5484 B13R1.452 C\C(=N\NC)\c1ccc(cc1)SC Amb25270861 [0,2,0,0,0,0|1,1,0]=4 5485 B13R1.452 C\C=C/C(=O)c1ccc(cc1)OC Amb24491381 [0,2,0,0,0,0|0,0,0]=2 5486 B13R1.452 C\C=C\C(=O)c1c[n]c([n]c1)OC Amb24661745 [0,2,0,0,0,0|2,0,0]=4 5487 B13R1.452 C\C=C\C(=O)c1ccc(cc1)C#N Amb25272971 [0,2,0,0,0,0|2,0,0]=4 5488 B13R1.452 C\C=C\C(=O)c1ccc(cc1)SC Amb25835807 [0,2,0,0,0,0|0,1,0]=3 5489 B13R1.452 ClCCC(=O)c1ccc(cc1)CC Amb17109137 [0,2,0,0,0,0|1,0,0]=3 5490 B13R1.452 ClCCC(c1ccc(cc1)OC)C Amb17236867 [0,2,0,0,0,0|1,0,1]=4 5491 B13R1.452 ClCCC(c1ccc(cc1)OC)O Amb17194815 [0,2,0,0,0,0|0,0,2]=4 5492 B13R1.452 ClCCN(c1ccc(cc1)OC)C Amb17337513 [0,2,0,0,0,0|2,0,0]=4 5493 B13R1.452 N#CCC(=O)c1ccc(cc1)C#N Amb2423648 [0,2,0,0,0,0|2,0,0]=4 5494 B13R1.452 NCCC(=O)c1ccc(cc1)CC Amb17194508 [0,2,0,0,0,0|1,0,0]=3 5495 B13R1.452 NCCC(=O)c1ccc(cc1)OC Amb17194534 [0,2,0,0,0,0|0,0,0]=2 5496 B13R1.452 NCCC(c1ccc(cc1)OC)O Amb17079142 [0,2,0,0,0,0|0,0,2]=4 5497 B13R1.452 NCCN(c1ccc(cc1)OC)C Amb17059651 [0,2,0,0,0,0|2,0,0]=4 5498 B13R1.452 NNCC(c1ccc(cc1)OC)O Amb17233905 [0,2,0,0,0,0|0,0,2]=4 5499 B13R1.452 NOCC(c1ccc(cc1)OC)O Amb17335614 [0,2,0,0,0,0|0,0,2]=4 5500 B13R1.452 OCCC(c1ccc(cc1)OC)C Amb17233696 [0,2,0,0,0,0|0,0,2]=4 5501 B13R1.452 OCCC(c1ccc(cc1)OC)N Amb1993954 [0,2,0,0,0,0|1,0,1]=4 5502 B13R1.452 OCCN(c1ccc(cc1)OC)C Amb17335501 [0,2,0,0,0,0|1,0,1]=4 5503 B13R1.452 ONCC(c1ccc(cc1)OC)O Amb17335613 [0,2,0,0,0,0|0,0,2]=4 5504 B13R1.452 SCCC(=O)c1ccc(cc1)CC Amb17401969 [0,2,0,0,0,0|1,0,0]=3 5505 B13R1.452 SCCC(=O)c1ccc(cc1)OC Amb17402127 [0,2,0,0,0,0|0,0,0]=2 5506 B13R1.537 BrCC(=O)c1ccc(cc1)N(C)C Amb10070741 [0,2,0,0,0,0|1,0,0]=3 5507 B13R1.537 CC(=C)c1ccc(cc1)C(=O)OC Amb24379756 [0,2,0,0,0,0|1,0,0]=3 5508 B13R1.537 CC(=C=O)c1ccc(cc1)C(C)C Amb24100679 [0,2,0,0,0,0|1,0,0]=3 5509 B13R1.537 CC(=O)c1ccc([n]c1)C(N)CC Amb25784064 [0,2,0,0,0,0|2,0,0]=4 5510 B13R1.537 CC(=O)c1ccc([n]c1)[C@@H](C)NC Amb24365267 [0,2,0,0,0,0|2,0,0]=4 5511 B13R1.537 CC(=O)c1ccc([n]c1)[C@H](C)NC Amb25700436 [0,2,0,0,0,0|2,0,0]=4 5512 B13R1.537 CC(=O)c1ccc(c[n]1)C(=O)OC Amb22498171 [0,2,0,0,0,0|1,0,0]=3 5513 B13R1.537 CC(=O)c1ccc(c[n]1)N(C)C=O Amb24749825 [0,2,0,0,0,0|2,0,0]=4 5514 B13R1.537 CC(=O)c1ccc(cc1)C(=C)OC Amb25092924 [0,2,0,0,0,0|0,0,0]=2 5515 B13R1.537 CC(=O)c1ccc(cc1)C(=O)CC Amb24752472 [0,2,0,0,0,0|1,0,0]=3 5516 B13R1.537 CC(=O)c1ccc(cc1)C(=O)NC Amb24416589 [0,2,0,0,0,0|1,0,0]=3 5517 B13R1.537 CC(=O)c1ccc(cc1)C(=O)NO Amb24736300 [0,2,0,0,0,0|2,0,0]=4 5518 B13R1.537 CC(=O)c1ccc(cc1)C(C)C=O Amb18127728 [0,2,0,0,0,0|1,0,0]=3 5519 B13R1.537 CC(=O)c1ccc(cc1)C(C)CCl Amb25053960 [0,2,0,0,0,0|1,0,0]=3 5520 B13R1.537 CC(=O)c1ccc(cc1)C(C)CO Amb24602925 [0,2,0,0,0,0|1,0,0]=3 5521 B13R1.537 CC(=O)c1ccc(cc1)C(C)OC Amb23568500 [0,2,0,0,0,0|0,0,0]=2 5522 B13R1.537 CC(=O)c1ccc(cc1)C(Cl)OC Amb24490555 [0,2,0,0,0,0|0,0,0]=2 5523 B13R1.537 CC(=O)c1ccc(cc1)C(O)CC Amb25723280 [0,2,0,0,0,0|1,0,0]=3 5524 B13R1.537 CC(=O)c1ccc(cc1)C(O)CO Amb25769447 [0,2,0,0,0,0|1,0,0]=3 5525 B13R1.537 CC(=O)c1ccc(cc1)[C@@H](C)C=C Amb25334942 [0,2,0,0,0,0|1,0,0]=3 5526 B13R1.537 CC(=O)c1ccc(cc1)[C@@H](C)C=O Amb24490480 [0,2,0,0,0,0|1,0,0]=3 5527 B13R1.537 CC(=O)c1ccc(cc1)[C@@H](C)CC Amb24492646 [0,2,0,0,0,0|1,0,0]=3 5528 B13R1.537 CC(=O)c1ccc(cc1)[C@H](C)C=C Amb25773342 [0,2,0,0,0,0|1,0,0]=3 5529 B13R1.537 CC(=O)c1ccc(cc1)[C@H](O)CC Amb24691770 [0,2,0,0,0,0|1,0,0]=3 5530 B13R1.537 CC(C#N)c1ccc(cc1)C(=O)Cl Amb24102657 [0,2,0,0,0,0|2,0,0]=4 5531 B13R1.537 CC(C)c1ccc(cc1)C(=O)C#N Amb24068579 [0,2,0,0,0,0|1,0,1]=4 5532 B13R1.537 CC(C)c1ccc(cc1)C(=O)C=C Amb18065534 [0,2,0,0,0,0|1,0,1]=4 5533 B13R1.537 CC(C)c1ccc(cc1)C(=O)C=O Amb18127710 [0,2,0,0,0,0|1,0,1]=4 5534 B13R1.537 CC(C)c1ccc(cc1)C(=O)CN Amb22963506 [0,2,0,0,0,0|1,0,0]=3 5535 B13R1.537 CC(C=O)c1ccc(cc1)N(C)C Amb18127988 [0,2,0,0,0,0|1,0,1]=4 5536 B13R1.537 CC(F)c1ccc(cc1)C(=O)CN Amb24742734 [0,2,0,0,0,0|1,0,0]=3 5537 B13R1.537 CC(NN)c1ccc(cc1)C(O)=O Amb24419926 [0,2,0,0,0,0|2,0,0]=4 5538 B13R1.537 CC(OC)c1ccc(cc1)C(C)N Amb23556409 [0,2,0,0,0,0|1,0,1]=4 5539 B13R1.537 CC(OC)c1ccc(cc1)C(C)O Amb23568514 [0,2,0,0,0,0|0,0,2]=4 5540 B13R1.537 CC(c1ccc(cc1)\C(=N\O)\C)C Amb1934545 [0,2,0,0,0,0|1,0,1]=4 5541 B13R1.537 CCC(=O)c1c[n]c(cc1)N(C)C Amb23446336 [0,2,0,0,0,0|2,0,0]=4 5542 B13R1.537 CCC(=O)c1ccc(c[n]1)C(C)N Amb25779219 [0,2,0,0,0,0|2,0,0]=4 5543 B13R1.537 CCC(=O)c1ccc(c[n]1)N(C)C Amb25041996 [0,2,0,0,0,0|2,0,0]=4 5544 B13R1.537 CCC(=O)c1ccc(c[n]1)[C@H](C)N Amb24390764 [0,2,0,0,0,0|2,0,0]=4 5545 B13R1.537 CCC(=O)c1ccc(cc1)C(=O)Cl Amb24070633 [0,2,0,0,0,0|2,0,0]=4 5546 B13R1.537 CCC(=O)c1ccc(cc1)C(C)C Amb2221566 [0,2,0,0,0,0|1,0,0]=3 5547 B13R1.537 CCC(=O)c1ccc(cc1)C(F)F Amb25174106 [0,2,0,0,0,0|2,0,0]=4 5548 B13R1.537 CCC(=O)c1ccc(cc1)C(N)C Amb17101614 [0,2,0,0,0,0|1,0,0]=3 5549 B13R1.537 CCC(=O)c1ccc(cc1)N(C)C Amb17138822 [0,2,0,0,0,0|1,0,0]=3 5550 B13R1.537 CCC(=O)c1ccc(cc1)[N+](=O)[O-] Amb16206223 [0,2,0,0,0,0|2,0,0]=4 5551 B13R1.537 CCC(Br)c1ccc(cc1)C(O)=O Amb25095921 [0,2,0,0,0,0|2,0,0]=4 5552 B13R1.537 CCC(C)c1ccc(cc1)C(=O)Cl Amb24070677 [0,2,0,0,0,0|2,0,0]=4 5553 B13R1.537 CCC(N)c1ccc(cc1)C(N)=O Amb24740945 [0,2,0,0,0,0|2,0,0]=4 5554 B13R1.537 CCC(N)c1ccc(cc1)C(O)=O Amb25827727 [0,2,0,0,0,0|2,0,0]=4 5555 B13R1.537 CCC(c1ccc(cc1)C(=O)N)C Amb17233284 [0,2,0,0,0,0|2,0,0]=4 5556 B13R1.537 CCN(c1ccc(cc1)C(=O)O)C Amb13951351 [0,2,0,0,0,0|2,0,0]=4 5557 B13R1.537 CCS(=O)c1ccc(cc1)C(O)=O Amb18289669 [0,2,0,0,0,0|1,1,0]=4 5558 B13R1.537 CC[C@@H](C)c1ccc(cc1)C(O)=O Amb24443053 [0,2,0,0,0,0|2,0,0]=4 5559 B13R1.537 CC[C@@H](N)c1ccc(cc1)C(O)=O Amb24626907 [0,2,0,0,0,0|2,0,0]=4 5560 B13R1.537 CN(C)c1ccc(c[n]1)C(=O)CN Amb24384828 [0,2,0,0,0,0|2,0,0]=4 5561 B13R1.537 CN(C)c1ccc(cc1)C(=O)C#C Amb24364188 [0,2,0,0,0,0|1,0,1]=4 5562 B13R1.537 CN(C)c1ccc(cc1)C(=O)C#N Amb25334904 [0,2,0,0,0,0|1,0,1]=4 5563 B13R1.537 CN(C)c1ccc(cc1)C(=O)C=O Amb25040016 [0,2,0,0,0,0|1,0,1]=4 5564 B13R1.537 CN(C)c1ccc(cc1)C(=O)CN Amb18105897 [0,2,0,0,0,0|1,0,0]=3 5565 B13R1.537 CN(C)c1ccc(cc1)C(=O)CO Amb18065829 [0,2,0,0,0,0|1,0,0]=3 5566 B13R1.537 CN(C)c1ccc(cc1)C(N)=S=O Amb25667867 [0,2,0,0,0,0|2,0,0]=4 5567 B13R1.537 CN(N=O)c1ccc(cc1)C(O)=O Amb25241559 [0,2,0,0,0,0|2,0,0]=4 5568 B13R1.537 CNC(=O)c1c[n]c(cc1)C(C)C Amb25334377 [0,2,0,0,0,0|2,0,0]=4 5569 B13R1.537 CNC(=O)c1ccc(c[n]1)N(C)C Amb25143627 [0,2,0,0,0,0|2,0,0]=4 5570 B13R1.537 CNC(=O)c1ccc(cc1)B(O)O Amb2456025 [0,2,0,0,0,0|2,0,0]=4 5571 B13R1.537 CNC(=O)c1ccc(cc1)C(C)C Amb24066855 [0,2,0,0,0,0|1,0,0]=3 5572 B13R1.537 CNC(=O)c1ccc(cc1)C(C)N Amb25731040 [0,2,0,0,0,0|1,0,0]=3 5573 B13R1.537 CNC(=O)c1ccc(cc1)C(F)F Amb25323455 [0,2,0,0,0,0|2,0,0]=4 5574 B13R1.537 CNC(=O)c1ccc(cc1)C(N)=O Amb25696850 [0,2,0,0,0,0|2,0,0]=4 5575 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1771584 [0,2,0,0,0,0|2,0,0]=4 5576 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1786386 [0,2,0,0,0,0|2,0,0]=4 5577 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1804380 [0,2,0,0,0,0|2,0,0]=4 5578 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1805171 [0,2,0,0,0,0|2,0,0]=4 5579 B13R1.537 CNC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1814523 [0,2,0,0,0,0|2,0,0]=4 5580 B13R1.537 CNC(=S)c1ccc(cc1)N(C)C Amb1091803 [0,2,0,0,0,0|1,1,0]=4 5581 B13R1.537 CNC(C)c1ccc(cc1)C(O)=O Amb25212244 [0,2,0,0,0,0|2,0,0]=4 5582 B13R1.537 CNC(C)c1ccc(cc1)S(C)=O Amb20623516 [0,2,0,0,0,0|2,0,0]=4 5583 B13R1.537 CN[C@@H](C)c1ccc(cc1)C(O)=O Amb24699025 [0,2,0,0,0,0|2,0,0]=4 5584 B13R1.537 CN[C@H](C)c1ccc(cc1)C(O)=O Amb25286800 [0,2,0,0,0,0|2,0,0]=4 5585 B13R1.537 COB(O)c1ccc(cc1)C(O)=O Amb24535347 [0,2,0,0,0,0|1,0,0]=3 5586 B13R1.537 COC(=C)c1ccc(cc1)[N+]([O-])=O Amb17674031 [0,2,0,0,0,0|2,0,0]=4 5587 B13R1.537 COC(=N)c1ccc(cc1)C(C)C Amb18180670 [0,2,0,0,0,0|1,0,1]=4 5588 B13R1.537 COC(=N)c1ccc(cc1)N(C)C Amb18796020 [0,2,0,0,0,0|2,0,0]=4 5589 B13R1.537 COC(=O)c1c[n]c(cc1)C(C)C Amb24378533 [0,2,0,0,0,0|2,0,0]=4 5590 B13R1.537 COC(=O)c1c[n]c(cc1)C(C)N Amb24697428 [0,2,0,0,0,0|2,0,0]=4 5591 B13R1.537 COC(=O)c1c[n]c(cc1)C(C)O Amb22498172 [0,2,0,0,0,0|2,0,0]=4 5592 B13R1.537 COC(=O)c1c[n]c(cc1)N(C)C Amb19959736 [0,2,0,0,0,0|2,0,0]=4 5593 B13R1.537 COC(=O)c1c[n]c(cc1)[C@H](C)N Amb25187879 [0,2,0,0,0,0|2,0,0]=4 5594 B13R1.537 COC(=O)c1ccc([n]c1)C(=O)Cl Amb24062477 [0,2,0,0,0,0|2,0,0]=4 5595 B13R1.537 COC(=O)c1ccc([n]c1)C(N)=O Amb19405992 [0,2,0,0,0,0|2,0,0]=4 5596 B13R1.537 COC(=O)c1ccc(c[n]1)C(C)C Amb25144102 [0,2,0,0,0,0|2,0,0]=4 5597 B13R1.537 COC(=O)c1ccc(c[n]1)C(C)N Amb25744580 [0,2,0,0,0,0|2,0,0]=4 5598 B13R1.537 COC(=O)c1ccc(c[n]1)C(C)O Amb25741452 [0,2,0,0,0,0|2,0,0]=4 5599 B13R1.537 COC(=O)c1ccc(c[n]1)C(N)=O Amb25061411 [0,2,0,0,0,0|2,0,0]=4 5600 B13R1.537 COC(=O)c1ccc(c[n]1)N(C)C Amb25668971 [0,2,0,0,0,0|2,0,0]=4 5601 B13R1.537 COC(=O)c1ccc(cc1)B(O)O Amb2447023 [0,2,0,0,0,0|2,0,0]=4 5602 B13R1.537 COC(=O)c1ccc(cc1)C(=N)N Amb10576606 [0,2,0,0,0,0|2,0,0]=4 5603 B13R1.537 COC(=O)c1ccc(cc1)C(=O)F Amb24097656 [0,2,0,0,0,0|1,0,0]=3 5604 B13R1.537 COC(=O)c1ccc(cc1)C(=S)N Amb13951471 [0,2,0,0,0,0|1,1,0]=4 5605 B13R1.537 COC(=O)c1ccc(cc1)C(Br)Br Amb1104625 [0,2,0,0,0,0|2,0,0]=4 5606 B13R1.537 COC(=O)c1ccc(cc1)C(Br)Br Amb20246859 [0,2,0,0,0,0|2,0,0]=4 5607 B13R1.537 COC(=O)c1ccc(cc1)C(C)Br Amb22728225 [0,2,0,0,0,0|1,0,0]=3 5608 B13R1.537 COC(=O)c1ccc(cc1)C(C)N Amb22232649 [0,2,0,0,0,0|1,0,0]=3 5609 B13R1.537 COC(=O)c1ccc(cc1)C(F)F Amb19888790 [0,2,0,0,0,0|2,0,0]=4 5610 B13R1.537 COC(=O)c1ccc(cc1)C(N)=N Amb20673125 [0,2,0,0,0,0|2,0,0]=4 5611 B13R1.537 COC(=O)c1ccc(cc1)C(N)C Amb17084725 [0,2,0,0,0,0|1,0,0]=3 5612 B13R1.537 COC(=O)c1ccc(cc1)C(O)=S Amb22289354 [0,2,0,0,0,0|1,0,1]=4 5613 B13R1.537 COC(=O)c1ccc(cc1)C([O-])=O Amb22230947 [0,2,0,0,0,0|1,0,0]=3 5614 B13R1.537 COC(=O)c1ccc(cc1)N(C)C Amb2582574 [0,2,0,0,0,0|1,0,0]=3 5615 B13R1.537 COC(=O)c1ccc(cc1)S(=O)Cl Amb25715438 [0,2,0,0,0,0|1,1,0]=4 5616 B13R1.537 COC(=O)c1ccc(cc1)S(=O)O Amb10564098 [0,2,0,0,0,0|1,1,0]=4 5617 B13R1.537 COC(=O)c1ccc(cc1)[C@@H](C)N Amb20241096 [0,2,0,0,0,0|1,0,0]=3 5618 B13R1.537 COC(=O)c1ccc(cc1)[C@@H](C)N Amb22748770 [0,2,0,0,0,0|1,0,0]=3 5619 B13R1.537 COC(=O)c1ccc(cc1)[C@@H](C)O Amb19372877 [0,2,0,0,0,0|1,0,0]=3 5620 B13R1.537 COC(=O)c1ccc(cc1)[C@@H](O)C Amb10610497 [0,2,0,0,0,0|1,0,0]=3 5621 B13R1.537 COC(=O)c1ccc(cc1)[C@H](C)N Amb20241095 [0,2,0,0,0,0|1,0,0]=3 5622 B13R1.537 COC(=O)c1ccc(cc1)[C@H](C)N Amb20241670 [0,2,0,0,0,0|1,0,0]=3 5623 B13R1.537 COC(=O)c1ccc(cc1)[SiH](C)C Amb25076792 [0,2,0,0,0,0|1,0,0]=3 5624 B13R1.537 COC(C)c1ccc(cc1)C(O)=O Amb25700926 [0,2,0,0,0,0|1,0,0]=3 5625 B13R1.537 COC(C)c1ccc(cc1)[N+]([O-])=O Amb25761979 [0,2,0,0,0,0|2,0,0]=4 5626 B13R1.537 CON(C)c1ccc(cc1)C(O)=O Amb25087251 [0,2,0,0,0,0|1,0,0]=3 5627 B13R1.537 CS(=O)c1ccc(cc1)C(=O)CCl Amb25095221 [0,2,0,0,0,0|0,1,0]=3 5628 B13R1.537 CS(=O)c1ccc(cc1)C(=O)NO Amb25143101 [0,2,0,0,0,0|1,1,0]=4 5629 B13R1.537 CS(=O)c1ccc(cc1)C(=O)OC Amb24654650 [0,2,0,0,0,0|0,1,0]=3 5630 B13R1.537 C[C@@H](CO)c1ccc(cc1)C(O)=O Amb25279521 [0,2,0,0,0,0|2,0,0]=4 5631 B13R1.537 C[C@@H](N)c1ccc(cc1)N(C)C=O Amb25713106 [0,2,0,0,0,0|2,0,0]=4 5632 B13R1.537 C[C@H](NN)c1ccc(cc1)C(O)=O Amb24093107 [0,2,0,0,0,0|2,0,0]=4 5633 B13R1.537 C\C(=N/O)\c1ccc(cc1)C(C)=O Amb25192555 [0,2,0,0,0,0|1,0,0]=3 5634 B13R1.537 C\C(=N\N)\c1ccc(cc1)C(O)=O Amb24496108 [0,2,0,0,0,0|2,0,0]=4 5635 B13R1.537 C\C(=N\N)\c1ccc(cc1)S(C)=O Amb24505403 [0,2,0,0,0,0|1,1,0]=4 5636 B13R1.537 ClCC(=O)c1ccc(cc1)C(C)C Amb2370827 [0,2,0,0,0,0|1,0,0]=3 5637 B13R1.537 ClCC(=O)c1ccc(cc1)N(C)C Amb10071339 [0,2,0,0,0,0|1,0,0]=3 5638 B13R1.537 NC(=N)c1ccc(cc1)C(=O)CCl Amb25060715 [0,2,0,0,0,0|2,0,0]=4 5639 B13R1.537 NC(=O)c1ccc(cc1)C(N)CN Amb24701296 [0,2,0,0,0,0|2,0,0]=4 5640 B13R1.537 NC(=O)c1ccc(cc1)[C@@H](N)CO Amb25090300 [0,2,0,0,0,0|2,0,0]=4 5641 B13R1.537 NC(=O)c1ccc(cc1)[C@H](N)CN Amb25034207 [0,2,0,0,0,0|2,0,0]=4 5642 B13R1.537 NC(=O)c1ccc(cc1)[C@H](N)CO Amb24428076 [0,2,0,0,0,0|2,0,0]=4 5643 B13R1.537 NC(=S)c1ccc(cc1)C(=O)CN Amb25189689 [0,2,0,0,0,0|2,0,0]=4 5644 B13R1.537 NC(CF)c1ccc(cc1)C(O)=O Amb25221940 [0,2,0,0,0,0|2,0,0]=4 5645 B13R1.537 NCC(=O)c1ccc(cc1)C(O)=O Amb24637132 [0,2,0,0,0,0|2,0,0]=4 5646 B13R1.537 NCC(=O)c1ccc(cc1)N(C)C Amb10070304 [0,2,0,0,0,0|1,0,0]=3 5647 B13R1.537 NCC(=O)c1ccc(cc1)[N+](=O)[O-] Amb1395877 [0,2,0,0,0,0|2,0,0]=4 5648 B13R1.537 NCC(=O)c1ccc(cc1)[N+](=O)[O-] Amb2560889 [0,2,0,0,0,0|2,0,0]=4 5649 B13R1.537 NCC(N)c1ccc(cc1)C(O)=O Amb25738306 [0,2,0,0,0,0|2,0,0]=4 5650 B13R1.537 N[C@@H](CO)c1ccc(cc1)C(O)=O Amb24359851 [0,2,0,0,0,0|2,0,0]=4 5651 B13R1.537 N[C@H](CF)c1ccc(cc1)C(O)=O Amb24445191 [0,2,0,0,0,0|2,0,0]=4 5652 B13R1.537 N[C@H](CO)c1ccc(cc1)C(O)=O Amb24533875 [0,2,0,0,0,0|2,0,0]=4 5653 B13R1.537 O=C(CBr)c1ccc(cc1)N(=O)=O Amb20620535 [0,2,0,0,0,0|2,0,0]=4 5654 B13R1.537 O=C(Cl)c1ccc(cc1)C(=O)CCl Amb24102939 [0,2,0,0,0,0|2,0,0]=4 5655 B13R1.537 O=CC(=O)c1ccc(cc1)N(C)C Amb10067944 [0,2,0,0,0,0|1,0,1]=4 5656 B13R1.537 O=CC(c1ccc(cc1)C(C)C)C Amb17138787 [0,2,0,0,0,0|1,0,1]=4 5657 B13R1.537 OC(=O)c1ccc(cc1)C(=O)CCl Amb22491849 [0,2,0,0,0,0|2,0,0]=4 5658 B13R1.537 OCC(=O)c1ccc(cc1)B(O)O Amb25177550 [0,2,0,0,0,0|2,0,0]=4 5659 B13R1.537 SCC(=O)c1ccc(cc1)C(C)C Amb17401970 [0,2,0,0,0,0|1,0,0]=3 5660 B13R1.3088 BrCC(=O)c1ccc(c(c1)Br)CC Amb17391690 [0,2,0,0,0,0|1,0,0]=3 5661 B13R1.3088 BrCC(=O)c1ccc(c(c1)Cl)OC Amb1765565 [0,2,0,0,0,0|0,0,0]=2 5662 B13R1.3088 BrCC(c1ccc(c(c1)C)OC)C Amb17256439 [0,2,0,0,0,0|1,0,1]=4 5663 B13R1.3088 BrCC(c1ccc(c(c1)C)OC)O Amb17206119 [0,2,0,0,0,0|0,0,2]=4 5664 B13R1.3088 BrCC(c1ccc(c(c1)Cl)OC)C Amb17270672 [0,2,0,0,0,0|1,0,1]=4 5665 B13R1.3088 BrCC(c1ccc(c(c1)F)OC)C Amb17258928 [0,2,0,0,0,0|1,0,1]=4 5666 B13R1.3088 CC(=NN)c1c[n]c(OC)c(Cl)c1 Amb25334450 [0,2,0,0,0,0|2,0,0]=4 5667 B13R1.3088 CCC(=O)c1cc(Br)c(cc1)C#N Amb24740229 [0,2,0,0,0,0|2,0,0]=4 5668 B13R1.3088 CCC(=O)c1cc(Cl)c(cc1)C#N Amb24616039 [0,2,0,0,0,0|2,0,0]=4 5669 B13R1.3088 CCC(=O)c1cc(F)c(CBr)cc1 Amb25238930 [0,2,0,0,0,0|2,0,0]=4 5670 B13R1.3088 CCC(=O)c1cc(I)c(CBr)cc1 Amb25208451 [0,2,0,0,0,0|2,0,0]=4 5671 B13R1.3088 CCC(=O)c1cc(I)c(cc1)OC Amb23538008 [0,2,0,0,0,0|0,0,0]=2 5672 B13R1.3088 CCC(=O)c1cc(I)c(cc1)SC Amb24695626 [0,2,0,0,0,0|0,1,0]=3 5673 B13R1.3088 CCC(=O)c1cc(N)c(CBr)cc1 Amb24536963 [0,2,0,0,0,0|2,0,0]=4 5674 B13R1.3088 CCC(=O)c1cc(N)c(CCl)cc1 Amb24536818 [0,2,0,0,0,0|2,0,0]=4 5675 B13R1.3088 CCC(=O)c1cc(N)c(cc1)SC Amb24697081 [0,2,0,0,0,0|0,1,0]=3 5676 B13R1.3088 CCC(=O)c1cc(O)c(cc1)NC Amb24677756 [0,2,0,0,0,0|1,0,0]=3 5677 B13R1.3088 CCC(=O)c1ccc(C=O)c(Br)c1 Amb25268452 [0,2,0,0,0,0|2,0,0]=4 5678 B13R1.3088 CCC(=O)c1ccc(C=O)c(F)c1 Amb24623672 [0,2,0,0,0,0|2,0,0]=4 5679 B13R1.3088 CCC(=O)c1ccc(CC)c(F)c1 Amb24639263 [0,2,0,0,0,0|1,0,0]=3 5680 B13R1.3088 CCC(=O)c1ccc(CC)c(I)c1 Amb25376415 [0,2,0,0,0,0|1,0,0]=3 5681 B13R1.3088 CCC(=O)c1ccc(CC)c(S)c1 Amb25208779 [0,2,0,0,0,0|1,0,0]=3 5682 B13R1.3088 CCC(=O)c1ccc(c(c1)Br)CC Amb17193981 [0,2,0,0,0,0|1,0,0]=3 5683 B13R1.3088 CCC(=O)c1ccc(c(c1)F)OC Amb2413194 [0,2,0,0,0,0|0,0,0]=2 5684 B13R1.3088 CCC(=O)c1ccc(c(c1)N)CC Amb17138813 [0,2,0,0,0,0|1,0,0]=3 5685 B13R1.3088 CCC(Br)c1cc(F)c(cc1)OC Amb25751964 [0,2,0,0,0,0|1,0,1]=4 5686 B13R1.3088 CCC(C)c1cc(Br)c(cc1)OC Amb25761215 [0,2,0,0,0,0|1,0,1]=4 5687 B13R1.3088 CCC(Cl)c1cc(Br)c(cc1)OC Amb24533831 [0,2,0,0,0,0|1,0,1]=4 5688 B13R1.3088 CCC(Cl)c1cc(F)c(cc1)OC Amb25768910 [0,2,0,0,0,0|1,0,1]=4 5689 B13R1.3088 CCC(N)c1cc(O)c(cc1)OC Amb24655925 [0,2,0,0,0,0|1,0,1]=4 5690 B13R1.3088 CCC(c1ccc(c(c1)Br)OC)O Amb17196304 [0,2,0,0,0,0|0,0,2]=4 5691 B13R1.3088 CCC(c1ccc(c(c1)C)OC)Cl Amb17139736 [0,2,0,0,0,0|1,0,1]=4 5692 B13R1.3088 CCC(c1ccc(c(c1)C)OC)O Amb17138969 [0,2,0,0,0,0|0,0,2]=4 5693 B13R1.3088 CCC(c1ccc(c(c1)Cl)OC)O Amb17194818 [0,2,0,0,0,0|0,0,2]=4 5694 B13R1.3088 CCC(c1ccc(c(c1)F)OC)N Amb1108113 [0,2,0,0,0,0|1,0,1]=4 5695 B13R1.3088 CCC(c1ccc(c(c1)F)OC)O Amb17194562 [0,2,0,0,0,0|0,0,2]=4 5696 B13R1.3088 CCC1=CC=C(NC1=O)C(=O)OC Amb24085019 [0,2,0,0,0,0|2,0,0]=4 5697 B13R1.3088 CCN(C)c1cc(Cl)c(cc1)OC Amb25663474 [0,2,0,0,0,0|2,0,0]=4 5698 B13R1.3088 CCN(C)c1cc(F)c(cc1)OC Amb24544293 [0,2,0,0,0,0|2,0,0]=4 5699 B13R1.3088 CCN(O)c1cc(N)c(cc1)OC Amb22168317 [0,2,0,0,0,0|1,0,1]=4 5700 B13R1.3088 CC[C@@H](N)c1cc(Cl)c(cc1)OC Amb25187949 [0,2,0,0,0,0|1,0,1]=4 5701 B13R1.3088 CC[C@@H](N)c1cc(O)c(cc1)OC Amb25114873 [0,2,0,0,0,0|1,0,1]=4 5702 B13R1.3088 CC[C@@H](O)c1cc(F)c(cc1)OC Amb24407216 [0,2,0,0,0,0|0,0,2]=4 5703 B13R1.3088 CC[C@H](N)c1cc(Br)c(cc1)OC Amb25778159 [0,2,0,0,0,0|1,0,1]=4 5704 B13R1.3088 CCc1[n]cc(cc1Br)C(=O)OC Amb25843048 [0,2,0,0,0,0|2,0,0]=4 5705 B13R1.3088 CCc1[n]cc(cc1Cl)C(=O)OC Amb25696700 [0,2,0,0,0,0|2,0,0]=4 5706 B13R1.3088 CCc1[n]cc(cc1F)C(=O)OC Amb25373767 [0,2,0,0,0,0|2,0,0]=4 5707 B13R1.3088 CCc1ccc(cc1Br)C(=O)NN Amb23492487 [0,2,0,0,0,0|2,0,0]=4 5708 B13R1.3088 CCc1ccc(cc1Cl)C(=O)CCl Amb18277493 [0,2,0,0,0,0|1,0,0]=3 5709 B13R1.3088 CCc1ccc(cc1Cl)C(=O)OC Amb18942648 [0,2,0,0,0,0|1,0,0]=3 5710 B13R1.3088 CCc1ccc(cc1F)C(=O)CBr Amb25134882 [0,2,0,0,0,0|1,0,0]=3 5711 B13R1.3088 CCc1ccc(cc1F)C(=O)OC Amb24378215 [0,2,0,0,0,0|1,0,0]=3 5712 B13R1.3088 CCc1ccc(cc1N)C(=O)OC Amb19001995 [0,2,0,0,0,0|1,0,0]=3 5713 B13R1.3088 CCc1ccc(cc1O)C(=O)CBr Amb25220281 [0,2,0,0,0,0|1,0,0]=3 5714 B13R1.3088 CNC(=O)c1cc(Cl)c(cc1)OC Amb19671364 [0,2,0,0,0,0|0,0,0]=2 5715 B13R1.3088 CNC(=O)c1cc(O)c(cc1)C#N Amb25697036 [0,2,0,0,0,0|2,0,0]=4 5716 B13R1.3088 CNC(=O)c1cc(O)c(cc1)OC Amb25719455 [0,2,0,0,0,0|0,0,0]=2 5717 B13R1.3088 CNC(=O)c1cc(O)c(cc1)SC Amb24565253 [0,2,0,0,0,0|0,1,0]=3 5718 B13R1.3088 CNC(=O)c1ccc(C=O)c(O)c1 Amb24738618 [0,2,0,0,0,0|2,0,0]=4 5719 B13R1.3088 CNC(=O)c1ccc(CN)c(O)c1 Amb24678376 [0,2,0,0,0,0|2,0,0]=4 5720 B13R1.3088 CNC(=O)c1ccc(OC)c(Br)[n]1 Amb25052872 [0,2,0,0,0,0|1,0,0]=3 5721 B13R1.3088 CNC(=O)c1ccc(OC)c(I)[n]1 Amb25205319 [0,2,0,0,0,0|1,0,0]=3 5722 B13R1.3088 CNC(=O)c1ccc(c(c1)Br)OC Amb2052287 [0,2,0,0,0,0|0,0,0]=2 5723 B13R1.3088 CNC(=O)c1ccc(c(c1)N)NC Amb16543641 [0,2,0,0,0,0|1,0,0]=3 5724 B13R1.3088 CNC(=O)c1ccc(c(c1)N)OC Amb10767191 [0,2,0,0,0,0|0,0,0]=2 5725 B13R1.3088 CNC(=O)c1ccc(c(c1)N)OC Amb1119254 [0,2,0,0,0,0|0,0,0]=2 5726 B13R1.3088 CNC(C)c1cc(N)c(cc1)OC Amb25803620 [0,2,0,0,0,0|1,0,1]=4 5727 B13R1.3088 CN[C@@H](C)c1cc(I)c(cc1)OC Amb25155039 [0,2,0,0,0,0|1,0,1]=4 5728 B13R1.3088 CN[C@@H](C)c1cc(N)c(cc1)OC Amb25074074 [0,2,0,0,0,0|1,0,1]=4 5729 B13R1.3088 CN[C@H](C)c1cc(N)c(cc1)OC Amb25061209 [0,2,0,0,0,0|1,0,1]=4 5730 B13R1.3088 CN[C@H](C)c1cc(O)c(cc1)OC Amb25713972 [0,2,0,0,0,0|1,0,1]=4 5731 B13R1.3088 CNc1[n]cc(cc1Br)C(=O)NC Amb25037030 [0,2,0,0,0,0|2,0,0]=4 5732 B13R1.3088 CNc1[n]cc(cc1Br)C(=O)OC Amb21926815 [0,2,0,0,0,0|2,0,0]=4 5733 B13R1.3088 CNc1[n]cc(cc1Cl)C(=O)NC Amb18959237 [0,2,0,0,0,0|2,0,0]=4 5734 B13R1.3088 CNc1[n]cc(cc1N)C(=O)OC Amb25232518 [0,2,0,0,0,0|2,0,0]=4 5735 B13R1.3088 CNc1ccc(cc1Cl)C(=O)NC Amb25724390 [0,2,0,0,0,0|1,0,0]=3 5736 B13R1.3088 CNc1ccc(cc1Cl)C(=O)OC Amb23437045 [0,2,0,0,0,0|1,0,0]=3 5737 B13R1.3088 CNc1ccc(cc1F)C(=O)OC Amb23412520 [0,2,0,0,0,0|1,0,0]=3 5738 B13R1.3088 COC(=O)c1c[n]c(OC)c(N)[n]1 Amb24096178 [0,2,0,0,0,0|2,0,0]=4 5739 B13R1.3088 COC(=O)c1c[n]c(SC)c(N)c1 Amb24062464 [0,2,0,0,0,0|1,1,0]=4 5740 B13R1.3088 COC(=O)c1cc(Br)c(cc1)C#C Amb22896649 [0,2,0,0,0,0|1,0,1]=4 5741 B13R1.3088 COC(=O)c1cc(Br)c(cc1)C#N Amb21857341 [0,2,0,0,0,0|2,0,0]=4 5742 B13R1.3088 COC(=O)c1cc(Br)c(cc1)NN Amb25341248 [0,2,0,0,0,0|2,0,0]=4 5743 B13R1.3088 COC(=O)c1cc(Cl)c(CCl)cc1 Amb25828478 [0,2,0,0,0,0|2,0,0]=4 5744 B13R1.3088 COC(=O)c1cc(Cl)c(c[n]1)OC Amb25804815 [0,2,0,0,0,0|1,0,0]=3 5745 B13R1.3088 COC(=O)c1cc(Cl)c(cc1)C#N Amb22001932 [0,2,0,0,0,0|2,0,0]=4 5746 B13R1.3088 COC(=O)c1cc(F)c(cc1)C#N Amb19515894 [0,2,0,0,0,0|2,0,0]=4 5747 B13R1.3088 COC(=O)c1cc(N)c(cc1)C#N Amb25804657 [0,2,0,0,0,0|2,0,0]=4 5748 B13R1.3088 COC(=O)c1cc(N)c(cc1)SC Amb18975481 [0,2,0,0,0,0|0,1,0]=3 5749 B13R1.3088 COC(=O)c1ccc(C=C)c(N)c1 Amb18127869 [0,2,0,0,0,0|1,0,1]=4 