0 B13R1.589 C=C(Cl)Cc1ccccc1C(N)=O Amb25784602 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.589 CC(=C)Cc1ccccc1B(O)O Amb24716991 [0,0,0,0,0,0|3,0,1]=4 2 B13R1.589 CC(=O)Cc1[n]cccc1C(O)=O Amb18648224 [0,0,0,0,0,0|2,0,0]=2 3 B13R1.589 CC(=O)Cc1c[n]ccc1C(O)=O Amb25216933 [0,0,0,0,0,0|2,0,0]=2 4 B13R1.589 CC(=O)Cc1cc[n]cc1C(O)=O Amb25290183 [0,0,0,0,0,0|2,0,0]=2 5 B13R1.589 CC(=O)Cc1ccccc1C(=O)Cl Amb24070192 [0,0,0,0,0,0|2,0,0]=2 6 B13R1.589 CC(=O)Cc1ccccc1C(C)=C Amb24491404 [0,0,0,0,0,0|3,0,0]=3 7 B13R1.589 CC(=O)Cc1ccccc1C(C)C Amb25838680 [0,0,0,0,0,0|3,0,1]=4 8 B13R1.589 CC(=O)Cc1ccccc1C(C)F Amb25178504 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.589 CC(=O)Cc1ccccc1N(C)C Amb24534709 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.589 CC(=O)Nc1[n]cc[n]c1C(O)=O Amb24428052 [0,0,0,0,0,0|3,0,0]=3 11 B13R1.589 CC(=O)Nc1[n]cccc1B(O)O Amb25130508 [0,0,0,0,0,0|3,0,1]=4 12 B13R1.589 CC(=O)Nc1[n]cccc1C(N)=O Amb24470064 [0,0,0,0,0,0|3,0,0]=3 13 B13R1.589 CC(=O)Nc1cc[n]cc1C(N)=O Amb25843765 [0,0,0,0,0,0|3,0,0]=3 14 B13R1.589 CC(=O)Nc1cc[n]cc1C(O)=O Amb20248236 [0,0,0,0,0,0|2,0,0]=2 15 B13R1.589 CC(=O)Nc1ccc[n]c1C(N)=O Amb24739666 [0,0,0,0,0,0|3,0,0]=3 16 B13R1.589 CC(=O)Nc1ccccc1B(O)O Amb2455618 [0,0,0,0,0,0|2,0,1]=3 17 B13R1.589 CC(=O)Nc1ccccc1C(=O)Cl Amb24616272 [0,0,0,0,0,0|2,0,0]=2 18 B13R1.589 CC(=O)Nc1ccccc1C(=O)O Amb1118185 [0,0,0,0,0,0|1,0,0]=1 19 B13R1.589 CC(=O)Nc1ccccc1C(C)=C Amb24310152 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.589 CC(=O)Nc1ccccc1C(C)Br Amb25815905 [0,0,0,0,0,0|3,0,1]=4 21 B13R1.589 CC(=O)Nc1ccccc1C(C)Cl Amb25049803 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.589 CC(=O)Nc1ccccc1C(N)C Amb1135033 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.589 CC(=O)Nc1ccccc1N(C)C Amb24309902 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.589 CC(=O)Nc1ccccc1S(C)=O Amb24308983 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.589 CC(=O)Nc1ccccc1[C@@H](C)N Amb24629155 [0,0,0,0,0,0|3,0,1]=4 26 B13R1.589 CC(=O)Nc1ccccc1[C@H](C)N Amb25679704 [0,0,0,0,0,0|3,0,1]=4 27 B13R1.589 CC(=O)Nc1ccccc1[N+](=O)[O-] Amb2550054 [0,0,0,0,0,0|2,0,1]=3 28 B13R1.589 CC(=O)Nc1cccnc1[N+](=O)[O-] Amb10552761 [0,0,0,0,0,0|3,0,1]=4 29 B13R1.589 CC(=O)Nc1ccncc1[N+](=O)[O-] Amb10552762 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.589 CC(=O)Oc1ccc[n]c1C(O)=O Amb24082668 [0,0,0,0,0,0|1,0,0]=1 31 B13R1.589 CC(=O)Oc1ccccc1C(=O)O Amb17616620 [0,0,0,0,0,0|0,0,0]=0 32 B13R1.589 CC(=O)Oc1ccccc1C(N)=S Amb22047826 [0,0,0,0,0,0|1,1,0]=2 33 B13R1.589 CC(=O)Oc1ccccc1C(O)=O Amb17757514 [0,0,0,0,0,0|0,0,0]=0 34 B13R1.589 CC(=O)Oc1ccccc1C(O)=O Amb22745446 [0,0,0,0,0,0|0,0,0]=0 35 B13R1.589 CC(=O)Oc1ccccc1C([O-])=O Amb17772216 [0,0,0,0,0,0|0,0,1]=1 36 B13R1.589 CC(=O)Oc1ccccc1[13C](=O)Cl Amb22367283 [0,0,0,0,0,0|1,0,0]=1 37 B13R1.589 CC(=O)Oc1ccccc1[13C](O)=O Amb22367282 [0,0,0,0,0,0|0,0,0]=0 38 B13R1.589 CC(=O)Oc1ccccc1[C@@H](C)N Amb24376708 [0,0,0,0,0,0|2,0,1]=3 39 B13R1.589 CC(=O)Oc1cccnc1[N+](=O)[O-] Amb10552732 [0,0,0,0,0,0|2,0,1]=3 40 B13R1.589 CC(=O)Sc1ccc[n]c1C(O)=O Amb25774520 [0,0,0,0,0,0|1,1,0]=2 41 B13R1.589 CC(=O)Sc1ccccc1C(=O)Cl Amb25155122 [0,0,0,0,0,0|1,1,0]=2 42 B13R1.589 CC(=O)Sc1ccccc1C(C)C Amb25336435 [0,0,0,0,0,0|2,1,1]=4 43 B13R1.589 CC(=O)Sc1ccccc1C(N)=O Amb24407251 [0,0,0,0,0,0|1,1,0]=2 44 B13R1.589 CC(=O)Sc1ccccc1C(O)=O Amb25851101 [0,0,0,0,0,0|0,1,0]=1 45 B13R1.589 CC(=O)c1[n]cccc1OC(C)=O Amb23412444 [0,0,0,0,0,0|2,0,0]=2 46 B13R1.589 CC(=O)c1ccc[n]c1OC(C)C Amb23571474 [0,0,0,0,0,0|3,0,1]=4 47 B13R1.589 CC(=O)c1ccccc1CC(C)N Amb24758195 [0,0,0,0,0,0|3,0,1]=4 48 B13R1.589 CC(=O)c1ccccc1NS(C)=O Amb24625754 [0,0,0,0,0,0|3,0,0]=3 49 B13R1.589 CC(=O)c1ccccc1SC(C)C Amb19051954 [0,0,0,0,0,0|2,1,1]=4 50 B13R1.589 CC(=S)Nc1ccccc1C(C)=C Amb25137161 [0,0,0,0,0,0|3,1,0]=4 51 B13R1.589 CC(C)=Cc1ccccc1C(N)=O Amb25774318 [0,0,0,0,0,0|3,0,0]=3 52 B13R1.589 CC(C)=Cc1ccccc1C(O)=O Amb18127731 [0,0,0,0,0,0|2,0,0]=2 53 B13R1.589 CC(C)=Cc1ccccc1[N+]([O-])=O Amb25101475 [0,0,0,0,0,0|3,0,1]=4 54 B13R1.589 CC(C)Cc1c[n]ccc1C(O)=O Amb22752356 [0,0,0,0,0,0|3,0,1]=4 55 B13R1.589 CC(C)Cc1ccccc1C(O)=O Amb18128234 [0,0,0,0,0,0|2,0,1]=3 56 B13R1.589 CC(C)Nc1c[n]ccc1C(O)=O Amb25683114 [0,0,0,0,0,0|3,0,1]=4 57 B13R1.589 CC(C)Nc1cc[n]cc1C(O)=O Amb23571339 [0,0,0,0,0,0|3,0,1]=4 58 B13R1.589 CC(C)Oc1[n][n]ccc1C(O)=O Amb25346977 [0,0,0,0,0,0|3,0,1]=4 