5750 B13R1.3088 COC(=O)c1ccc(C=O)c(Br)c1 Amb21857342 [0,2,0,0,0,0|2,0,0]=4 5751 B13R1.3088 COC(=O)c1ccc(C=O)c(Cl)c1 Amb21856991 [0,2,0,0,0,0|2,0,0]=4 5752 B13R1.3088 COC(=O)c1ccc(C=O)c(F)c1 Amb20671039 [0,2,0,0,0,0|2,0,0]=4 5753 B13R1.3088 COC(=O)c1ccc(C=O)c(O)c1 Amb18128551 [0,2,0,0,0,0|2,0,0]=4 5754 B13R1.3088 COC(=O)c1ccc(CBr)c(I)c1 Amb20621627 [0,2,0,0,0,0|2,0,0]=4 5755 B13R1.3088 COC(=O)c1ccc(CCl)c(F)c1 Amb25156381 [0,2,0,0,0,0|2,0,0]=4 5756 B13R1.3088 COC(=O)c1ccc(CCl)c(N)c1 Amb25157196 [0,2,0,0,0,0|2,0,0]=4 5757 B13R1.3088 COC(=O)c1ccc(CN)c(F)c1 Amb25719483 [0,2,0,0,0,0|2,0,0]=4 5758 B13R1.3088 COC(=O)c1ccc(CO)c(Br)c1 Amb22728295 [0,2,0,0,0,0|2,0,0]=4 5759 B13R1.3088 COC(=O)c1ccc(CS)c(Br)c1 Amb25039074 [0,2,0,0,0,0|2,0,0]=4 5760 B13R1.3088 COC(=O)c1ccc(OC)c(F)[n]1 Amb24386272 [0,2,0,0,0,0|1,0,0]=3 5761 B13R1.3088 COC(=O)c1ccc(OC)c(I)[n]1 Amb22751531 [0,2,0,0,0,0|1,0,0]=3 5762 B13R1.3088 COC(=O)c1ccc(c(c1)Br)CC Amb16232633 [0,2,0,0,0,0|1,0,0]=3 5763 B13R1.3088 COC(=O)c1ccc(c(c1)Br)NC Amb16232856 [0,2,0,0,0,0|1,0,0]=3 5764 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)CBr Amb16233191 [0,2,0,0,0,0|2,0,0]=4 5765 B13R1.3088 COC(=O)c1ccc(c(c1)Cl)CN Amb16233192 [0,2,0,0,0,0|2,0,0]=4 5766 B13R1.3088 COC(=O)c1ccc(c(c1)F)CBr Amb10602643 [0,2,0,0,0,0|2,0,0]=4 5767 B13R1.3088 COC(=O)c1ccc(c(c1)F)OC Amb10607173 [0,2,0,0,0,0|0,0,0]=2 5768 B13R1.3088 COC(=O)c1ccc(c(c1)I)CC Amb16232838 [0,2,0,0,0,0|1,0,0]=3 5769 B13R1.3088 COC(=O)c1ccc(c(c1)I)NC Amb16232857 [0,2,0,0,0,0|1,0,0]=3 5770 B13R1.3088 COC(=O)c1ccc(c(c1)N)NC Amb10975652 [0,2,0,0,0,0|1,0,0]=3 5771 B13R1.3088 COC(=O)c1ccc(c(c1)N)OC Amb2099720 [0,2,0,0,0,0|0,0,0]=2 5772 B13R1.3088 COC(=O)c1ccc(c(c1)O)CO Amb10071376 [0,2,0,0,0,0|2,0,0]=4 5773 B13R1.3088 COC(=O)c1cnc(c(c1)Cl)OC Amb10975391 [0,2,0,0,0,0|1,0,0]=3 5774 B13R1.3088 COC(=O)c1cnc(c(c1)I)OC Amb15695294 [0,2,0,0,0,0|1,0,0]=3 5775 B13R1.3088 COC1=CN=C(NC1=S)C(=O)OC Amb24581949 [0,2,0,0,0,0|2,0,0]=4 5776 B13R1.3088 COC1=CNC(=CC1=O)C(=O)OC Amb25035460 [0,2,0,0,0,0|1,0,0]=3 5777 B13R1.3088 COC1=COC(=CC1=O)C(=O)NC Amb24387659 [0,2,0,0,0,0|1,0,0]=3 5778 B13R1.3088 COC1=COC(=CC1=O)C(=O)NO Amb25837639 [0,2,0,0,0,0|2,0,0]=4 5779 B13R1.3088 COC1=COC(=CC1=O)C(=O)OC Amb25358463 [0,2,0,0,0,0|1,0,0]=3 5780 B13R1.3088 COc1[n]cc(cc1Br)C(=O)OC Amb20621568 [0,2,0,0,0,0|1,0,0]=3 5781 B13R1.3088 COc1[n]cc(cc1Cl)C(=O)NO Amb25092591 [0,2,0,0,0,0|2,0,0]=4 5782 B13R1.3088 COc1[n]cc(cc1F)C(=O)OC Amb22233800 [0,2,0,0,0,0|1,0,0]=3 5783 B13R1.3088 COc1[n]cc(cc1N)C(=O)OC Amb20171058 [0,2,0,0,0,0|1,0,0]=3 5784 B13R1.3088 COc1[n]cc(cc1O)C(=O)OC Amb22728172 [0,2,0,0,0,0|1,0,0]=3 5785 B13R1.3088 COc1ccc([n]c1Br)C(=O)NN Amb24596551 [0,2,0,0,0,0|2,0,0]=4 5786 B13R1.3088 COc1ccc([n]c1Br)C(=O)NO Amb24732682 [0,2,0,0,0,0|2,0,0]=4 5787 B13R1.3088 COc1ccc([n]c1Cl)C(=O)NO Amb24380408 [0,2,0,0,0,0|2,0,0]=4 5788 B13R1.3088 COc1ccc(c[n+]1[O-])C(=O)OC Amb24476017 [0,2,0,0,0,0|1,0,0]=3 5789 B13R1.3088 COc1ccc(cc1Br)C(=O)C#C Amb24698218 [0,2,0,0,0,0|0,0,1]=3 5790 B13R1.3088 COc1ccc(cc1Br)C(=O)C=C Amb18577487 [0,2,0,0,0,0|0,0,1]=3 5791 B13R1.3088 COc1ccc(cc1Br)C(=O)NO Amb23551911 [0,2,0,0,0,0|1,0,0]=3 5792 B13R1.3088 COc1ccc(cc1Br)C(C)NN Amb18873508 [0,2,0,0,0,0|1,0,1]=4 5793 B13R1.3088 COc1ccc(cc1Br)C(F)CN Amb24388521 [0,2,0,0,0,0|1,0,1]=4 5794 B13R1.3088 COc1ccc(cc1Br)C(N)CN Amb18971474 [0,2,0,0,0,0|1,0,1]=4 5795 B13R1.3088 COc1ccc(cc1Br)C(O)CO Amb18580495 [0,2,0,0,0,0|0,0,2]=4 5796 B13R1.3088 COc1ccc(cc1Br)[C@@H](C)NO Amb25342425 [0,2,0,0,0,0|0,0,2]=4 5797 B13R1.3088 COc1ccc(cc1Br)[C@@H](N)CF Amb24659685 [0,2,0,0,0,0|1,0,1]=4 5798 B13R1.3088 COc1ccc(cc1Br)[C@@H](N)CO Amb24629032 [0,2,0,0,0,0|1,0,1]=4 5799 B13R1.3088 COc1ccc(cc1Br)[C@H](C)NO Amb25091068 [0,2,0,0,0,0|0,0,2]=4 5800 B13R1.3088 COc1ccc(cc1Br)[C@H](N)CF Amb25197969 [0,2,0,0,0,0|1,0,1]=4 5801 B13R1.3088 COc1ccc(cc1Br)[C@H](N)CO Amb24623305 [0,2,0,0,0,0|1,0,1]=4 5802 B13R1.3088 COc1ccc(cc1Br)[C@H](O)CN Amb25200217 [0,2,0,0,0,0|0,0,2]=4 5803 B13R1.3088 COc1ccc(cc1Cl)C(=O)C=C Amb18066408 [0,2,0,0,0,0|0,0,1]=3 5804 B13R1.3088 COc1ccc(cc1Cl)C(=O)NN Amb19553753 [0,2,0,0,0,0|1,0,0]=3 5805 B13R1.3088 COc1ccc(cc1Cl)C(C)NN Amb18225068 [0,2,0,0,0,0|1,0,1]=4 5806 B13R1.3088 COc1ccc(cc1Cl)C(C)SC Amb25120511 [0,2,0,0,0,0|0,1,1]=4 5807 B13R1.3088 COc1ccc(cc1Cl)C(N)=NO Amb18317152 [0,2,0,0,0,0|1,0,1]=4 5808 B13R1.3088 COc1ccc(cc1Cl)C(N)CF Amb24580433 [0,2,0,0,0,0|1,0,1]=4 5809 B13R1.3088 COc1ccc(cc1Cl)C(N)CN Amb25133202 [0,2,0,0,0,0|1,0,1]=4 5810 B13R1.3088 COc1ccc(cc1Cl)C(O)CO Amb18566625 [0,2,0,0,0,0|0,0,2]=4 5811 B13R1.3088 COc1ccc(cc1Cl)[C@@H](N)CN Amb25155506 [0,2,0,0,0,0|1,0,1]=4 5812 B13R1.3088 COc1ccc(cc1Cl)[C@H](N)CF Amb24742372 [0,2,0,0,0,0|1,0,1]=4 5813 B13R1.3088 COc1ccc(cc1Cl)\C(\Cl)=N\O Amb24520860 [0,2,0,0,0,0|1,0,1]=4 5814 B13R1.3088 COc1ccc(cc1Cl)\C(\N)=N\N Amb24361159 [0,2,0,0,0,0|2,0,0]=4 5815 B13R1.3088 COc1ccc(cc1F)C(=N)OC Amb25187884 [0,2,0,0,0,0|1,0,0]=3 5816 B13R1.3088 COc1ccc(cc1F)C(=O)C=C Amb18065900 [0,2,0,0,0,0|0,0,1]=3 5817 B13R1.3088 COc1ccc(cc1F)C(=O)C=O Amb18128965 [0,2,0,0,0,0|0,0,1]=3 5818 B13R1.3088 COc1ccc(cc1F)C(=O)CF Amb24084126 [0,2,0,0,0,0|0,0,0]=2 5819 B13R1.3088 COc1ccc(cc1F)C(=O)NO Amb19075167 [0,2,0,0,0,0|1,0,0]=3 5820 B13R1.3088 COc1ccc(cc1F)C(F)CN Amb24668594 [0,2,0,0,0,0|1,0,1]=4 5821 B13R1.3088 COc1ccc(cc1F)C(N)=NN Amb19045163 [0,2,0,0,0,0|2,0,0]=4 5822 B13R1.3088 COc1ccc(cc1F)C(N)CF Amb25192289 [0,2,0,0,0,0|1,0,1]=4 5823 B13R1.3088 COc1ccc(cc1F)C(O)CO Amb18066173 [0,2,0,0,0,0|0,0,2]=4 5824 B13R1.3088 COc1ccc(cc1F)[C@@H](C)NO Amb24630420 [0,2,0,0,0,0|0,0,2]=4 5825 B13R1.3088 COc1ccc(cc1F)[C@@H](N)CO Amb24493912 [0,2,0,0,0,0|1,0,1]=4 5826 B13R1.3088 COc1ccc(cc1F)[C@@H](O)CN Amb24668366 [0,2,0,0,0,0|0,0,2]=4 5827 B13R1.3088 COc1ccc(cc1F)[C@H](C)NO Amb24471432 [0,2,0,0,0,0|0,0,2]=4 5828 B13R1.3088 COc1ccc(cc1F)[C@H](N)CO Amb25817482 [0,2,0,0,0,0|1,0,1]=4 5829 B13R1.3088 COc1ccc(cc1F)[C@H](O)CN Amb25719703 [0,2,0,0,0,0|0,0,2]=4 5830 B13R1.3088 COc1ccc(cc1I)C(=O)NO Amb25741028 [0,2,0,0,0,0|1,0,0]=3 5831 B13R1.3088 COc1ccc(cc1I)[C@@H](N)CO Amb25738545 [0,2,0,0,0,0|1,0,1]=4 5832 B13R1.3088 COc1ccc(cc1I)[C@H](N)CN Amb25096301 [0,2,0,0,0,0|1,0,1]=4 5833 B13R1.3088 COc1ccc(cc1N)C(=O)CCl Amb25362176 [0,2,0,0,0,0|0,0,0]=2 5834 B13R1.3088 COc1ccc(cc1N)C(=O)NN Amb25189932 [0,2,0,0,0,0|1,0,0]=3 5835 B13R1.3088 COc1ccc(cc1N)[C@@H](N)CN Amb24601351 [0,2,0,0,0,0|1,0,1]=4 5836 B13R1.3088 COc1ccc(cc1N)[C@@H](N)CO Amb25724362 [0,2,0,0,0,0|1,0,1]=4 5837 B13R1.3088 COc1ccc(cc1O)C(=N)OC Amb18796406 [0,2,0,0,0,0|1,0,0]=3 5838 B13R1.3088 COc1ccc(cc1O)C(=O)C#N Amb24534518 [0,2,0,0,0,0|0,0,1]=3 5839 B13R1.3088 COc1ccc(cc1O)C(=O)CBr Amb18135452 [0,2,0,0,0,0|0,0,0]=2 5840 B13R1.3088 COc1ccc(cc1O)C(=O)CF Amb24084127 [0,2,0,0,0,0|0,0,0]=2 5841 B13R1.3088 COc1ccc(cc1O)C(C)C#N Amb24584093 [0,2,0,0,0,0|1,0,1]=4 5842 B13R1.3088 COc1ccc(cc1O)C(C)NN Amb25160553 [0,2,0,0,0,0|1,0,1]=4 5843 B13R1.3088 COc1ccc(cc1O)C(C)NO Amb25677449 [0,2,0,0,0,0|0,0,2]=4 5844 B13R1.3088 COc1ccc(cc1O)C(F)CN Amb24511527 [0,2,0,0,0,0|1,0,1]=4 5845 B13R1.3088 COc1ccc(cc1O)C(N)CN Amb24679638 [0,2,0,0,0,0|1,0,1]=4 5846 B13R1.3088 COc1ccc(cc1O)C(N)CO Amb18971966 [0,2,0,0,0,0|1,0,1]=4 5847 B13R1.3088 COc1ccc(cc1O)C(O)CC Amb25717747 [0,2,0,0,0,0|0,0,2]=4 5848 B13R1.3088 COc1ccc(cc1O)N(C)N=O Amb25263114 [0,2,0,0,0,0|1,0,0]=3 5849 B13R1.3088 COc1ccc(cc1O)[C@@H](N)CF Amb25324760 [0,2,0,0,0,0|1,0,1]=4 5850 B13R1.3088 COc1ccc(cc1O)[C@H](C)NO Amb25125342 [0,2,0,0,0,0|0,0,2]=4 5851 B13R1.3088 COc1ccc(cc1O)[C@H](N)CN Amb24384397 [0,2,0,0,0,0|1,0,1]=4 5852 B13R1.3088 COc1ccc(cc1O)[C@H](N)CO Amb24617464 [0,2,0,0,0,0|1,0,1]=4 5853 B13R1.3088 COc1ccc(cc1S)C(=O)OC Amb25153670 [0,2,0,0,0,0|0,0,0]=2 5854 B13R1.3088 CSc1ccc(cc1F)C(=O)CN Amb25352129 [0,2,0,0,0,0|0,1,0]=3 5855 B13R1.3088 CSc1ccc(cc1O)C(=O)CCl Amb24104221 [0,2,0,0,0,0|0,1,0]=3 5856 B13R1.3088 C\C(=N/N)\c1ccc(OC)c(Br)c1 Amb24530132 [0,2,0,0,0,0|1,0,0]=3 5857 B13R1.3088 C\C(=N/N)\c1ccc(OC)c(F)c1 Amb25796161 [0,2,0,0,0,0|1,0,0]=3 5858 B13R1.3088 C\C(=N/N)\c1ccc(SC)c(F)c1 Amb24619463 [0,2,0,0,0,0|1,1,0]=4 5859 B13R1.3088 C\C(=N/O)\c1cc(O)c(cc1)OC Amb24417241 [0,2,0,0,0,0|0,0,1]=3 5860 B13R1.3088 C\C(=N/O)\c1ccc(OC)c(Br)c1 Amb25105614 [0,2,0,0,0,0|0,0,1]=3 5861 B13R1.3088 Cc1[n]c(ccc1CC)C(=O)OC Amb22750342 [0,2,0,0,0,0|2,0,0]=4 5862 B13R1.3088 Cc1cc(c[n]c1NC)C(=O)CC Amb23578567 [0,2,0,0,0,0|2,0,0]=4 5863 B13R1.3088 Cc1cc(c[n]c1NC)C(=O)OC Amb23578557 [0,2,0,0,0,0|2,0,0]=4 5864 B13R1.3088 Cc1cc(c[n]c1OC)C(=O)CC Amb23578499 [0,2,0,0,0,0|1,0,0]=3 5865 B13R1.3088 Cc1cc(c[n]c1OC)C(=O)NN Amb24455261 [0,2,0,0,0,0|2,0,0]=4 5866 B13R1.3088 Cc1cc(c[n]c1OC)C(=O)OC Amb22410826 [0,2,0,0,0,0|1,0,0]=3 5867 B13R1.3088 Cc1cc(c[n]c1SC)C(=O)CC Amb23578544 [0,2,0,0,0,0|1,1,0]=4 5868 B13R1.3088 Cc1cc(c[n]c1SC)C(=O)OC Amb23578539 [0,2,0,0,0,0|1,1,0]=4 5869 B13R1.3088 Cc1cc(ccc1C#N)C(=O)CBr Amb24413895 [0,2,0,0,0,0|2,0,0]=4 5870 B13R1.3088 Cc1cc(ccc1C#N)C(=O)OC Amb19958558 [0,2,0,0,0,0|2,0,0]=4 5871 B13R1.3088 Cc1cc(ccc1CC)C(=O)CBr Amb25059706 [0,2,0,0,0,0|1,0,0]=3 5872 B13R1.3088 Cc1cc(ccc1CC)C(=O)OC Amb25775280 [0,2,0,0,0,0|1,0,0]=3 5873 B13R1.3088 Cc1cc(ccc1CCl)C(=O)CC Amb24754522 [0,2,0,0,0,0|2,0,0]=4 5874 B13R1.3088 Cc1cc(ccc1CN)C(=O)OC Amb24594992 [0,2,0,0,0,0|2,0,0]=4 5875 B13R1.3088 Cc1cc(ccc1CO)C(=O)OC Amb25034237 [0,2,0,0,0,0|2,0,0]=4 5876 B13R1.3088 Cc1cc(ccc1NC)C(=O)NC Amb18288709 [0,2,0,0,0,0|1,0,0]=3 5877 B13R1.3088 Cc1cc(ccc1NC)C(=O)OC Amb19002840 [0,2,0,0,0,0|1,0,0]=3 5878 B13R1.3088 Cc1cc(ccc1NN)C(=O)NC Amb25315024 [0,2,0,0,0,0|2,0,0]=4 5879 B13R1.3088 Cc1cc(ccc1NN)C(=O)OC Amb25324645 [0,2,0,0,0,0|2,0,0]=4 5880 B13R1.3088 Cc1cc(ccc1OC)C(=N)NC Amb25315721 [0,2,0,0,0,0|1,0,0]=3 5881 B13R1.3088 Cc1cc(ccc1OC)C(=N)OC Amb18796126 [0,2,0,0,0,0|1,0,0]=3 5882 B13R1.3088 Cc1cc(ccc1OC)C(=O)C=C Amb18065613 [0,2,0,0,0,0|0,0,1]=3 5883 B13R1.3088 Cc1cc(ccc1OC)C(=O)C=O Amb24733874 [0,2,0,0,0,0|0,0,1]=3 5884 B13R1.3088 Cc1cc(ccc1OC)C(=O)CO Amb18065907 [0,2,0,0,0,0|0,0,0]=2 5885 B13R1.3088 Cc1cc(ccc1OC)C(=O)NC Amb19558497 [0,2,0,0,0,0|0,0,0]=2 5886 B13R1.3088 Cc1cc(ccc1OC)C(=O)OC Amb22263054 [0,2,0,0,0,0|0,0,0]=2 5887 B13R1.3088 Cc1cc(ccc1OC)C(Br)CC Amb25316443 [0,2,0,0,0,0|1,0,1]=4 5888 B13R1.3088 Cc1cc(ccc1OC)C(C)NN Amb18224689 [0,2,0,0,0,0|1,0,1]=4 5889 B13R1.3088 Cc1cc(ccc1OC)C(N)=NN Amb18796135 [0,2,0,0,0,0|2,0,0]=4 5890 B13R1.3088 Cc1cc(ccc1OC)C(N)CF Amb25705080 [0,2,0,0,0,0|1,0,1]=4 5891 B13R1.3088 Cc1cc(ccc1OC)C(N)CN Amb18986638 [0,2,0,0,0,0|1,0,1]=4 5892 B13R1.3088 Cc1cc(ccc1OC)C(O)CO Amb18066066 [0,2,0,0,0,0|0,0,2]=4 5893 B13R1.3088 Cc1cc(ccc1OC)[C@@H](N)CO Amb25339995 [0,2,0,0,0,0|1,0,1]=4 5894 B13R1.3088 Cc1cc(ccc1OC)[C@@H](O)CC Amb25376840 [0,2,0,0,0,0|0,0,2]=4 5895 B13R1.3088 Cc1cc(ccc1OC)[C@H](C)NC Amb25059895 [0,2,0,0,0,0|1,0,1]=4 5896 B13R1.3088 Cc1cc(ccc1OC)[C@H](N)CC Amb25138867 [0,2,0,0,0,0|1,0,1]=4 5897 B13R1.3088 Cc1cc(ccc1OC)[C@H](N)CN Amb24591291 [0,2,0,0,0,0|1,0,1]=4 5898 B13R1.3088 Cc1cc(ccc1OC)\C(\N)=N\O Amb18181062 [0,2,0,0,0,0|1,0,1]=4 5899 B13R1.3088 ClCC(=O)c1ccc(c(c1)Br)CC Amb17358596 [0,2,0,0,0,0|1,0,0]=3 5900 B13R1.3088 ClCC(=O)c1ccc(c(c1)F)OC Amb1106053 [0,2,0,0,0,0|0,0,0]=2 5901 B13R1.3088 ClCC(c1ccc(c(c1)Br)OC)C Amb17270674 [0,2,0,0,0,0|1,0,1]=4 5902 B13R1.3088 ClCC(c1ccc(c(c1)Br)OC)O Amb17197294 [0,2,0,0,0,0|0,0,2]=4 5903 B13R1.3088 ClCC(c1ccc(c(c1)C)OC)C Amb17236868 [0,2,0,0,0,0|1,0,1]=4 5904 B13R1.3088 ClCC(c1ccc(c(c1)C)OC)O Amb17194816 [0,2,0,0,0,0|0,0,2]=4 5905 B13R1.3088 ClCC(c1ccc(c(c1)Cl)OC)C Amb17243533 [0,2,0,0,0,0|1,0,1]=4 5906 B13R1.3088 ClCC(c1ccc(c(c1)Cl)OC)O Amb17195416 [0,2,0,0,0,0|0,0,2]=4 5907 B13R1.3088 ClCC(c1ccc(c(c1)F)OC)C Amb17237579 [0,2,0,0,0,0|1,0,1]=4 5908 B13R1.3088 ClCC(c1ccc(c(c1)F)OC)O Amb17194892 [0,2,0,0,0,0|0,0,2]=4 5909 B13R1.3088 N#CC(=C)c1ccc(c(c1)Br)OC Amb17254037 [0,2,0,0,0,0|1,0,1]=4 5910 B13R1.3088 N#CC(=C)c1ccc(c(c1)C)OC Amb17232946 [0,2,0,0,0,0|1,0,1]=4 5911 B13R1.3088 N#CC(=C)c1ccc(c(c1)Cl)OC Amb17235852 [0,2,0,0,0,0|1,0,1]=4 5912 B13R1.3088 N#CC(=C)c1ccc(c(c1)F)OC Amb17233248 [0,2,0,0,0,0|1,0,1]=4 5913 B13R1.3088 N#CC(c1ccc(c(c1)Br)OC)C Amb17255068 [0,2,0,0,0,0|1,0,1]=4 5914 B13R1.3088 N#CC(c1ccc(c(c1)C)OC)C Amb17089242 [0,2,0,0,0,0|1,0,1]=4 5915 B13R1.3088 N#CC(c1ccc(c(c1)Cl)OC)C Amb17236319 [0,2,0,0,0,0|1,0,1]=4 5916 B13R1.3088 N#Cc1ccc(cc1Cl)C(=O)CBr Amb25783081 [0,2,0,0,0,0|2,0,0]=4 5917 B13R1.3088 N#Cc1ccc(cc1F)C(=O)CBr Amb22011723 [0,2,0,0,0,0|2,0,0]=4 5918 B13R1.3088 N#Cc1ccc(cc1F)C(=O)CCl Amb24414997 [0,2,0,0,0,0|2,0,0]=4 5919 B13R1.3088 NCC(=O)c1ccc(c(c1)Br)OC Amb17196250 [0,2,0,0,0,0|0,0,0]=2 5920 B13R1.3088 NCC(=O)c1ccc(c(c1)Cl)OC Amb17194801 [0,2,0,0,0,0|0,0,0]=2 5921 B13R1.3088 NCC(=O)c1ccc(c(c1)F)OC Amb17194554 [0,2,0,0,0,0|0,0,0]=2 5922 B13R1.3088 NCC(c1ccc(c(c1)Br)OC)C Amb17256971 [0,2,0,0,0,0|1,0,1]=4 5923 B13R1.3088 NCC(c1ccc(c(c1)Br)OC)O Amb17350445 [0,2,0,0,0,0|0,0,2]=4 5924 B13R1.3088 NCC(c1ccc(c(c1)C)OC)C Amb17087286 [0,2,0,0,0,0|1,0,1]=4 5925 B13R1.3088 NCC(c1ccc(c(c1)C)OC)O Amb17335494 [0,2,0,0,0,0|0,0,2]=4 5926 B13R1.3088 NCC(c1ccc(c(c1)Cl)OC)C Amb17237049 [0,2,0,0,0,0|1,0,1]=4 5927 B13R1.3088 NCC(c1ccc(c(c1)Cl)OC)O Amb17337708 [0,2,0,0,0,0|0,0,2]=4 5928 B13R1.3088 NCC(c1ccc(c(c1)F)OC)O Amb17335738 [0,2,0,0,0,0|0,0,2]=4 5929 B13R1.3088 NCC(c1ccc(c(c1)O)OC)O Amb1107917 [0,2,0,0,0,0|0,0,2]=4 5930 B13R1.3088 NOC(c1ccc(c(c1)C)OC)C Amb17089198 [0,2,0,0,0,0|0,0,2]=4 5931 B13R1.3088 O=CC(c1ccc(c(c1)Br)OC)C Amb17196240 [0,2,0,0,0,0|0,0,1]=3 5932 B13R1.3088 O=CC(c1ccc(c(c1)C)OC)C Amb17138857 [0,2,0,0,0,0|0,0,1]=3 5933 B13R1.3088 O=CC(c1ccc(c(c1)Cl)OC)C Amb17194778 [0,2,0,0,0,0|0,0,1]=3 5934 B13R1.3088 O=CC(c1ccc(c(c1)F)OC)C Amb17194549 [0,2,0,0,0,0|0,0,1]=3 5935 B13R1.3088 OCC(=O)c1ccc(c(c1)Cl)OC Amb232172 [0,2,0,0,0,0|0,0,0]=2 5936 B13R1.3088 OCC(c1ccc(c(c1)Br)OC)C Amb17257487 [0,2,0,0,0,0|0,0,2]=4 5937 B13R1.3088 OCC(c1ccc(c(c1)Br)OC)N Amb17258153 [0,2,0,0,0,0|1,0,1]=4 5938 B13R1.3088 OCC(c1ccc(c(c1)C)OC)C Amb17233697 [0,2,0,0,0,0|0,0,2]=4 5939 B13R1.3088 OCC(c1ccc(c(c1)C)OC)N Amb17233811 [0,2,0,0,0,0|1,0,1]=4 5940 B13R1.3088 OCC(c1ccc(c(c1)Cl)OC)C Amb17237184 [0,2,0,0,0,0|0,0,2]=4 5941 B13R1.3088 OCC(c1ccc(c(c1)Cl)OC)N Amb2236317 [0,2,0,0,0,0|1,0,1]=4 5942 B13R1.3088 OCC(c1ccc(c(c1)F)OC)C Amb17234065 [0,2,0,0,0,0|0,0,2]=4 5943 B13R1.3088 ONC(c1ccc(c(c1)C)OC)C Amb17089215 [0,2,0,0,0,0|0,0,2]=4 5944 B13R1.3088 O\N=C(\c1ccc(c(c1)Cl)OC)/C Amb17237027 [0,2,0,0,0,0|0,0,1]=3 5945 B13R1.3088 O\N=C(\c1ccc(c(c1)O)OC)/N Amb1044659 [0,2,0,0,0,0|1,0,1]=4 5946 B13R1.3088 SCC(=O)c1ccc(c(c1)Br)OC Amb17416168 [0,2,0,0,0,0|0,0,0]=2 5947 B13R1.3088 SCC(=O)c1ccc(c(c1)C)OC Amb17402128 [0,2,0,0,0,0|0,0,0]=2 5948 B13R1.3088 SCC(=O)c1ccc(c(c1)Cl)OC Amb17404668 [0,2,0,0,0,0|0,0,0]=2 5949 B13R1.3088 SCC(=O)c1ccc(c(c1)F)OC Amb17402339 [0,2,0,0,0,0|0,0,0]=2 5950 B13R1.3088 [C-]#[N+]c1ccc(cc1Br)C(=O)OC Amb25217320 [0,2,0,0,0,0|1,0,1]=4 5951 B13R1.38 CCc1ccc(cc1N)S(=O)(=O)C Amb17106406 [0,2,0,0,0,0|2,0,0]=4 5952 B13R1.38 CNc1ccc(cc1Cl)S(C)(=O)=O Amb24490314 [0,2,0,0,0,0|2,0,0]=4 5953 B13R1.38 COc1ccc(cc1Br)C(C)(C)C Amb18246781 [0,2,0,0,0,0|1,0,1]=4 5954 B13R1.38 COc1ccc(cc1Br)C(N)(C)C Amb17196253 [0,2,0,0,0,0|1,0,1]=4 5955 B13R1.38 COc1ccc(cc1Br)C(O)(C)C Amb17411222 [0,2,0,0,0,0|0,0,2]=4 5956 B13R1.38 COc1ccc(cc1Br)S(=O)(=O)Cl Amb1104925 [0,2,0,0,0,0|2,0,0]=4 5957 B13R1.38 COc1ccc(cc1Br)S(=O)(=O)F Amb18593422 [0,2,0,0,0,0|2,0,0]=4 5958 B13R1.38 COc1ccc(cc1Br)S(O)(=O)=O Amb18884733 [0,2,0,0,0,0|2,0,0]=4 5959 B13R1.38 COc1ccc(cc1Br)S([O-])(=O)=O Amb25185892 [0,2,0,0,0,0|2,0,0]=4 5960 B13R1.38 COc1ccc(cc1C)C(N)(C)C Amb17078784 [0,2,0,0,0,0|1,0,1]=4 5961 B13R1.38 COc1ccc(cc1C)C(O)(C)C Amb17400793 [0,2,0,0,0,0|0,0,2]=4 5962 B13R1.38 COc1ccc(cc1Cl)C(N)(C)C Amb17194805 [0,2,0,0,0,0|1,0,1]=4 5963 B13R1.38 COc1ccc(cc1Cl)C(O)(C)C Amb17402381 [0,2,0,0,0,0|0,0,2]=4 5964 B13R1.38 COc1ccc(cc1Cl)S(=O)(=O)Br Amb24677134 [0,2,0,0,0,0|2,0,0]=4 5965 B13R1.38 COc1ccc(cc1Cl)S(=O)(=O)Cl Amb1102507 [0,2,0,0,0,0|2,0,0]=4 5966 B13R1.38 COc1ccc(cc1Cl)S(=O)(=O)F Amb18069712 [0,2,0,0,0,0|2,0,0]=4 5967 B13R1.38 COc1ccc(cc1Cl)[Si](C)(C)C Amb24439165 [0,2,0,0,0,0|1,1,0]=4 5968 B13R1.38 COc1ccc(cc1F)C(C)(C)C Amb25208188 [0,2,0,0,0,0|1,0,1]=4 5969 B13R1.38 COc1ccc(cc1F)C(N)(C)C Amb17194556 [0,2,0,0,0,0|1,0,1]=4 5970 B13R1.38 COc1ccc(cc1F)C(O)(C)C Amb17401013 [0,2,0,0,0,0|0,0,2]=4 5971 B13R1.38 COc1ccc(cc1F)S(=O)(=O)Br Amb24614002 [0,2,0,0,0,0|2,0,0]=4 5972 B13R1.38 COc1ccc(cc1F)S(=O)(=O)Cl Amb2236312 [0,2,0,0,0,0|2,0,0]=4 5973 B13R1.38 COc1ccc(cc1F)S(=O)(=O)F Amb18568299 [0,2,0,0,0,0|2,0,0]=4 5974 B13R1.38 COc1ccc(cc1F)S(C)(=O)=O Amb22497185 [0,2,0,0,0,0|1,0,0]=3 5975 B13R1.38 COc1ccc(cc1F)S(O)(=O)=O Amb18225094 [0,2,0,0,0,0|2,0,0]=4 5976 B13R1.38 COc1ccc(cc1F)[Si](C)(C)C Amb19886425 [0,2,0,0,0,0|1,1,0]=4 5977 B13R1.38 COc1ccc(cc1I)C(C)(C)C Amb25237298 [0,2,0,0,0,0|1,0,1]=4 5978 B13R1.38 COc1ccc(cc1I)C(C)(C)O Amb24603429 [0,2,0,0,0,0|0,0,2]=4 5979 B13R1.38 COc1ccc(cc1N)C(C)(C)N Amb24467185 [0,2,0,0,0,0|1,0,1]=4 5980 B13R1.38 COc1ccc(cc1N)S(=O)(=O)N Amb1157138 [0,2,0,0,0,0|2,0,0]=4 5981 B13R1.38 COc1ccc(cc1N)S(=O)(=O)O Amb1397671 [0,2,0,0,0,0|2,0,0]=4 5982 B13R1.38 COc1ccc(cc1O)C(C)(C)C Amb17203167 [0,2,0,0,0,0|1,0,1]=4 5983 B13R1.38 COc1ccc(cc1O)C(C)(C)F Amb25300707 [0,2,0,0,0,0|1,0,1]=4 5984 B13R1.38 COc1ccc(cc1O)S(=O)(=O)Cl Amb24453208 [0,2,0,0,0,0|2,0,0]=4 5985 B13R1.38 COc1ccc(cc1O)S(=O)(=O)F Amb25768453 [0,2,0,0,0,0|2,0,0]=4 5986 B13R1.38 COc1ccc(cc1O)S(O)(=O)=O Amb24736377 [0,2,0,0,0,0|2,0,0]=4 5987 B13R1.38 COc1ccc(cc1O)S([O-])(=O)=O Amb24309065 [0,2,0,0,0,0|2,0,0]=4 5988 B13R1.38 COc1ccc(cc1O)[N+](C)(C)C Amb24342742 [0,2,0,0,0,0|2,0,0]=4 5989 B13R1.38 CSc1ccc(cc1N)S(C)(=O)=O Amb18951024 [0,2,0,0,0,0|1,1,0]=4 5990 B13R1.38 Cc1cc(ccc1OC)S(=O)(=O)F Amb18566884 [0,2,0,0,0,0|2,0,0]=4 5991 B13R1.38 Cc1cc(ccc1OC)S(C)(=O)=O Amb22736350 [0,2,0,0,0,0|1,0,0]=3 5992 B13R1.38 Cc1cc(ccc1OC)S(O)(=O)=O Amb18864527 [0,2,0,0,0,0|2,0,0]=4 5993 B13R1.96 COc1cc(Br)c(cc1)S(N)(=O)=O Amb19888075 [0,2,0,0,0,0|2,0,0]=4 5994 B13R1.96 COc1cc(Cl)c(cc1)C(C)(C)N Amb18066526 [0,2,0,0,0,0|1,0,1]=4 5995 B13R1.96 COc1cc(Cl)c(cc1)S(=O)(=O)F Amb18571084 [0,2,0,0,0,0|2,0,0]=4 5996 B13R1.96 COc1cc(Cl)c(cc1)S(C)(=O)=O Amb25686769 [0,2,0,0,0,0|1,0,0]=3 5997 B13R1.96 COc1cc(Cl)c(cc1)S(N)(=O)=O Amb18067882 [0,2,0,0,0,0|2,0,0]=4 5998 B13R1.96 COc1cc(Cl)c(cc1)S(O)(=O)=O Amb18226994 [0,2,0,0,0,0|2,0,0]=4 5999 B13R1.96 COc1cc(F)c(cc1)C(C)(C)N Amb18823324 [0,2,0,0,0,0|1,0,1]=4 6000 B13R1.96 COc1cc(F)c(cc1)S([O-])(=O)=O Amb22552394 [0,2,0,0,0,0|2,0,0]=4 6001 B13R1.96 COc1cc(F)c(cc1)[Si](C)(C)C Amb25360539 [0,2,0,0,0,0|1,1,0]=4 6002 B13R1.96 COc1cc(I)c(cc1)S(=O)(=O)Cl Amb25280627 [0,2,0,0,0,0|2,0,0]=4 6003 B13R1.96 COc1cc(N)c(cc1)C(C)(C)C Amb25101606 [0,2,0,0,0,0|1,0,1]=4 6004 B13R1.96 COc1cc(N)c(cc1)S(C)(=O)=O Amb24556181 [0,2,0,0,0,0|1,0,0]=3 6005 B13R1.96 COc1cc(N)c(cc1)S(O)(=O)=O Amb25076208 [0,2,0,0,0,0|2,0,0]=4 6006 B13R1.96 COc1cc(O)c(cc1)P(O)(O)=O Amb25192101 [0,2,0,0,0,0|2,0,0]=4 6007 B13R1.96 COc1cc(O)c(cc1)S(=O)(=O)Cl Amb25757392 [0,2,0,0,0,0|2,0,0]=4 6008 B13R1.96 COc1cc(O)c(cc1)S(N)(=O)=O Amb25208391 [0,2,0,0,0,0|2,0,0]=4 6009 B13R1.96 COc1ccc(c(c1)Br)S(=O)(=O)Cl Amb2236313 [0,2,0,0,0,0|2,0,0]=4 6010 B13R1.96 COc1ccc(c(c1)C)S(=O)(=O)N Amb11458218 [0,2,0,0,0,0|2,0,0]=4 6011 B13R1.96 Cc1cc(ccc1C(C)(C)N)OC Amb25667760 [0,2,0,0,0,0|1,0,1]=4 6012 B13R1.96 Cc1cc(ccc1[Si](C)(C)C)OC Amb25757470 [0,2,0,0,0,0|1,1,0]=4 6013 B13R1.140 CCOc1c[n]c(cc1)S(C)(=O)=O Amb20242817 [0,2,0,0,0,0|2,0,0]=4 6014 B13R1.140 CCOc1ccc(c[n]1)S(C)(=O)=O Amb22277009 [0,2,0,0,0,0|2,0,0]=4 6015 B13R1.140 CCOc1ccc(cc1)C(O)(C)C Amb17400797 [0,2,0,0,0,0|0,0,2]=4 6016 B13R1.140 CCOc1ccc(cc1)S(=O)(=O)Br Amb25778528 [0,2,0,0,0,0|2,0,0]=4 6017 B13R1.140 CCOc1ccc(cc1)S(=O)(=O)Cl Amb1103578 [0,2,0,0,0,0|2,0,0]=4 6018 B13R1.140 CCOc1ccc(cc1)S(=O)(=O)F Amb18566886 [0,2,0,0,0,0|2,0,0]=4 