59 B13R1.589 CC(C)Oc1[n]cc[n]c1C(O)=O Amb18995655 [0,0,0,0,0,0|3,0,1]=4 60 B13R1.589 CC(C)Oc1[n]cccc1C(N)=O Amb24433889 [0,0,0,0,0,0|3,0,1]=4 61 B13R1.589 CC(C)Oc1cc[n]cc1C(O)=O Amb25850474 [0,0,0,0,0,0|2,0,1]=3 62 B13R1.589 CC(C)Oc1ccc[n]c1C(N)=O Amb25668633 [0,0,0,0,0,0|3,0,1]=4 63 B13R1.589 CC(C)Oc1ccc[n]c1C(O)=O Amb18977581 [0,0,0,0,0,0|2,0,1]=3 64 B13R1.589 CC(C)Oc1ccccc1[C@H](C)O Amb24408742 [0,0,0,0,0,0|2,0,2]=4 65 B13R1.589 CC(C)Oc1ccccc1[N+]([O-])=O Amb19888994 [0,0,0,0,0,0|2,0,2]=4 66 B13R1.589 CC(C)Sc1ccc[n]c1C(O)=O Amb24354564 [0,0,0,0,0,0|2,1,1]=4 67 B13R1.589 CC(C)Sc1ccccc1C(=O)Cl Amb24101325 [0,0,0,0,0,0|2,1,1]=4 68 B13R1.589 CC(C)c1ccccc1OC(=O)Cl Amb24438320 [0,0,0,0,0,0|3,0,1]=4 69 B13R1.589 CC(Cc1ccccc1C(=O)O)Cl Amb17477621 [0,0,0,0,0,0|2,0,1]=3 70 B13R1.589 CC(Cc1ccccc1C(=O)O)O Amb17477610 [0,0,0,0,0,0|1,0,2]=3 71 B13R1.589 CC(N)Cc1ccccc1C(N)=O Amb25180431 [0,0,0,0,0,0|3,0,1]=4 72 B13R1.589 CC(O)Oc1ccccc1C(O)=O Amb24373220 [0,0,0,0,0,0|0,0,2]=2 73 B13R1.589 CC(Oc1ccccc1C(=O)Cl)C Amb16230156 [0,0,0,0,0,0|2,0,1]=3 74 B13R1.589 CC(Oc1ccccc1C(=O)N)C Amb2001134 [0,0,0,0,0,0|2,0,1]=3 75 B13R1.589 CC(Oc1ccccc1C(=O)O)C Amb1135783 [0,0,0,0,0,0|1,0,1]=2 76 B13R1.589 CC(Sc1ccccc1C(=O)N)C Amb2186327 [0,0,0,0,0,0|2,1,1]=4 77 B13R1.589 CC(Sc1ccccc1C(=O)O)C Amb1928158 [0,0,0,0,0,0|1,1,1]=3 78 B13R1.589 CC(Sc1ncccc1C(=O)O)C Amb10201576 [0,0,0,0,0,0|2,1,1]=4 79 B13R1.589 CC(Sc1ncccc1C(=O)O)C Amb1124373 [0,0,0,0,0,0|2,1,1]=4 80 B13R1.589 CN(C)Cc1[n]cccc1C(O)=O Amb25788511 [0,0,0,0,0,0|4,0,0]=4 81 B13R1.589 CN(C)Cc1ccc[n]c1C(O)=O Amb19002537 [0,0,0,0,0,0|4,0,0]=4 82 B13R1.589 CN(C)Nc1c[n]ccc1C(O)=O Amb24635307 [0,0,0,0,0,0|4,0,0]=4 83 B13R1.589 CN(C)Nc1cc[n]cc1C(O)=O Amb25088111 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.589 CN(C)Nc1ccc[n]c1C(O)=O Amb24415022 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.589 CN(Cc1ccccc1C(=O)C)C Amb17106882 [0,0,0,0,0,0|4,0,0]=4 86 B13R1.589 CN(O)Cc1ccccc1C(O)=O Amb25264713 [0,0,0,0,0,0|2,0,1]=3 87 B13R1.589 CS(=O)Cc1ccccc1B(O)O Amb24511544 [0,0,0,0,0,0|3,0,1]=4 88 B13R1.589 CS(=O)Cc1ccccc1C(O)=O Amb18974542 [0,0,0,0,0,0|2,0,0]=2 89 B13R1.589 CS(=O)Nc1[n]cc[n]c1C(O)=O Amb24625741 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.589 CS(=O)Nc1[n]cccc1C(O)=O Amb24545568 [0,0,0,0,0,0|3,0,0]=3 91 B13R1.589 CS(=O)Nc1c[n]ccc1C(O)=O Amb25177299 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.589 CS(=O)c1ccccc1CC(N)=O Amb25066210 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.589 CS(C)=Nc1ccccc1C(N)=O Amb25088457 [0,0,0,0,0,0|4,0,0]=4 94 B13R1.589 C[C@H](N)Cc1ccccc1C(O)=O Amb24611753 [0,0,0,0,0,0|2,0,1]=3 95 B13R1.589 C[SiH](C)c1ccccc1OC(=O)Cl Amb24579230 [0,0,0,0,0,0|3,1,0]=4 96 B13R1.589 ClC(=O)Oc1ccccc1[N+](=O)[O-] Amb10844788 [0,0,0,0,0,0|2,0,1]=3 97 B13R1.589 FC(Oc1ccccc1C(=O)C)F Amb1103340 [0,0,0,0,0,0|3,0,1]=4 98 B13R1.589 FC(Oc1ccccc1C(=O)O)F Amb1209367 [0,0,0,0,0,0|2,0,1]=3 99 B13R1.589 FC(Sc1ccccc1C(=O)O)F Amb1212419 [0,0,0,0,0,0|2,1,1]=4 100 B13R1.589 NC(=N)c1ccccc1CC(O)=O Amb25699043 [0,0,0,0,0,0|4,0,0]=4 101 B13R1.589 NC(=O)Cc1ccccc1C(O)=O Amb25234469 [0,0,0,0,0,0|2,0,0]=2 102 B13R1.589 NC(=O)Nc1[n]cccc1C(O)=O Amb25125124 [0,0,0,0,0,0|3,0,0]=3 103 B13R1.589 NC(=O)Nc1c[n]ccc1C(O)=O Amb24460552 [0,0,0,0,0,0|3,0,0]=3 104 B13R1.589 NC(=O)Nc1ccc[n]c1C(O)=O Amb25362309 [0,0,0,0,0,0|3,0,0]=3 105 B13R1.589 NC(=O)Nc1ccccc1C(=O)O Amb1116749 [0,0,0,0,0,0|2,0,0]=2 106 B13R1.589 NC(=O)Nc1ccccc1C(N)=N Amb25189729 [0,0,0,0,0,0|4,0,0]=4 107 B13R1.589 NC(=O)c1cc[n]cc1CC(N)=O Amb24650944 [0,0,0,0,0,0|4,0,0]=4 108 B13R1.589 NC(=S)Cc1ccccc1C(=O)N Amb17499528 [0,0,0,0,0,0|3,1,0]=4 109 B13R1.589 NC(=S)Nc1ccccc1C(O)=O Amb23129365 [0,0,0,0,0,0|2,1,0]=3 110 B13R1.589 O=C(Cl)c1ccccc1CC(=O)Cl Amb25241835 [0,0,0,0,0,0|3,0,0]=3 111 B13R1.589 OC(=O)Cc1ccccc1B(O)O Amb20171111 [0,0,0,0,0,0|3,0,1]=4 112 B13R1.589 OC(=O)Cc1ccccc1C(=O)C Amb10560909 [0,0,0,0,0,0|3,0,0]=3 113 B13R1.589 OC(=O)Cc1ccccc1C(=O)Cl Amb24443996 [0,0,0,0,0,0|3,0,0]=3 114 B13R1.589 OC(=O)Cc1ccccc1C(=O)O Amb1093877 [0,0,0,0,0,0|2,0,0]=2 115 B13R1.589 OC(=O)c1[n]cc[n]c1CC(O)=O Amb18192793 [0,0,0,0,0,0|4,0,0]=4 116 B13R1.589 OC(=O)c1[n]cccc1OC(F)F Amb18292088 [0,0,0,0,0,0|3,0,1]=4 117 B13R1.589 OC(=O)c1c[n]c[n]c1CC(O)=O Amb18192797 [0,0,0,0,0,0|4,0,0]=4 118 B13R1.589 OC(=O)c1cc[n]cc1CC(O)=O Amb25124095 [0,0,0,0,0,0|3,0,0]=3 119 B13R1.589 OC(=O)c1cc[n]cc1OC(F)F