6019 B13R1.140 CCOc1ccc(cc1)S(=O)(=O)N Amb1106702 [0,2,0,0,0,0|2,0,0]=4 6020 B13R1.140 CCOc1ccc(cc1)S(=O)(=O)[O-] Amb1900131 [0,2,0,0,0,0|2,0,0]=4 6021 B13R1.140 CCOc1ccc(cc1)S(C)(=O)=O Amb24447972 [0,2,0,0,0,0|1,0,0]=3 6022 B13R1.140 CCOc1ccc(cc1)S(O)(=O)=O Amb18864529 [0,2,0,0,0,0|2,0,0]=4 6023 B13R1.140 CCOc1ccc(cc1)[N+](C)(C)C Amb10553401 [0,2,0,0,0,0|2,0,0]=4 6024 B13R1.140 CCOc1ccc(cc1)[Te](C)(Br)Br Amb22359505 [0,2,0,0,0,0|2,0,0]=4 6025 B13R1.140 CCOc1ccc(cc1)[Te](C)(C)I Amb22359499 [0,2,0,0,0,0|2,0,0]=4 6026 B13R1.140 CCOc1ccc(cc1)[Te](C)(Cl)Cl Amb22359503 [0,2,0,0,0,0|2,0,0]=4 6027 B13R1.140 CCOc1ccc(cc1)[Te](C)(I)I Amb22359506 [0,2,0,0,0,0|2,0,0]=4 6028 B13R1.140 CCSc1ccc(cc1)S(C)(=O)=O Amb24718240 [0,2,0,0,0,0|1,1,0]=4 6029 B13R1.140 COCc1ccc(cc1)S(=O)(=O)Cl Amb25160736 [0,2,0,0,0,0|2,0,0]=4 6030 B13R1.140 CS(=O)(=O)c1ccc(CCBr)cc1 Amb18229755 [0,2,0,0,0,0|2,0,0]=4 6031 B13R1.140 CS(=O)(=O)c1ccc(CCCl)cc1 Amb18226309 [0,2,0,0,0,0|2,0,0]=4 6032 B13R1.140 CS(=O)(=O)c1ccc(CCO)cc1 Amb18225038 [0,2,0,0,0,0|2,0,0]=4 6033 B13R1.140 CS(=O)(=O)c1ccc(CNC)cc1 Amb19000541 [0,2,0,0,0,0|2,0,0]=4 6034 B13R1.140 CS(=O)(=O)c1ccc(cc1)OC=C Amb25119064 [0,2,0,0,0,0|1,0,1]=4 6035 B13R1.140 CS(=O)(=O)c1ccc(cc1)SCCl Amb24599938 [0,2,0,0,0,0|1,1,0]=4 6036 B13R1.140 C[Si](C)(C)c1ccc(COC)cc1 Amb25049019 [0,2,0,0,0,0|1,1,0]=4 6037 B13R1.140 O=S(=O)(Cl)c1ccc(cc1)OCF Amb25268644 [0,2,0,0,0,0|2,0,0]=4 6038 B13R1.338 CC(=C)c1ccc(cc1)C(C)(C)C Amb25296796 [0,2,0,0,0,0|2,0,0]=4 6039 B13R1.338 CC(=C)c1ccc(cc1)S(C)(=O)=O Amb24369719 [0,2,0,0,0,0|1,1,0]=4 6040 B13R1.338 CC(=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)C(F)(F)F Amb17620962 [0,2,0,0,0,0|2,0,0]=4 6041 B13R1.338 CC(=O)c1ccc([n]c1)C(C)(C)C Amb25785755 [0,2,0,0,0,0|2,0,0]=4 6042 B13R1.338 CC(=O)c1ccc([n]c1)S(C)(=O)=O Amb24511737 [0,2,0,0,0,0|1,1,0]=4 6043 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)C Amb1214645 [0,2,0,0,0,0|1,0,0]=3 6044 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)F Amb24685230 [0,2,0,0,0,0|1,0,0]=3 6045 B13R1.338 CC(=O)c1ccc(cc1)C(C)(C)O Amb24080543 [0,2,0,0,0,0|1,0,0]=3 6046 B13R1.338 CC(=O)c1ccc(cc1)C(Cl)(Cl)Cl Amb18105998 [0,2,0,0,0,0|2,0,0]=4 6047 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)C Amb1651659 [0,2,0,0,0,0|0,1,0]=3 6048 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)Cl Amb1649005 [0,2,0,0,0,0|1,1,0]=4 6049 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)F Amb22046806 [0,2,0,0,0,0|1,1,0]=4 6050 B13R1.338 CC(=O)c1ccc(cc1)S(=O)(=O)[O-] Amb10552952 [0,2,0,0,0,0|1,1,0]=4 6051 B13R1.338 CC(=O)c1ccc(cc1)S(C)(=C)=C Amb24572893 [0,2,0,0,0,0|0,1,0]=3 6052 B13R1.338 CC(=O)c1ccc(cc1)[B-](F)(F)F Amb20242670 [0,2,0,0,0,0|2,0,0]=4 6053 B13R1.338 CC(=O)c1ccc(cc1)[Si](C)(C)C Amb25036074 [0,2,0,0,0,0|1,0,0]=3 6054 B13R1.338 CC(C)(C)c1ccc(cc1)C(=O)F Amb24496603 [0,2,0,0,0,0|2,0,0]=4 6055 B13R1.338 CC(C)(C)c1ccc(cc1)C(O)=O Amb22474526 [0,2,0,0,0,0|2,0,0]=4 6056 B13R1.338 CC(C)(C)c1ccc(cc1)C([O-])=O Amb22469231 [0,2,0,0,0,0|2,0,0]=4 6057 B13R1.338 CC(C)(C)c1ccc(cc1)C([O-])=O Amb22474541 [0,2,0,0,0,0|2,0,0]=4 6058 B13R1.338 CC(C)(C)c1ccc(cc1)C([O-])=O Amb22474542 [0,2,0,0,0,0|2,0,0]=4 6059 B13R1.338 CC(C)(C)c1ccc(cc1)C([O-])=O Amb22730285 [0,2,0,0,0,0|2,0,0]=4 6060 B13R1.338 CC(C)(Cl)c1ccc(cc1)C(O)=O Amb24732566 [0,2,0,0,0,0|2,0,0]=4 6061 B13R1.338 CC(C)(N)c1ccc(cc1)C(N)=O Amb24453941 [0,2,0,0,0,0|2,0,0]=4 6062 B13R1.338 CC(C)(S)c1ccc(cc1)C(O)=O Amb25797434 [0,2,0,0,0,0|2,0,0]=4 6063 B13R1.338 CC(F)(F)c1ccc(cc1)C(O)=O Amb22444731 [0,2,0,0,0,0|2,0,0]=4 6064 B13R1.338 CC(c1ccc(cc1)S(=O)(=O)C)N Amb1108107 [0,2,0,0,0,0|2,0,0]=4 6065 B13R1.338 CN(c1ccc(cc1)S(=O)(=O)C)C Amb1085933 [0,2,0,0,0,0|2,0,0]=4 6066 B13R1.338 CS(=N)(=O)c1ccc(cc1)C(O)=O Amb25226476 [0,2,0,0,0,0|1,1,0]=4 6067 B13R1.338 C[C@@H](N)c1ccc(cc1)S(C)(=O)=O Amb19514541 [0,2,0,0,0,0|2,0,0]=4 6068 B13R1.338 C[C@@H](c1ccc(cc1)S(=O)(=O)C)N Amb10609981 [0,2,0,0,0,0|2,0,0]=4 6069 B13R1.338 C[N+](C)(C)c1ccc(cc1)C(O)=O Amb24759091 [0,2,0,0,0,0|2,0,0]=4 6070 B13R1.338 C[Si](F)(F)c1ccc(cc1)C(O)=O Amb24375735 [0,2,0,0,0,0|2,0,0]=4 6071 B13R1.120 CC(=C)c1cc(O)c(cc1)C(O)=O Amb24488839 [0,2,0,0,0,0|2,0,0]=4 6072 B13R1.120 CC(=O)C1=CC=C(NC1=O)C(C)C Amb18262394 [0,2,0,0,0,0|2,0,0]=4 6073 B13R1.120 CC(=O)c1[n]cc(cc1O)C(C)=O Amb24494548 [0,2,0,0,0,0|2,0,0]=4 6074 B13R1.120 CC(=O)c1c[n]c(C(C)C)c(Br)c1 Amb24054708 [0,2,0,0,0,0|2,0,0]=4 6075 B13R1.120 CC(=O)c1cc(Br)c(cc1)C(O)=O Amb18662750 [0,2,0,0,0,0|2,0,0]=4 6076 B13R1.120 CC(=O)c1cc(Br)c(cc1)[N+]([O-])=O Amb23401089 [0,2,0,0,0,0|2,0,0]=4 6077 B13R1.120 CC(=O)c1cc(C)c(c[n]1)C(C)=O Amb24538795 [0,2,0,0,0,0|2,0,0]=4 6078 B13R1.120 CC(=O)c1cc(C)c(cc1)C(=O)Cl Amb24683007 [0,2,0,0,0,0|2,0,0]=4 6079 B13R1.120 CC(=O)c1cc(Cl)c(c[n]1)C(C)=O Amb24600178 [0,2,0,0,0,0|2,0,0]=4 6080 B13R1.120 CC(=O)c1cc(Cl)c(cc1)C(O)=O Amb24055331 [0,2,0,0,0,0|2,0,0]=4 6081 B13R1.120 CC(=O)c1cc(Cl)c(cc1)[N+]([O-])=O Amb21964329 [0,2,0,0,0,0|2,0,0]=4 6082 B13R1.120 CC(=O)c1cc(F)c(cc1)C(O)=O Amb24366007 [0,2,0,0,0,0|2,0,0]=4 6083 B13R1.120 CC(=O)c1cc(F)c(cc1)[N+]([O-])=O Amb21964805 [0,2,0,0,0,0|2,0,0]=4 6084 B13R1.120 CC(=O)c1cc(O)c(c[n]1)C(C)=O Amb24492036 [0,2,0,0,0,0|2,0,0]=4 6085 B13R1.120 CC(=O)c1cc(O)c(cc1)C(N)=O Amb20246775 [0,2,0,0,0,0|2,0,0]=4 6086 B13R1.120 CC(=O)c1cc(O)c(cc1)N(=O)=O Amb20621422 [0,2,0,0,0,0|2,0,0]=4 6087 B13R1.120 CC(=O)c1ccc(C(C)C)c(O)c1 Amb24492690 [0,2,0,0,0,0|1,0,0]=3 6088 B13R1.120 CC(=O)c1ccc(c(Br)c1)N(C)C Amb22233648 [0,2,0,0,0,0|1,0,0]=3 6089 B13R1.120 CC(=O)c1ccc(c(Cl)c1)N(C)C Amb18318330 [0,2,0,0,0,0|1,0,0]=3 6090 B13R1.120 CC(=O)c1ccc(c(N)c1)N(C)C Amb18224611 [0,2,0,0,0,0|1,0,0]=3 6091 B13R1.120 CC(=O)c1ccc(c(O)[n]1)C(C)=O Amb25735853 [0,2,0,0,0,0|2,0,0]=4 6092 B13R1.120 CC(=O)c1ccc(c(c1)Br)C(C)C Amb17193979 [0,2,0,0,0,0|1,0,0]=3 6093 B13R1.120 CC(=O)c1ccc(c(c1)C)N(C)C Amb17204209 [0,2,0,0,0,0|1,0,0]=3 6094 B13R1.120 CC(=O)c1ccc(c(c1)C)[N+](=O)[O-] Amb10569589 [0,2,0,0,0,0|2,0,0]=4 6095 B13R1.120 CC(=O)c1ccc(cc1Br)[N+]([O-])=O Amb22490703 [0,2,0,0,0,0|2,0,0]=4 6096 B13R1.120 CC(=O)c1ccc(cc1C)C(=O)Cl Amb24091161 [0,2,0,0,0,0|2,0,0]=4 6097 B13R1.120 CC(=O)c1ccc(cc1C)C(O)=O Amb24570952 [0,2,0,0,0,0|2,0,0]=4 6098 B13R1.120 CC(=O)c1ccc(cc1C)N(=O)=O Amb20621644 [0,2,0,0,0,0|2,0,0]=4 6099 B13R1.120 CC(=O)c1ccc(cc1C)[N+]([O-])=O Amb22169858 [0,2,0,0,0,0|2,0,0]=4 6100 B13R1.120 CC(=O)c1ccc(cc1Cl)C(F)F Amb24511311 [0,2,0,0,0,0|2,0,0]=4 6101 B13R1.120 CC(=O)c1ccc(cc1Cl)C(O)=O Amb25109935 [0,2,0,0,0,0|2,0,0]=4 6102 B13R1.120 CC(=O)c1ccc(cc1Cl)N(C)C Amb25098709 [0,2,0,0,0,0|1,0,0]=3 6103 B13R1.120 CC(=O)c1ccc(cc1F)C(C)=O Amb24610717 [0,2,0,0,0,0|1,0,0]=3 6104 B13R1.120 CC(=O)c1ccc(cc1F)C(O)=O Amb25342268 [0,2,0,0,0,0|2,0,0]=4 6105 B13R1.120 CC(=O)c1ccc(cc1F)N(C)C Amb24405999 [0,2,0,0,0,0|1,0,0]=3 6106 B13R1.120 CC(=O)c1ccc(cc1F)[N+]([O-])=O Amb23401090 [0,2,0,0,0,0|2,0,0]=4 6107 B13R1.120 CC(=O)c1ccc(cc1N)N(C)C Amb18128238 [0,2,0,0,0,0|1,0,0]=3 6108 B13R1.120 CC(=O)c1ccc(cc1O)C(C)=O Amb25205860 [0,2,0,0,0,0|1,0,0]=3 6109 B13R1.120 CC(=O)c1ccc(cc1O)C(F)F Amb25311582 [0,2,0,0,0,0|2,0,0]=4 6110 B13R1.120 CC(=O)c1ccc(cc1O)C(O)=O Amb18128540 [0,2,0,0,0,0|2,0,0]=4 6111 B13R1.120 CC(=O)c1ccc(cc1O)N(C)C Amb18128416 [0,2,0,0,0,0|1,0,0]=3 6112 B13R1.120 CC(C)c1cc(N)c(cc1)C(O)=O Amb21858611 [0,2,0,0,0,0|2,0,0]=4 6113 B13R1.120 CC(C)c1cc(O)c(cc1)C(N)=O Amb24740168 [0,2,0,0,0,0|2,0,0]=4 6114 B13R1.120 CC(C)c1ccc(cc1Br)C(=O)Cl Amb23596353 [0,2,0,0,0,0|2,0,0]=4 6115 B13R1.120 CC(C)c1ccc(cc1Br)C(N)=O Amb23492474 [0,2,0,0,0,0|2,0,0]=4 6116 B13R1.120 CC(C)c1ccc(cc1O)C(N)=O Amb24496963 [0,2,0,0,0,0|2,0,0]=4 6117 B13R1.120 CC(C)c1ccc(cc1O)C(O)=O Amb18128619 [0,2,0,0,0,0|2,0,0]=4 6118 B13R1.120 CC(F)c1cc(Cl)c(cc1)C(O)=O Amb24564132 [0,2,0,0,0,0|2,0,0]=4 6119 B13R1.120 CC(N)c1cc(Cl)c(cc1)C(O)=O Amb24715757 [0,2,0,0,0,0|2,0,0]=4 6120 B13R1.120 CC(N)c1cc(O)c(cc1)C(O)=O Amb25694423 [0,2,0,0,0,0|2,0,0]=4 6121 B13R1.120 CC(N)c1ccc(cc1F)C(O)=O Amb25117989 [0,2,0,0,0,0|2,0,0]=4 6122 B13R1.120 CC(N)c1ccc(cc1I)C(O)=O Amb24492313 [0,2,0,0,0,0|2,0,0]=4 6123 B13R1.120 CN(C)c1cc(Cl)c(cc1)C(O)=O Amb18966085 [0,2,0,0,0,0|2,0,0]=4 6124 B13R1.120 CN(C)c1cc(F)c(cc1)C(N)=O Amb25369267 [0,2,0,0,0,0|2,0,0]=4 6125 B13R1.120 CN(C)c1cc(F)c(cc1)C(O)=O Amb22157248 [0,2,0,0,0,0|2,0,0]=4 6126 B13R1.120 CN(C)c1ccc(cc1Br)C(N)=O Amb23437132 [0,2,0,0,0,0|2,0,0]=4 6127 B13R1.120 CN(C)c1ccc(cc1Cl)C(O)=O Amb18288676 [0,2,0,0,0,0|2,0,0]=4 6128 B13R1.120 CN(C)c1ccc(cc1F)C(N)=O Amb24510065 [0,2,0,0,0,0|2,0,0]=4 6129 B13R1.120 CN(C)c1ccc(cc1N)C(N)=O Amb19410348 [0,2,0,0,0,0|2,0,0]=4 6130 B13R1.120 CN(C)c1ccc(cc1O)C(N)=O Amb25046165 [0,2,0,0,0,0|2,0,0]=4 6131 B13R1.120 CN(C)c1ccc(cc1O)C(O)=O Amb25700896 [0,2,0,0,0,0|2,0,0]=4 6132 B13R1.120 CN(c1ccc(c(c1)O)C(=O)O)C Amb2441815 [0,2,0,0,0,0|2,0,0]=4 6133 B13R1.120 C[C@@H](N)c1cc(Cl)c(cc1)C(O)=O Amb25375183 [0,2,0,0,0,0|2,0,0]=4 6134 B13R1.120 C[C@@H](N)c1cc(F)c(cc1)C(O)=O Amb24671199 [0,2,0,0,0,0|2,0,0]=4 6135 B13R1.120 C[C@@H](N)c1cc(O)c(cc1)C(O)=O Amb24376643 [0,2,0,0,0,0|2,0,0]=4 6136 B13R1.120 C[C@@H](N)c1ccc(cc1Br)C(O)=O Amb24445325 [0,2,0,0,0,0|2,0,0]=4 6137 B13R1.120 C[C@@H](N)c1ccc(cc1I)C(O)=O Amb25728372 [0,2,0,0,0,0|2,0,0]=4 6138 B13R1.120 C[C@@H](N)c1ccc(cc1N)C(O)=O Amb24494451 [0,2,0,0,0,0|2,0,0]=4 6139 B13R1.120 C[C@H](N)c1ccc(cc1Cl)C(O)=O Amb24365334 [0,2,0,0,0,0|2,0,0]=4 6140 B13R1.120 C[C@H](N)c1ccc(cc1N)C(O)=O Amb25733671 [0,2,0,0,0,0|2,0,0]=4 6141 B13R1.120 Cc1cc(ccc1B(O)O)C(C)=O Amb25776216 [0,2,0,0,0,0|2,0,0]=4 6142 B13R1.120 Cc1cc(ccc1C(C)=C)C(C)=O Amb25059546 [0,2,0,0,0,0|1,0,0]=3 6143 B13R1.120 Cc1cc(ccc1C(C)=O)C(C)C Amb24492533 [0,2,0,0,0,0|1,0,0]=3 6144 B13R1.120 Cc1cc(ccc1C(C)=O)C(C)O Amb25284551 [0,2,0,0,0,0|1,0,0]=3 6145 B13R1.120 Cc1cc(ccc1C(C)=O)N(C)C Amb25730293 [0,2,0,0,0,0|1,0,0]=3 6146 B13R1.120 Cc1cc(ccc1C(C)C)C(C)=O Amb24408433 [0,2,0,0,0,0|1,0,0]=3 6147 B13R1.120 Cc1cc(ccc1C(C)C)C(O)=O Amb25274659 [0,2,0,0,0,0|2,0,0]=4 6148 B13R1.120 Cc1cc(ccc1C(N)=O)N(C)C Amb25675348 [0,2,0,0,0,0|2,0,0]=4 6149 B13R1.120 Cc1cc(ccc1C(N)=O)[N+](C)=O Amb23567000 [0,2,0,0,0,0|2,0,0]=4 6150 B13R1.120 Cc1cc(ccc1C(O)=O)[C@H](C)N Amb25843310 [0,2,0,0,0,0|2,0,0]=4 6151 B13R1.120 Cc1cc(ccc1N(C)C)C(N)=O Amb22049886 [0,2,0,0,0,0|2,0,0]=4 6152 B13R1.120 Cc1cc(ccc1[C@@H](C)N)C(O)=O Amb25061206 [0,2,0,0,0,0|2,0,0]=4 6153 B13R1.120 Cc1cc(ccc1[C@H](C)N)C(O)=O Amb24496659 [0,2,0,0,0,0|2,0,0]=4 6154 B13R1.120 OB(c1ccc(c(c1)F)C(=O)C)O Amb16185901 [0,2,0,0,0,0|2,0,0]=4 6155 B13R1.120 OC(=O)c1ccc(c(c1)Br)C(C)C Amb16231793 [0,2,0,0,0,0|2,0,0]=4 6156 B13R1.120 OC(=O)c1ccc(c(c1)Br)N(C)C Amb16232700 [0,2,0,0,0,0|2,0,0]=4 6157 B13R1.120 OC(=O)c1ccc(c(c1)F)N(C)C Amb10610044 [0,2,0,0,0,0|2,0,0]=4 6158 B13R1.120 OC(=O)c1ccc(c(c1)I)C(C)C Amb16231796 [0,2,0,0,0,0|2,0,0]=4 6159 B13R1.120 OC(=O)c1ccc(c(c1)I)N(C)C Amb16232701 [0,2,0,0,0,0|2,0,0]=4 6160 B13R1.144 CC(=O)c1c[n]c(NCC)c(Cl)c1 Amb25355948 [0,2,0,0,0,0|2,0,0]=4 6161 B13R1.144 CC(=O)c1cc(I)c(cc1)N=[N+]=[N-] Amb25133856 [0,2,0,0,0,0|2,0,0]=4 6162 B13R1.144 CC(=O)c1ccc(CCC)c(N)c1 Amb18648059 [0,2,0,0,0,0|1,0,0]=3 6163 B13R1.144 CC(=O)c1ccc(NCC)c(F)c1 Amb18564165 [0,2,0,0,0,0|1,0,0]=3 6164 B13R1.144 CC(=O)c1ccc(NCC)c(N)c1 Amb18224610 [0,2,0,0,0,0|1,0,0]=3 6165 B13R1.144 CC(=O)c1ccc(OCC)c(I)c1 Amb23569065 [0,2,0,0,0,0|0,0,0]=2 6166 B13R1.144 CC(=O)c1ccc(\C=C\C)c(O)c1 Amb24662406 [0,2,0,0,0,0|1,0,0]=3 6167 B13R1.144 CC(Br)c1cc(Br)c(cc1)OCC Amb24565084 [0,2,0,0,0,0|1,0,1]=4 6168 B13R1.144 CCCc1ccc(cc1Br)C(=O)O Amb16232635 [0,2,0,0,0,0|2,0,0]=4 6169 B13R1.144 CCCc1ccc(cc1C)C(C)=O Amb24492721 [0,2,0,0,0,0|1,0,0]=3 6170 B13R1.144 CCCc1ccc(cc1F)C(O)=O Amb24520549 [0,2,0,0,0,0|2,0,0]=4 6171 B13R1.144 CCCc1ccc(cc1I)C(=O)O Amb16232685 [0,2,0,0,0,0|2,0,0]=4 6172 B13R1.144 CCNc1ccc(cc1Br)C(=O)O Amb16232742 [0,2,0,0,0,0|2,0,0]=4 6173 B13R1.144 CCNc1ccc(cc1Cl)C(O)=O Amb19002824 [0,2,0,0,0,0|2,0,0]=4 6174 B13R1.144 CCNc1ccc(cc1F)C(O)=O Amb18995611 [0,2,0,0,0,0|2,0,0]=4 6175 B13R1.144 CCNc1ccc(cc1I)C(=O)O Amb16232743 [0,2,0,0,0,0|2,0,0]=4 6176 B13R1.144 CCNc1ccc(cc1N)C(=O)O Amb1206734 [0,2,0,0,0,0|2,0,0]=4 6177 B13R1.144 CCOC1=COC(=CC1=O)C(O)=O Amb19120069 [0,2,0,0,0,0|2,0,0]=4 6178 B13R1.144 CCOc1[n]cc(cc1Cl)C(N)=O Amb24359368 [0,2,0,0,0,0|2,0,0]=4 6179 B13R1.144 CCOc1ccc(cc1Br)C(=O)C Amb17200576 [0,2,0,0,0,0|0,0,0]=2 6180 B13R1.144 CCOc1ccc(cc1Br)C(C)Cl Amb24725742 [0,2,0,0,0,0|1,0,1]=4 6181 B13R1.144 CCOc1ccc(cc1Br)C(N)=N Amb24492165 [0,2,0,0,0,0|2,0,0]=4 6182 B13R1.144 CCOc1ccc(cc1Br)S([O-])=O Amb24382271 [0,2,0,0,0,0|2,0,0]=4 6183 B13R1.144 CCOc1ccc(cc1Br)[C@H](C)N Amb25189788 [0,2,0,0,0,0|1,0,1]=4 6184 B13R1.144 CCOc1ccc(cc1Br)[C@H](C)O Amb25156242 [0,2,0,0,0,0|0,0,2]=4 6185 B13R1.144 CCOc1ccc(cc1Br)[N+]([O-])=O Amb19888308 [0,2,0,0,0,0|2,0,0]=4 6186 B13R1.144 CCOc1ccc(cc1C)C(=O)C Amb17200744 [0,2,0,0,0,0|0,0,0]=2 6187 B13R1.144 CCOc1ccc(cc1C)C(N)C Amb17233623 [0,2,0,0,0,0|1,0,1]=4 6188 B13R1.144 CCOc1ccc(cc1C)C(O)C Amb17233731 [0,2,0,0,0,0|0,0,2]=4 6189 B13R1.144 CCOc1ccc(cc1Cl)C(=O)C Amb2209370 [0,2,0,0,0,0|0,0,0]=2 6190 B13R1.144 CCOc1ccc(cc1Cl)C(N)=N Amb19038152 [0,2,0,0,0,0|2,0,0]=4 6191 B13R1.144 CCOc1ccc(cc1Cl)C(N)=S Amb25041362 [0,2,0,0,0,0|1,1,0]=4 6192 B13R1.144 CCOc1ccc(cc1Cl)C(O)C Amb17237203 [0,2,0,0,0,0|0,0,2]=4 6193 B13R1.144 CCOc1ccc(cc1Cl)S(O)=O Amb18226547 [0,2,0,0,0,0|2,0,0]=4 6194 B13R1.144 CCOc1ccc(cc1Cl)[C@@H](C)N Amb25705400 [0,2,0,0,0,0|1,0,1]=4 6195 B13R1.144 CCOc1ccc(cc1Cl)[C@@H](C)O Amb24402811 [0,2,0,0,0,0|0,0,2]=4 6196 B13R1.144 CCOc1ccc(cc1Cl)[C@H](C)N Amb24463935 [0,2,0,0,0,0|1,0,1]=4 6197 B13R1.144 CCOc1ccc(cc1Cl)[C@H](C)O Amb25071142 [0,2,0,0,0,0|0,0,2]=4 6198 B13R1.144 CCOc1ccc(cc1Cl)[N+]([O-])=O Amb18894773 [0,2,0,0,0,0|2,0,0]=4 6199 B13R1.144 CCOc1ccc(cc1F)C(C)O Amb21987853 [0,2,0,0,0,0|0,0,2]=4 6200 B13R1.144 CCOc1ccc(cc1F)C(N)=O Amb18893683 [0,2,0,0,0,0|1,0,0]=3 6201 B13R1.144 CCOc1ccc(cc1F)S(O)=O Amb18864917 [0,2,0,0,0,0|2,0,0]=4 6202 B13R1.144 CCOc1ccc(cc1F)[C@@H](C)N Amb24439621 [0,2,0,0,0,0|1,0,1]=4 6203 B13R1.144 CCOc1ccc(cc1F)[C@@H](C)O Amb25781395 [0,2,0,0,0,0|0,0,2]=4 6204 B13R1.144 CCOc1ccc(cc1F)[C@H](C)N Amb25674925 [0,2,0,0,0,0|1,0,1]=4 6205 B13R1.144 CCOc1ccc(cc1F)[C@H](C)O Amb24463541 [0,2,0,0,0,0|0,0,2]=4 6206 B13R1.144 CCOc1ccc(cc1F)[N+]([O-])=O Amb18243845 [0,2,0,0,0,0|2,0,0]=4 6207 B13R1.144 CCOc1ccc(cc1I)C(=O)O Amb16232761 [0,2,0,0,0,0|1,0,0]=3 6208 B13R1.144 CCOc1ccc(cc1N)C(=O)C Amb2209359 [0,2,0,0,0,0|0,0,0]=2 6209 B13R1.144 CCOc1ccc(cc1N)C(C)C Amb17203777 [0,2,0,0,0,0|1,0,1]=4 6210 B13R1.144 CCOc1ccc(cc1N)N(C)C Amb17138979 [0,2,0,0,0,0|2,0,0]=4 6211 B13R1.144 CCOc1ccc(cc1O)C(=O)O Amb17201685 [0,2,0,0,0,0|1,0,0]=3 6212 B13R1.144 CCOc1ccc(cc1O)[N+]([O-])=O Amb24435492 [0,2,0,0,0,0|2,0,0]=4 6213 B13R1.144 CCOc1ccc(cc1S)C(O)=O Amb25704408 [0,2,0,0,0,0|1,0,0]=3 6214 B13R1.144 CCOc1ccc(cc1S)[N+]([O-])=O Amb24591518 [0,2,0,0,0,0|2,0,0]=4 6215 B13R1.144 CCOc1ncc(cc1Cl)C(=O)O Amb1135726 [0,2,0,0,0,0|2,0,0]=4 6216 B13R1.144 CCSc1ccc(cc1Cl)C(O)=O Amb25040247 [0,2,0,0,0,0|1,1,0]=4 6217 B13R1.144 CCSc1ccc(cc1F)C(O)=O Amb18995670 [0,2,0,0,0,0|1,1,0]=4 6218 B13R1.144 CCSc1ccc(cc1N)C(O)=O Amb18970806 [0,2,0,0,0,0|1,1,0]=4 6219 B13R1.144 CNCc1ccc(cc1Cl)C(N)=O Amb25191400 [0,2,0,0,0,0|2,0,0]=4 6220 B13R1.144 COCc1ccc(cc1Cl)C(N)=N Amb24382344 [0,2,0,0,0,0|2,0,0]=4 6221 B13R1.144 COCc1ccc(cc1Cl)C(N)=S Amb25743203 [0,2,0,0,0,0|1,1,0]=4 6222 B13R1.144 COCc1ccc(cc1F)C(C)N Amb25858194 [0,2,0,0,0,0|1,0,1]=4 6223 B13R1.144 COCc1ccc(cc1F)C(O)=O Amb19002560 [0,2,0,0,0,0|1,0,0]=3 6224 B13R1.144 COCc1ccc(cc1F)[N+]([O-])=O Amb25153239 [0,2,0,0,0,0|2,0,0]=4 6225 B13R1.144 COCc1ccc(cc1I)C(O)=O Amb25331237 [0,2,0,0,0,0|1,0,0]=3 6226 B13R1.144 COCc1ccc(cc1N)C(O)=O Amb18302902 [0,2,0,0,0,0|1,0,0]=3 6227 B13R1.144 COCc1ccc(cc1O)C(O)=O Amb24492260 [0,2,0,0,0,0|1,0,0]=3 6228 B13R1.144 CONc1ccc(cc1Cl)[N+]([O-])=O Amb25057563 [0,2,0,0,0,0|2,0,0]=4 6229 B13R1.144 CSCc1ccc(cc1Cl)C(O)=O Amb25859003 [0,2,0,0,0,0|1,1,0]=4 6230 B13R1.144 CSCc1ccc(cc1F)C(O)=O Amb19002587 [0,2,0,0,0,0|1,1,0]=4 6231 B13R1.144 CSCc1ccc(cc1N)C(N)=O Amb18290082 [0,2,0,0,0,0|1,1,0]=4 6232 B13R1.144 C\C=C\c1ccc(cc1O)C(O)=O Amb24621903 [0,2,0,0,0,0|2,0,0]=4 6233 B13R1.144 Cc1[n]c(ccc1OCC)C(O)=O Amb25677815 [0,2,0,0,0,0|2,0,0]=4 6234 B13R1.144 Cc1cc(c[n]c1OCC)C(O)=O Amb23578620 [0,2,0,0,0,0|2,0,0]=4 6235 B13R1.144 Cc1cc(ccc1COC)C(N)=S Amb24671639 [0,2,0,0,0,0|1,1,0]=4 6236 B13R1.144 Cc1cc(ccc1CSC)C(O)=O Amb25802132 [0,2,0,0,0,0|1,1,0]=4 6237 B13R1.144 Cc1cc(ccc1OCC)C(C)C Amb24092700 [0,2,0,0,0,0|1,0,1]=4 6238 B13R1.144 Cc1cc(ccc1OCC)C(N)=N Amb18180785 [0,2,0,0,0,0|2,0,0]=4 6239 B13R1.144 Cc1cc(ccc1OCC)C(N)=S Amb18321337 [0,2,0,0,0,0|1,1,0]=4 6240 B13R1.144 Cc1cc(ccc1OCC)S(O)=O Amb18864308 [0,2,0,0,0,0|2,0,0]=4 6241 B13R1.144 Cc1cc(ccc1OCC)[C@@H](C)N Amb24422883 [0,2,0,0,0,0|1,0,1]=4 6242 B13R1.144 Cc1cc(ccc1OCC)[C@H](C)O Amb25755254 [0,2,0,0,0,0|0,0,2]=4 6243 B13R1.144 Cc1cc(ccc1OCC)[N+]([O-])=O Amb18893665 [0,2,0,0,0,0|2,0,0]=4 6244 B13R1.144 Cc1cc(ccc1OCCl)[N+]([O-])=O Amb24379424 [0,2,0,0,0,0|2,0,0]=4 6245 B13R1.144 Cc1cc(ccc1SCC)C(O)=O Amb18995671 [0,2,0,0,0,0|1,1,0]=4 6246 B13R1.144 NC(=O)c1ccc(CON)c(Cl)c1 Amb25820567 [0,2,0,0,0,0|2,0,0]=4 6247 B13R1.652 CC(=O)c1cc(Br)c(cc1I)OC Amb24088414 [0,2,0,0,0,0|0,0,0]=2 6248 B13R1.652 CC(=O)c1cc(Cl)c(CC)cc1N Amb22831119 [0,2,0,0,0,0|1,0,0]=3 6249 B13R1.652 CC(=O)c1cc(Cl)c(cc1Cl)OC Amb18067440 [0,2,0,0,0,0|0,0,0]=2 6250 B13R1.652 CC(=O)c1cc(F)c(cc1F)C#N Amb25670824 [0,2,0,0,0,0|2,0,0]=4 6251 B13R1.652 CC(=O)c1cc(F)c(cc1F)OC Amb25286781 [0,2,0,0,0,0|0,0,0]=2 6252 B13R1.652 CC(=O)c1cc(F)c(cc1N)OC Amb25269819 [0,2,0,0,0,0|0,0,0]=2 6253 B13R1.652 CC(=O)c1cc(F)c(cc1O)OC Amb24344178 [0,2,0,0,0,0|0,0,0]=2 6254 B13R1.652 CC(=O)c1cc(I)c(cc1Br)OC Amb24088425 [0,2,0,0,0,0|0,0,0]=2 6255 B13R1.652 CC(=O)c1cc(I)c(cc1I)OC Amb24708427 [0,2,0,0,0,0|0,0,0]=2 6256 B13R1.652 CC(=O)c1cc(O)c(cc1Br)OC Amb22040170 [0,2,0,0,0,0|0,0,0]=2 6257 B13R1.652 CC(=O)c1cc(O)c(cc1F)OC Amb20621277 [0,2,0,0,0,0|0,0,0]=2 6258 B13R1.652 CC(=O)c1cc(O)c(cc1O)OC Amb18128978 [0,2,0,0,0,0|0,0,0]=2 6259 B13R1.652 CCc1cc(C)c(cc1C)C(C)=O Amb25078682 [0,2,0,0,0,0|1,0,0]=3 6260 B13R1.652 CCc1cc(N)c(cc1F)C(O)=O Amb25043263 [0,2,0,0,0,0|2,0,0]=4 6261 B13R1.652 CN1C=C(OC)C(=O)C=C1C(O)=O Amb21937072 [0,2,0,0,0,0|2,0,0]=4 6262 B13R1.652 CNc1cc(Br)c(cc1F)C(O)=O Amb24469108 [0,2,0,0,0,0|2,0,0]=4 6263 B13R1.652 CNc1cc(F)c(cc1N)C(O)=O Amb24378866 [0,2,0,0,0,0|2,0,0]=4 6264 B13R1.652 COc1[n]c(Cl)c(cc1Br)C(O)=O Amb25820531 [0,2,0,0,0,0|2,0,0]=4 6265 B13R1.652 COc1cc(Br)c(cc1F)C(N)=S Amb25135081 [0,2,0,0,0,0|1,1,0]=4 6266 B13R1.652 COc1cc(Br)c(cc1F)C(O)=O Amb22751487 [0,2,0,0,0,0|1,0,0]=3 6267 B13R1.652 COc1cc(Br)c(cc1I)C(O)=O Amb24088429 [0,2,0,0,0,0|1,0,0]=3 6268 B13R1.652 COc1cc(Br)c(cc1N)C(O)=O Amb19888271 [0,2,0,0,0,0|1,0,0]=3 6269 B13R1.652 COc1cc(Br)c(cc1N)[N+]([O-])=O Amb25198241 [0,2,0,0,0,0|2,0,0]=4 6270 B13R1.652 COc1cc(Br)c(cc1O)C(=O)Cl Amb24610730 [0,2,0,0,0,0|1,0,0]=3 6271 B13R1.652 COc1cc(Br)c(cc1O)C(O)=O Amb20620497 [0,2,0,0,0,0|1,0,0]=3 6272 B13R1.652 COc1cc(Br)c(cc1O)[C@H](C)N Amb24382179 [0,2,0,0,0,0|1,0,1]=4 6273 B13R1.652 COc1cc(C)c(cc1C)C(=O)C Amb17194522 [0,2,0,0,0,0|0,0,0]=2 6274 B13R1.652 COc1cc(C)c(cc1C)C(=O)Cl Amb24070439 [0,2,0,0,0,0|1,0,0]=3 6275 B13R1.652 COc1cc(C)c(cc1C)C(=O)N Amb17233538 [0,2,0,0,0,0|1,0,0]=3 6276 B13R1.652 COc1cc(C)c(cc1C)C(C)Cl Amb24751649 [0,2,0,0,0,0|1,0,1]=4 6277 B13R1.652 COc1cc(C)c(cc1C)C(N)C Amb17194538 [0,2,0,0,0,0|1,0,1]=4 6278 B13R1.652 COc1cc(C)c(cc1C)C(O)=O Amb17778354 [0,2,0,0,0,0|1,0,0]=3 6279 B13R1.652 COc1cc(C)c(cc1C)C(O)C Amb17194544 [0,2,0,0,0,0|0,0,2]=4 6280 B13R1.652 COc1cc(C)c(cc1C)S(=O)Cl Amb18067428 [0,2,0,0,0,0|2,0,0]=4 6281 B13R1.652 COc1cc(C)c(cc1C)S(O)=O Amb18566225 [0,2,0,0,0,0|2,0,0]=4 6282 B13R1.652 COc1cc(C)c(cc1C)[C@@H](C)N Amb25340388 [0,2,0,0,0,0|1,0,1]=4 6283 B13R1.652 COc1cc(C)c(cc1C)[N+]([O-])=O Amb18243801 [0,2,0,0,0,0|2,0,0]=4 6284 B13R1.652 COc1cc(Cl)c(cc1Cl)C(C)Br Amb25693868 [0,2,0,0,0,0|1,0,1]=4 6285 B13R1.652 COc1cc(Cl)c(cc1Cl)C(C)Cl Amb24344193 [0,2,0,0,0,0|1,0,1]=4 6286 B13R1.652 COc1cc(Cl)c(cc1Cl)C(C)O Amb25192342 [0,2,0,0,0,0|0,0,2]=4 6287 B13R1.652 COc1cc(Cl)c(cc1Cl)C(N)=N Amb18244485 [0,2,0,0,0,0|2,0,0]=4 6288 B13R1.652 COc1cc(Cl)c(cc1Cl)C(N)=O Amb18896727 [0,2,0,0,0,0|1,0,0]=3 6289 B13R1.652 COc1cc(Cl)c(cc1Cl)C(O)=O Amb18067743 [0,2,0,0,0,0|1,0,0]=3 6290 B13R1.652 COc1cc(Cl)c(cc1Cl)S(O)=O Amb18872234 [0,2,0,0,0,0|2,0,0]=4 6291 B13R1.652 COc1cc(Cl)c(cc1Cl)[C@@H](C)N Amb25192537 [0,2,0,0,0,0|1,0,1]=4 6292 B13R1.652 COc1cc(Cl)c(cc1Cl)[C@@H](C)O Amb24491945 [0,2,0,0,0,0|0,0,2]=4 6293 B13R1.652 COc1cc(Cl)c(cc1Cl)[C@H](C)N Amb24459545 [0,2,0,0,0,0|1,0,1]=4 6294 B13R1.652 COc1cc(Cl)c(cc1F)C(N)=O Amb24681097 [0,2,0,0,0,0|1,0,0]=3 6295 B13R1.652 COc1cc(Cl)c(cc1F)C(O)=O Amb25041074 [0,2,0,0,0,0|1,0,0]=3 6296 B13R1.652 COc1cc(Cl)c(cc1N)C([O-])=O Amb24688109 [0,2,0,0,0,0|1,0,0]=3 6297 B13R1.652 COc1cc(Cl)c(cc1N)[N+]([O-])=O Amb22736079 [0,2,0,0,0,0|2,0,0]=4 6298 B13R1.652 COc1cc(F)c(cc1Br)C(C)C Amb22406276 [0,2,0,0,0,0|1,0,1]=4 6299 B13R1.652 COc1cc(F)c(cc1Br)C(O)=O Amb21962828 [0,2,0,0,0,0|1,0,0]=3 6300 B13R1.652 COc1cc(F)c(cc1Br)[N+]([O-])=O Amb24183653 [0,2,0,0,0,0|2,0,0]=4 6301 B13R1.652 COc1cc(F)c(cc1Cl)C(C)O Amb25311649 [0,2,0,0,0,0|0,0,2]=4 6302 B13R1.652 COc1cc(F)c(cc1Cl)C(O)=O Amb24468857 [0,2,0,0,0,0|1,0,0]=3 6303 B13R1.652 COc1cc(F)c(cc1F)C(=O)Cl Amb24057104 [0,2,0,0,0,0|1,0,0]=3 6304 B13R1.652 COc1cc(F)c(cc1F)C(N)=N Amb25777796 [0,2,0,0,0,0|2,0,0]=4 6305 B13R1.652 COc1cc(F)c(cc1F)C(N)=O Amb24057105 [0,2,0,0,0,0|1,0,0]=3 6306 B13R1.652 COc1cc(F)c(cc1F)C(O)=O Amb21963793 [0,2,0,0,0,0|1,0,0]=3 6307 B13R1.652 COc1cc(F)c(cc1F)[N+]([O-])=O Amb20623034 [0,2,0,0,0,0|2,0,0]=4 6308 B13R1.652 COc1cc(F)c(cc1I)C(O)=O Amb24057388 [0,2,0,0,0,0|1,0,0]=3 6309 B13R1.652 COc1cc(F)c(cc1N)C(O)=O Amb24057397 [0,2,0,0,0,0|1,0,0]=3 6310 B13R1.652 COc1cc(F)c(cc1N)[N+]([O-])=O Amb22274699 [0,2,0,0,0,0|2,0,0]=4 6311 B13R1.652 COc1cc(I)c(cc1Br)[N+]([O-])=O Amb24077265 [0,2,0,0,0,0|2,0,0]=4 6312 B13R1.652 COc1cc(I)c(cc1I)[N+]([O-])=O Amb24184028 [0,2,0,0,0,0|2,0,0]=4 6313 B13R1.652 COc1cc(N)c(cc1Br)C(O)=O Amb21858459 [0,2,0,0,0,0|1,0,0]=3 6314 B13R1.652 COc1cc(N)c(cc1Br)[N+]([O-])=O Amb19959384 [0,2,0,0,0,0|2,0,0]=4 6315 B13R1.652 COc1cc(N)c(cc1C)C(=O)O Amb10975262 [0,2,0,0,0,0|1,0,0]=3 6316 B13R1.652 COc1cc(N)c(cc1Cl)C(N)=O Amb24469365 [0,2,0,0,0,0|1,0,0]=3 6317 B13R1.652 COc1cc(N)c(cc1Cl)C(O)=O Amb18130808 [0,2,0,0,0,0|1,0,0]=3 6318 B13R1.652 COc1cc(N)c(cc1Cl)[N+](=O)[O-] Amb10072737 [0,2,0,0,0,0|2,0,0]=4 6319 B13R1.652 COc1cc(N)c(cc1F)C(O)=O Amb24420489 [0,2,0,0,0,0|1,0,0]=3 6320 B13R1.652 COc1cc(N)c(cc1F)[N+]([O-])=O Amb19959454 [0,2,0,0,0,0|2,0,0]=4 6321 B13R1.652 COc1cc(N)c(cc1I)[N+]([O-])=O Amb25692203 [0,2,0,0,0,0|2,0,0]=4 6322 B13R1.652 COc1cc(N)c(cc1O)C(O)=O Amb22288732 [0,2,0,0,0,0|1,0,0]=3 6323 B13R1.652 COc1cc(N)c(cc1O)[C@@H](C)N Amb25133777 [0,2,0,0,0,0|1,0,1]=4 6324 B13R1.652 COc1cc(O)c(cc1Br)C(O)=O Amb22347934 [0,2,0,0,0,0|1,0,0]=3 6325 B13R1.652 COc1cc(O)c(cc1Cl)C(C)N Amb25353704 [0,2,0,0,0,0|1,0,1]=4 6326 B13R1.652 COc1cc(O)c(cc1Cl)C(N)=O Amb25743860 [0,2,0,0,0,0|1,0,0]=3 6327 B13R1.652 COc1cc(O)c(cc1Cl)C(O)=O Amb24382521 [0,2,0,0,0,0|1,0,0]=3 6328 B13R1.652 COc1cc(O)c(cc1F)C(C)N Amb25239041 [0,2,0,0,0,0|1,0,1]=4 6329 B13R1.652 COc1cc(O)c(cc1F)C(N)=O Amb24511655 [0,2,0,0,0,0|1,0,0]=3 6330 B13R1.652 COc1cc(O)c(cc1I)C(O)=O Amb25333081 [0,2,0,0,0,0|1,0,0]=3 6331 B13R1.652 COc1cc(O)c(cc1O)C(=O)Cl Amb25767728 [0,2,0,0,0,0|1,0,0]=3 6332 B13R1.652 COc1cc(O)c(cc1O)C(O)=O Amb18129297 [0,2,0,0,0,0|1,0,0]=3 6333 B13R1.652 COc1cc(O)c(cc1O)[C@@H](C)N Amb25782979 [0,2,0,0,0,0|1,0,1]=4 6334 B13R1.652 COc1nc(Cl)c(cc1F)C(=O)O Amb10975266 [0,2,0,0,0,0|2,0,0]=4 6335 B13R1.652 Cc1[n]c(OC)c(Br)cc1C(C)=O Amb21926530 [0,2,0,0,0,0|1,0,0]=3 6336 B13R1.652 Cc1[n]c(OC)c(C)cc1C(O)=O Amb24534077 [0,2,0,0,0,0|2,0,0]=4 6337 B13R1.652 Cc1[n]c(OC)c(I)cc1C(C)=O Amb21927569 [0,2,0,0,0,0|1,0,0]=3 6338 B13R1.652 Cc1cc(C(C)N)c(Cl)cc1OC Amb25040353 [0,2,0,0,0,0|1,0,1]=4 6339 B13R1.652 Cc1cc(C(C)O)c(F)cc1OC Amb24694589 [0,2,0,0,0,0|0,0,2]=4 6340 B13R1.652 Cc1cc(OC)c(Br)cc1C(O)=O Amb24056347 [0,2,0,0,0,0|1,0,0]=3 6341 B13R1.652 Cc1cc(OC)c(Br)cc1[N+]([O-])=O Amb22304303 [0,2,0,0,0,0|2,0,0]=4 6342 B13R1.652 Cc1cc(OC)c(Cl)cc1C(C)=O Amb18066490 [0,2,0,0,0,0|0,0,0]=2 6343 B13R1.652 Cc1cc(OC)c(Cl)cc1C(C)N Amb18894642 [0,2,0,0,0,0|1,0,1]=4 6344 B13R1.652 Cc1cc(OC)c(Cl)cc1C(N)=N Amb18894608 [0,2,0,0,0,0|2,0,0]=4 6345 B13R1.652 Cc1cc(OC)c(Cl)cc1C(N)=O Amb18894640 [0,2,0,0,0,0|1,0,0]=3 6346 B13R1.652 Cc1cc(OC)c(Cl)cc1C(O)=O Amb18066545 [0,2,0,0,0,0|1,0,0]=3 6347 B13R1.652 Cc1cc(OC)c(Cl)cc1S(O)=O Amb18867096 [0,2,0,0,0,0|2,0,0]=4 6348 B13R1.652 Cc1cc(OC)c(Cl)cc1[N+]([O-])=O Amb18894772 [0,2,0,0,0,0|2,0,0]=4 6349 B13R1.652 Cc1cc(OC)c(F)cc1[N+]([O-])=O Amb22749332 [0,2,0,0,0,0|2,0,0]=4 6350 B13R1.652 Cc1cc(OC)c(N)cc1C(N)=O Amb24344184 [0,2,0,0,0,0|1,0,0]=3 6351 B13R1.652 Cc1cc(OC)c(N)cc1N(C)C Amb25243269 [0,2,0,0,0,0|2,0,0]=4 6352 B13R1.652 Cc1cc(OC)c(N)cc1[N+]([O-])=O Amb24062971 [0,2,0,0,0,0|2,0,0]=4 6353 B13R1.652 Cc1cc(OC)c(O)cc1C(C)=O Amb18128612 [0,2,0,0,0,0|0,0,0]=2 6354 B13R1.652 Cc1cc(OC)c(O)cc1S(C)=O Amb25373386 [0,2,0,0,0,0|1,0,0]=3 6355 B13R1.652 Cc1cc(c(Br)cc1OC)[N+]([O-])=O Amb24686302 [0,2,0,0,0,0|2,0,0]=4 6356 B13R1.652 Cc1cc(c(F)cc1OC)C(C)=O Amb25211899 [0,2,0,0,0,0|0,0,0]=2 6357 B13R1.652 Cc1cc(c(F)cc1OC)C(O)=O Amb25075173 [0,2,0,0,0,0|1,0,0]=3 6358 B13R1.652 Cc1cc(c(N)cc1OC)C(N)=O Amb24658267 [0,2,0,0,0,0|1,0,0]=3 6359 B13R1.652 Cc1cc(c(N)cc1OC)N(=O)=O Amb22492520 [0,2,0,0,0,0|2,0,0]=4 6360 B13R1.652 Cc1cc(c(N)cc1OC)[N+]([O-])=O Amb20671131 [0,2,0,0,0,0|2,0,0]=4 6361 B13R1.652 Cc1cc(c(O)cc1C#N)C(C)=O Amb25275711 [0,2,0,0,0,0|2,0,0]=4 6362 B13R1.652 Cc1cc(c(O)cc1OC)C(C)=O Amb18128634 [0,2,0,0,0,0|0,0,0]=2 6363 B13R1.652 Cc1cc(c(O)cc1OC)C(O)=O Amb24738613 [0,2,0,0,0,0|1,0,0]=3 6364 B13R1.652 Cc1cc(c(O)cc1OC)[N+]([O-])=O Amb25196652 [0,2,0,0,0,0|2,0,0]=4 6365 B13R1.3091 CC(=C)c1cc(OC)c(cc1)OC Amb22171578 [0,2,0,0,0,0|1,0,0]=3 6366 B13R1.3091 CC(=C)c1ccc(OC)c(C=O)c1 Amb25712231 [0,2,0,0,0,0|1,0,0]=3 6367 B13R1.3091 CC(=O)c1cc(C#C)c(cc1)C#C Amb25767740 [0,2,0,0,0,0|1,0,1]=4 6368 B13R1.3091 CC(=O)c1cc(C#N)c([n]c1)OC Amb24707255 [0,2,0,0,0,0|1,0,0]=3 6369 B13R1.3091 CC(=O)c1cc(CC)c(CC)cc1 Amb25195757 [0,2,0,0,0,0|1,0,0]=3 6370 B13R1.3091 CC(=O)c1cc(N=O)c(cc1)C=O Amb25373357 [0,2,0,0,0,0|2,0,0]=4 6371 B13R1.3091 CC(=O)c1cc(OC)c(C=O)cc1 Amb18128118 [0,2,0,0,0,0|2,0,0]=4 6372 B13R1.3091 CC(=O)c1cc(OC)c(CC)c[n]1 Amb25352506 [0,2,0,0,0,0|2,0,0]=4 6373 B13R1.3091 CC(=O)c1cc(OC)c(CCl)cc1 Amb25348174 [0,2,0,0,0,0|2,0,0]=4 6374 B13R1.3091 CC(=O)c1cc(OC)c(c[n]1)OC Amb25684195 [0,2,0,0,0,0|1,0,0]=3 6375 B13R1.3091 CC(=O)c1cc(OC)c(cc1)C#N Amb25262714 [0,2,0,0,0,0|2,0,0]=4 6376 B13R1.3091 CC(=O)c1cc(OC)c(cc1)NC Amb25050442 [0,2,0,0,0,0|1,0,0]=3 6377 B13R1.3091 CC(=O)c1ccc(OC)c(CF)c1 Amb25287577 [0,2,0,0,0,0|0,0,0]=2 6378 B13R1.3091 CC(=O)c1ccc(OC)c(CN)c1 Amb18909095 [0,2,0,0,0,0|0,0,0]=2 6379 B13R1.3091 CCc1cc([n]cc1OC)C(O)=O Amb18193341 [0,2,0,0,0,0|2,0,0]=4 6380 B13R1.3091 CCc1cc(ccc1NC)C(O)=O Amb25311423 [0,2,0,0,0,0|2,0,0]=4 6381 B13R1.3091 CCc1cc(ccc1OC)C(=O)C Amb17203910 [0,2,0,0,0,0|0,0,0]=2 6382 B13R1.3091 CCc1cc(ccc1OC)C(=O)O Amb17203904 [0,2,0,0,0,0|1,0,0]=3 6383 B13R1.3091 CCc1cc(ccc1OC)C(C)O Amb25135175 [0,2,0,0,0,0|0,0,2]=4 6384 B13R1.3091 CCc1cc(ccc1OC)C(N)=N Amb18243726 [0,2,0,0,0,0|2,0,0]=4 6385 B13R1.3091 CCc1cc(ccc1OC)C(N)=O Amb18243755 [0,2,0,0,0,0|1,0,0]=3 6386 B13R1.3091 CCc1cc(ccc1OC)C(N)=S Amb18244071 [0,2,0,0,0,0|1,1,0]=4 6387 B13R1.3091 CCc1cc(ccc1OC)S(O)=O Amb18225035 [0,2,0,0,0,0|2,0,0]=4 6388 B13R1.3091 CCc1cc(ccc1OC)[C@H](C)N Amb24707767 [0,2,0,0,0,0|1,0,1]=4 6389 B13R1.3091 CCc1cc(ccc1OC)[N+]([O-])=O Amb18243802 [0,2,0,0,0,0|2,0,0]=4 6390 B13R1.3091 CCc1ccc(cc1C#N)C(O)=O Amb20668457 [0,2,0,0,0,0|2,0,0]=4 6391 B13R1.3091 CCc1ccc(cc1CC)C(=O)Cl Amb24085471 [0,2,0,0,0,0|2,0,0]=4 6392 B13R1.3091 CCc1ccc(cc1CC)C(N)=O Amb24350025 [0,2,0,0,0,0|2,0,0]=4 6393 B13R1.3091 CCc1ccc(cc1CC)C(O)=O Amb22059708 [0,2,0,0,0,0|2,0,0]=4 6394 B13R1.3091 CCc1ccc(cc1NC)C(O)=O Amb24754183 [0,2,0,0,0,0|2,0,0]=4 6395 B13R1.3091 CNc1cc(ccc1OC)C(C)C Amb18065870 [0,2,0,0,0,0|1,0,1]=4 6396 B13R1.3091 CNc1cc(ccc1OC)C(N)=O Amb19002867 [0,2,0,0,0,0|1,0,0]=3 6397 B13R1.3091 COc1[n]cc(cc1C#N)C(O)=O Amb23450276 [0,2,0,0,0,0|2,0,0]=4 6398 B13R1.3091 COc1cc(ccc1OC)C(=S)N Amb1152770 [0,2,0,0,0,0|1,1,0]=4 6399 B13R1.3091 COc1cc(ccc1OC)C(N)C Amb1108791 [0,2,0,0,0,0|1,0,1]=4 6400 B13R1.3091 COc1cc(ccc1OC)C(O)C Amb1111053 [0,2,0,0,0,0|0,0,2]=4 6401 B13R1.3091 COc1cc(ccc1OC)[13C](=O)O Amb17613166 [0,2,0,0,0,0|1,0,0]=3 6402 B13R1.3091 COc1cc(ccc1OC)[N+](=O)[O-] Amb1352020 [0,2,0,0,0,0|2,0,0]=4 6403 B13R1.3091 COc1cc(ccc1OC)[S-](=O)=O Amb13881374 [0,2,0,0,0,0|2,0,0]=4 6404 B13R1.3091 COc1cc(ccc1SC)C(=O)C Amb13951675 [0,2,0,0,0,0|0,1,0]=3 6405 B13R1.3091 COc1cc(ccc1SC)C(=O)Cl Amb25301785 [0,2,0,0,0,0|1,1,0]=4 6406 B13R1.3091 COc1cc(ccc1SC)C(O)=O Amb18652883 [0,2,0,0,0,0|1,1,0]=4 6407 B13R1.3091 COc1cc(cnc1OC)C(=O)O Amb13889888 [0,2,0,0,0,0|2,0,0]=4 6408 B13R1.3091 COc1ccc(cc1C#C)C(C)C Amb24408999 [0,2,0,0,0,0|1,0,1]=4 6409 B13R1.3091 COc1ccc(cc1C#C)[N+]([O-])=O Amb19944536 [0,2,0,0,0,0|2,0,0]=4 6410 B13R1.3091 COc1ccc(cc1C#N)C(=O)Cl Amb24085938 [0,2,0,0,0,0|1,0,0]=3 6411 B13R1.3091 COc1ccc(cc1C#N)C(C)Cl Amb25798939 [0,2,0,0,0,0|1,0,1]=4 6412 B13R1.3091 COc1ccc(cc1C#N)C(N)=O Amb25684148 [0,2,0,0,0,0|1,0,0]=3 6413 B13R1.3091 COc1ccc(cc1C=C)C(O)=O Amb25074405 [0,2,0,0,0,0|1,0,0]=3 6414 B13R1.3091 COc1ccc(cc1C=O)C(O)=O Amb24329414 [0,2,0,0,0,0|1,0,0]=3 6415 B13R1.3091 COc1ccc(cc1C=O)N(C)C Amb24467030 [0,2,0,0,0,0|2,0,0]=4 6416 B13R1.3091 COc1ccc(cc1CBr)C(O)=O Amb25676434 [0,2,0,0,0,0|1,0,0]=3 6417 B13R1.3091 COc1ccc(cc1CBr)N(=O)=O Amb20621524 [0,2,0,0,0,0|2,0,0]=4 6418 B13R1.3091 COc1ccc(cc1CCl)C(=O)Cl Amb25695916 [0,2,0,0,0,0|1,0,0]=3 6419 B13R1.3091 COc1ccc(cc1CCl)C(O)=O Amb25224908 [0,2,0,0,0,0|1,0,0]=3 6420 B13R1.3091 COc1ccc(cc1CCl)[C@H](C)N Amb24700402 [0,2,0,0,0,0|1,0,1]=4 6421 B13R1.3091 COc1ccc(cc1CF)C(C)N Amb24536168 [0,2,0,0,0,0|1,0,1]=4 6422 B13R1.3091 COc1ccc(cc1CI)[N+]([O-])=O Amb25820754 [0,2,0,0,0,0|2,0,0]=4 6423 B13R1.3091 COc1ccc(cc1CN)C(O)=O Amb23559373 [0,2,0,0,0,0|1,0,0]=3 6424 B13R1.3091 COc1ccc(cc1CN)C(O)=O Amb24117603 [0,2,0,0,0,0|1,0,0]=3 6425 B13R1.3091 COc1ccc(cc1CN)N(C)C Amb23575687 [0,2,0,0,0,0|2,0,0]=4 6426 B13R1.3091 COc1ccc(cc1CO)C(O)=O Amb23559309 [0,2,0,0,0,0|1,0,0]=3 6427 B13R1.3091 COc1ccc(cc1CO)[C@@H](C)N Amb25757383 [0,2,0,0,0,0|1,0,1]=4 6428 B13R1.3091 COc1ccc(cc1CO)[C@H](C)N Amb25326337 [0,2,0,0,0,0|1,0,1]=4 6429 B13R1.3091 COc1ccc(cc1CS)C(O)=O Amb24382201 [0,2,0,0,0,0|1,0,0]=3 6430 B13R1.3091 COc1ccc(cc1CS)[N+]([O-])=O Amb24388892 [0,2,0,0,0,0|2,0,0]=4 6431 B13R1.3091 COc1ccc(cc1NN)C(C)C Amb18893649 [0,2,0,0,0,0|1,0,1]=4 6432 B13R1.3091 COc1ccc(cc1NN)C(O)=O Amb25160552 [0,2,0,0,0,0|1,0,0]=3 6433 B13R1.3091 COc1ccc(cc1OC)C(C)C Amb25267764 [0,2,0,0,0,0|1,0,1]=4 6434 B13R1.3091 COc1ccc(cc1OC)C(C)O Amb24064114 [0,2,0,0,0,0|0,0,2]=4 6435 B13R1.3091 COc1ccc(cc1OC)N(C)C Amb18268723 [0,2,0,0,0,0|2,0,0]=4 6436 B13R1.3091 COc1ccc(cc1OC)S(=O)=O Amb24758193 [0,2,0,0,0,0|2,0,0]=4 6437 B13R1.3091 COc1ccc(cc1OC)S(=O)Cl Amb18570762 [0,2,0,0,0,0|2,0,0]=4 6438 B13R1.3091 COc1ccc(cc1OC)S(C)=O Amb19892217 [0,2,0,0,0,0|1,0,0]=3 6439 B13R1.3091 COc1ccc(cc1OC)S(O)=O Amb18566482 [0,2,0,0,0,0|2,0,0]=4 6440 B13R1.3091 COc1ccc(cc1OC)S([O-])=O Amb24112906 [0,2,0,0,0,0|2,0,0]=4 6441 B13R1.3091 COc1ccc(cc1OC)[S-](=O)=O Amb22042484 [0,2,0,0,0,0|2,0,0]=4 6442 B13R1.3091 COc1ccc(cc1ON)[N+]([O-])=O Amb25340599 [0,2,0,0,0,0|2,0,0]=4 6443 B13R1.3091 COc1nc(ccc1OC)C(=O)C Amb13889982 [0,2,0,0,0,0|1,0,0]=3 6444 B13R1.3091 CSc1ccc(cc1NN)C(O)=O Amb25267983 [0,2,0,0,0,0|1,1,0]=4 6445 B13R1.3091 ClCc1cc(ccc1OC)C(=O)C Amb1657374 [0,2,0,0,0,0|0,0,0]=2 6446 B13R1.3091 ClCc1cc(ccc1OC)C(C)C Amb17236875 [0,2,0,0,0,0|1,0,1]=4 6447 B13R1.3091 N#Cc1cc(ccc1CC)C(=O)C Amb17138703 [0,2,0,0,0,0|1,0,0]=3 6448 B13R1.3091 N#Cc1cc(ccc1OC)C(=O)C Amb17138755 [0,2,0,0,0,0|0,0,0]=2 6449 B13R1.3091 N#Cc1cc(ccc1OC)C(=O)O Amb17201731 [0,2,0,0,0,0|1,0,0]=3 6450 B13R1.3091 N#Cc1cc(ccc1OC)C(C)C Amb17203735 [0,2,0,0,0,0|1,0,1]=4 6451 B13R1.3091 N#Cc1cc(ccc1OC)[N+](=O)[O-] Amb1915174 [0,2,0,0,0,0|2,0,0]=4 6452 B13R1.3091 N#[N+]c1cc(ccc1OC)[N+](=O)[O-] Amb16231819 [0,2,0,0,0,0|2,0,0]=4 6453 B13R1.3091 NCc1cc(ccc1OC)C(C)C Amb17233598 [0,2,0,0,0,0|1,0,1]=4 6454 B13R1.3091 O=Cc1cc(ccc1OC)C(=O)C Amb17594530 [0,2,0,0,0,0|0,0,0]=2 6455 B13R1.3091 O=Cc1cc(ccc1OC)C(C)C Amb10807494 [0,2,0,0,0,0|1,0,1]=4 6456 B13R1.3091 OCc1cc(ccc1OC)C(=O)C Amb1110767 [0,2,0,0,0,0|0,0,0]=2 6457 B13R1.3091 OCc1cc(ccc1OC)C(C)C Amb17233704 [0,2,0,0,0,0|1,0,1]=4 6458 B13R1.3091 SCc1cc(ccc1OC)C(C)C Amb17402155 [0,2,0,0,0,0|1,0,1]=4 6459 B13R1.3091 [C-]#[N+]c1cc(ccc1OC)[N+]([O-])=O Amb24604349 [0,2,0,0,0,0|2,0,0]=4 6460 B13R1.3096 CC(=O)c1ccc(C#N)c(F)c1F Amb24637082 [0,2,0,0,0,0|2,0,0]=4 6461 B13R1.3096 CC(=O)c1ccc(OC)c(Br)c1N Amb21962155 [0,2,0,0,0,0|0,0,0]=2 6462 B13R1.3096 CC(=O)c1ccc(OC)c(Br)c1O Amb25313275 [0,2,0,0,0,0|0,0,0]=2 6463 B13R1.3096 CC(=O)c1ccc(OC)c(Cl)c1N Amb19895326 [0,2,0,0,0,0|0,0,0]=2 6464 B13R1.3096 CC(=O)c1ccc(OC)c(F)c1N Amb24548219 [0,2,0,0,0,0|0,0,0]=2 6465 B13R1.3096 CC(=O)c1ccc(OC)c(I)c1I Amb24586577 [0,2,0,0,0,0|0,0,0]=2 6466 B13R1.3096 CC(=O)c1ccc(OC)c(I)c1O Amb24309396 [0,2,0,0,0,0|0,0,0]=2 6467 B13R1.3096 CC(=O)c1ccc(OC)c(N)c1Cl Amb25815138 [0,2,0,0,0,0|0,0,0]=2 6468 B13R1.3096 CCc1ccc(C(O)=O)c(F)c1F Amb25662028 [0,2,0,0,0,0|2,0,0]=4 6469 B13R1.3096 CCc1ccc(c(N)c1O)C(O)=O Amb18128815 [0,2,0,0,0,0|2,0,0]=4 6470 B13R1.3096 CNc1ccc(C(N)=O)c(O)c1Cl Amb25350493 [0,2,0,0,0,0|2,0,0]=4 6471 B13R1.3096 COC1=COC(C(O)=O)=C(Br)C1=O Amb25241807 [0,2,0,0,0,0|2,0,0]=4 6472 B13R1.3096 COc1ccc(C(=O)Cl)c(C)c1C Amb25270537 [0,2,0,0,0,0|1,0,0]=3 6473 B13R1.3096 COc1ccc(C(=O)Cl)c(F)c1F Amb22738116 [0,2,0,0,0,0|1,0,0]=3 6474 B13R1.3096 COc1ccc(C(=O)Cl)c(I)c1I Amb24591052 [0,2,0,0,0,0|1,0,0]=3 6475 B13R1.3096 COc1ccc(C(C)N)c(Br)c1O Amb24446483 [0,2,0,0,0,0|1,0,1]=4 6476 B13R1.3096 COc1ccc(C(C)N)c(C)c1C Amb18555429 [0,2,0,0,0,0|1,0,1]=4 6477 B13R1.3096 COc1ccc(C(C)N)c(Cl)c1Cl Amb18275781 [0,2,0,0,0,0|1,0,1]=4 6478 B13R1.3096 COc1ccc(C(C)N)c(Cl)c1O Amb24654657 [0,2,0,0,0,0|1,0,1]=4 6479 B13R1.3096 COc1ccc(C(C)N)c(N)c1O Amb25198288 [0,2,0,0,0,0|1,0,1]=4 6480 B13R1.3096 COc1ccc(C(C)O)c(C)c1C Amb18056700 [0,2,0,0,0,0|0,0,2]=4 6481 B13R1.3096 COc1ccc(C(C)O)c(F)c1Cl Amb24663512 [0,2,0,0,0,0|0,0,2]=4 6482 B13R1.3096 COc1ccc(C(C)O)c(F)c1F Amb25202418 [0,2,0,0,0,0|0,0,2]=4 6483 B13R1.3096 COc1ccc(C(N)=N)c(C)c1C Amb18893625 [0,2,0,0,0,0|2,0,0]=4 6484 B13R1.3096 COc1ccc(C(N)=N)c(Cl)c1Cl Amb25084238 [0,2,0,0,0,0|2,0,0]=4 6485 B13R1.3096 COc1ccc(C(N)=O)c(C)c1C Amb18056730 [0,2,0,0,0,0|1,0,0]=3 6486 B13R1.3096 COc1ccc(C(N)=O)c(Cl)c1Cl Amb18275764 [0,2,0,0,0,0|1,0,0]=3 6487 B13R1.3096 COc1ccc(C(N)=O)c(N)c1N Amb25726793 [0,2,0,0,0,0|1,0,0]=3 6488 B13R1.3096 COc1ccc(C(N)=O)c(O)c1I Amb25248454 [0,2,0,0,0,0|1,0,0]=3 6489 B13R1.3096 COc1ccc(C(N)=S)c(Br)c1F Amb25755393 [0,2,0,0,0,0|1,1,0]=4 6490 B13R1.3096 COc1ccc(C(N)=S)c(F)c1F Amb25703680 [0,2,0,0,0,0|1,1,0]=4 6491 B13R1.3096 COc1ccc(C(O)=O)c(F)c1Cl Amb24519109 [0,2,0,0,0,0|1,0,0]=3 6492 B13R1.3096 COc1ccc(C(O)=O)c(F)c1S Amb25123452 [0,2,0,0,0,0|1,0,0]=3 6493 B13R1.3096 COc1ccc(C(O)=O)c(I)c1I Amb24727443 [0,2,0,0,0,0|1,0,0]=3 6494 B13R1.3096 COc1ccc(C(O)=O)c(N)c1N Amb18128995 [0,2,0,0,0,0|1,0,0]=3 6495 B13R1.3096 COc1ccc(C(O)=O)c(O)c1Br Amb25156037 [0,2,0,0,0,0|1,0,0]=3 6496 B13R1.3096 COc1ccc(C(O)=O)c(O)c1Cl Amb25156408 [0,2,0,0,0,0|1,0,0]=3 6497 B13R1.3096 COc1ccc([C@@H](C)N)c(O)c1F Amb25720917 [0,2,0,0,0,0|1,0,1]=4 6498 B13R1.3096 COc1ccc([C@@H](C)N)c(O)c1O Amb24494248 [0,2,0,0,0,0|1,0,1]=4 6499 B13R1.3096 COc1ccc(c(Br)c1F)[N+]([O-])=O Amb23402626 [0,2,0,0,0,0|2,0,0]=4 6500 B13R1.3096 COc1ccc(c(Br)c1O)[N+]([O-])=O Amb22234536 [0,2,0,0,0,0|2,0,0]=4 6501 B13R1.3096 COc1ccc(c(C)c1C)S(O)=O Amb18225037 [0,2,0,0,0,0|2,0,0]=4 6502 B13R1.3096 COc1ccc(c(Cl)c1F)[N+]([O-])=O Amb23402625 [0,2,0,0,0,0|2,0,0]=4 6503 B13R1.3096 COc1ccc(c(F)c1Br)[N+]([O-])=O Amb23402628 [0,2,0,0,0,0|2,0,0]=4 6504 B13R1.3096 COc1ccc(c(F)c1Cl)[N+]([O-])=O Amb23402627 [0,2,0,0,0,0|2,0,0]=4 6505 B13R1.3096 COc1ccc(c(F)c1I)[N+]([O-])=O Amb23402629 [0,2,0,0,0,0|2,0,0]=4 6506 B13R1.3096 COc1ccc(c(F)c1O)C(O)=O Amb25111541 [0,2,0,0,0,0|1,0,0]=3 6507 B13R1.3096 COc1ccc(c(I)c1F)[N+]([O-])=O Amb23402617 [0,2,0,0,0,0|2,0,0]=4 6508 B13R1.3096 COc1ccc(c(N)c1Br)C(O)=O Amb24679946 [0,2,0,0,0,0|1,0,0]=3 6509 B13R1.3096 COc1ccc(c(N)c1Cl)C(O)=O Amb24417997 [0,2,0,0,0,0|1,0,0]=3 6510 B13R1.3096 COc1ccc(c(N)c1F)C(O)=O Amb19149063 [0,2,0,0,0,0|1,0,0]=3 6511 B13R1.3096 COc1ccc(c(N)c1O)[N+]([O-])=O Amb25174151 [0,2,0,0,0,0|2,0,0]=4 6512 B13R1.3096 COc1ccc(c(c1C)C)C(=O)C Amb17203372 [0,2,0,0,0,0|0,0,0]=2 6513 B13R1.3096 COc1ccc(c(c1C)C)C(=O)O Amb10789222 [0,2,0,0,0,0|1,0,0]=3 6514 B13R1.3096 COc1ccc(c(c1C)N)C(=O)C Amb10602109 [0,2,0,0,0,0|0,0,0]=2 6515 B13R1.3096 COc1ccc(c(c1Cl)Cl)C(=O)O Amb17596019 [0,2,0,0,0,0|1,0,0]=3 6516 B13R1.3096 COc1ccc(c(c1F)F)C(=O)N Amb10841431 [0,2,0,0,0,0|1,0,0]=3 6517 B13R1.3096 COc1ccc(c(c1F)F)[N+](=O)[O-] Amb10839269 [0,2,0,0,0,0|2,0,0]=4 6518 B13R1.3096 Cc1c(Br)c([n]cc1C(O)=O)OC Amb23597926 [0,2,0,0,0,0|2,0,0]=4 6519 B13R1.3096 Cc1c(Br)c(ccc1[N+]([O-])=O)OC Amb25192523 [0,2,0,0,0,0|2,0,0]=4 6520 B13R1.3096 Cc1c(Cl)c(ccc1OC)C(O)=O Amb22473880 [0,2,0,0,0,0|1,0,0]=3 6521 B13R1.3096 Cc1c(Cl)c(ccc1SC)C(O)=O Amb24682486 [0,2,0,0,0,0|1,1,0]=4 6522 B13R1.3096 Cc1c(F)c(ccc1OC)C(C)=O Amb25721191 [0,2,0,0,0,0|0,0,0]=2 6523 B13R1.3096 Cc1c(F)c(ccc1OC)[N+]([O-])=O Amb24638066 [0,2,0,0,0,0|2,0,0]=4 6524 B13R1.3096 Cc1c(F)c(ccc1[N+]([O-])=O)OC Amb24492286 [0,2,0,0,0,0|2,0,0]=4 6525 B13R1.3096 Cc1c(N)c(ccc1C(O)=O)SC Amb24085784 [0,2,0,0,0,0|1,1,0]=4 6526 B13R1.3096 Cc1c(N)c(ccc1OC)C(O)=O Amb24406638 [0,2,0,0,0,0|1,0,0]=3 6527 B13R1.3096 Cc1c(N)c(ccc1OC)[N+]([O-])=O Amb24329412 [0,2,0,0,0,0|2,0,0]=4 6528 B13R1.3096 Cc1c(N)c(ccc1SC)C(O)=O Amb24543800 [0,2,0,0,0,0|1,1,0]=4 6529 B13R1.3096 Cc1c(O)c(ccc1CCl)C(C)=O Amb18652968 [0,2,0,0,0,0|2,0,0]=4 6530 B13R1.3096 Cc1c(O)c(ccc1OC)C(C)=O Amb18648344 [0,2,0,0,0,0|0,0,0]=2 6531 B13R1.3096 Cc1c(ccc(c1O)C(O)=O)OC Amb18128973 [0,2,0,0,0,0|1,0,0]=3 6532 B13R1.3380 CC(=O)c1cc(C)c(C#N)c(C)c1 Amb25723316 [0,2,0,0,0,0|2,0,0]=4 6533 B13R1.3380 CC(=O)c1cc(I)c(OC)c(I)c1 Amb23571800 [0,2,0,0,0,0|0,0,0]=2 6534 B13R1.3380 CC(=O)c1cc(N)c(OC)c(Br)c1 Amb25087934 [0,2,0,0,0,0|0,0,0]=2 6535 B13R1.3380 CCc1c(C)cc([n]c1C)C(C)=O Amb24730572 [0,2,0,0,0,0|2,0,0]=4 6536 B13R1.3380 CCc1c(C)cc(cc1C)C(C)=O Amb25294443 [0,2,0,0,0,0|1,0,0]=3 6537 B13R1.3380 CCc1c(Cl)cc(cc1Cl)C(O)=O Amb22547128 [0,2,0,0,0,0|2,0,0]=4 6538 B13R1.3380 CNc1c(F)cc(cc1F)C(O)=O Amb24085535 [0,2,0,0,0,0|2,0,0]=4 6539 B13R1.3380 COc1c(Br)cc(cc1Br)C(C)C Amb22490076 [0,2,0,0,0,0|1,0,1]=4 6540 B13R1.3380 COc1c(Br)cc(cc1Br)[C@H](C)N Amb24758906 [0,2,0,0,0,0|1,0,1]=4 6541 B13R1.3380 COc1c(Br)cc(cc1Br)[N+](=O)[O-] Amb1085925 [0,2,0,0,0,0|2,0,0]=4 6542 B13R1.3380 COc1c(Br)cc(cc1O)C(O)=O Amb18136942 [0,2,0,0,0,0|1,0,0]=3 6543 B13R1.3380 COc1c(C)cc(cc1C)C(=O)C Amb1953502 [0,2,0,0,0,0|0,0,0]=2 6544 B13R1.3380 COc1c(C)cc(cc1C)C(C)Br Amb25198148 [0,2,0,0,0,0|1,0,1]=4 6545 B13R1.3380 COc1c(C)cc(cc1C)C(C)O Amb24346766 [0,2,0,0,0,0|0,0,2]=4 6546 B13R1.3380 COc1c(C)cc(cc1C)C(N)=N Amb24726192 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.3380 COc1c(C)cc(cc1C)C(N)=O Amb23594693 [0,2,0,0,0,0|1,0,0]=3 6548 B13R1.3380 COc1c(C)cc(cc1C)S([O-])=O Amb25726988 [0,2,0,0,0,0|2,0,0]=4 6549 B13R1.3380 COc1c(C)cc(cc1C)[C@@H](C)N Amb24655812 [0,2,0,0,0,0|1,0,1]=4 6550 B13R1.3380 COc1c(C)cc(cc1C)[C@H](C)N Amb24744384 [0,2,0,0,0,0|1,0,1]=4 6551 B13R1.3380 COc1c(C)cc(cc1C)[C@H](C)O Amb24491049 [0,2,0,0,0,0|0,0,2]=4 6552 B13R1.3380 COc1c(Cl)cc(cc1Br)[N+]([O-])=O Amb19959375 [0,2,0,0,0,0|2,0,0]=4 6553 B13R1.3380 COc1c(Cl)cc(cc1Cl)C(=O)N Amb217122 [0,2,0,0,0,0|1,0,0]=3 6554 B13R1.3380 COc1c(Cl)cc(cc1Cl)C(=O)O Amb1217690 [0,2,0,0,0,0|1,0,0]=3 6555 B13R1.3380 COc1c(Cl)cc(cc1Cl)C(C)N Amb18275052 [0,2,0,0,0,0|1,0,1]=4 6556 B13R1.3380 COc1c(Cl)cc(cc1Cl)[C@@H](C)N Amb25155359 [0,2,0,0,0,0|1,0,1]=4 6557 B13R1.3380 COc1c(Cl)cc(cc1Cl)[N+](=O)[O-] Amb1085934 [0,2,0,0,0,0|2,0,0]=4 6558 B13R1.3380 COc1c(Cl)cc(cc1O)C(O)=O Amb18654079 [0,2,0,0,0,0|1,0,0]=3 6559 B13R1.3380 COc1c(F)cc(cc1Br)C(O)=O Amb22751493 [0,2,0,0,0,0|1,0,0]=3 6560 B13R1.3380 COc1c(F)cc(cc1Br)[N+](=O)[O-] Amb10807710 [0,2,0,0,0,0|2,0,0]=4 6561 B13R1.3380 COc1c(F)cc(cc1Cl)C(=O)C Amb10808082 [0,2,0,0,0,0|0,0,0]=2 6562 B13R1.3380 COc1c(F)cc(cc1Cl)C(=O)Cl Amb22738253 [0,2,0,0,0,0|1,0,0]=3 6563 B13R1.3380 COc1c(F)cc(cc1Cl)C(=O)O Amb10808079 [0,2,0,0,0,0|1,0,0]=3 6564 B13R1.3380 COc1c(F)cc(cc1Cl)C(C)N Amb25679096 [0,2,0,0,0,0|1,0,1]=4 6565 B13R1.3380 COc1c(F)cc(cc1Cl)C(N)=O Amb22738273 [0,2,0,0,0,0|1,0,0]=3 6566 B13R1.3380 COc1c(F)cc(cc1Cl)[C@@H](C)N Amb24443907 [0,2,0,0,0,0|1,0,1]=4 6567 B13R1.3380 COc1c(F)cc(cc1Cl)[C@H](C)N Amb25192175 [0,2,0,0,0,0|1,0,1]=4 6568 B13R1.3380 COc1c(F)cc(cc1F)C(=O)Cl Amb10840854 [0,2,0,0,0,0|1,0,0]=3 6569 B13R1.3380 COc1c(F)cc(cc1F)C(=O)N Amb16185941 [0,2,0,0,0,0|1,0,0]=3 6570 B13R1.3380 COc1c(F)cc(cc1F)C(C)Br Amb24748499 [0,2,0,0,0,0|1,0,1]=4 6571 B13R1.3380 COc1c(F)cc(cc1F)C(C)Cl Amb24398061 [0,2,0,0,0,0|1,0,1]=4 6572 B13R1.3380 COc1c(F)cc(cc1F)C(C)N Amb25680029 [0,2,0,0,0,0|1,0,1]=4 6573 B13R1.3380 COc1c(F)cc(cc1F)C(N)=N Amb25806532 [0,2,0,0,0,0|2,0,0]=4 6574 B13R1.3380 COc1c(F)cc(cc1F)N(=O)=O Amb20621054 [0,2,0,0,0,0|2,0,0]=4 6575 B13R1.3380 COc1c(F)cc(cc1F)[C@H](C)N Amb25836332 [0,2,0,0,0,0|1,0,1]=4 6576 B13R1.3380 COc1c(F)cc(cc1F)[N+](=O)[O-] Amb10839911 [0,2,0,0,0,0|2,0,0]=4 6577 B13R1.3380 COc1c(F)cc(cc1I)C(O)=O Amb24410575 [0,2,0,0,0,0|1,0,0]=3 6578 B13R1.3380 COc1c(F)cc(cc1O)C(O)=O Amb24552881 [0,2,0,0,0,0|1,0,0]=3 6579 B13R1.3380 COc1c(F)cc(cc1S)C(O)=O Amb25362928 [0,2,0,0,0,0|1,0,0]=3 6580 B13R1.3380 COc1c(I)cc(cc1I)C(=O)Cl Amb24610883 [0,2,0,0,0,0|1,0,0]=3 6581 B13R1.3380 COc1c(I)cc(cc1I)[N+](=O)[O-] Amb1085983 [0,2,0,0,0,0|2,0,0]=4 6582 B13R1.3380 COc1c(N)cc(cc1F)C(O)=O Amb18288413 [0,2,0,0,0,0|1,0,0]=3 6583 B13R1.3380 COc1c(N)cc(cc1N)C(C)C Amb24452437 [0,2,0,0,0,0|1,0,1]=4 6584 B13R1.3380 COc1c(N)cc(cc1O)C(O)=O Amb18129171 [0,2,0,0,0,0|1,0,0]=3 6585 B13R1.3380 COc1c(O)cc(cc1Cl)[N+]([O-])=O Amb25329887 [0,2,0,0,0,0|2,0,0]=4 6586 B13R1.3380 COc1c(O)cc(cc1F)C(C)C Amb24513964 [0,2,0,0,0,0|1,0,1]=4 6587 B13R1.3380 COc1c(O)cc(cc1F)C(C)F Amb25350886 [0,2,0,0,0,0|1,0,1]=4 6588 B13R1.3380 COc1c(S)cc(cc1O)C(O)=O Amb18653235 [0,2,0,0,0,0|1,0,0]=3 6589 B13R1.3380 CSc1c(F)cc(cc1F)C(O)=O Amb25667862 [0,2,0,0,0,0|1,1,0]=4 6590 B13R1.3380 Cc1cc(cc(Br)c1OC)C(C)=O Amb24596050 [0,2,0,0,0,0|0,0,0]=2 6591 B13R1.3380 Cc1cc(cc(Br)c1OC)C(O)=O Amb24057174 [0,2,0,0,0,0|1,0,0]=3 6592 B13R1.3380 Cc1cc(cc(Br)c1OC)[N+]([O-])=O Amb22371602 [0,2,0,0,0,0|2,0,0]=4 6593 B13R1.3380 Cc1cc(cc(Cl)c1OC)C(C)=O Amb22524654 [0,2,0,0,0,0|0,0,0]=2 6594 B13R1.3380 Cc1cc(cc(F)c1CF)C(C)=O Amb24511320 [0,2,0,0,0,0|2,0,0]=4 6595 B13R1.3380 Cc1cc(cc(F)c1OC)C(C)=O Amb24563630 [0,2,0,0,0,0|0,0,0]=2 6596 B13R1.3380 Cc1cc(cc(F)c1OC)C(O)=O Amb25673800 [0,2,0,0,0,0|1,0,0]=3 6597 B13R1.3380 Cc1cc(cc(F)c1OC)[N+]([O-])=O Amb24628158 [0,2,0,0,0,0|2,0,0]=4 6598 B13R1.3380 Cc1cc(cc(N)c1OC)C(O)=O Amb25212149 [0,2,0,0,0,0|1,0,0]=3 6599 B13R1.3380 Cc1cc(cc(N)c1OC)[N+]([O-])=O Amb24617306 [0,2,0,0,0,0|2,0,0]=4 6600 B13R1.3380 Cc1cc(cc(O)c1OC)C(O)=O Amb25111229 [0,2,0,0,0,0|1,0,0]=3 6601 B13R1.3380 Cc1cc(cc(O)c1OC)[N+]([O-])=O Amb24529426 [0,2,0,0,0,0|2,0,0]=4 6602 B13R1.74 BrCCOc1ccc(cc1)C(O)C Amb17257502 [0,2,0,0,0,0|0,0,2]=4 6603 B13R1.74 C#CCCc1ccc(cc1)C(O)=O Amb18636107 [0,2,0,0,0,0|2,0,0]=4 6604 B13R1.74 C#CCNc1ccc(cc1)C(N)=O Amb18295298 [0,2,0,0,0,0|2,0,0]=4 6605 B13R1.74 C#CCNc1ccc(cc1)C(O)=O Amb18999390 [0,2,0,0,0,0|2,0,0]=4 6606 B13R1.74 C#CCOc1c[n]c(cc1)C(O)=O Amb25043010 [0,2,0,0,0,0|2,0,0]=4 6607 B13R1.74 C#CCOc1ccc(cc1)C(N)=O Amb18808644 [0,2,0,0,0,0|1,0,0]=3 6608 B13R1.74 C#CCOc1ccc(cc1)N(O)=O Amb22053249 [0,2,0,0,0,0|2,0,0]=4 6609 B13R1.74 C#CCSc1ccc(cc1)C(=O)C Amb17482901 [0,2,0,0,0,0|0,1,0]=3 6610 B13R1.74 C=CCNc1ccc(cc1)C(=O)C Amb17305937 [0,2,0,0,0,0|1,0,0]=3 6611 B13R1.74 C=CCNc1ccc(cc1)C(=O)Cl Amb24102910 [0,2,0,0,0,0|2,0,0]=4 6612 B13R1.74 C=CCNc1ccc(cc1)C(=O)N Amb17305831 [0,2,0,0,0,0|2,0,0]=4 6613 B13R1.74 C=CCNc1ccc(cc1)C(=O)O Amb1394961 [0,2,0,0,0,0|2,0,0]=4 6614 B13R1.74 C=CCOc1ccc(cc1)C(N)C Amb17233291 [0,2,0,0,0,0|1,0,1]=4 6615 B13R1.74 C=CCSc1ccc(cc1)C(=O)C Amb17482843 [0,2,0,0,0,0|0,1,0]=3 6616 B13R1.74 CC#CSc1ccc(cc1)C(O)=O Amb24677778 [0,2,0,0,0,0|1,1,0]=4 6617 B13R1.74 CC(=O)c1ccc(CCC=O)cc1 Amb24093036 [0,2,0,0,0,0|1,0,0]=3 6618 B13R1.74 CC(=O)c1ccc(CN=C=O)cc1 Amb25054068 [0,2,0,0,0,0|1,0,1]=4 6619 B13R1.74 CC(=O)c1ccc(COCCl)cc1 Amb22756088 [0,2,0,0,0,0|0,0,0]=2 6620 B13R1.74 CC(=O)c1ccc(C\C=C/C)cc1 Amb25319023 [0,2,0,0,0,0|1,0,0]=3 6621 B13R1.74 CC(=O)c1ccc(C\C=C\C)cc1 Amb24578296 [0,2,0,0,0,0|1,0,0]=3 6622 B13R1.74 CC(=O)c1ccc(\C=C/CO)cc1 Amb25730248 [0,2,0,0,0,0|1,0,0]=3 6623 B13R1.74 CC(=O)c1ccc(\C=C\C=C)cc1 Amb24370157 [0,2,0,0,0,0|1,0,1]=4 6624 B13R1.74 CC(=O)c1ccc(\C=C\C=O)cc1 Amb24594313 [0,2,0,0,0,0|1,0,1]=4 6625 B13R1.74 CC(=O)c1ccc(\C=C\CN)cc1 Amb25765639 [0,2,0,0,0,0|1,0,0]=3 6626 B13R1.74 CC(=O)c1ccc(\C=C\OC)cc1 Amb25093711 [0,2,0,0,0,0|0,0,0]=2 6627 B13R1.74 CC(=O)c1ccc(c[n]1)OCC#C Amb24428841 [0,2,0,0,0,0|1,0,0]=3 6628 B13R1.74 CC(=O)c1ccc(cc1)C#CC=O Amb25695304 [0,2,0,0,0,0|1,0,1]=4 6629 B13R1.74 CC(=O)c1ccc(cc1)C#CCC Amb25730233 [0,2,0,0,0,0|1,0,0]=3 6630 B13R1.74 CC(=O)c1ccc(cc1)N=C=NC Amb25718363 [0,2,0,0,0,0|1,0,0]=3 6631 B13R1.74 CC(=O)c1ccc(cc1)OCCF Amb23579952 [0,2,0,0,0,0|0,0,0]=2 6632 B13R1.74 CC(=O)c1ccc(cc1)\C=C\C#N Amb25094414 [0,2,0,0,0,0|1,0,1]=4 6633 B13R1.74 CC(=O)c1ccc(cc1)\N=C/C=O Amb24523781 [0,2,0,0,0,0|1,0,1]=4 6634 B13R1.74 CC(=O)c1ccc(cc1)\N=C\C=O Amb25370618 [0,2,0,0,0,0|1,0,1]=4 6635 B13R1.74 CC(Br)c1ccc(cc1)OCCF Amb23580146 [0,2,0,0,0,0|1,0,1]=4 6636 B13R1.74 CC(C)c1ccc(cc1)OCC#C Amb18185827 [0,2,0,0,0,0|1,0,1]=4 6637 B13R1.74 CC(N)c1ccc(cc1)OCC#C Amb18289517 [0,2,0,0,0,0|1,0,1]=4 6638 B13R1.74 CC(N)c1ccc(cc1)OCC#N Amb19373013 [0,2,0,0,0,0|1,0,1]=4 6639 B13R1.74 CC(N)c1ccc(cc1)OCCF Amb23580145 [0,2,0,0,0,0|1,0,1]=4 6640 B13R1.74 CC(O)c1ccc(cc1)OCCF Amb23580144 [0,2,0,0,0,0|0,0,2]=4 6641 B13R1.74 CCC#Cc1ccc(cc1)C(O)=O Amb24368657 [0,2,0,0,0,0|2,0,0]=4 6642 B13R1.74 CCCCc1ccc(cc1)C(=O)N Amb1776971 [0,2,0,0,0,0|2,0,0]=4 6643 B13R1.74 CCCCc1ccc(cc1)C(=O)O Amb1218808 [0,2,0,0,0,0|2,0,0]=4 6644 B13R1.74 CCCNc1ccc(cc1)C(=O)Cl Amb24489069 [0,2,0,0,0,0|2,0,0]=4 6645 B13R1.74 CCCNc1ccc(cc1)C(=O)O Amb2372325 [0,2,0,0,0,0|2,0,0]=4 6646 B13R1.74 CCCOc1ccc(c[n]1)C(N)=O Amb23536513 [0,2,0,0,0,0|2,0,0]=4 6647 B13R1.74 CCCOc1ccc(cc1)C(=O)Cl Amb10789020 [0,2,0,0,0,0|1,0,0]=3 6648 B13R1.74 CCCOc1ccc(cc1)C(N)C Amb1114932 [0,2,0,0,0,0|1,0,1]=4 6649 B13R1.74 CCCOc1ccc(cc1)C(N)C Amb13949213 [0,2,0,0,0,0|1,0,1]=4 6650 B13R1.74 CCCOc1ccc(cc1)C(O)C Amb1110745 [0,2,0,0,0,0|0,0,2]=4 6651 B13R1.74 CCCOc1ccc(cc1)S(O)=O Amb18225034 [0,2,0,0,0,0|2,0,0]=4 6652 B13R1.74 CCCOc1ccc(cc1)[N+]([O-])=O Amb17940055 [0,2,0,0,0,0|2,0,0]=4 6653 B13R1.74 CCCSc1ccc(cc1)C(=O)Cl Amb24103023 [0,2,0,0,0,0|1,1,0]=4 6654 B13R1.74 CCCSc1ccc(cc1)C(=O)O Amb1136189 [0,2,0,0,0,0|1,1,0]=4 6655 B13R1.74 CCNCc1ccc(cc1)C(=O)O Amb2119470 [0,2,0,0,0,0|2,0,0]=4 6656 B13R1.74 CCONc1ccc(c[n]1)C(N)=O Amb25332059 [0,2,0,0,0,0|2,0,0]=4 6657 B13R1.74 CN(C)c1ccc(\C=N\OC)cc1 Amb24732878 [0,2,0,0,0,0|2,0,0]=4 6658 B13R1.74 CN/N=C/c1ccc(cc1)C(O)=O Amb17704434 [0,2,0,0,0,0|2,0,0]=4 6659 B13R1.74 CNCCc1ccc(cc1)C(O)=O Amb22728368 [0,2,0,0,0,0|2,0,0]=4 6660 B13R1.74 CN\N=C\c1ccc(cc1)C(N)=O Amb24476357 [0,2,0,0,0,0|2,0,0]=4 6661 B13R1.74 CN\N=N\c1ccc(cc1)C(O)=O Amb25109197 [0,2,0,0,0,0|2,0,0]=4 6662 B13R1.74 COCCc1ccc(cc1)C(=O)C Amb17138855 [0,2,0,0,0,0|0,0,0]=2 6663 B13R1.74 COCCc1ccc(cc1)[N+]([O-])=O Amb21811935 [0,2,0,0,0,0|2,0,0]=4 6664 B13R1.74 COCNc1ccc(cc1)[N+](=O)[O-] Amb10565495 [0,2,0,0,0,0|2,0,0]=4 6665 B13R1.74 COCOc1ccc(c[n]1)C(O)=O Amb24062479 [0,2,0,0,0,0|2,0,0]=4 6666 B13R1.74 COCOc1ccc(cc1)C(O)=O Amb21912445 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.74 COCSc1ccc(cc1)C(O)=O Amb18638274 [0,2,0,0,0,0|1,0,0]=3 6668 B13R1.74 CO\C=C\c1ccc(cc1)C(O)=O Amb24760814 [0,2,0,0,0,0|1,0,0]=3 6669 B13R1.74 CO\N=C\c1ccc(cc1)C(=O)O Amb1107418 [0,2,0,0,0,0|1,0,0]=3 6670 B13R1.74 CO\N=C\c1ccc(cc1)C(C)C Amb24689014 [0,2,0,0,0,0|1,0,1]=4 6671 B13R1.74 CO\N=C\c1ccc(cc1)[N+]([O-])=O Amb25769173 [0,2,0,0,0,0|2,0,0]=4 6672 B13R1.74 CO\N=N/c1ccc(cc1)C(=O)Cl Amb24103284 [0,2,0,0,0,0|1,0,0]=3 6673 B13R1.74 CO\N=N\c1ccc(cc1)C(=O)Cl Amb25201750 [0,2,0,0,0,0|1,0,0]=3 6674 B13R1.74 C[C@@H](O)c1ccc(cc1)OCC#N Amb25063857 [0,2,0,0,0,0|0,0,2]=4 6675 B13R1.74 C[C@H](O)c1ccc(cc1)OCC#N Amb24426903 [0,2,0,0,0,0|0,0,2]=4 6676 B13R1.74 C\C=N\Nc1ccc(cc1)C(O)=O Amb24346703 [0,2,0,0,0,0|2,0,0]=4 6677 B13R1.74 ClCCNc1ccc(cc1)C(=O)C Amb17337251 [0,2,0,0,0,0|1,0,0]=3 6678 B13R1.74 ClCCOc1ccc(cc1)[N+](=O)[O-] Amb2447011 [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.74 N#CCCc1ccc(cc1)C(=O)Cl Amb24102738 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.74 N#CCCc1ccc(cc1)C(O)=O Amb24595399 [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.74 N#CCNc1ccc(cc1)C(=O)O Amb10808385 [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.74 N#CCSc1ccc(cc1)C(=O)C Amb17482845 [0,2,0,0,0,0|0,1,0]=3 6683 B13R1.74 NC(=O)c1ccc(cc1)C#CCN Amb18968602 [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.74 NC(=O)c1ccc(cc1)C#CCO Amb18795563 [0,2,0,0,0,0|2,0,0]=4 6685 B13R1.74 NC(=O)c1ccc(cc1)NCCF Amb25067598 [0,2,0,0,0,0|2,0,0]=4 6686 B13R1.74 NC(=O)c1ccc(cc1)NCCN Amb18304555 [0,2,0,0,0,0|2,0,0]=4 6687 B13R1.74 NC(=O)c1ccc(cc1)OCCF Amb23580151 [0,2,0,0,0,0|1,0,0]=3 6688 B13R1.74 NC(=O)c1ccc(cc1)SCC#N Amb25056548 [0,2,0,0,0,0|1,1,0]=4 6689 B13R1.74 NCCCc1ccc(cc1)C(=O)C Amb17101588 [0,2,0,0,0,0|1,0,0]=3 6690 B13R1.74 NCCNc1ccc(cc1)C(O)=O Amb18186559 [0,2,0,0,0,0|2,0,0]=4 6691 B13R1.74 NCCOc1ccc(c[n]1)C(O)=O Amb23556408 [0,2,0,0,0,0|2,0,0]=4 6692 B13R1.74 NCCOc1ccc(cc1)C(=O)C Amb17233530 [0,2,0,0,0,0|0,0,0]=2 6693 B13R1.74 NCCOc1ccc(cc1)C(C)C Amb1139521 [0,2,0,0,0,0|1,0,1]=4 6694 B13R1.74 NCCOc1ccc(cc1)N(C)C Amb17087594 [0,2,0,0,0,0|2,0,0]=4 6695 B13R1.74 NCCOc1ccc(cc1)[N+](=O)[O-] Amb10068001 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.74 NCCOc1ccc(cc1)[N+](=O)[O-] Amb17335528 [0,2,0,0,0,0|2,0,0]=4 6697 B13R1.74 O=C(Cl)c1ccc(cc1)OCCF Amb23580150 [0,2,0,0,0,0|1,0,0]=3 6698 B13R1.74 O=CCOc1ccc(cc1)[N+](=O)[O-] Amb17099946 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.74 O=N(=O)c1ccc(cc1)OCCBr Amb20620463 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.74 O=N(=O)c1ccc(cc1)OCCCl Amb20620702 [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.74 OC(=O)c1c[n]c(cc1)OCCCl Amb23556379 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.74 OC(=O)c1c[n]c(cc1)OCCF Amb23556443 [0,2,0,0,0,0|2,0,0]=4 6703 B13R1.74 OC(=O)c1ccc(CCC=O)cc1 Amb24093091 [0,2,0,0,0,0|2,0,0]=4 6704 B13R1.74 OC(=O)c1ccc(CCCBr)cc1 Amb18135962 [0,2,0,0,0,0|2,0,0]=4 6705 B13R1.74 OC(=O)c1ccc(cc1)C#CCF Amb25355014 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.74 OC(=O)c1ccc(cc1)NCCCl Amb24106420 [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.74 OC(=O)c1ccc(cc1)OCCF Amb23579954 [0,2,0,0,0,0|1,0,0]=3 6708 B13R1.74 OCCNc1ccc(cc1)C(=O)C Amb17305958 [0,2,0,0,0,0|1,0,0]=3 6709 B13R1.74 OCCNc1ccc(cc1)C(=O)O Amb2372270 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.74 OCCOc1ccc(cc1)C(=O)O Amb2413148 [0,2,0,0,0,0|1,0,0]=3 6711 B13R1.74 OCCSc1ccc(cc1)C(=O)O Amb1201511 [0,2,0,0,0,0|1,1,0]=4 6712 B13R1.74 SCCOc1ccc(cc1)C(C)C Amb17236468 [0,2,0,0,0,0|1,0,1]=4 6713 B13R1.74 [NH3+]CC[NH2+]c1ccc(cc1)C(=O)O Amb2437405 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.74 [O-]N(=O)c1ccc(cc1)OCCO Amb22302817 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.74 [O-][N+](=O)c1ccc(cc1)OCCF Amb21856584 [0,2,0,0,0,0|2,0,0]=4 6716 B13R1.385 CC(=O)c1ccc(cc1Cl)NCC Amb25305857 [0,2,0,0,0,0|1,0,0]=3 6717 B13R1.385 CC(=O)c1ccc(cc1Cl)OCC Amb18057481 [0,2,0,0,0,0|0,0,0]=2 6718 B13R1.385 CC(=O)c1ccc(cc1F)OCC Amb23412325 [0,2,0,0,0,0|0,0,0]=2 6719 B13R1.385 CC(=O)c1ccc(cc1N)SCC Amb25153881 [0,2,0,0,0,0|0,1,0]=3 6720 B13R1.385 CC(Br)c1ccc(cc1Br)OCC Amb24404231 [0,2,0,0,0,0|1,0,1]=4 6721 B13R1.385 CCCc1cc(N)c(cc1)C(O)=O Amb24554219 [0,2,0,0,0,0|2,0,0]=4 6722 B13R1.385 CCNc1cc(Cl)c(cc1)C(O)=O Amb19000434 [0,2,0,0,0,0|2,0,0]=4 6723 B13R1.385 CCNc1cc(F)c(cc1)C(N)=O Amb25345691 [0,2,0,0,0,0|2,0,0]=4 6724 B13R1.385 CCOc1c[n]c(C(O)=O)c(Cl)c1 Amb24601024 [0,2,0,0,0,0|2,0,0]=4 6725 B13R1.385 CCOc1c[n]c(c(N)c1)C(O)=O Amb25064780 [0,2,0,0,0,0|2,0,0]=4 6726 B13R1.385 CCOc1cc(Br)c(cc1)C(C)Cl Amb25845737 [0,2,0,0,0,0|1,0,1]=4 6727 B13R1.385 CCOc1cc(Br)c(cc1)C(N)=S Amb24393260 [0,2,0,0,0,0|1,1,0]=4 6728 B13R1.385 CCOc1cc(Br)c(cc1)C(O)=O Amb25373465 [0,2,0,0,0,0|1,0,0]=3 6729 B13R1.385 CCOc1cc(Br)c(cc1)[C@@H](C)N Amb25154949 [0,2,0,0,0,0|1,0,1]=4 6730 B13R1.385 CCOc1cc(Br)c(cc1)[C@@H](C)O Amb24672934 [0,2,0,0,0,0|0,0,2]=4 6731 B13R1.385 CCOc1cc(Br)c(cc1)[C@H](C)O Amb25097917 [0,2,0,0,0,0|0,0,2]=4 6732 B13R1.385 CCOc1cc(Br)c(cc1)[N+]([O-])=O Amb22755606 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.385 CCOc1cc(Cl)c(cc1)C(C)O Amb18057488 [0,2,0,0,0,0|0,0,2]=4 6734 B13R1.385 CCOc1cc(Cl)c(cc1)C(N)=N Amb18316693 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.385 CCOc1cc(Cl)c(cc1)C(N)=S Amb25851060 [0,2,0,0,0,0|1,1,0]=4 6736 B13R1.385 CCOc1cc(Cl)c(cc1)C(O)=O Amb19000438 [0,2,0,0,0,0|1,0,0]=3 6737 B13R1.385 CCOc1cc(F)c(cc1)C(=O)Cl Amb22738440 [0,2,0,0,0,0|1,0,0]=3 6738 B13R1.385 CCOc1cc(F)c(cc1)C(N)=O Amb22738390 [0,2,0,0,0,0|1,0,0]=3 6739 B13R1.385 CCOc1cc(F)c(cc1)C(O)=O Amb22738434 [0,2,0,0,0,0|1,0,0]=3 6740 B13R1.385 CCOc1cc(F)c(cc1)[C@H](C)O Amb25755300 [0,2,0,0,0,0|0,0,2]=4 6741 B13R1.385 CCOc1cc(I)c(cc1)[C@@H](C)N Amb25040124 [0,2,0,0,0,0|1,0,1]=4 6742 B13R1.385 CCOc1cc(N)c(cc1)C(N)=O Amb25299395 [0,2,0,0,0,0|1,0,0]=3 6743 B13R1.385 CCOc1cc(S)c(cc1)C(N)=O Amb24342309 [0,2,0,0,0,0|1,0,0]=3 6744 B13R1.385 CCOc1ccc(C(O)=O)c(Cl)[n]1 Amb25804698 [0,2,0,0,0,0|2,0,0]=4 6745 B13R1.385 CCOc1ccc(c(Cl)c1)[N+]([O-])=O Amb17906639 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.385 CCOc1ccc(c(c1)F)[N+](=O)[O-] Amb10840052 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.385 CCOc1ccc(c(c1)O)C(=O)C Amb2209361 [0,2,0,0,0,0|0,0,0]=2 6748 B13R1.385 CCSc1cc(Cl)c(cc1)C(O)=O Amb24389300 [0,2,0,0,0,0|1,1,0]=4 6749 B13R1.385 CCSc1cc(I)c(cc1)C(O)=O Amb24364199 [0,2,0,0,0,0|1,1,0]=4 6750 B13R1.385 CCSc1cc(N)c(cc1)C(N)=O Amb25153267 [0,2,0,0,0,0|1,1,0]=4 6751 B13R1.385 CCSc1cc(O)c(cc1)C(O)=O Amb25329600 [0,2,0,0,0,0|1,1,0]=4 6752 B13R1.385 COCc1c[n]c(C(O)=O)c(Cl)c1 Amb25239386 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.385 COCc1ccc(C(N)=O)c(N)[n]1 Amb24658429 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.385 COCc1ccc(C(O)=O)c(Cl)[n]1 Amb24682817 [0,2,0,0,0,0|2,0,0]=4 6755 B13R1.385 COCc1ccc(c(F)c1)[N+]([O-])=O Amb24724202 [0,2,0,0,0,0|2,0,0]=4 6756 B13R1.385 C[C@H](N)c1ccc(cc1N)OCC Amb24435915 [0,2,0,0,0,0|1,0,1]=4 6757 B13R1.385 Cc1[n]c(COC)[n]cc1C(C)=O Amb18184714 [0,2,0,0,0,0|2,0,0]=4 6758 B13R1.385 Cc1[n]c(ccc1C(C)=O)OCC Amb24578713 [0,2,0,0,0,0|1,0,0]=3 6759 B13R1.385 Cc1[n]c(ccc1C(N)=O)OCC Amb25816144 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.385 Cc1[n]c(ccc1C(O)=O)OCC Amb23569400 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.385 Cc1cc(CCC)ccc1C(O)=O Amb25061408 [0,2,0,0,0,0|2,0,0]=4 6762 B13R1.385 Cc1cc([n]cc1C(O)=O)OCC Amb23569379 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.385 Cc1cc(ccc1C(C)C)OCCl Amb25843037 [0,2,0,0,0,0|1,0,1]=4 6764 B13R1.385 Cc1cc(ccc1C(C)O)OCC Amb18055346 [0,2,0,0,0,0|0,0,2]=4 6765 B13R1.385 Cc1cc(ccc1C(N)=N)OCC Amb24489289 [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.385 Cc1cc(ccc1C(N)=O)NCC Amb25853890 [0,2,0,0,0,0|2,0,0]=4 6767 B13R1.385 Cc1cc(ccc1C(N)=S)OCC Amb24390689 [0,2,0,0,0,0|1,1,0]=4 6768 B13R1.385 Cc1cc(ccc1C(O)=O)OCC Amb18554217 [0,2,0,0,0,0|1,0,0]=3 6769 B13R1.385 Cc1cc(ccc1[N+]([O-])=O)OCC Amb24665813 [0,2,0,0,0,0|2,0,0]=4 6770 B13R1.385 Cc1cc(ccc1[N+]([O-])=O)OCCl Amb25076556 [0,2,0,0,0,0|2,0,0]=4 6771 B13R1.385 O=COc1ccc(c(c1)O)C(=O)C Amb1486543 [0,2,0,0,0,0|0,0,1]=3 6772 B13R1.385 Oc1cc(ccc1C(O)=O)NCO Amb25109914 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.385 [O-][N+](=O)c1ccc(cc1F)OCCl Amb24391884 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.99 CC(=C)c1ccc(cc1CO)OC Amb25846194 [0,2,0,0,0,0|1,0,0]=3 6775 B13R1.99 CC(=O)c1[n]cc(CC)cc1OC Amb25705077 [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.99 CC(=O)c1[n]cc([n]c1OC)OC Amb25156445 [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.99 CC(=O)c1[n]cc(cc1OC)OC Amb25324713 [0,2,0,0,0,0|1,0,0]=3 6778 B13R1.99 CC(=O)c1ccc(CC)cc1CC Amb25189824 [0,2,0,0,0,0|1,0,0]=3 6779 B13R1.99 CC(=O)c1ccc([n]c1OC)OC Amb22347827 [0,2,0,0,0,0|1,0,0]=3 6780 B13R1.99 CC(=O)c1ccc(cc1C#N)OC Amb24534708 [0,2,0,0,0,0|0,0,0]=2 6781 B13R1.99 CC(=O)c1ccc(cc1CC)OC Amb18057231 [0,2,0,0,0,0|0,0,0]=2 6782 B13R1.99 CC(=O)c1ccc(cc1SC)SC Amb25683084 [0,2,0,0,0,0|0,1,0]=3 6783 B13R1.99 CCc1[n]c(ccc1C(O)=O)OC Amb25667892 [0,2,0,0,0,0|2,0,0]=4 6784 B13R1.99 CCc1cc(C#N)c(cc1)C(O)=O Amb25140160 [0,2,0,0,0,0|2,0,0]=4 6785 B13R1.99 CCc1cc(NC)c(cc1)C(O)=O Amb24536035 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.99 CCc1cc(OC)c(cc1)C(=O)Cl Amb24091533 [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.99 CCc1cc(ccc1C(C)N)OC Amb18057240 [0,2,0,0,0,0|1,0,1]=4 6788 B13R1.99 CCc1cc(ccc1C(C)O)OC Amb18555947 [0,2,0,0,0,0|0,0,2]=4 6789 B13R1.99 CCc1cc(ccc1C(N)=O)OC Amb18057245 [0,2,0,0,0,0|1,0,0]=3 6790 B13R1.99 CCc1cc(ccc1C(N)=S)OC Amb25304023 [0,2,0,0,0,0|1,1,0]=4 6791 B13R1.99 CCc1cc(ccc1C(O)=O)NC Amb25222877 [0,2,0,0,0,0|2,0,0]=4 6792 B13R1.99 CCc1cc(ccc1C(O)=O)OC Amb18555930 [0,2,0,0,0,0|1,0,0]=3 6793 B13R1.99 CN(C)c1ccc(cc1N=O)OC Amb25350873 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.99 CNc1cc(C#N)c(cc1)C(O)=O Amb25174060 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.99 CNc1cc(OC)c(cc1)C(O)=O Amb25708524 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.99 CNc1cc(OC)ccc1[N+](=O)[O-] Amb10067929 [0,2,0,0,0,0|2,0,0]=4 6797 B13R1.99 CNc1cc(ccc1C(N)=N)OC Amb25308688 [0,2,0,0,0,0|2,0,0]=4 6798 B13R1.99 CNc1cc(ccc1C(N)=O)OC Amb25323921 [0,2,0,0,0,0|1,0,0]=3 6799 B13R1.99 CNc1cc(ccc1C(O)=O)OC Amb24740734 [0,2,0,0,0,0|1,0,0]=3 6800 B13R1.99 COc1c[n]c(C(=O)Cl)c(c1)C#N Amb24528419 [0,2,0,0,0,0|2,0,0]=4 6801 B13R1.99 COc1c[n]c(C(O)=O)c(c1)C#N Amb24564084 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.99 COc1cc(C#N)c(cc1)C(O)=O Amb22169831 [0,2,0,0,0,0|1,0,0]=3 6803 B13R1.99 COc1cc(C#N)c(cc1)[C@@H](C)N Amb24700334 [0,2,0,0,0,0|1,0,1]=4 6804 B13R1.99 COc1cc(C=C)c(cc1)C(O)=O Amb25774516 [0,2,0,0,0,0|1,0,0]=3 6805 B13R1.99 COc1cc(C=O)c(cc1)C(O)=O Amb19661626 [0,2,0,0,0,0|1,0,0]=3 6806 B13R1.99 COc1cc(C=O)c(cc1)N(C)C Amb23401960 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.99 COc1cc(CBr)c(cc1)C(O)=O Amb25797606 [0,2,0,0,0,0|1,0,0]=3 6808 B13R1.99 COc1cc(CBr)c(cc1)[N+]([O-])=O Amb20247182 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.99 COc1cc(CCl)c(cc1)[N+]([O-])=O Amb23401142 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.99 COc1cc(CN)c(cc1)C(C)C Amb24579958 [0,2,0,0,0,0|1,0,1]=4 6811 B13R1.99 COc1cc(CO)c(cc1)C(C)N Amb24659728 [0,2,0,0,0,0|1,0,1]=4 6812 B13R1.99 COc1cc(CO)c(cc1)[N+]([O-])=O Amb22496101 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.99 COc1cc(N#N)c(cc1)C(N)=O Amb22733050 [0,2,0,0,0,0|1,0,0]=3 6814 B13R1.99 COc1cc(NN)c(cc1)C(O)=O Amb24680931 [0,2,0,0,0,0|1,0,0]=3 6815 B13R1.99 COc1cc(NN)c(cc1)[N+]([O-])=O Amb25235111 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.99 COc1cc(OC)ccc1C(=O)C Amb1212539 [0,2,0,0,0,0|0,0,0]=2 6817 B13R1.99 COc1cc(OC)ccc1C(=S)N Amb2370861 [0,2,0,0,0,0|1,1,0]=4 6818 B13R1.99 COc1cc(OC)ccc1C(N)C Amb1107973 [0,2,0,0,0,0|1,0,1]=4 6819 B13R1.99 COc1cc(OC)ccc1S(=O)N Amb2441050 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.99 COc1cc(ON)c(cc1)[N+]([O-])=O Amb25698458 [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.99 COc1cc(SC)c(cc1)C(=O)Cl Amb25245246 [0,2,0,0,0,0|1,0,0]=3 6822 B13R1.99 COc1cc(SC)c(cc1)C(N)=N Amb25180859 [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.99 COc1cc(SC)c(cc1)C(N)=O Amb24070438 [0,2,0,0,0,0|1,0,0]=3 6824 B13R1.99 COc1cc(SC)c(cc1)C(O)=O Amb18130486 [0,2,0,0,0,0|1,0,0]=3 6825 B13R1.99 COc1cc(SC)ccc1C(=O)N Amb1214330 [0,2,0,0,0,0|1,1,0]=4 6826 B13R1.99 COc1cc([N+]#N)c(cc1)C(N)=O Amb22264996 [0,2,0,0,0,0|1,0,0]=3 6827 B13R1.99 COc1cc([N+]#N)c(cc1)C(O)=O Amb24336589 [0,2,0,0,0,0|1,0,0]=3 6828 B13R1.99 COc1cc(ccc1S(=O)Cl)OC Amb18067661 [0,2,0,0,0,0|2,0,0]=4 6829 B13R1.99 COc1cc(ccc1S(O)=O)OC Amb18566483 [0,2,0,0,0,0|2,0,0]=4 6830 B13R1.99 COc1ccc(C(=O)Cl)c([n]1)OC Amb24101827 [0,2,0,0,0,0|2,0,0]=4 6831 B13R1.99 COc1ccc(C(O)=O)c(C#N)[n]1 Amb25287617 [0,2,0,0,0,0|2,0,0]=4 6832 B13R1.99 COc1ccc(C(O)=O)c(C=O)[n]1 Amb24406581 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.99 CSc1cc(C#N)c(cc1)C(O)=O Amb25692928 [0,2,0,0,0,0|1,1,0]=4 6834 B13R1.99 CSc1cc(NN)c(cc1)C(O)=O Amb25253225 [0,2,0,0,0,0|1,1,0]=4 6835 B13R1.99 CSc1cc(ccc1C(O)=O)SC Amb18131838 [0,2,0,0,0,0|1,1,0]=4 6836 B13R1.99 N#Cc1cc(OC)ccc1[N+](=O)[O-] Amb16185721 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.428 CC(=O)C=1C(=O)C=C(CC)NC1C Amb24383094 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.428 CC(=O)c1c(Br)cc(cc1Br)OC Amb23400683 [0,2,0,0,0,0|0,0,0]=2 6839 B13R1.428 CC(=O)c1c(Cl)cc(CBr)cc1Cl Amb25829950 [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.428 CC(=O)c1c(Cl)cc(cc1Cl)SC Amb25777576 [0,2,0,0,0,0|0,1,0]=3 6841 B13R1.428 CC(=O)c1c(F)cc(cc1Cl)OC Amb24727521 [0,2,0,0,0,0|0,0,0]=2 6842 B13R1.428 CC(=O)c1c(F)cc(cc1F)C#N Amb24364294 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.428 CC(=O)c1c(F)cc(cc1F)OC Amb19058334 [0,2,0,0,0,0|0,0,0]=2 6844 B13R1.428 CNc1cc(C)c(C(O)=O)c(C)c1 Amb25189807 [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.428 CNc1cc(O)c(c(F)c1)C(O)=O Amb24452578 [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.428 COc1cc(Br)c(C(N)=O)c(Br)c1 Amb23400757 [0,2,0,0,0,0|1,0,0]=3 6847 B13R1.428 COc1cc(Br)c(C(O)=O)c(Br)c1 Amb23400792 [0,2,0,0,0,0|1,0,0]=3 6848 B13R1.428 COc1cc(C)c(C(N)=O)c(C)c1 Amb18555488 [0,2,0,0,0,0|1,0,0]=3 6849 B13R1.428 COc1cc(C)c(c(C)c1)S(=O)Cl Amb24600921 [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.428 COc1cc(C)c(c(C)c1)[N+]([O-])=O Amb17733825 [0,2,0,0,0,0|2,0,0]=4 6851 B13R1.428 COc1cc(C)c(c(c1)C)C(N)C Amb17194539 [0,2,0,0,0,0|1,0,1]=4 6852 B13R1.428 COc1cc(Cl)c(C(O)=O)c(Cl)c1 Amb24088870 [0,2,0,0,0,0|1,0,0]=3 6853 B13R1.428 COc1cc(Cl)c(c(c1)Cl)[N+](=O)[O-] Amb16186872 [0,2,0,0,0,0|2,0,0]=4 6854 B13R1.428 COc1cc(F)c(C(C)Br)c(F)c1 Amb20622527 [0,2,0,0,0,0|1,0,1]=4 6855 B13R1.428 COc1cc(F)c(C(C)N)c(F)c1 Amb18950628 [0,2,0,0,0,0|1,0,1]=4 6856 B13R1.428 COc1cc(F)c(C(C)O)c(F)c1 Amb19059638 [0,2,0,0,0,0|0,0,2]=4 6857 B13R1.428 COc1cc(F)c(C(N)=N)c(F)c1 Amb25331710 [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.428 COc1cc(F)c(C(N)=S)c(F)c1 Amb24343875 [0,2,0,0,0,0|1,1,0]=4 6859 B13R1.428 COc1cc(F)c(C(O)=O)c(Br)c1 Amb24330613 [0,2,0,0,0,0|1,0,0]=3 6860 B13R1.428 COc1cc(F)c([C@H](C)N)c(F)c1 Amb24496711 [0,2,0,0,0,0|1,0,1]=4 6861 B13R1.428 COc1cc(F)c(c(c1)F)C(=O)Cl Amb10576226 [0,2,0,0,0,0|1,0,0]=3 6862 B13R1.428 COc1cc(F)c(c(c1)F)C(=O)N Amb16186004 [0,2,0,0,0,0|1,0,0]=3 6863 B13R1.428 COc1cc(I)c(c(I)c1)[N+]([O-])=O Amb25253595 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.428 COc1cc(N)c(C(O)=O)c(Br)c1 Amb20242105 [0,2,0,0,0,0|1,0,0]=3 6865 B13R1.428 COc1cc(N)c(C(O)=O)c(F)c1 Amb24489317 [0,2,0,0,0,0|1,0,0]=3 6866 B13R1.428 COc1cc(O)c(C(C)N)c(F)c1 Amb24494275 [0,2,0,0,0,0|1,0,1]=4 6867 B13R1.428 COc1cc(O)c(c(F)c1)C(O)=O Amb24637040 [0,2,0,0,0,0|1,0,0]=3 6868 B13R1.428 COc1cc(O)c(c(c1)O)C(=O)O Amb10843357 [0,2,0,0,0,0|1,0,0]=3 6869 B13R1.428 CSc1cc(F)c(C(O)=O)c(F)c1 Amb24491140 [0,2,0,0,0,0|1,1,0]=4 6870 B13R1.428 Cc1cc(cc(Cl)c1[N+]([O-])=O)OC Amb25287592 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.428 Cc1cc(cc(F)c1C(O)=O)OC Amb25281806 [0,2,0,0,0,0|1,0,0]=3 6872 B13R1.428 Cc1cc(cc(F)c1[N+]([O-])=O)OC Amb24331977 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.428 Cc1cc(cc(N)c1[N+]([O-])=O)OC Amb24707898 [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.428 Cc1cc(cc(O)c1C(C)=O)OC Amb18128620 [0,2,0,0,0,0|0,0,0]=2 6875 B11R1.11 COC(OC)=C1CC(=O)C=C1 Amb24408506 [0,0,1,1,0,0|1,0,1]=4 6876 B11R1.172 CC(=O)C=C=Cc1ccco1 Amb24689517 [0,0,1,1,0,0|0,0,2]=4 6877 B11R1.949 CC=1C=CC=C(OC)C(=O)C1 Amb25028196 [0,0,1,1,0,0|2,0,0]=4 6878 B11R1.226 COC(=O)C1=CC(=C)C(=O)N1 Amb25129516 [0,0,1,1,0,0|2,0,0]=4 6879 B11R1.958 COC=1C=CC(=O)C(O)=CC1 Amb25792979 [0,0,1,1,0,0|1,0,1]=4 6880 B11R1.159 CC(=O)c1cccc(c1C)C Amb17232041 [0,0,1,1,0,0|1,0,1]=4 6881 B11R1.159 CC(=O)c1cccc(c1O)C Amb1489192 [0,0,1,1,0,0|2,0,0]=4 6882 B11R1.159 Cc1cccc(c1Br)C(C)=O Amb22749800 [0,0,1,1,0,0|2,0,0]=4 6883 B11R1.159 Cc1cccc(c1Cl)C(C)=O Amb24439010 [0,0,1,1,0,0|2,0,0]=4 6884 B11R1.159 Cc1cccc(c1F)C(C)=O Amb24055916 [0,0,1,1,0,0|2,0,0]=4 6885 B11R1.159 Cc1cccc(c1N)C(C)=O Amb18124985 [0,0,1,1,0,0|2,0,0]=4 6886 B11R1.706 CC(=O)C=1C=CC=CC=CC1 Amb24424921 [0,0,1,1,0,0|1,0,1]=4 6887 B11R2.190 COc1ccc2CCc2c1 Amb17778865 [1,0,0,1,0,0|0,0,1]=3 6888 B11R2.190 O=Cc1cc2C=Cc2cc1 Amb22167649 [1,0,0,1,0,0|1,0,1]=4 6889 B11R2.34 Cc1ccc(cc1)C2CN2 Amb18861118 [1,0,0,1,0,0|1,0,1]=4 6890 B11R2.34 Cc1ccc(cc1)C2OC2 Amb1131681 [1,0,0,1,0,0|0,0,2]=4 6891 B11R2.34 Cc1ccc(cc1)[C@@H]2CO2 Amb24387280 [1,0,0,1,0,0|0,0,2]=4 6892 B11R2.34 Cc1ccc(cc1)[C@H]2CO2 Amb24478464 [1,0,0,1,0,0|0,0,2]=4 6893 B11R2.34 Oc1ccc(cc1)C2OC2 Amb17090258 [1,0,0,1,0,0|0,0,2]=4 6894 B11R2.34 Oc1ccc(cc1)[C@@H]2CO2 Amb24721771 [1,0,0,1,0,0|0,0,2]=4 6895 B11R2.34 Oc1ccc(cc1)[C@H]2CO2 Amb24478301 [1,0,0,1,0,0|0,0,2]=4 6896 B11R2.363 Cc1ccc2C(=O)Cc2c1 Amb17843959 [1,0,0,1,0,0|0,0,0]=2 6897 B13R2.16 COc1ccc(cc1)C2CC2Cl Amb24724567 [0,0,0,1,0,1|1,0,1]=4 6898 B13R2.16 COc1ccc(cc1)C2CC2N Amb19287253 [0,0,0,1,0,1|1,0,1]=4 6899 B13R2.16 COc1ccc(cc1)C2OC2C Amb1137927 [0,0,0,1,0,1|0,0,2]=4 6900 B13R2.16 COc1ccc(cc1)[C@@H]2C[C@H]2Br Amb25368068 [0,0,0,1,0,1|1,0,1]=4 6901 B13R2.16 COc1ccc(cc1)[C@@H]2C[C@H]2Cl Amb25249115 [0,0,0,1,0,1|1,0,1]=4 6902 B13R2.16 COc1ccc(cc1)[C@@H]2C[C@H]2N Amb24100232 [0,0,0,1,0,1|1,0,1]=4 6903 B13R2.184 COc1ccc(C=C2CC2)cc1 Amb19515481 [0,0,0,1,0,1|1,0,0]=3 6904 B13R2.184 COc1ccc(cc1)NC2CC2 Amb18270129 [0,0,0,1,0,1|1,0,1]=4 6905 B13R2.184 COc1ccc(cc1)OC2CO2 Amb25079251 [0,0,0,1,0,1|0,0,2]=4 6906 B13R2.184 COc1ccc(cc1)O[C@@H]2CO2 Amb25761977 [0,0,0,1,0,1|0,0,2]=4 6907 B13R2.1279 CC(=O)Nc1cc2CCc2cc1 Amb24452151 [0,0,0,1,0,1|1,0,0]=3 6908 B13R2.2121 CCc1c[n]c2NC(=O)Cc2c1 Amb24082552 [0,0,0,1,0,1|2,0,0]=4 6909 B13R2.2121 CCc1cc2CC(=O)Oc2cc1 Amb24071298 [0,0,0,1,0,1|1,0,0]=3 6910 B13R2.2121 CCc1cc2NC(=O)Cc2cc1 Amb25831671 [0,0,0,1,0,1|2,0,0]=4 6911 B13R2.2121 CCc1cc2NC(=O)Nc2cc1 Amb18043066 [0,0,0,1,0,1|2,0,0]=4 6912 B13R2.2121 CCc1cc2NC(=O)Oc2cc1 Amb18036627 [0,0,0,1,0,1|2,0,0]=4 6913 B13R2.2121 CCc1cc2OC(=O)Cc2cc1 Amb24086459 [0,0,0,1,0,1|2,0,0]=4 6914 B13R2.2121 CCc1ccc2c(c1)CC(=O)N2 Amb17138521 [0,0,0,1,0,1|1,0,0]=3 6915 B13R2.2121 CCc1ccc2c(c1)[nH]c(n2)C Amb17506443 [0,0,0,1,0,1|2,0,0]=4 6916 B13R2.2121 CCc1ccc2c(c1)nc(o2)C Amb17570045 [0,0,0,1,0,1|2,0,0]=4 6917 B13R2.2121 CNc1cc2CC(=O)Nc2cc1 Amb18563549 [0,0,0,1,0,1|1,0,0]=3 6918 B13R2.2121 CNc1cc2NC(=O)Nc2cc1 Amb18949263 [0,0,0,1,0,1|2,0,0]=4 6919 B13R2.2121 CNc1ccc2CC(=O)Nc2c1 Amb25223813 [0,0,0,1,0,1|2,0,0]=4 6920 B13R2.2121 CNc1ccc2OC(=O)Nc2c1 Amb18281000 [0,0,0,1,0,1|2,0,0]=4 6921 B13R2.2121 COC1=CC2=CC(=O)N=C2C=C1 Amb25231753 [0,0,0,1,0,1|0,0,1]=3 6922 B13R2.2121 COC1=CC2=NC(=O)C=C2C=C1 Amb24738615 [0,0,0,1,0,1|1,0,0]=3 6923 B13R2.2121 COc1c[n]c2CC(=O)Nc2c1 Amb24329806 [0,0,0,1,0,1|2,0,0]=4 6924 B13R2.2121 COc1c[n]c2NC(=O)Cc2c1 Amb23402834 [0,0,0,1,0,1|1,0,0]=3 6925 B13R2.2121 COc1cc2CC(=O)Nc2c[n]1 Amb23437333 [0,0,0,1,0,1|1,0,0]=3 6926 B13R2.2121 COc1cc2CC(=O)Oc2cc1 Amb24100543 [0,0,0,1,0,1|0,0,0]=2 6927 B13R2.2121 COc1cc2CC(=O)Sc2cc1 Amb20242264 [0,0,0,1,0,1|0,0,0]=2 6928 B13R2.2121 COc1cc2CC(N)Cc2cc1 Amb21927476 [0,0,0,1,0,1|1,0,1]=4 6929 B13R2.2121 COc1cc2CC(N)Cc2cc1 Amb22584175 [0,0,0,1,0,1|1,0,1]=4 6930 B13R2.2121 COc1cc2CC(O)Cc2cc1 Amb25795512 [0,0,0,1,0,1|0,0,2]=4 6931 B13R2.2121 COc1cc2CN(C)Cc2cc1 Amb25851509 [0,0,0,1,0,1|2,0,0]=4 6932 B13R2.2121 COc1cc2NC(=O)Nc2cc1 Amb18043078 [0,0,0,1,0,1|1,0,0]=3 6933 B13R2.2121 COc1cc2NC(=O)Oc2cc1 Amb18043103 [0,0,0,1,0,1|1,0,0]=3 6934 B13R2.2121 COc1cc2NC(=O)Sc2cc1 Amb21857280 [0,0,0,1,0,1|1,0,0]=3 6935 B13R2.2121 COc1cc2NC(=S)Nc2cc1 Amb18043088 [0,0,0,1,0,1|1,1,0]=4 6936 B13R2.2121 COc1cc2NC(=S)Oc2cc1 Amb22001516 [0,0,0,1,0,1|1,1,0]=4 6937 B13R2.2121 COc1cc2NC(C)Cc2cc1 Amb18559938 [0,0,0,1,0,1|1,0,1]=4 6938 B13R2.2121 COc1cc2N[C@H](C)Cc2cc1 Amb25720988 [0,0,0,1,0,1|1,0,1]=4 6939 B13R2.2121 COc1cc2SC(=O)Cc2cc1 Amb25256268 [0,0,0,1,0,1|1,0,0]=3 6940 B13R2.2121 COc1cc2SC(=O)Nc2cc1 Amb19957540 [0,0,0,1,0,1|1,0,0]=3 6941 B13R2.2121 COc1cc2SC(=S)Nc2cc1 Amb18043611 [0,0,0,1,0,1|1,1,0]=4 6942 B13R2.2121 COc1cc2SC(=S)Sc2cc1 Amb25155667 [0,0,0,1,0,1|1,1,0]=4 6943 B13R2.2121 COc1cc2[nH]c(Br)[n]c2cc1 Amb25674143 [0,0,0,1,0,1|2,0,0]=4 6944 B13R2.2121 COc1cc2[nH]c(Cl)cc2cc1 Amb25125358 [0,0,0,1,0,1|2,0,0]=4 6945 B13R2.2121 COc1cc2[nH]c(I)cc2cc1 Amb25721116 [0,0,0,1,0,1|2,0,0]=4 6946 B13R2.2121 COc1cc2[nH]c(N)cc2cc1 Amb25152595 [0,0,0,1,0,1|2,0,0]=4 6947 B13R2.2121 COc1cc2[n][n](C)cc2cc1 Amb24105470 [0,0,0,1,0,1|2,0,0]=4 6948 B13R2.2121 COc1cc2[n]c(Cl)oc2cc1 Amb21856785 [0,0,0,1,0,1|2,0,0]=4 6949 B13R2.2121 COc1cc2[n]c(F)[nH]c2cc1 Amb24564880 [0,0,0,1,0,1|2,0,0]=4 6950 B13R2.2121 COc1cc2[n]c(F)[s]c2cc1 Amb24589652 [0,0,0,1,0,1|2,0,0]=4 6951 B13R2.2121 COc1cc2[n]c(I)[s]c2cc1 Amb21857284 [0,0,0,1,0,1|2,0,0]=4 6952 B13R2.2121 COc1cc2[n]c(N)[nH]c2cc1 Amb22491219 [0,0,0,1,0,1|2,0,0]=4 6953 B13R2.2121 COc1cc2[n]c([SH3])oc2cc1 Amb18547342 [0,0,0,1,0,1|1,1,0]=4 6954 B13R2.2121 COc1cc2[s]c(Cl)cc2cc1 Amb24679510 [0,0,0,1,0,1|1,1,0]=4 6955 B13R2.2121 COc1cc2[s]c(F)[n]c2cc1 Amb23437200 [0,0,0,1,0,1|1,1,0]=4 6956 B13R2.2121 COc1cc2[s]c(I)[n]c2cc1 Amb23401252 [0,0,0,1,0,1|1,1,0]=4 6957 B13R2.2121 COc1cc2[s]c(I)cc2cc1 Amb24093070 [0,0,0,1,0,1|1,1,0]=4 6958 B13R2.2121 COc1cc2[s]c(N)cc2cc1 Amb24089421 [0,0,0,1,0,1|1,1,0]=4 6959 B13R2.2121 COc1cc2c[n](C)[n]c2cc1 Amb24379437 [0,0,0,1,0,1|2,0,0]=4 6960 B13R2.2121 COc1cc2cc(Br)[nH]c2cc1 Amb25726397 [0,0,0,1,0,1|1,0,1]=4 6961 B13R2.2121 COc1cc2cc(Br)[s]c2cc1 Amb22756199 [0,0,0,1,0,1|1,0,1]=4 6962 B13R2.2121 COc1cc2cc(I)[nH]c2cc1 Amb24067555 [0,0,0,1,0,1|1,0,1]=4 6963 B13R2.2121 COc1ccc2CC(=O)Nc2[n]1 Amb23402855 [0,0,0,1,0,1|2,0,0]=4 6964 B13R2.2121 COc1ccc2NC(=O)Oc2c1 Amb18046732 [0,0,0,1,0,1|1,0,0]=3 6965 B13R2.2121 COc1ccc2NC(=O)Sc2[n]1 Amb25215783 [0,0,0,1,0,1|2,0,0]=4 6966 B13R2.2121 COc1ccc2OC(=O)Sc2c1 Amb20001514 [0,0,0,1,0,1|1,0,0]=3 6967 B13R2.2121 COc1ccc2OC(C)Cc2c1 Amb17670241 [0,0,0,1,0,1|1,0,1]=4 6968 B13R2.2121 COc1ccc2[n]c(Br)oc2c1 Amb25311738 [0,0,0,1,0,1|1,0,1]=4 6969 B13R2.2121 COc1ccc2[n]c(N)oc2c1 Amb22371620 [0,0,0,1,0,1|1,0,1]=4 6970 B13R2.2121 COc1ccc2c(c1)CC(=O)C2 Amb15692717 [0,0,0,1,0,1|0,0,0]=2 6971 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 Amb2237085 [0,0,0,1,0,1|0,0,0]=2 6972 B13R2.2121 COc1ccc2c(c1)CC(N2)C Amb17232428 [0,0,0,1,0,1|1,0,1]=4 6973 B13R2.2121 COc1ccc2c(c1)OC(=O)C2 Amb13884835 [0,0,0,1,0,1|1,0,0]=3 6974 B13R2.2121 COc1ccc2c(c1)nc([nH]2)C Amb10068726 [0,0,0,1,0,1|1,0,0]=3 6975 B13R2.2121 COc1ccc2c(c1)nc([nH]2)O Amb17615490 [0,0,0,1,0,1|1,0,1]=4 6976 B13R2.2121 COc1ccc2c(c1)nc(o2)N Amb17570095 [0,0,0,1,0,1|2,0,0]=4 6977 B13R2.2121 COc1ccc2c(c1)nc(o2)S Amb17570374 [0,0,0,1,0,1|1,1,0]=4 6978 B13R2.2121 COc1ccc2c(c1)nc(s2)Br Amb10602020 [0,0,0,1,0,1|2,0,0]=4 6979 B13R2.2121 COc1ccc2oc(C)cc2c1 Amb17741496 [0,0,0,1,0,1|1,0,0]=3 6980 B13R2.2121 COc1cnc2c(c1)cc([nH]2)C Amb13884991 [0,0,0,1,0,1|2,0,0]=4 6981 B13R2.2121 CSc1cc2CC(=O)Nc2cc1 Amb25700833 [0,0,0,1,0,1|0,1,0]=3 6982 B13R2.2121 CSc1cc2OC(=O)Nc2cc1 Amb24619461 [0,0,0,1,0,1|1,1,0]=4 6983 B13R2.2121 Cc1[nH]c2[n]c(ccc2[n]1)OC Amb24078859 [0,0,0,1,0,1|2,0,0]=4 6984 B13R2.2121 Cc1[nH]c2ccc(cc2[n]1)NC Amb18949277 [0,0,0,1,0,1|2,0,0]=4 6985 B13R2.2121 Cc1[nH]c2ccc(cc2[n]1)NC Amb20634230 [0,0,0,1,0,1|2,0,0]=4 6986 B13R2.2121 Cc1[nH]c2ccc(cc2[n]1)OC Amb21961680 [0,0,0,1,0,1|1,0,0]=3 6987 B13R2.2121 Cc1[n]c2cc(CC)ccc2[s]1 Amb25275679 [0,0,0,1,0,1|2,0,0]=4 6988 B13R2.2121 Cc1[n]c2cc(ccc2[s]1)NC Amb24089296 [0,0,0,1,0,1|2,0,0]=4 6989 B13R2.2121 Cc1[n]c2cc(ccc2[s]1)SC Amb22395129 [0,0,0,1,0,1|1,1,0]=4 6990 B13R2.2121 Cc1[n]c2cc(ccc2o1)NC Amb18949262 [0,0,0,1,0,1|2,0,0]=4 6991 B13R2.2121 Cc1[n]c2ccc(CC)cc2[s]1 Amb24091649 [0,0,0,1,0,1|1,1,0]=4 6992 B13R2.2121 Cc1[n]c2ccc(CC)cc2o1 Amb25268613 [0,0,0,1,0,1|1,0,1]=4 6993 B13R2.2121 Cc1[n]c2ccc(cc2[s]1)NC Amb18949264 [0,0,0,1,0,1|1,1,0]=4 6994 B13R2.2121 Cc1[n]c2ccc(cc2o1)SC Amb25351898 [0,0,0,1,0,1|0,1,1]=4 6995 B13R2.2121 Cc1c[n]2cc(ccc2[n]1)OC Amb24095512 [0,0,0,1,0,1|2,0,0]=4 6996 B13R2.2121 Cc1c[n]2ccc(cc2[n]1)OC Amb22728375 [0,0,0,1,0,1|2,0,0]=4 6997 B13R2.2121 Cc1cc2[n]c(ccc2[nH]1)OC Amb24330696 [0,0,0,1,0,1|2,0,0]=4 6998 B13R2.2121 Cc1cc2[n]cc(cc2[nH]1)OC Amb24329785 [0,0,0,1,0,1|2,0,0]=4 6999 B13R2.2121 Cc1cc2c[n]c(cc2[nH]1)OC Amb24329968 [0,0,0,1,0,1|2,0,0]=4 7000 B13R2.2121 Cc1cc2cc(CC)ccc2[nH]1 Amb18563277 [0,0,0,1,0,1|2,0,0]=4 7001 B13R2.2121 Cc1cc2cc(CC)ccc2o1 Amb24071319 [0,0,0,1,0,1|2,0,0]=4 7002 B13R2.2121 Cc1cc2cc([n]cc2[nH]1)OC Amb21927985 [0,0,0,1,0,1|2,0,0]=4 7003 B13R2.2121 Cc1cc2cc(ccc2[nH]1)NC Amb25837333 [0,0,0,1,0,1|2,0,0]=4 7004 B13R2.2121 Cc1cc2cc(ccc2[nH]1)SC Amb25290318 [0,0,0,1,0,1|1,1,0]=4 7005 B13R2.2121 Cc1cc2cc(ccc2[s]1)OC Amb22276758 [0,0,0,1,0,1|1,0,0]=3 7006 B13R2.2121 Cc1cc2ccc([n]c2[nH]1)OC Amb24725198 [0,0,0,1,0,1|2,0,0]=4 7007 B13R2.2121 Cc1cc2ccc(cc2[nH]1)OC Amb18563281 [0,0,0,1,0,1|1,0,0]=3 7008 B13R2.2121 Cc1cc2ccc(cc2[s]1)OC Amb25293954 [0,0,0,1,0,1|0,1,0]=3 7009 B13R2.2121 Cc1cc2ccc(cc2o1)OC Amb21962997 [0,0,0,1,0,1|0,0,1]=3 7010 B13R2.2121 N#Cc1cc2CC(=O)Cc2cc1 Amb22585858 [0,0,0,1,0,1|2,0,0]=4 7011 B13R2.2121 NCc1cc2CC(=O)Cc2cc1 Amb24438624 [0,0,0,1,0,1|2,0,0]=4 7012 B13R2.2121 NCc1ccc2c(c1)CC(=O)N2 Amb13951774 [0,0,0,1,0,1|2,0,0]=4 7013 B13R2.2121 NNc1cc2CC(=O)Nc2cc1 Amb18893473 [0,0,0,1,0,1|2,0,0]=4 7014 B13R2.2121 O=C1Cc2cc(CBr)ccc2N1 Amb24728035 [0,0,0,1,0,1|2,0,0]=4 7015 B13R2.2121 O=C1Cc2cc(CCl)ccc2O1 Amb25783951 [0,0,0,1,0,1|2,0,0]=4 7016 B13R2.2121 O=C1Cc2cc(ccc2N1)C=O Amb18563511 [0,0,0,1,0,1|2,0,0]=4 7017 B13R2.2121 O=C1Cc2cc(ccc2O1)C=O Amb24727269 [0,0,0,1,0,1|2,0,0]=4 7018 B13R2.2121 OCc1cc2CC(=O)Nc2cc1 Amb18862569 [0,0,0,1,0,1|2,0,0]=4 7019 B13R2.93 COc1cc2CC(CN)c2cc1 Amb25270642 [0,1,0,1,0,0|1,0,1]=4 7020 B13R2.93 COc1ccc2C(Cc2c1)C#N Amb17844035 [0,1,0,1,0,0|1,0,1]=4 7021 B13R2.185 COc1ccc([n]c1)C=2CCC2 Amb24416612 [0,1,0,1,0,0|2,0,0]=4 7022 B13R2.185 COc1ccc(cc1)C2CCN2 Amb21959304 [0,1,0,1,0,0|1,0,1]=4 7023 B13R2.185 COc1ccc(cc1)C2CCS2 Amb25225577 [0,1,0,1,0,0|0,1,1]=4 7024 B13R2.185 COc1ccc(cc1)C2CNC2 Amb18563582 [0,1,0,1,0,0|1,0,1]=4 7025 B13R2.186 COc1ccc(cc1)C2(C)CC2 Amb24064719 [0,1,0,1,0,0|1,0,1]=4 7026 B13R2.186 COc1ccc(cc1)C2(C)CN2 Amb18862588 [0,1,0,1,0,0|1,0,1]=4 7027 B13R2.186 COc1ccc(cc1)C2(C)OC2 Amb17089390 [0,1,0,1,0,0|0,0,2]=4 7028 B13R2.186 COc1ccc(cc1)C2(N)CC2 Amb19515005 [0,1,0,1,0,0|1,0,1]=4 7029 B13R2.186 COc1ccc(cc1)C2(O)CC2 Amb18798286 [0,1,0,1,0,0|0,0,2]=4 7030 B13R2.1139 COC(=O)c1cc2C=Cc2cc1 Amb25756959 [0,1,0,1,0,0|1,0,1]=4 7031 B13R2.2112 COc1cc2c(cc1)C(=O)C2=O Amb21948305 [0,1,0,1,0,0|0,0,1]=3 7032 B13R2.2130 C#Cc1cc2CCC(=O)c2cc1 Amb19944517 [0,1,0,1,0,0|1,0,1]=4 7033 B13R2.2130 C#Cc1cc2COC(=O)c2cc1 Amb19944519 [0,1,0,1,0,0|1,0,1]=4 7034 B13R2.2130 C=Cc1cc2CCC(=O)c2cc1 Amb25781430 [0,1,0,1,0,0|1,0,1]=4 7035 B13R2.2130 CCc1cc2CCC(=O)c2cc1 Amb21856202 [0,1,0,1,0,0|1,0,0]=3 7036 B13R2.2130 CCc1ccc2c(CNC2=O)[n]1 Amb25243158 [0,1,0,1,0,0|2,0,0]=4 7037 B13R2.2130 COC1=CC2=NC[N+]([O-])=C2C=C1 Amb25114723 [0,1,0,1,0,0|1,0,1]=4 7038 B13R2.2130 COc1[n]cc2C(=O)NCc2[n]1 Amb25174111 [0,1,0,1,0,0|2,0,0]=4 7039 B13R2.2130 COc1c[n]c2C(=O)NCc2c1 Amb24083628 [0,1,0,1,0,0|1,0,0]=3 7040 B13R2.2130 COc1cc2C=CC(=O)c2cc1 Amb21962796 [0,1,0,1,0,0|0,0,1]=3 7041 B13R2.2130 COc1cc2C=NC(=O)c2cc1 Amb22015142 [0,1,0,1,0,0|0,0,1]=3 7042 B13R2.2130 COc1cc2CCC(=O)c2c[n]1 Amb25056693 [0,1,0,1,0,0|1,0,0]=3 7043 B13R2.2130 COc1cc2CCC(F)c2cc1 Amb24653080 [0,1,0,1,0,0|1,0,1]=4 7044 B13R2.2130 COc1cc2CCC(N)c2cc1 Amb18645893 [0,1,0,1,0,0|1,0,1]=4 7045 B13R2.2130 COc1cc2CCC(N)c2cc1 Amb23399558 [0,1,0,1,0,0|1,0,1]=4 7046 B13R2.2130 COc1cc2CCC(O)c2cc1 Amb25843292 [0,1,0,1,0,0|0,0,2]=4 7047 B13R2.2130 COc1cc2CC[C@@H](O)c2cc1 Amb25121499 [0,1,0,1,0,0|0,0,2]=4 7048 B13R2.2130 COc1cc2CC[C@H](O)c2cc1 Amb24484124 [0,1,0,1,0,0|0,0,2]=4 7049 B13R2.2130 COc1cc2CN=C(N)c2cc1 Amb24627274 [0,1,0,1,0,0|1,0,0]=3 7050 B13R2.2130 COc1cc2CNC(C)c2cc1 Amb24543702 [0,1,0,1,0,0|1,0,1]=4 7051 B13R2.2130 COc1cc2CN[C@H](C)c2cc1 Amb25342252 [0,1,0,1,0,0|1,0,1]=4 7052 B13R2.2130 COc1cc2N=CC(=O)c2cc1 Amb24087322 [0,1,0,1,0,0|0,0,1]=3 7053 B13R2.2130 COc1cc2NCC(C)c2cc1 Amb18063190 [0,1,0,1,0,0|1,0,1]=4 7054 B13R2.2130 COc1cc2OCC(=C)c2cc1 Amb25757129 [0,1,0,1,0,0|1,0,0]=3 7055 B13R2.2130 COc1cc2SCC(=O)c2cc1 Amb18824508 [0,1,0,1,0,0|0,0,0]=2 7056 B13R2.2130 COc1cc2[nH][n]c(Br)c2cc1 Amb21964763 [0,1,0,1,0,0|2,0,0]=4 7057 B13R2.2130 COc1cc2[nH]cc(Br)c2cc1 Amb25755457 [0,1,0,1,0,0|1,0,1]=4 7058 B13R2.2130 COc1cc2[nH]cc(N)c2cc1 Amb18829737 [0,1,0,1,0,0|1,0,1]=4 7059 B13R2.2130 COc1cc2[nH]cc(O)c2cc1 Amb24067433 [0,1,0,1,0,0|0,0,2]=4 7060 B13R2.2130 COc1cc2[s][n]c(Cl)c2cc1 Amb25154078 [0,1,0,1,0,0|1,1,0]=4 7061 B13R2.2130 COc1cc2[s][n]c(N)c2cc1 Amb25139608 [0,1,0,1,0,0|1,1,0]=4 7062 B13R2.2130 COc1cc2[s]cc(Br)c2cc1 Amb24638314 [0,1,0,1,0,0|1,0,1]=4 7063 B13R2.2130 COc1cc2[s]cc(Cl)c2cc1 Amb25060114 [0,1,0,1,0,0|1,0,1]=4 7064 B13R2.2130 COc1cc2[s]cc(N)c2cc1 Amb23403649 [0,1,0,1,0,0|1,0,1]=4 7065 B13R2.2130 COc1cc2o[n]c(Cl)c2cc1 Amb25697012 [0,1,0,1,0,0|1,0,1]=4 7066 B13R2.2130 COc1cc2o[n]c(N)c2cc1 Amb22263918 [0,1,0,1,0,0|1,0,1]=4 7067 B13R2.2130 COc1cc2occ(Br)c2cc1 Amb25089747 [0,1,0,1,0,0|1,0,1]=4 7068 B13R2.2130 COc1cc2occ(O)c2cc1 Amb24061892 [0,1,0,1,0,0|0,0,2]=4 7069 B13R2.2130 COc1ccc2C(=O)CCc2[n]1 Amb21964782 [0,1,0,1,0,0|1,0,0]=3 7070 B13R2.2130 COc1ccc2C(=O)NCc2[n]1 Amb24083430 [0,1,0,1,0,0|1,0,0]=3 7071 B13R2.2130 COc1ccc2C(=O)NCc2c1 Amb17942829 [0,1,0,1,0,0|0,0,0]=2 7072 B13R2.2130 COc1ccc2C(N)COc2c1 Amb18646281 [0,1,0,1,0,0|1,0,1]=4 7073 B13R2.2130 COc1ccc2C(O)COc2c1 Amb20623798 [0,1,0,1,0,0|0,0,2]=4 7074 B13R2.2130 COc1ccc2[C@@H](N)COc2c1 Amb25148610 [0,1,0,1,0,0|1,0,1]=4 7075 B13R2.2130 COc1ccc2[C@H](N)COc2c1 Amb24737615 [0,1,0,1,0,0|1,0,1]=4 7076 B13R2.2130 COc1ccc2c(N)o[n]c2c1 Amb25791615 [0,1,0,1,0,0|1,0,1]=4 7077 B13R2.2130 COc1ccc2c(c1)OCC2=O Amb2499974 [0,1,0,1,0,0|0,0,0]=2 7078 B13R2.2130 COc1ccc2c(c1)[nH]nc2C Amb15692188 [0,1,0,1,0,0|1,0,0]=3 7079 B13R2.2130 COc1ccc2c(c1)[nH]nc2I Amb10602321 [0,1,0,1,0,0|2,0,0]=4 7080 B13R2.2130 COc1ccc2c(c1)n[nH]c2I Amb15692180 [0,1,0,1,0,0|2,0,0]=4 7081 B13R2.2130 Cc1[n][nH]c2cc(c[n]c12)OC Amb25149814 [0,1,0,1,0,0|2,0,0]=4 7082 B13R2.2130 Cc1[n]oc2cc(CC)ccc12 Amb24696930 [0,1,0,1,0,0|1,0,1]=4 7083 B13R2.2130 Cc1[n]oc2cc(ccc12)OC Amb22802465 [0,1,0,1,0,0|0,0,1]=3 7084 B13R2.2130 Cc1c[nH]c2cc(ccc12)OC Amb18893453 [0,1,0,1,0,0|1,0,0]=3 7085 B13R2.2130 Cc1coc2cc(CC)ccc12 Amb24091654 [0,1,0,1,0,0|1,0,1]=4 7086 B13R2.2130 Cc1coc2cc(ccc12)OC Amb22757474 [0,1,0,1,0,0|0,0,1]=3 7087 B13R2.2130 N#Cc1cc2CNC(=O)c2cc1 Amb20171555 [0,1,0,1,0,0|2,0,0]=4 7088 B13R2.2130 N#Cc1cc2OCC(=O)c2cc1 Amb25335402 [0,1,0,1,0,0|2,0,0]=4 7089 B13R2.2130 N#Cc1ccc2c(c1)CCC2=O Amb10602515 [0,1,0,1,0,0|2,0,0]=4 7090 B13R2.2130 NCc1cc2CCC(=O)c2cc1 Amb24764118 [0,1,0,1,0,0|2,0,0]=4 7091 B13R2.2130 NCc1cc2CNC(=O)c2cc1 Amb25797635 [0,1,0,1,0,0|2,0,0]=4 7092 B13R2.2130 NCc1cc2COC(=O)c2cc1 Amb24683989 [0,1,0,1,0,0|2,0,0]=4 7093 B13R2.2130 NNc1cc2COC(=O)c2cc1 Amb24739027 [0,1,0,1,0,0|2,0,0]=4 7094 B13R2.2130 O=C1CCc2cc(CBr)ccc21 Amb24615781 [0,1,0,1,0,0|2,0,0]=4 7095 B13R2.2130 O=C1CCc2cc(ccc12)C=O Amb22494852 [0,1,0,1,0,0|2,0,0]=4 7096 B13R2.2130 O=C1COc2cc(CBr)ccc21 Amb24461300 [0,1,0,1,0,0|2,0,0]=4 7097 B13R2.2130 O=C1NCc2cc(ccc12)C=O Amb21963174 [0,1,0,1,0,0|2,0,0]=4 7098 B13R2.2130 OCc1cc2CNC(=O)c2cc1 Amb22008616 [0,1,0,1,0,0|2,0,0]=4 7099 B13R2.2130 OCc1cc2COC(=O)c2cc1 Amb22229986 [0,1,0,1,0,0|2,0,0]=4 7100 B13R2.2130 OCc1cc2OCC(=O)c2cc1 Amb25678282 [0,1,0,1,0,0|2,0,0]=4 7101 B13R2.97 [2H]C1(O)Cc2cc(OC)ccc12 Amb17778678 [0,1,0,1,0,0|0,0,2]=4 7102 B13R2.430 CC(=C)c1cc2ccoc2cc1 Amb24460889 [0,1,0,1,0,0|1,0,1]=4 7103 B13R2.430 CC(=C)c1ccc2CCNc2c1 Amb25705238 [0,1,0,1,0,0|2,0,0]=4 7104 B13R2.430 CC(=O)c1cc2CCOc2c[n]1 Amb24636991 [0,1,0,1,0,0|1,0,0]=3 7105 B13R2.430 CC(=O)c1cc2CCSc2cc1 Amb18824832 [0,1,0,1,0,0|0,1,0]=3 7106 B13R2.430 CC(=O)c1cc2CNCc2cc1 Amb22227654 [0,1,0,1,0,0|1,0,0]=3 7107 B13R2.430 CC(=O)c1cc2COCc2cc1 Amb18798090 [0,1,0,1,0,0|0,0,0]=2 7108 B13R2.430 CC(=O)c1cc2[nH][n][n]c2cc1 Amb25767706 [0,1,0,1,0,0|2,0,0]=4 7109 B13R2.430 CC(=O)c1cc2[n]c[s]c2cc1 Amb18243694 [0,1,0,1,0,0|0,1,1]=4 7110 B13R2.430 CC(=O)c1cc2[n]o[n]c2cc1 Amb23402230 [0,1,0,1,0,0|1,0,0]=3 7111 B13R2.430 CC(=O)c1cc2[s]c[n]c2cc1 Amb21857859 [0,1,0,1,0,0|1,0,1]=4 7112 B13R2.430 CC(=O)c1cc2[s]ccc2cc1 Amb24095171 [0,1,0,1,0,0|1,0,1]=4 7113 B13R2.430 CC(=O)c1cc2ccoc2[n]c1 Amb25667073 [0,1,0,1,0,0|1,0,1]=4 7114 B13R2.430 CC(=O)c1cc2ccoc2c[n]1 Amb22490558 [0,1,0,1,0,0|1,0,1]=4 7115 B13R2.430 CC(=O)c1cc2ccoc2cc1 Amb18830288 [0,1,0,1,0,0|0,0,1]=3 7116 B13R2.430 CC(=O)c1cc2oc[n]c2cc1 Amb18830116 [0,1,0,1,0,0|1,0,1]=4 7117 B13R2.430 CC(=O)c1cc2occc2cc1 Amb23401817 [0,1,0,1,0,0|1,0,1]=4 7118 B13R2.430 CC(=O)c1ccc2C=CCc2c1 Amb25128945 [0,1,0,1,0,0|1,0,0]=3 7119 B13R2.430 CC(=O)c1ccc2CCNc2c1 Amb18829947 [0,1,0,1,0,0|1,0,0]=3 7120 B13R2.430 CC(=O)c1ccc2OCCc2[n]1 Amb23455394 [0,1,0,1,0,0|1,0,0]=3 7121 B13R2.430 CC(=O)c1ccc2c(c1)CCC2 Amb1657672 [0,1,0,1,0,0|1,0,0]=3 7122 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 Amb1680104 [0,1,0,1,0,0|0,0,0]=2 7123 B13R2.430 CC(=O)c1ccc2c(c1)CNC2 Amb17480538 [0,1,0,1,0,0|1,0,0]=3 7124 B13R2.430 CC(=O)c1ccc2c(c1)[nH]nc2 Amb10070463 [0,1,0,1,0,0|2,0,0]=4 7125 B13R2.430 CC(=O)c1ccc2c(c1)ccs2 Amb16232253 [0,1,0,1,0,0|0,1,1]=4 7126 B13R2.430 CC(=O)c1ccc2c(c1)cn[nH]2 Amb10070462 [0,1,0,1,0,0|1,0,1]=4 7127 B13R2.430 CC(=O)c1ccc2c(c1)nc[nH]2 Amb17202070 [0,1,0,1,0,0|1,0,1]=4 7128 B13R2.430 CC(=O)c1ccc2c(c1)nco2 Amb17319977 [0,1,0,1,0,0|0,0,1]=3 7129 B13R2.430 CC(=S)c1cc2OCOc2cc1 Amb24720829 [0,1,0,1,0,0|0,1,0]=3 7130 B13R2.430 CC(Cl)c1cc2CCOc2cc1 Amb19057043 [0,1,0,1,0,0|1,0,1]=4 7131 B13R2.430 CC(Cl)c1cc2COCc2cc1 Amb19045143 [0,1,0,1,0,0|1,0,1]=4 7132 B13R2.430 CC(N)c1cc2COCc2cc1 Amb18280879 [0,1,0,1,0,0|1,0,1]=4 7133 B13R2.430 CC(O)c1cc2COCc2cc1 Amb18788276 [0,1,0,1,0,0|0,0,2]=4 7134 B13R2.430 CC(c1ccc2c(c1)CCO2)N Amb1108948 [0,1,0,1,0,0|1,0,1]=4 7135 B13R2.430 CC(c1ccc2c(c1)OCO2)N Amb1108031 [0,1,0,1,0,0|1,0,1]=4 7136 B13R2.430 CN(c1ccc2c(c1)OCO2)C Amb15772457 [0,1,0,1,0,0|2,0,0]=4 7137 B13R2.430 CS(=O)c1cc2ccoc2cc1 Amb25313201 [0,1,0,1,0,0|1,0,1]=4 7138 B13R2.430 C[C@@H](N)c1cc2CCOc2cc1 Amb22746901 [0,1,0,1,0,0|1,0,1]=4 7139 B13R2.430 C[C@H](N)c1cc2CCOc2cc1 Amb25034594 [0,1,0,1,0,0|1,0,1]=4 7140 B13R2.430 C[C@H](c1ccc2c(c1)CCO2)N Amb16233828 [0,1,0,1,0,0|1,0,1]=4 7141 B13R2.430 NC(=O)c1c[n]c2OCOc2c1 Amb25700364 [0,1,0,1,0,0|2,0,0]=4 7142 B13R2.430 NC(=O)c1cc2CCNc2cc1 Amb20669540 [0,1,0,1,0,0|2,0,0]=4 7143 B13R2.430 NC(=O)c1cc2CNCc2cc1 Amb22230773 [0,1,0,1,0,0|2,0,0]=4 7144 B13R2.430 NC(=O)c1cc2COCc2cc1 Amb25724633 [0,1,0,1,0,0|1,0,0]=3 7145 B13R2.430 NC(=O)c1cc2OCOc2c[n]1 Amb25837412 [0,1,0,1,0,0|2,0,0]=4 7146 B13R2.430 NC(=O)c1cc2[n]o[n]c2cc1 Amb23402234 [0,1,0,1,0,0|2,0,0]=4 7147 B13R2.430 NC(=O)c1cc2ccoc2cc1 Amb23401830 [0,1,0,1,0,0|1,0,1]=4 7148 B13R2.430 NC(=O)c1ccc2CCNc2c1 Amb22736752 [0,1,0,1,0,0|2,0,0]=4 7149 B13R2.430 NC(=O)c1ccc2CCOc2c1 Amb23399917 [0,1,0,1,0,0|2,0,0]=4 7150 B13R2.430 O=C(Cl)c1cc2CNCc2cc1 Amb24753900 [0,1,0,1,0,0|2,0,0]=4 7151 B13R2.430 O=C(Cl)c1cc2[n]coc2cc1 Amb24089335 [0,1,0,1,0,0|1,0,1]=4 7152 B13R2.430 O=C(Cl)c1ccc2CCOc2c1 Amb24101537 [0,1,0,1,0,0|2,0,0]=4 7153 B13R2.430 O=S(Cl)c1cc2OCOc2cc1 Amb18567170 [0,1,0,1,0,0|2,0,0]=4 7154 B13R2.430 OC(=O)c1c[n]c2OCOc2c1 Amb18827404 [0,1,0,1,0,0|2,0,0]=4 7155 B13R2.430 OC(=O)c1cc2CCOc2c[n]1 Amb24101554 [0,1,0,1,0,0|2,0,0]=4 7156 B13R2.430 OC(=O)c1cc2CNCc2cc1 Amb19514871 [0,1,0,1,0,0|2,0,0]=4 7157 B13R2.430 OC(=O)c1cc2CNCc2cc1 Amb20241434 [0,1,0,1,0,0|2,0,0]=4 7158 B13R2.430 OC(=O)c1cc2COCc2[n]c1 Amb24415023 [0,1,0,1,0,0|2,0,0]=4 7159 B13R2.430 OC(=O)c1cc2NCNc2cc1 Amb24088911 [0,1,0,1,0,0|2,0,0]=4 7160 B13R2.430 OC(=O)c1cc2OCOc2c[n]1 Amb24060671 [0,1,0,1,0,0|2,0,0]=4 7161 B13R2.430 OC(=O)c1cc2SCOc2c[n]1 Amb24591264 [0,1,0,1,0,0|2,0,0]=4 7162 B13R2.430 OC(=O)c1cc2[n][n]oc2cc1 Amb24425657 [0,1,0,1,0,0|2,0,0]=4 7163 B13R2.430 OC(=O)c1cc2[n]occ2cc1 Amb25178269 [0,1,0,1,0,0|2,0,0]=4 7164 B13R2.430 OC(=O)c1cc2co[n]c2cc1 Amb25159751 [0,1,0,1,0,0|1,0,1]=4 7165 B13R2.430 OC(=O)c1ccc2CCNc2c1 Amb22756227 [0,1,0,1,0,0|2,0,0]=4 7166 B13R2.430 OC(=O)c1ccc2OCCc2[n]1 Amb24346611 [0,1,0,1,0,0|2,0,0]=4 7167 B13R2.430 OC(=O)c1ccc2OCOc2[n]1 Amb18827396 [0,1,0,1,0,0|2,0,0]=4 7168 B13R2.430 OC(=O)c1ccc2c(c1)CCC2 Amb1091099 [0,1,0,1,0,0|2,0,0]=4 7169 B13R2.430 OC(=O)c1ccc2c(c1)CCN2 Amb1223232 [0,1,0,1,0,0|2,0,0]=4 7170 B13R2.430 OC(=O)c1ccc2c(c1)CNC2 Amb10067687 [0,1,0,1,0,0|2,0,0]=4 7171 B13R2.430 OC(=O)c1ccc2c(c1)COC2 Amb13951734 [0,1,0,1,0,0|1,0,0]=3 7172 B13R2.430 OC(=O)c1ccc2c(c1)OCC2 Amb10602522 [0,1,0,1,0,0|2,0,0]=4 7173 B13R2.430 OC(=O)c1ccc2c(c1)OCN2 Amb17621777 [0,1,0,1,0,0|2,0,0]=4 7174 B13R2.430 OC(=O)c1ccc2c(c1)OCO2 Amb2542764 [0,1,0,1,0,0|1,0,0]=3 7175 B13R2.430 OC(=O)c1ccc2c(c1)non2 Amb1087899 [0,1,0,1,0,0|2,0,0]=4 7176 B13R2.430 OS(=O)c1cc2OCOc2cc1 Amb18066175 [0,1,0,1,0,0|2,0,0]=4 7177 B13R2.430 [O-]C(=O)c1cc2OCOc2cc1 Amb24309015 [0,1,0,1,0,0|1,0,0]=3 7178 B13R2.430 [O-]S(=O)c1cc2OCOc2cc1 Amb25677807 [0,1,0,1,0,0|2,0,0]=4 7179 B13R2.430 [O-][N+](=O)c1cc2CCOc2cc1 Amb22498102 [0,1,0,1,0,0|2,0,0]=4 7180 B13R2.430 [O-][N+](=O)c1ccc2c(c1)OCO2 Amb1950845 [0,1,0,1,0,0|2,0,0]=4 7181 B13R2.1590 COc1cc2CC(=O)c2cc1C Amb17778714 [0,1,0,1,0,0|0,0,0]=2 7182 B13R2.1590 COc1cc2CC(Cl)c2cc1C Amb17844042 [0,1,0,1,0,0|1,0,1]=4 7183 B13R2.2131 COc1ccc2C(=O)Cc2c1C Amb17843964 [0,1,0,1,0,0|0,0,0]=2 7184 B13R2.2396 COc1ccc(cc1Br)C2CC2 Amb20617883 [0,1,0,1,0,0|1,0,1]=4 7185 B13R2.2396 COc1ccc(cc1Br)C2CN2 Amb18227530 [0,1,0,1,0,0|1,0,1]=4 7186 B13R2.2396 COc1ccc(cc1Br)C2OC2 Amb17248415 [0,1,0,1,0,0|0,0,2]=4 7187 B13R2.2396 COc1ccc(cc1C)C2OC2 Amb17232467 [0,1,0,1,0,0|0,0,2]=4 7188 B13R2.2396 COc1ccc(cc1Cl)C2CC2 Amb24321149 [0,1,0,1,0,0|1,0,1]=4 7189 B13R2.2396 COc1ccc(cc1Cl)C2CN2 Amb18863071 [0,1,0,1,0,0|1,0,1]=4 7190 B13R2.2396 COc1ccc(cc1Cl)C2OC2 Amb17234144 [0,1,0,1,0,0|0,0,2]=4 7191 B13R2.2396 COc1ccc(cc1F)C2CN2 Amb18862707 [0,1,0,1,0,0|1,0,1]=4 7192 B13R2.2396 COc1ccc(cc1F)[C@@H]2CO2 Amb24455950 [0,1,0,1,0,0|0,0,2]=4 7193 B13R2.2396 COc1ccc(cc1F)[C@H]2CO2 Amb24684248 [0,1,0,1,0,0|0,0,2]=4 7194 B13R2.2396 COc1ccc(cc1N)C2CC2 Amb18962039 [0,1,0,1,0,0|1,0,1]=4 7195 B13R2.2396 COc1ccc(cc1O)C2OC2 Amb17090257 [0,1,0,1,0,0|0,0,2]=4 7196 B13R2.2396 Cc1cc(ccc1OC)C2CN2 Amb18862589 [0,1,0,1,0,0|1,0,1]=4 7197 B13R2.4687 [O-][N+](=O)c1ccc2C(=O)Cc2c1 Amb17778719 [0,1,0,1,0,0|2,0,0]=4 7198 B13R2.60 CCOc1ccc(cc1)C2CC2 Amb22494698 [0,1,0,1,0,0|1,0,1]=4 7199 B13R2.60 CCOc1ccc(cc1)C2CN2 Amb18862584 [0,1,0,1,0,0|1,0,1]=4 7200 B13R2.60 CCOc1ccc(cc1)C2OC2 Amb1138261 [0,1,0,1,0,0|0,0,2]=4 7201 B13R2.428 CC(=O)c1c[n]c(cc1)C2CC2 Amb25829048 [0,1,0,1,0,0|2,0,0]=4 7202 B13R2.428 CC(=O)c1ccc(c[n]1)C2CC2 Amb22236241 [0,1,0,1,0,0|2,0,0]=4 7203 B13R2.428 CC(=O)c1ccc(cc1)C2CO2 Amb25857957 [0,1,0,1,0,0|0,0,0]=2 7204 B13R2.428 CN(c1ccc(cc1)C2OC2)C Amb17090252 [0,1,0,1,0,0|2,0,0]=4 7205 B13R2.428 OC(=O)c1ccc(cc1)C2CC2 Amb1821871 [0,1,0,1,0,0|2,0,0]=4 7206 B13R2.428 OC(=O)c1ccc(cc1)C2OC2 Amb17621425 [0,1,0,1,0,0|1,0,0]=3 7207 B13R2.428 [O-][N+](=O)c1ccc(cc1)C2OC2 Amb1147662 [0,1,0,1,0,0|2,0,0]=4 7208 B13R2.428 [O-][N+](=O)c1ccc(cc1)[C@H]2OC2 Amb16185466 [0,1,0,1,0,0|2,0,0]=4 7209 B13R2.2170 COc1cc(Br)c(cc1)C2CC2 Amb20617897 [0,1,0,1,0,0|1,0,1]=4 7210 B13R2.2170 COc1cc(Cl)c(cc1)C2CC2 Amb24321164 [0,1,0,1,0,0|1,0,1]=4 7211 B13R2.2170 COc1cc(Cl)c(cc1)C2CN2 Amb18863073 [0,1,0,1,0,0|1,0,1]=4 7212 B13R2.2170 COc1ccc(C2CO2)c(Cl)c1 Amb18564309 [0,1,0,1,0,0|0,0,2]=4 7213 B13R2.6688 Cc1cc(cc2CC(=O)c12)OC Amb21948275 [0,1,0,1,0,0|0,0,0]=2 7214 B9R0.43 CC(=O)\C=C\C(\CC)=C\Cl Amb24602488 [0,0,1,0,1,0|2,0,0]=4 7215 B9R0.42 CC(=O)C(=C)CC(=O)OC Amb24378956 [0,0,1,0,1,0|1,0,1]=4 7216 B9R0.42 CC(=O)C(C)=CC(=O)OC Amb20668358 [0,0,1,0,1,0|1,0,1]=4 7217 B9R0.42 CC(=O)\C(\C)=C/C(=O)OC Amb25106945 [0,0,1,0,1,0|1,0,1]=4 7218 B9R0.42 CC(=O)\C(\C)=C\C(=O)OC Amb24545647 [0,0,1,0,1,0|1,0,1]=4 7219 B9R1.21 CC[n]1cc(C=O)cc1 Amb24417132 [1,0,0,0,1,0|2,0,0]=4 7220 B9R1.21 CC[n]1cc(cc1)OC Amb24386702 [1,0,0,0,1,0|1,0,1]=4 7221 B9R1.21 CCc1cc(C=O)[nH]c1 Amb21971277 [1,0,0,0,1,0|2,0,0]=4 7222 B9R1.21 CCc1cc(C=O)[s]c1 Amb24694630 [1,0,0,0,1,0|2,0,0]=4 7223 B9R1.21 CCc1cc(C=O)c[nH]1 Amb18142592 [1,0,0,0,1,0|2,0,0]=4 7224 B9R1.21 CCc1cc(C=O)c[s]1 Amb18643619 [1,0,0,0,1,0|2,0,0]=4 7225 B9R1.21 CCc1cc(C=O)co1 Amb18678528 [1,0,0,0,1,0|2,0,0]=4 7226 B9R1.21 CCc1cc(C=O)oc1 Amb18673932 [1,0,0,0,1,0|2,0,0]=4 7227 B9R1.21 CCc1ccc(OC)[s]1 Amb25380674 [1,0,0,0,1,0|1,0,1]=4 7228 B9R1.21 CCc1ccc([nH]1)C=O Amb17593257 [1,0,0,0,1,0|2,0,0]=4 7229 B9R1.21 COc1[nH]cc(C=O)[n]1 Amb25075970 [1,0,0,0,1,0|2,0,0]=4 7230 B9R1.21 COc1[n]c(C=O)c[s]1 Amb24099740 [1,0,0,0,1,0|2,0,0]=4 7231 B9R1.21 COc1c[s]c(C=O)c1 Amb18202589 [1,0,0,0,1,0|1,0,0]=3 7232 B9R1.21 COc1cc(C=O)c[nH]1 Amb18832857 [1,0,0,0,1,0|1,0,0]=3 7233 B9R1.21 COc1cc(C=O)c[s]1 Amb18643873 [1,0,0,0,1,0|1,0,0]=3 7234 B9R1.21 COc1cc(C=O)o[n]1 Amb24331446 [1,0,0,0,1,0|2,0,0]=4 7235 B9R1.21 COc1ccc(C=O)[nH]1 Amb18832853 [1,0,0,0,1,0|1,0,0]=3 7236 B9R1.21 COc1ccc(C=O)o1 Amb18832781 [1,0,0,0,1,0|1,0,0]=3 7237 B9R1.21 COc1ccc(CC)o1 Amb25229999 [1,0,0,0,1,0|1,0,1]=4 7238 B9R1.21 COc1ccc(N=O)[s]1 Amb24759285 [1,0,0,0,1,0|2,0,0]=4 7239 B9R1.21 COc1ccc(o1)OC Amb22295890 [1,0,0,0,1,0|2,0,0]=4 7240 B9R1.21 COc1ccc(s1)C=O Amb17593592 [1,0,0,0,1,0|1,0,0]=3 7241 B9R1.21 COc1coc(c1)C=O Amb18832782 [1,0,0,0,1,0|1,0,0]=3 7242 B9R1.21 CSc1cc(OC)[s]c1 Amb24741946 [1,0,0,0,1,0|2,0,0]=4 7243 B9R1.21 CSc1cc(c[s]1)C=O Amb18680675 [1,0,0,0,1,0|1,1,0]=4 7244 B9R1.21 CSc1cc(c[s]1)OC Amb25253688 [1,0,0,0,1,0|2,0,0]=4 7245 B9R1.21 CSc1ccc(C=O)[nH]1 Amb18124598 [1,0,0,0,1,0|1,1,0]=4 7246 B9R1.21 CSc1ccc(C=O)o1 Amb18643872 [1,0,0,0,1,0|1,1,0]=4 7247 B9R1.21 CSc1coc(C=O)c1 Amb25072714 [1,0,0,0,1,0|1,1,0]=4 7248 B9R1.35 Brc1scc(c1)C(=O)C Amb10603337 [1,0,0,0,1,0|2,0,0]=4 7249 B9R1.35 CC(=C)c1c[n](C)cc1 Amb22229334 [1,0,0,0,1,0|2,0,0]=4 7250 B9R1.35 CC(=O)[n]1cc(N)cc1 Amb24482008 [1,0,0,0,1,0|2,0,0]=4 7251 B9R1.35 CC(=O)c1c[n](C)c[n]1 Amb23399836 [1,0,0,0,1,0|2,0,0]=4 7252 B9R1.35 CC(=O)c1c[n](O)[n]c1 Amb25188907 [1,0,0,0,1,0|2,0,0]=4 7253 B9R1.35 CC(=O)c1c[s]c(F)c1 Amb18202409 [1,0,0,0,1,0|2,0,0]=4 7254 B9R1.35 CC(=O)c1c[s]c(I)c1 Amb25785696 [1,0,0,0,1,0|2,0,0]=4 7255 B9R1.35 CC(=O)c1c[s]c(O)[n]1 Amb25243684 [1,0,0,0,1,0|2,0,0]=4 7256 B9R1.35 CC(=O)c1cc(Br)co1 Amb25780956 [1,0,0,0,1,0|2,0,0]=4 7257 B9R1.35 CC(=O)c1cc(F)c[s]1 Amb18831508 [1,0,0,0,1,0|2,0,0]=4 7258 B9R1.35 CC(=O)c1cc(I)c[nH]1 Amb22498099 [1,0,0,0,1,0|2,0,0]=4 7259 B9R1.35 CC(=O)c1cc(I)c[s]1 Amb22751276 [1,0,0,0,1,0|2,0,0]=4 7260 B9R1.35 CC(=O)c1cc(N)c[nH]1 Amb18142624 [1,0,0,0,1,0|2,0,0]=4 7261 B9R1.35 CC(=O)c1cc(N)c[s]1 Amb18678229 [1,0,0,0,1,0|2,0,0]=4 7262 B9R1.35 CC(=O)c1cc(O)o[n]1 Amb25174380 [1,0,0,0,1,0|2,0,0]=4 7263 B9R1.35 CC(=O)c1cc(c[nH]1)Cl Amb10601713 [1,0,0,0,1,0|2,0,0]=4 7264 B9R1.35 CC(=O)c1cc(cs1)Br Amb1946493 [1,0,0,0,1,0|2,0,0]=4 7265 B9R1.35 CC(=O)c1ccc(Br)o1 Amb18678443 [1,0,0,0,1,0|2,0,0]=4 7266 B9R1.35 CC(=O)c1ccc(Cl)[nH]1 Amb24383198 [1,0,0,0,1,0|2,0,0]=4 7267 B9R1.35 CC(=O)c1ccc(Cl)o1 Amb24476595 [1,0,0,0,1,0|2,0,0]=4 7268 B9R1.35 CC(=O)c1ccc(F)[s]1 Amb18831509 [1,0,0,0,1,0|2,0,0]=4 7269 B9R1.35 CC(=O)c1ccc(F)o1 Amb24569531 [1,0,0,0,1,0|2,0,0]=4 7270 B9R1.35 CC(=O)c1ccc(I)[s]1 Amb19886673 [1,0,0,0,1,0|2,0,0]=4 7271 B9R1.35 CC(=O)c1ccc(I)o1 Amb24678169 [1,0,0,0,1,0|2,0,0]=4 7272 B9R1.35 CC(=O)c1ccc(N)o1 Amb18642262 [1,0,0,0,1,0|2,0,0]=4 7273 B9R1.35 CC(=O)c1ccc(S)[s]1 Amb25706073 [1,0,0,0,1,0|1,1,0]=4 7274 B9R1.35 CC(=O)c1ccc(S)o1 Amb25376412 [1,0,0,0,1,0|1,1,0]=4 7275 B9R1.35 CC(=O)c1ccc([nH]1)Br Amb10601714 [1,0,0,0,1,0|2,0,0]=4 7276 B9R1.35 CC(=O)c1ccc([nH]1)C Amb17593258 [1,0,0,0,1,0|1,0,0]=3 7277 B9R1.35 CC(=O)c1ccc([nH]1)I Amb10601715 [1,0,0,0,1,0|2,0,0]=4 7278 B9R1.35 CC(=O)c1ccc(s1)Br Amb1151096 [1,0,0,0,1,0|2,0,0]=4 7279 B9R1.35 CC(=O)c1ccc(s1)Cl Amb1148733 [1,0,0,0,1,0|2,0,0]=4 7280 B9R1.35 CC(=O)c1ccc(s1)N Amb17477841 [1,0,0,0,1,0|2,0,0]=4 7281 B9R1.35 CC(=O)c1cnc([nH]1)C Amb17593272 [1,0,0,0,1,0|2,0,0]=4 7282 B9R1.35 CC(=O)c1csc([nH+]1)C Amb2410562 [1,0,0,0,1,0|2,0,0]=4 7283 B9R1.35 CC(=S)c1c[n](C)cc1 Amb25801284 [1,0,0,0,1,0|1,1,0]=4 7284 B9R1.35 CC(C)=C1C=C(C)C=C1 Amb24399879 [1,0,0,0,1,0|1,0,0]=3 7285 B9R1.35 C[n]1cc(cc1)C(=O)Cl Amb25222626 [1,0,0,0,1,0|2,0,0]=4 7286 B9R1.35 C[n]1cc(cc1)C(N)=O Amb18243390 [1,0,0,0,1,0|2,0,0]=4 7287 B9R1.35 Cc1[n]c(c[s]1)C(C)=O Amb20622917 [1,0,0,0,1,0|2,0,0]=4 7288 B9R1.35 Cc1[n]c(co1)C(C)=O Amb18832850 [1,0,0,0,1,0|2,0,0]=4 7289 B9R1.35 Cc1[n]cc([s]1)C(C)=O Amb19882144 [1,0,0,0,1,0|2,0,0]=4 7290 B9R1.35 Cc1[n]cc(o1)C(C)=O Amb23437343 [1,0,0,0,1,0|2,0,0]=4 7291 B9R1.35 Cc1c[nH]c(n1)C(=O)C Amb15701563 [1,0,0,0,1,0|2,0,0]=4 7292 B9R1.35 Cc1c[n](c[n]1)C(C)=O Amb25137790 [1,0,0,0,1,0|2,0,0]=4 7293 B9R1.35 Cc1c[n]c([s]1)C(C)=O Amb18831720 [1,0,0,0,1,0|2,0,0]=4 7294 B9R1.35 Cc1c[n]c(o1)C(C)=O Amb18832862 [1,0,0,0,1,0|2,0,0]=4 7295 B9R1.35 Cc1c[s]c([n]1)C(C)=O Amb22347859 [1,0,0,0,1,0|2,0,0]=4 7296 B9R1.35 Cc1cc([nH][n]1)C(C)=O Amb18832906 [1,0,0,0,1,0|2,0,0]=4 7297 B9R1.35 Cc1cc([nH]c1)C(N)=O Amb24476641 [1,0,0,0,1,0|2,0,0]=4 7298 B9R1.35 Cc1cc([n][s]1)C(C)=O Amb18831706 [1,0,0,0,1,0|2,0,0]=4 7299 B9R1.35 Cc1cc([n]o1)C(C)=O Amb21964495 [1,0,0,0,1,0|2,0,0]=4 7300 B9R1.35 Cc1cc([s][n]1)C(C)=O Amb18831719 [1,0,0,0,1,0|2,0,0]=4 7301 B9R1.35 Cc1cc(c[s]1)C(C)=C Amb24632078 [1,0,0,0,1,0|2,0,0]=4 7302 B9R1.35 Cc1cc(c[s]1)C(C)=O Amb22494674 [1,0,0,0,1,0|1,0,0]=3 7303 B9R1.35 Cc1cc(c[s]1)C(N)=O Amb25700357 [1,0,0,0,1,0|2,0,0]=4 7304 B9R1.35 Cc1cc(c[s]1)C(O)=O Amb17659438 [1,0,0,0,1,0|2,0,0]=4 7305 B9R1.35 Cc1cc(co1)C(=O)Cl Amb25742363 [1,0,0,0,1,0|2,0,0]=4 7306 B9R1.35 Cc1cc(co1)C(N)=O Amb23589835 [1,0,0,0,1,0|2,0,0]=4 7307 B9R1.35 Cc1cc(o[n]1)C(C)=O Amb18672024 [1,0,0,0,1,0|2,0,0]=4 7308 B9R1.35 Cc1cc(oc1)C(O)=O Amb18642368 [1,0,0,0,1,0|2,0,0]=4 7309 B9R1.35 Cc1ccc([nH]1)C(N)=O Amb25277435 [1,0,0,0,1,0|2,0,0]=4 7310 B9R1.35 Cc1ccc([s]1)C(C)=C Amb24478627 [1,0,0,0,1,0|2,0,0]=4 7311 B9R1.35 Cc1ccc(o1)C(=O)C Amb1154368 [1,0,0,0,1,0|1,0,0]=3 7312 B9R1.35 Cc1ccc(o1)C(C)=C Amb24716757 [1,0,0,0,1,0|2,0,0]=4 7313 B9R1.35 Cc1ccc(s1)C(=O)C Amb1153736 [1,0,0,0,1,0|1,0,0]=3 7314 B9R1.35 Cc1ccc(s1)C(=O)O Amb1157149 [1,0,0,0,1,0|2,0,0]=4 7315 B9R1.35 Cc1coc([n]1)C(C)=O Amb21963773 [1,0,0,0,1,0|2,0,0]=4 7316 B9R1.35 Cc1occ(c1)C(=O)O Amb16231454 [1,0,0,0,1,0|2,0,0]=4 7317 B9R1.35 Cc1scc(c1)C(=O)Cl Amb16230125 [1,0,0,0,1,0|2,0,0]=4 7318 B9R1.35 Cn1ccc(c1)C(=O)O Amb10603441 [1,0,0,0,1,0|2,0,0]=4 7319 B9R1.35 Cn1ccc(n1)C(=O)C Amb1946513 [1,0,0,0,1,0|2,0,0]=4 7320 B9R1.35 Cn1ncc(c1)C(=O)C Amb1945443 [1,0,0,0,1,0|2,0,0]=4 7321 B9R1.35 Oc1c[nH]c(c1)C(O)=O Amb24649356 [1,0,0,0,1,0|2,0,0]=4 7322 B9R1.35 Oc1ccc(o1)C(O)=O Amb18946939 [1,0,0,0,1,0|2,0,0]=4 7323 B11R1.20 CC(=Cc1ccc(cc1)O)C Amb1333686 [1,0,0,0,0,1|1,0,0]=3 7324 B11R1.20 CC(=N)Nc1ccc(Cl)cc1 Amb24477671 [1,0,0,0,0,1|2,0,0]=4 7325 B11R1.20 CC(=O)CN1C=CC(=O)C=C1 Amb18787428 [1,0,0,0,0,1|1,0,1]=4 7326 B11R1.20 CC(=O)C[n+]1ccc(cc1)C Amb10573522 [1,0,0,0,0,1|1,0,0]=3 7327 B11R1.20 CC(=O)Cc1ccc(Cl)c[n]1 Amb23437495 [1,0,0,0,0,1|2,0,0]=4 7328 B11R1.20 CC(=O)Cc1ccc(F)[n]c1 Amb25733918 [1,0,0,0,0,1|2,0,0]=4 7329 B11R1.20 CC(=O)Cc1ccc(N)[n]c1 Amb18201937 [1,0,0,0,0,1|2,0,0]=4 7330 B11R1.20 CC(=O)Cc1ccc(cn1)C Amb10607335 [1,0,0,0,0,1|1,0,0]=3 7331 B11R1.20 CC(=O)Cc1ccc(nc1)Cl Amb10976126 [1,0,0,0,0,1|2,0,0]=4 7332 B11R1.20 CC(=O)NC1C=CC(=O)C=C1 Amb25695875 [1,0,0,0,0,1|0,0,2]=4 7333 B11R1.20 CC(=O)N[13c]1[13cH][13cH][13c]([13cH][13cH]1)Cl Amb17610795 [1,0,0,0,0,1|1,0,0]=3 7334 B11R1.20 CC(=O)Nc1cc[n+](cc1)[O-] Amb10552789 [1,0,0,0,0,1|1,0,1]=4 7335 B11R1.20 CC(=O)Nc1ccc(Cl)[n]c1 Amb24121741 [1,0,0,0,0,1|2,0,0]=4 7336 B11R1.20 CC(=O)Nc1ccc(F)[n]c1 Amb24486081 [1,0,0,0,0,1|2,0,0]=4 7337 B11R1.20 CC(=O)Nc1ccc(N)[n]c1 Amb18949287 [1,0,0,0,0,1|2,0,0]=4 7338 B11R1.20 CC(=O)Nc1ccc(O)[n]c1 Amb22752688 [1,0,0,0,0,1|1,0,0]=3 7339 B11R1.20 CC(=O)Nc1ccc(O)c[n]1 Amb22002364 [1,0,0,0,0,1|1,0,0]=3 7340 B11R1.20 CC(=O)Nc1ccc([NH3+])cc1 Amb24113861 [1,0,0,0,0,1|1,0,0]=3 7341 B11R1.20 CC(=O)Nc1ccc(cc1)N Amb1208563 [1,0,0,0,0,1|1,0,0]=3 7342 B11R1.20 CC(=O)Nc1ccc(cc1)O Amb1209347 [1,0,0,0,0,1|0,0,0]=2 7343 B11R1.20 CC(=O)Nc1ccc(cn1)Cl Amb1808922 [1,0,0,0,0,1|2,0,0]=4 7344 B11R1.20 CC(=O)Nc1ccc(cn1)I Amb2054963 [1,0,0,0,0,1|2,0,0]=4 7345 B11R1.20 CC(=O)Nc1ccc(nc1)Br Amb10071320 [1,0,0,0,0,1|2,0,0]=4 7346 B11R1.20 CC(=O)Nc1ccc(nc1)I Amb10608890 [1,0,0,0,0,1|2,0,0]=4 7347 B11R1.20 CC(=O)Nc1ccc(nc1)S Amb10569732 [1,0,0,0,0,1|1,1,0]=4 7348 B11R1.20 CC(=O)Oc1ccc(Br)[n]c1 Amb20617838 [1,0,0,0,0,1|2,0,0]=4 7349 B11R1.20 CC(=O)Oc1ccc(Br)c[n]1 Amb25149038 [1,0,0,0,0,1|2,0,0]=4 7350 B11R1.20 CC(=O)Oc1ccc(F)[n]c1 Amb25689698 [1,0,0,0,0,1|2,0,0]=4 7351 B11R1.20 CC(=O)Oc1ccc(I)cc1 Amb25330825 [1,0,0,0,0,1|1,0,0]=3 7352 B11R1.20 CC(=O)Oc1ccc(N)cc1 Amb18125232 [1,0,0,0,0,1|1,0,0]=3 7353 B11R1.20 CC(=O)Oc1ccc(cc1)O Amb10843589 [1,0,0,0,0,1|0,0,0]=2 7354 B11R1.20 CC(=O)Oc1ccc(cc1)[*] Amb22045256 [1,0,0,0,0,1|1,0,0]=3 7355 B11R1.20 CC(=O)Sc1ccc(C)cc1 Amb17741675 [1,0,0,0,0,1|0,0,0]=2 7356 B11R1.20 CC(=O)Sc1ccc(Cl)cc1 Amb24433357 [1,0,0,0,0,1|1,0,0]=3 7357 B11R1.20 CC(=O)Sc1ccc(F)cc1 Amb25348487 [1,0,0,0,0,1|1,0,0]=3 7358 B11R1.20 CC(=O)Sc1ccc(I)cc1 Amb22344406 [1,0,0,0,0,1|1,0,0]=3 7359 B11R1.20 CC(=O)Sc1ccc(cc1)Br Amb1394995 [1,0,0,0,0,1|1,0,0]=3 7360 B11R1.20 CC(=S)Nc1ccc(cc1)C Amb2553853 [1,0,0,0,0,1|0,1,0]=3 7361 B11R1.20 CC(=S)Nc1ccc(cc1)F Amb2373818 [1,0,0,0,0,1|1,1,0]=4 7362 B11R1.20 CC(=S)Oc1ccc(Br)cc1 Amb24637638 [1,0,0,0,0,1|1,1,0]=4 7363 B11R1.20 CC(C)=Cc1c[n]c(C)cc1 Amb24084788 [1,0,0,0,0,1|2,0,0]=4 7364 B11R1.20 CC(C)=Cc1ccc(C)cc1 Amb24484512 [1,0,0,0,0,1|1,0,0]=3 7365 B11R1.20 CC(C)=Cc1ccc(N)cc1 Amb18124842 [1,0,0,0,0,1|2,0,0]=4 7366 B11R1.20 CC(C)=Nc1ccc(N)cc1 Amb24761154 [1,0,0,0,0,1|2,0,0]=4 7367 B11R1.20 CC(C)Cc1ccc(O)cc1 Amb17779015 [1,0,0,0,0,1|1,0,1]=4 7368 B11R1.20 CC(C)Sc1ccc(O)cc1 Amb18180156 [1,0,0,0,0,1|1,0,1]=4 7369 B11R1.20 CC(Cc1ccc(cc1)C)Cl Amb17477591 [1,0,0,0,0,1|1,0,1]=4 7370 B11R1.20 CC(Cc1ccc(cc1)C)O Amb17138431 [1,0,0,0,0,1|0,0,2]=4 7371 B11R1.20 CC(N)Oc1ccc(O)cc1 Amb24637918 [1,0,0,0,0,1|1,0,1]=4 7372 B11R1.20 CC(Nc1ccc(cc1)C)C Amb13952217 [1,0,0,0,0,1|1,0,1]=4 7373 B11R1.20 CC(O)Cc1ccc(O)cc1 Amb25265892 [1,0,0,0,0,1|0,0,2]=4 7374 B11R1.20 CC(O)Oc1ccc(O)cc1 Amb24752465 [1,0,0,0,0,1|0,0,2]=4 7375 B11R1.20 CN(C)Cc1ccc(C)cc1 Amb17663830 [1,0,0,0,0,1|2,0,0]=4 7376 B11R1.20 CN(Cc1ccc(cc1)O)C Amb1803821 [1,0,0,0,0,1|2,0,0]=4 7377 B11R1.20 CS(=O)Cc1ccc(N)cc1 Amb18952403 [1,0,0,0,0,1|2,0,0]=4 7378 B11R1.20 CS(=O)Nc1ccc(Br)cc1 Amb24601287 [1,0,0,0,0,1|2,0,0]=4 7379 B11R1.20 CS(=O)Nc1ccc(I)cc1 Amb25177241 [1,0,0,0,0,1|2,0,0]=4 7380 B11R1.20 CS(=O)Nc1ccc(N)cc1 Amb25359575 [1,0,0,0,0,1|2,0,0]=4 7381 B11R1.20 C[C@H](N)Cc1ccc(O)cc1 Amb25172822 [1,0,0,0,0,1|1,0,1]=4 7382 B11R1.20 C\C(\N)=C\c1ccc(Cl)cc1 Amb25028102 [1,0,0,0,0,1|2,0,0]=4 7383 B11R1.20 C\C(\N)=N\c1ccc(Br)cc1 Amb24311042 [1,0,0,0,0,1|2,0,0]=4 7384 B11R1.20 C\C(\O)=C\c1ccc(F)cc1 Amb24100279 [1,0,0,0,0,1|1,0,1]=4 7385 B11R1.20 Cc1[n]cc(c[n]1)NC(C)=O Amb24351754 [1,0,0,0,0,1|2,0,0]=4 7386 B11R1.20 Cc1c[n]c(CC(C)=O)c[n]1 Amb25234305 [1,0,0,0,0,1|2,0,0]=4 7387 B11R1.20 Cc1c[n]c(c[n]1)NC(C)=O Amb25075657 [1,0,0,0,0,1|2,0,0]=4 7388 B11R1.20 Cc1c[n]c(c[n]1)OC(C)=O Amb24628239 [1,0,0,0,0,1|2,0,0]=4 7389 B11R1.20 Cc1ccc(C=C(Br)Br)cc1 Amb18117913 [1,0,0,0,0,1|2,0,0]=4 7390 B11R1.20 Cc1ccc(CC(C)=C)c[n]1 Amb24484467 [1,0,0,0,0,1|2,0,0]=4 7391 B11R1.20 Cc1ccc(CC(C)C)cc1 Amb24064801 [1,0,0,0,0,1|1,0,1]=4 7392 B11R1.20 Cc1ccc(CC(C)N)cc1 Amb22055742 [1,0,0,0,0,1|1,0,1]=4 7393 B11R1.20 Cc1ccc(CC(N)=O)c[n]1 Amb25027878 [1,0,0,0,0,1|2,0,0]=4 7394 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb18201731 [1,0,0,0,0,1|2,0,0]=4 7395 B11R1.20 Cc1ccc(CC(O)=O)[n]c1 Amb22495844 [1,0,0,0,0,1|2,0,0]=4 7396 B11R1.20 Cc1ccc(CC(O)=O)cc1 Amb22434999 [1,0,0,0,0,1|1,0,0]=3 7397 B11R1.20 Cc1ccc(CC(O)=S)cc1 Amb22229853 [1,0,0,0,0,1|1,0,1]=4 7398 B11R1.20 Cc1ccc(CN(C)N)cc1 Amb18065318 [1,0,0,0,0,1|2,0,0]=4 7399 B11R1.20 Cc1ccc(C[C@@H](C)N)cc1 Amb25141953 [1,0,0,0,0,1|1,0,1]=4 7400 B11R1.20 Cc1ccc(NC(C)=N)[n]c1 Amb24399215 [1,0,0,0,0,1|2,0,0]=4 7401 B11R1.20 Cc1ccc(NC(C)=O)[n][n]1 Amb24434903 [1,0,0,0,0,1|2,0,0]=4 7402 B11R1.20 Cc1ccc(NC(N)=O)[n]c1 Amb24390796 [1,0,0,0,0,1|2,0,0]=4 7403 B11R1.20 Cc1ccc(NC(S)=N)cc1 Amb17938675 [1,0,0,0,0,1|1,1,0]=4 7404 B11R1.20 Cc1ccc([n]c1)OC(C)=O Amb25337544 [1,0,0,0,0,1|1,0,0]=3 7405 B11R1.20 Cc1ccc(\C=C(/C)\N)cc1 Amb25111949 [1,0,0,0,0,1|1,0,0]=3 7406 B11R1.20 Cc1ccc(c[n]1)NC(C)=O Amb20248220 [1,0,0,0,0,1|1,0,0]=3 7407 B11R1.20 Cc1ccc(c[n]1)OC(C)=O Amb24103883 [1,0,0,0,0,1|1,0,0]=3 7408 B11R1.20 Cc1ccc(cc1)NC(=N)Cl Amb25725948 [1,0,0,0,0,1|2,0,0]=4 7409 B11R1.20 Cc1ccc(cc1)NC(=N)[NH3+] Amb22480234 [1,0,0,0,0,1|2,0,0]=4 7410 B11R1.20 Cc1ccc(cc1)NC(=O)Cl Amb24419875 [1,0,0,0,0,1|1,0,0]=3 7411 B11R1.20 Cc1ccc(cc1)NC(=O)F Amb25277105 [1,0,0,0,0,1|1,0,0]=3 7412 B11R1.20 Cc1ccc(cc1)NC(C)=C Amb24374732 [1,0,0,0,0,1|1,0,0]=3 7413 B11R1.20 Cc1ccc(cc1)NC(C)=N Amb25761000 [1,0,0,0,0,1|1,0,0]=3 7414 B11R1.20 Cc1ccc(cc1)NC(C)O Amb24571159 [1,0,0,0,0,1|0,0,2]=4 7415 B11R1.20 Cc1ccc(cc1)NC(N)=N Amb20249361 [1,0,0,0,0,1|2,0,0]=4 7416 B11R1.20 Cc1ccc(cc1)NC(N)=N Amb22757010 [1,0,0,0,0,1|2,0,0]=4 7417 B11R1.20 Cc1ccc(cc1)NC([S-])=S Amb22757808 [1,0,0,0,0,1|1,1,0]=4 7418 B11R1.20 Cc1ccc(cc1)OC(C)C Amb25794421 [1,0,0,0,0,1|1,0,1]=4 7419 B11R1.20 Cc1ccc(cc1)OC(C)Cl Amb24538160 [1,0,0,0,0,1|1,0,1]=4 7420 B11R1.20 Cc1ccc(cc1)OC(N)=N Amb24484851 [1,0,0,0,0,1|2,0,0]=4 7421 B11R1.20 Cc1ccc(cc1)SC(C)O Amb25032605 [1,0,0,0,0,1|0,0,2]=4 7422 B11R1.20 Cc1ccc(cc1)SC(N)=N Amb24747710 [1,0,0,0,0,1|2,0,0]=4 7423 B11R1.20 ClC(=O)Cc1ccc(cc1)Cl Amb1680103 [1,0,0,0,0,1|2,0,0]=4 7424 B11R1.20 ClC(=O)Oc1ccc(cc1)Cl Amb10068923 [1,0,0,0,0,1|2,0,0]=4 7425 B11R1.20 NC(=N)Nc1ccc(cc1)C Amb16227208 [1,0,0,0,0,1|2,0,0]=4 7426 B11R1.20 NC(=O)Cc1ccc(S)cc1 Amb25148336 [1,0,0,0,0,1|1,1,0]=4 7427 B11R1.20 NC(=O)Cc1ccc(cc1)N Amb1121163 [1,0,0,0,0,1|2,0,0]=4 7428 B11R1.20 NC(=O)Nc1ccc(cc1)Br Amb1215049 [1,0,0,0,0,1|2,0,0]=4 7429 B11R1.20 NC(=O)Nc1ccc(cc1)C Amb1195893 [1,0,0,0,0,1|1,0,0]=3 7430 B11R1.20 NC(=O)Nc1ccc(cc1)Cl Amb1195894 [1,0,0,0,0,1|2,0,0]=4 7431 B11R1.20 NC(=O)Nc1ccc(cc1)F Amb1130731 [1,0,0,0,0,1|2,0,0]=4 7432 B11R1.20 NC(=O)Nc1ccc(cc1)I Amb1144373 [1,0,0,0,0,1|2,0,0]=4 7433 B11R1.20 NC(=O)Nc1ccc(cc1)N Amb1116957 [1,0,0,0,0,1|2,0,0]=4 7434 B11R1.20 NC(=O)Oc1ccc(Br)cc1 Amb25790618 [1,0,0,0,0,1|2,0,0]=4 7435 B11R1.20 NC(=O)Oc1ccc(cc1)Cl Amb10575589 [1,0,0,0,0,1|2,0,0]=4 7436 B11R1.20 NC(=S)Cc1ccc(cc1)O Amb1112056 [1,0,0,0,0,1|1,1,0]=4 7437 B11R1.20 NC(=S)Nc1ccc(cc1)C Amb1042391 [1,0,0,0,0,1|1,1,0]=4 7438 B11R1.20 NC(=S)Nc1ccc(cc1)O Amb1263735 [1,0,0,0,0,1|1,1,0]=4 7439 B11R1.20 Nc1ccc(CC(N)=O)cc1 Amb22899489 [1,0,0,0,0,1|2,0,0]=4 7440 B11R1.20 Nc1ccc(C[13C](O)=O)cc1 Amb22367320 [1,0,0,0,0,1|2,0,0]=4 7441 B11R1.20 Nc1ccc(cc1)SC(=O)F Amb25169490 [1,0,0,0,0,1|2,0,0]=4 7442 B11R1.20 Nc1ccc(cc1)SC(N)=O Amb24433331 [1,0,0,0,0,1|2,0,0]=4 7443 B11R1.20 O=C(Br)Cc1ccc(F)cc1 Amb25130669 [1,0,0,0,0,1|2,0,0]=4 7444 B11R1.20 O=C(Cl)Cc1ccc(I)cc1 Amb24693364 [1,0,0,0,0,1|2,0,0]=4 7445 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 Amb21618685 [1,0,0,0,0,1|2,0,0]=4 7446 B11R1.20 O=C(Cl)Oc1ccc(I)cc1 Amb25775700 [1,0,0,0,0,1|2,0,0]=4 7447 B11R1.20 O=C(F)Nc1ccc(Cl)cc1 Amb24484940 [1,0,0,0,0,1|2,0,0]=4 7448 B11R1.20 O=C1C=CC(=NC(=O)C)C=C1 Amb10071635 [1,0,0,0,0,1|0,0,1]=3 7449 B11R1.20 OC(=O)C[n+]1ccc(cc1)C Amb17098175 [1,0,0,0,0,1|2,0,0]=4 7450 B11R1.20 OC(=O)Cc1ccc(cc1)Br Amb1140645 [1,0,0,0,0,1|2,0,0]=4 7451 B11R1.20 OC(=O)Cc1ccc(cc1)O Amb1214964 [1,0,0,0,0,1|1,0,0]=3 7452 B11R1.20 OC(=O)Cc1ccc(cc1)S Amb10808003 [1,0,0,0,0,1|1,1,0]=4 7453 B11R1.20 Oc1ccc(C=C(Br)Br)cc1 Amb18635918 [1,0,0,0,0,1|2,0,0]=4 7454 B11R1.20 Oc1ccc(C=C(Cl)Cl)cc1 Amb22480456 [1,0,0,0,0,1|2,0,0]=4 7455 B11R1.20 Oc1ccc(CC(=O)Br)cc1 Amb25202724 [1,0,0,0,0,1|1,0,0]=3 7456 B11R1.20 Oc1ccc(CC(=O)Cl)cc1 Amb25730089 [1,0,0,0,0,1|1,0,0]=3 7457 B11R1.20 Oc1ccc(cc1)NC(O)=S Amb24076711 [1,0,0,0,0,1|1,0,1]=4 7458 B11R1.20 Oc1ccc(cc1)NC(S)=S Amb25366269 [1,0,0,0,0,1|1,1,0]=4 7459 B11R1.20 Oc1ccc(cc1)OP(O)=O Amb24513753 [1,0,0,0,0,1|2,0,0]=4 7460 B11R1.20 [O-]C(=O)Cc1ccc(F)cc1 Amb24088363 [1,0,0,0,0,1|2,0,0]=4 7461 B11R1.20 [O-]\[N+](=C/c1ccc(cc1)C)\C Amb2425090 [1,0,0,0,0,1|1,0,1]=4 7462 B11R1.20 [S-]C(=S)Nc1ccc(cc1)C Amb15741177 [1,0,0,0,0,1|1,1,0]=4 7463 B11R1.266 CC(=C)c1[n]c(cc[n]1)OC Amb24084445 [0,0,0,0,1,1|2,0,0]=4 7464 B11R1.266 CC(=C)c1cccc([n]1)OC Amb24084453 [0,0,0,0,1,1|2,0,0]=4 7465 B11R1.266 CC(=O)C=1CC(CC)=CNC1 Amb24726111 [0,0,0,0,1,1|1,0,1]=4 7466 B11R1.266 CC(=O)C=1CC=CN(CC)C1 Amb25793449 [0,0,0,0,1,1|2,0,0]=4 7467 B11R1.266 CC(=O)c1c[n+](CC)ccc1 Amb25206136 [0,0,0,0,1,1|2,0,0]=4 7468 B11R1.266 CC(=O)c1c[n][n]c([n]1)OC Amb18201172 [0,0,0,0,1,1|2,0,0]=4 7469 B11R1.266 CC(=O)c1c[n]cc(C=C)c1 Amb25032530 [0,0,0,0,1,1|1,0,1]=4 7470 B11R1.266 CC(=O)c1c[n]cc(CC)[n]1 Amb24080163 [0,0,0,0,1,1|2,0,0]=4 7471 B11R1.266 CC(=O)c1c[n]cc(c1)C=O Amb25320846 [0,0,0,0,1,1|2,0,0]=4 7472 B11R1.266 CC(=O)c1cc(C=C)cc[n]1 Amb25687610 [0,0,0,0,1,1|1,0,1]=4 7473 B11R1.266 CC(=O)c1cc(CC)[n]cc1 Amb25240599 [0,0,0,0,1,1|1,0,0]=3 7474 B11R1.266 CC(=O)c1cc(CF)cc[n]1 Amb24513917 [0,0,0,0,1,1|2,0,0]=4 7475 B11R1.266 CC(=O)c1cc(CO)cc[n]1 Amb25152862 [0,0,0,0,1,1|2,0,0]=4 7476 B11R1.266 CC(=O)c1cc([n]cc1)OC Amb22494173 [0,0,0,0,1,1|0,0,0]=2 7477 B11R1.266 CC(=O)c1cc(c[n]c1)SC Amb24663472 [0,0,0,0,1,1|0,1,0]=3 7478 B11R1.266 CC(=O)c1cc(cc[n]1)C=O Amb22494566 [0,0,0,0,1,1|2,0,0]=4 7479 B11R1.266 CC(=O)c1cc(ccc1)N=O Amb25087142 [0,0,0,0,1,1|2,0,0]=4 7480 B11R1.266 CC(=O)c1cc(ccc1)NO Amb24486320 [0,0,0,0,1,1|2,0,0]=4 7481 B11R1.266 CC(=O)c1cc(ccc1)SC Amb25228464 [0,0,0,0,1,1|0,1,0]=3 7482 B11R1.266 CC(=O)c1cc[n]c(CC)[n]1 Amb24417481 [0,0,0,0,1,1|2,0,0]=4 7483 B11R1.266 CC(=O)c1cc[n]c(CN)c1 Amb24488212 [0,0,0,0,1,1|2,0,0]=4 7484 B11R1.266 CC(=O)c1cc[n]c(CO)c1 Amb24717075 [0,0,0,0,1,1|2,0,0]=4 7485 B11R1.266 CC(=O)c1cc[n]c(NC)[n]1 Amb25778109 [0,0,0,0,1,1|2,0,0]=4 7486 B11R1.266 CC(=O)c1cc[n]c([n]1)OC Amb22498197 [0,0,0,0,1,1|1,0,0]=3 7487 B11R1.266 CC(=O)c1cc[n]c(c1)C=O Amb22500677 [0,0,0,0,1,1|2,0,0]=4 7488 B11R1.266 CC(=O)c1cccc(C=C)c1 Amb24627220 [0,0,0,0,1,1|1,0,1]=4 7489 B11R1.266 CC(=O)c1cccc(CBr)c1 Amb22886702 [0,0,0,0,1,1|2,0,0]=4 7490 B11R1.266 CC(=O)c1cccc(CN)c1 Amb18251318 [0,0,0,0,1,1|2,0,0]=4 7491 B11R1.266 CC(=O)c1cccc([n]1)SC Amb23590739 [0,0,0,0,1,1|1,1,0]=4 7492 B11R1.266 CC(=S)c1cc(ccc1)OC Amb25786886 [0,0,0,0,1,1|0,1,0]=3 7493 B11R1.266 CCc1cc(c[n]c1)C(O)=O Amb24062468 [0,0,0,0,1,1|2,0,0]=4 7494 B11R1.266 CCc1cc(cc[n]1)C(=O)Cl Amb24379461 [0,0,0,0,1,1|2,0,0]=4 7495 B11R1.266 CCc1cc(ccc1)C(=O)Cl Amb22269011 [0,0,0,0,1,1|2,0,0]=4 7496 B11R1.266 CCc1cc(ccc1)C(N)=O Amb24102136 [0,0,0,0,1,1|2,0,0]=4 7497 B11R1.266 CCc1ccnc(c1)C(=O)O Amb17614160 [0,0,0,0,1,1|2,0,0]=4 7498 B11R1.266 CCc1nccc(c1)C(=O)N Amb10606527 [0,0,0,0,1,1|2,0,0]=4 7499 B11R1.266 CNc1cc(cc[n]1)C(N)=O Amb18284839 [0,0,0,0,1,1|2,0,0]=4 7500 B11R1.266 CNc1cc(ccc1)C(N)=O Amb18288699 [0,0,0,0,1,1|2,0,0]=4 7501 B11R1.266 CNc1cc(ccc1)C(O)=O Amb22899076 [0,0,0,0,1,1|2,0,0]=4 7502 B11R1.266 CNc1cc(ccc1)S(C)=O Amb25118569 [0,0,0,0,1,1|2,0,0]=4 7503 B11R1.266 CNc1cccc(c1)C(=O)C Amb17306672 [0,0,0,0,1,1|1,0,0]=3 7504 B11R1.266 CNc1cccc(c1)C(=O)O Amb17306309 [0,0,0,0,1,1|2,0,0]=4 7505 B11R1.266 CNc1nccc(c1)C(=O)O Amb13949124 [0,0,0,0,1,1|2,0,0]=4 7506 B11R1.266 CO[n+]1cccc(c1)C(=O)N Amb10573211 [0,0,0,0,1,1|2,0,0]=4 7507 B11R1.266 CO[n+]1cccc(c1)C(=O)O Amb10573214 [0,0,0,0,1,1|2,0,0]=4 7508 B11R1.266 COc1[n]c(cc[n]1)C(O)=O Amb18125652 [0,0,0,0,1,1|2,0,0]=4 7509 B11R1.266 COc1c[n]cc(c1)C(C)Cl Amb25107873 [0,0,0,0,1,1|1,0,1]=4 7510 B11R1.266 COc1c[n]cc(c1)C(N)=O Amb23401210 [0,0,0,0,1,1|1,0,0]=3 7511 B11R1.266 COc1c[n]cc(c1)C(N)=S Amb25760189 [0,0,0,0,1,1|1,1,0]=4 7512 B11R1.266 COc1c[n]cc(c1)[C@H](C)N Amb25282253 [0,0,0,0,1,1|1,0,1]=4 7513 B11R1.266 COc1c[n]cc(c1)[N+]([O-])=O Amb21857059 [0,0,0,0,1,1|2,0,0]=4 7514 B11R1.266 COc1cc([n]cc1)C(N)=N Amb18177177 [0,0,0,0,1,1|2,0,0]=4 7515 B11R1.266 COc1cc([n]cc1)C(N)=N Amb22235903 [0,0,0,0,1,1|2,0,0]=4 7516 B11R1.266 COc1cc([n]cc1)C(N)=S Amb18177875 [0,0,0,0,1,1|1,1,0]=4 7517 B11R1.266 COc1cc([n]cc1)N(C)C Amb24533161 [0,0,0,0,1,1|2,0,0]=4 7518 B11R1.266 COc1cc([n]cc1)[N+]([O-])=O Amb20247847 [0,0,0,0,1,1|2,0,0]=4 7519 B11R1.266 COc1cc(c[n][n]1)C(O)=O Amb23401892 [0,0,0,0,1,1|2,0,0]=4 7520 B11R1.266 COc1cc(cc[n]1)C(=O)Cl Amb24378926 [0,0,0,0,1,1|1,0,0]=3 7521 B11R1.266 COc1cc(cc[n]1)C(O)=O Amb22499680 [0,0,0,0,1,1|1,0,0]=3 7522 B11R1.266 COc1cc(cc[n]1)[C@@H](C)N Amb22747304 [0,0,0,0,1,1|1,0,1]=4 7523 B11R1.266 COc1cc(cc[n]1)[N+]([O-])=O Amb21857422 [0,0,0,0,1,1|2,0,0]=4 7524 B11R1.266 COc1cc(ccc1)C(=O)Br Amb24102346 [0,0,0,0,1,1|1,0,0]=3 7525 B11R1.266 COc1cc(ccc1)C(C)C Amb24105022 [0,0,0,0,1,1|1,0,1]=4 7526 B11R1.266 COc1cc(ccc1)N(=O)=O Amb20621755 [0,0,0,0,1,1|2,0,0]=4 7527 B11R1.266 COc1cc(ccc1)S(C)=O Amb19892063 [0,0,0,0,1,1|1,0,0]=3 7528 B11R1.266 COc1cc(ccc1)S(O)=O Amb18862872 [0,0,0,0,1,1|2,0,0]=4 7529 B11R1.266 COc1cc(ccc1)S([O-])=O Amb19944451 [0,0,0,0,1,1|2,0,0]=4 7530 B11R1.266 COc1cc(ccc1)[C@@H](C)N Amb22288628 [0,0,0,0,1,1|1,0,1]=4 7531 B11R1.266 COc1cc(ccc1)[C@H](C)N Amb22406370 [0,0,0,0,1,1|1,0,1]=4 7532 B11R1.266 COc1cc[n]c([n]1)C(N)=O Amb24551258 [0,0,0,0,1,1|2,0,0]=4 7533 B11R1.266 COc1cccc([n]1)C(=O)Cl Amb25332430 [0,0,0,0,1,1|2,0,0]=4 7534 B11R1.266 COc1cccc(c1)C(=O)O Amb1227738 [0,0,0,0,1,1|1,0,0]=3 7535 B11R1.266 COc1cccc(c1)C(=S)N Amb1209474 [0,0,0,0,1,1|1,1,0]=4 7536 B11R1.266 COc1cccc(c1)C(C)N Amb17935767 [0,0,0,0,1,1|1,0,1]=4 7537 B11R1.266 COc1cccc(c1)C(N)C Amb1102480 [0,0,0,0,1,1|1,0,1]=4 7538 B11R1.266 COc1cccc(c1)C(O)C Amb1109827 [0,0,0,0,1,1|0,0,2]=4 7539 B11R1.266 COc1cccc(c1)N(N)C Amb17232109 [0,0,0,0,1,1|2,0,0]=4 7540 B11R1.266 COc1cccc(n1)C(=O)C Amb10601920 [0,0,0,0,1,1|1,0,0]=3 7541 B11R1.266 COc1cccc(n1)C(O)=O Amb17672016 [0,0,0,0,1,1|2,0,0]=4 7542 B11R1.266 COc1ccnc(c1)C(=O)C Amb17621642 [0,0,0,0,1,1|0,0,0]=2 7543 B11R1.266 COc1ccnc(n1)C(=O)O Amb10603796 [0,0,0,0,1,1|2,0,0]=4 7544 B11R1.266 COc1nccc(c1)C(=O)O Amb1102567 [0,0,0,0,1,1|1,0,0]=3 7545 B11R1.266 COc1nccc(c1)C(=S)N Amb2372599 [0,0,0,0,1,1|1,1,0]=4 7546 B11R1.266 COc1ncnc(c1)C(=O)O Amb1487615 [0,0,0,0,1,1|2,0,0]=4 7547 B11R1.266 CSc1cc([n]cc1)C(O)=O Amb18281638 [0,0,0,0,1,1|1,1,0]=4 7548 B11R1.266 CSc1cc(cc[n]1)C(N)=O Amb25734501 [0,0,0,0,1,1|1,1,0]=4 7549 B11R1.266 CSc1cc(ccc1)C(N)=O Amb24415513 [0,0,0,0,1,1|1,1,0]=4 7550 B11R1.266 CSc1nccc(c1)C(=O)O Amb10610037 [0,0,0,0,1,1|1,1,0]=4 7551 B11R1.266 CSc1nccc(n1)C(=O)C Amb10975833 [0,0,0,0,1,1|1,1,0]=4 7552 B11R1.266 ClCc1cccc(c1)C(=O)C Amb17621753 [0,0,0,0,1,1|2,0,0]=4 7553 B11R1.266 N#Cc1nccc(c1)C(=O)C Amb10573618 [0,0,0,0,1,1|2,0,0]=4 7554 B11R1.266 O=Cc1cccc(c1)C(=O)C Amb10607476 [0,0,0,0,1,1|2,0,0]=4 7555 B11R1.266 OCc1cccc(c1)C(=O)C Amb10608833 [0,0,0,0,1,1|2,0,0]=4 7556 B11R1.266 [C-]#[N+]c1cccc(c1)C(=O)C Amb1981041 [0,0,0,0,1,1|1,0,1]=4 7557 B13R1.3 CC(=C)CNc1c[n]c(cc1)OC Amb18184359 [0,0,0,0,0,2|2,0,0]=4 7558 B13R1.3 CC(=C)CNc1ccc(cc1)SC Amb18324668 [0,0,0,0,0,2|1,1,0]=4 7559 B13R1.3 CC(=C)COc1ccc(cc1)NC Amb19009318 [0,0,0,0,0,2|2,0,0]=4 7560 B13R1.3 CC(=N)NCc1ccc(cc1)OC Amb25187706 [0,0,0,0,0,2|1,0,0]=3 7561 B13R1.3 CC(=O)C#Cc1ccc(CO)cc1 Amb24494978 [0,0,0,0,0,2|2,0,0]=4 7562 B13R1.3 CC(=O)C=Cc1ccc(cc1)OC Amb24062875 [0,0,0,0,0,2|0,0,0]=2 7563 B13R1.3 CC(=O)CCc1ccc(CC)c[n]1 Amb22396133 [0,0,0,0,0,2|2,0,0]=4 7564 B13R1.3 CC(=O)CCc1ccc(cc1)SC Amb18863960 [0,0,0,0,0,2|0,1,0]=3 7565 B13R1.3 CC(=O)COc1ccc(cc1)C#N Amb18185871 [0,0,0,0,0,2|2,0,0]=4 7566 B13R1.3 CC(=O)NCc1ccc(CN)cc1 Amb18975234 [0,0,0,0,0,2|2,0,0]=4 7567 B13R1.3 CC(=O)NCc1ccc(CO)cc1 Amb24682791 [0,0,0,0,0,2|2,0,0]=4 7568 B13R1.3 CC(=O)NCc1ccc(cc1)C=O Amb24356121 [0,0,0,0,0,2|2,0,0]=4 7569 B13R1.3 CC(=O)NNc1ccc(CO)cc1 Amb24344510 [0,0,0,0,0,2|2,0,0]=4 7570 B13R1.3 CC(=O)NNc1ccc(cc1)C#N Amb25848506 [0,0,0,0,0,2|2,0,0]=4 7571 B13R1.3 CC(=O)NNc1ccc(cc1)OC Amb24117872 [0,0,0,0,0,2|0,0,0]=2 7572 B13R1.3 CC(=O)OCc1ccc(cc1)C#N Amb18127396 [0,0,0,0,0,2|2,0,0]=4 7573 B13R1.3 CC(=O)ONc1ccc(cc1)OC Amb25783139 [0,0,0,0,0,2|0,0,0]=2 7574 B13R1.3 CC(=O)SCc1ccc(cc1)C#N Amb22231634 [0,0,0,0,0,2|2,0,0]=4 7575 B13R1.3 CC(=O)\C=C/c1ccc(cc1)OC Amb25704085 [0,0,0,0,0,2|0,0,0]=2 7576 B13R1.3 CC(=O)\C=C\c1ccc(C=C)cc1 Amb24584508 [0,0,0,0,0,2|1,0,1]=4 7577 B13R1.3 CC(=O)\C=C\c1ccc(cc1)C#N Amb18126770 [0,0,0,0,0,2|2,0,0]=4 7578 B13R1.3 CC(=O)\C=C\c1ccc(cc1)C=O Amb22493603 [0,0,0,0,0,2|2,0,0]=4 7579 B13R1.3 CC(=O)\C=C\c1ccc(cc1)SC Amb25054921 [0,0,0,0,0,2|0,1,0]=3 7580 B13R1.3 CC(C)=CNc1ccc(CC)cc1 Amb25103978 [0,0,0,0,0,2|2,0,0]=4 7581 B13R1.3 CCc1ccc(cc1)C#CC(=O)O Amb17138716 [0,0,0,0,0,2|2,0,0]=4 7582 B13R1.3 CCc1ccc(cc1)CCC(=O)O Amb1214445 [0,0,0,0,0,2|2,0,0]=4 7583 B13R1.3 CCc1ccc(cc1)NCC(=C)C Amb17306617 [0,0,0,0,0,2|2,0,0]=4 7584 B13R1.3 CCc1ccc(cc1)OCC(=O)Cl Amb10788985 [0,0,0,0,0,2|2,0,0]=4 7585 B13R1.3 CCc1ccc(cc1)OCC(=O)N Amb2573127 [0,0,0,0,0,2|2,0,0]=4 7586 B13R1.3 CCc1ccc(cc1)SCC(=O)O Amb17082983 [0,0,0,0,0,2|2,0,0]=4 7587 B13R1.3 CCc1ccc(cc1)\C=C\C(=O)C Amb17477341 [0,0,0,0,0,2|1,0,0]=3 7588 B13R1.3 CCc1ccc(cc1)\C=C\C(=O)Cl Amb17143147 [0,0,0,0,0,2|2,0,0]=4 7589 B13R1.3 CN(C)\C=N\c1ccc(cc1)OC Amb25185438 [0,0,0,0,0,2|2,0,0]=4 7590 B13R1.3 CNc1ccc(cc1)OCC(N)=O Amb18315970 [0,0,0,0,0,2|2,0,0]=4 7591 B13R1.3 COc1c[n]c(cc1)NNC(N)=O Amb25135986 [0,0,0,0,0,2|2,0,0]=4 7592 B13R1.3 COc1c[n]c(cc1)\C=C\C(O)=O Amb18128338 [0,0,0,0,0,2|2,0,0]=4 7593 B13R1.3 COc1ccc(CCC(N)=N)cc1 Amb18065783 [0,0,0,0,0,2|2,0,0]=4 7594 B13R1.3 COc1ccc(CCC(O)=O)c[n]1 Amb22886578 [0,0,0,0,0,2|2,0,0]=4 7595 B13R1.3 COc1ccc(CCN(C)N)cc1 Amb18065945 [0,0,0,0,0,2|2,0,0]=4 7596 B13R1.3 COc1ccc(CNC(=O)Cl)cc1 Amb24657364 [0,0,0,0,0,2|1,0,0]=3 7597 B13R1.3 COc1ccc(CNC(N)=O)c[n]1 Amb18809470 [0,0,0,0,0,2|2,0,0]=4 7598 B13R1.3 COc1ccc(CNC(S)=S)cc1 Amb24378167 [0,0,0,0,0,2|1,1,0]=4 7599 B13R1.3 COc1ccc(COC(N)=N)cc1 Amb24070464 [0,0,0,0,0,2|2,0,0]=4 7600 B13R1.3 COc1ccc(CSC(N)=N)cc1 Amb21961563 [0,0,0,0,0,2|2,0,0]=4 7601 B13R1.3 COc1ccc(c[n]1)\C=C\C(N)=O Amb25258171 [0,0,0,0,0,2|2,0,0]=4 7602 B13R1.3 COc1ccc(c[n]1)\C=C\C(O)=O Amb18128337 [0,0,0,0,0,2|2,0,0]=4 7603 B13R1.3 COc1ccc(cc1)/C=N/N(C)C Amb17867301 [0,0,0,0,0,2|2,0,0]=4 7604 B13R1.3 COc1ccc(cc1)C#CC(=O)C Amb10567241 [0,0,0,0,0,2|0,0,0]=2 7605 B13R1.3 COc1ccc(cc1)C#CC(C)N Amb24704522 [0,0,0,0,0,2|1,0,1]=4 7606 B13R1.3 COc1ccc(cc1)C#CC(N)=O Amb24711335 [0,0,0,0,0,2|1,0,0]=3 7607 B13R1.3 COc1ccc(cc1)C#C[C@H](C)O Amb24495495 [0,0,0,0,0,2|0,0,2]=4 7608 B13R1.3 COc1ccc(cc1)CCC(=O)C Amb1101994 [0,0,0,0,0,2|0,0,0]=2 7609 B13R1.3 COc1ccc(cc1)CCC(N)C Amb1134257 [0,0,0,0,0,2|1,0,1]=4 7610 B13R1.3 COc1ccc(cc1)CCC(O)C Amb1110699 [0,0,0,0,0,2|0,0,2]=4 7611 B13R1.3 COc1ccc(cc1)CCN(C)C Amb17611970 [0,0,0,0,0,2|2,0,0]=4 7612 B13R1.3 COc1ccc(cc1)CNC(=O)N Amb2435040 [0,0,0,0,0,2|1,0,0]=3 7613 B13R1.3 COc1ccc(cc1)CNC(C)C Amb2118680 [0,0,0,0,0,2|1,0,1]=4 7614 B13R1.3 COc1ccc(cc1)CSC(=N)N Amb10075134 [0,0,0,0,0,2|2,0,0]=4 7615 B13R1.3 COc1ccc(cc1)NCC(=C)Br Amb19005218 [0,0,0,0,0,2|1,0,1]=4 7616 B13R1.3 COc1ccc(cc1)NCC(=C)C Amb17306120 [0,0,0,0,0,2|1,0,0]=3 7617 B13R1.3 COc1ccc(cc1)NCC(=C)Cl Amb18303798 [0,0,0,0,0,2|1,0,1]=4 7618 B13R1.3 COc1ccc(cc1)NCC(=O)Cl Amb24652622 [0,0,0,0,0,2|1,0,0]=3 7619 B13R1.3 COc1ccc(cc1)NCC(=O)O Amb1981429 [0,0,0,0,0,2|1,0,0]=3 7620 B13R1.3 COc1ccc(cc1)NCC(C)N Amb24741032 [0,0,0,0,0,2|1,0,1]=4 7621 B13R1.3 COc1ccc(cc1)NCC(O)=O Amb23438819 [0,0,0,0,0,2|1,0,0]=3 7622 B13R1.3 COc1ccc(cc1)NCC(O)C Amb17139008 [0,0,0,0,0,2|0,0,2]=4 7623 B13R1.3 COc1ccc(cc1)NC[C@@H](C)N Amb24433389 [0,0,0,0,0,2|1,0,1]=4 7624 B13R1.3 COc1ccc(cc1)NC[C@@H](C)O Amb24495287 [0,0,0,0,0,2|0,0,2]=4 7625 B13R1.3 COc1ccc(cc1)NC[C@H](C)N Amb24649715 [0,0,0,0,0,2|1,0,1]=4 7626 B13R1.3 COc1ccc(cc1)NC[C@H](C)O Amb25083644 [0,0,0,0,0,2|0,0,2]=4 7627 B13R1.3 COc1ccc(cc1)OCC(=O)N Amb2411549 [0,0,0,0,0,2|1,0,0]=3 7628 B13R1.3 COc1ccc(cc1)OCC(C)O Amb18805497 [0,0,0,0,0,2|0,0,2]=4 7629 B13R1.3 COc1ccc(cc1)OCC(N)=N Amb20669587 [0,0,0,0,0,2|2,0,0]=4 7630 B13R1.3 COc1ccc(cc1)OCC(N)C Amb1133718 [0,0,0,0,0,2|1,0,1]=4 7631 B13R1.3 COc1ccc(cc1)OC[C@@H](C)N Amb18035957 [0,0,0,0,0,2|1,0,1]=4 7632 B13R1.3 COc1ccc(cc1)SCC(=O)O Amb1197559 [0,0,0,0,0,2|1,0,0]=3 7633 B13R1.3 COc1ccc(cc1)SCC(C)N Amb18565988 [0,0,0,0,0,2|1,0,1]=4 7634 B13R1.3 COc1ccc(cc1)\C=C/C(O)=O Amb24669596 [0,0,0,0,0,2|1,0,0]=3 7635 B13R1.3 COc1ccc(cc1)\C=C\C(=O)C Amb1240513 [0,0,0,0,0,2|0,0,0]=2 7636 B13R1.3 COc1ccc(cc1)\C=C\C(=O)O Amb10816837 [0,0,0,0,0,2|1,0,0]=3 7637 B13R1.3 COc1ccc(cc1)\C=C\C(=O)O Amb16210874 [0,0,0,0,0,2|1,0,0]=3 7638 B13R1.3 COc1ccc(cc1)\C=C\C(=O)O Amb2228956 [0,0,0,0,0,2|1,0,0]=3 7639 B13R1.3 COc1ccc(cc1)\C=C\C(=O)[O-] Amb1010966 [0,0,0,0,0,2|1,0,0]=3 7640 B13R1.3 COc1ccc(cc1)\C=C\C(=O)[O-] Amb10553863 [0,0,0,0,0,2|1,0,0]=3 7641 B13R1.3 COc1ccc(cc1)\C=C\C(C)Br Amb25152907 [0,0,0,0,0,2|1,0,1]=4 7642 B13R1.3 COc1ccc(cc1)\C=C\C(C)N Amb25114739 [0,0,0,0,0,2|1,0,1]=4 7643 B13R1.3 COc1ccc(cc1)\C=C\N([O-])=O Amb22291099 [0,0,0,0,0,2|2,0,0]=4 7644 B13R1.3 COc1ccc(cc1)\C=C\[C@@H](C)O Amb24429881 [0,0,0,0,0,2|0,0,2]=4 7645 B13R1.3 CSc1ccc(cc1)C#CC(O)=O Amb25334092 [0,0,0,0,0,2|1,1,0]=4 7646 B13R1.3 CSc1ccc(cc1)\C=C\C(=O)Cl Amb24567241 [0,0,0,0,0,2|1,1,0]=4 7647 B13R1.3 CSc1ccc(cc1)\C=C\C(=O)O Amb1661167 [0,0,0,0,0,2|1,1,0]=4 7648 B13R1.3 N#Cc1ccc(cc1)CNC(=O)C Amb10180010 [0,0,0,0,0,2|2,0,0]=4 7649 B13R1.3 [C-]#[N+]c1ccc(cc1)\C=C\C(C)=O Amb24494975 [0,0,0,0,0,2|1,0,1]=4