Amb25347356 [0,0,0,0,0,0|3,0,1]=4 120 B13R1.589 OC(=O)c1ccc[n]c1CC(O)=O Amb24652538 [0,0,0,0,0,0|3,0,0]=3 121 B13R1.589 OC(=O)c1ccc[n]c1OC(F)F Amb24117883 [0,0,0,0,0,0|3,0,1]=4 122 B13R1.589 OC(=O)c1ccccc1CC(=O)Cl Amb25191468 [0,0,0,0,0,0|2,0,0]=2 123 B13R1.589 OC(=O)c1ccccc1NS(O)=O Amb24101377 [0,0,0,0,0,0|3,0,0]=3 124 B13R1.589 [O-]C(=O)Cc1ccccc1[N+]([O-])=O Amb22456151 [0,0,0,0,0,0|3,0,1]=4 125 B13R1.589 [O-]C(=O)c1cccc[n+]1CC(O)=O Amb25282151 [0,0,0,0,0,0|3,0,1]=4 126 B13R1.589 [O-][N+](=O)Nc1[n]cccc1C(O)=O Amb20248038 [0,0,0,0,0,0|4,0,0]=4 127 B13R1.589 [O-][N+](=O)Nc1ccc[n]c1C(O)=O Amb24757047 [0,0,0,0,0,0|4,0,0]=4 128 B13R1.589 [O-][N+](=O)c1ccccc1CC(Cl)=O Amb17940433 [0,0,0,0,0,0|3,0,1]=4 129 B12R1.75 C=Cc1ccccc1NC(N)=O Amb24726165 [1,0,0,0,0,0|3,0,0]=4 130 B12R1.75 CC(=C)Cc1ccccc1C=O Amb24070179 [1,0,0,0,0,0|2,0,0]=3 131 B12R1.75 CC(=C)Cc1ccccc1CO Amb24748495 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.75 CC(=O)Cc1ccccc1C=C Amb24691712 [1,0,0,0,0,0|2,0,0]=3 133 B12R1.75 CC(=O)Cc1ccccc1C=O Amb18645650 [1,0,0,0,0,0|1,0,0]=2 134 B12R1.75 CC(=O)Cc1ccccc1CN Amb18908621 [1,0,0,0,0,0|2,0,1]=4 135 B12R1.75 CC(=O)Cc1ccccc1CO Amb24736343 [1,0,0,0,0,0|1,0,1]=3 136 B12R1.75 CC(=O)Nc1[n]cccc1CO Amb18625185 [1,0,0,0,0,0|2,0,1]=4 137 B12R1.75 CC(=O)Nc1c[n]ccc1C=O Amb22371535 [1,0,0,0,0,0|2,0,0]=3 138 B12R1.75 CC(=O)Nc1ccccc1C#C Amb25783787 [1,0,0,0,0,0|2,0,1]=4 139 B12R1.75 CC(=O)Nc1ccccc1CCl Amb24635762 [1,0,0,0,0,0|2,0,1]=4 140 B12R1.75 CC(=O)Nc1ccccc1CN Amb19341300 [1,0,0,0,0,0|2,0,1]=4 141 B12R1.75 CC(=O)Nc1ccccc1N=O Amb24446438 [1,0,0,0,0,0|2,0,0]=3 142 B12R1.75 CC(=O)Nc1ccccc1NN Amb24586260 [1,0,0,0,0,0|3,0,0]=4 143 B12R1.75 CC(=O)Nc1ccccc1NO Amb25678573 [1,0,0,0,0,0|2,0,0]=3 144 B12R1.75 CC(=O)Oc1[n]cccc1C=O Amb18646202 [1,0,0,0,0,0|1,0,0]=2 145 B12R1.75 CC(=O)Oc1cc[n]cc1CC Amb25236888 [1,0,0,0,0,0|2,0,1]=4 146 B12R1.75 CC(=O)Oc1ccc[n]c1C=C Amb25348445 [1,0,0,0,0,0|2,0,0]=3 147 B12R1.75 CC(=O)Oc1ccc[n]c1C=O Amb25827095 [1,0,0,0,0,0|1,0,0]=2 148 B12R1.75 CC(=O)Oc1ccccc1C#C Amb23412358 [1,0,0,0,0,0|1,0,1]=3 149 B12R1.75 CC(=O)Oc1ccccc1C=C Amb18798087 [1,0,0,0,0,0|1,0,0]=2 150 B12R1.75 CC(=O)Oc1ccccc1CBr Amb22737638 [1,0,0,0,0,0|1,0,1]=3 151 B12R1.75 CC(=O)Oc1ccccc1CC Amb22230209 [1,0,0,0,0,0|1,0,1]=3 152 B12R1.75 CC(=O)Oc1ccccc1CN Amb22284286 [1,0,0,0,0,0|1,0,1]=3 153 B12R1.75 CC(=O)Oc1ccccc1CO Amb24077558 [1,0,0,0,0,0|0,0,1]=2 154 B12R1.75 CC(=O)Sc1ccccc1SC Amb24571197 [1,0,0,0,0,0|2,1,0]=4 155 B12R1.75 CC(=S)Nc1ccccc1C=C Amb25351502 [1,0,0,0,0,0|2,1,0]=4 156 B12R1.75 CC(C)=Cc1ccccc1C=O Amb18645369 [1,0,0,0,0,0|2,0,0]=3 157 B12R1.75 CC(C)=Cc1ccccc1CO Amb25741369 [1,0,0,0,0,0|2,0,1]=4 158 B12R1.75 CC(C)Cc1ccccc1C=O Amb25137753 [1,0,0,0,0,0|2,0,1]=4 159 B12R1.75 CC(C)Nc1ccccc1C=O Amb24710350 [1,0,0,0,0,0|2,0,1]=4 160 B12R1.75 CC(C)Oc1ccc[n]c1C=O Amb22755033 [1,0,0,0,0,0|2,0,1]=4 161 B12R1.75 CC(C)Oc1ccccc1C=C Amb22586355 [1,0,0,0,0,0|2,0,1]=4 162 B12R1.75 CC(C)Sc1ccccc1C=O Amb25081579 [1,0,0,0,0,0|1,1,1]=4 163 B12R1.75 CCc1ccccc1OC(N)=O Amb25101550 [1,0,0,0,0,0|2,0,1]=4 164 B12R1.75 CN(C)\C=C/1\C=CC=C\C1=C\O Amb24661220 [1,0,0,0,0,0|3,0,0]=4 165 B12R1.75 COc1ccccc1OC(=O)Cl Amb21618687 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.75 COc1ccccc1OC(=O)N Amb2099602 [1,0,0,0,0,0|3,0,0]=4 167 B12R1.75 CS(=O)Cc1ccccc1CO Amb25157918 [1,0,0,0,0,0|2,0,1]=4 168 B12R1.75 CS(=O)Nc1ccccc1CO Amb25177366 [1,0,0,0,0,0|2,0,1]=4 169 B12R1.75 NC(=O)Nc1ccccc1CO Amb18792741 [1,0,0,0,0,0|2,0,1]=4 170 B12R1.75 NC(=O)Oc1ccccc1CCl Amb24740728 [1,0,0,0,0,0|2,0,1]=4 171 B12R1.75 NCc1ccccc1NC(=O)C Amb1112133 [1,0,0,0,0,0|2,0,1]=4 172 B12R1.75 NCc1ccccc1OC(=O)C Amb10669545 [1,0,0,0,0,0|1,0,1]=3 173 B12R1.75 O=C(Cl)Oc1ccccc1C=O Amb24375240 [1,0,0,0,0,0|1,0,0]=2 174 B12R1.75 O=C(Cl)Oc1ccccc1CCl Amb25731852 [1,0,0,0,0,0|2,0,1]=4 175 B12R1.75 O=Cc1ccccc1CN(C)C Amb16187131 [1,0,0,0,0,0|3,0,0]=4 176 B12R1.75 O=Cc1ccccc1OB(F)F Amb25733051 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.75 O=Cc1ccccc1OC(C)C Amb1033079 [1,0,0,0,0,0|1,0,1]=3 178 B12R1.75 O=Cc1ccccc1OC(F)F Amb1234413 [1,0,0,0,0,0|2,0,1]=4 179 B12R1.75 OB(O)Oc1ccccc1C=O Amb25326242 [1,0,0,0,0,0|2,0,1]=4 180 B12R1.75 OC(=O)Cc1ccccc1C=O Amb18645971 [1,0,0,0,0,0|2,0,0]=3 181 B12R1.75 OC(=O)Cc1ccccc1CO Amb18646479 [1,0,0,0,0,0|2,0,1]=4 182 B12R1.75 OCc1ccccc1NC(=O)C Amb13952729 [1,0,0,0,0,0|1,0,1]=3 183 B12R1.283 C/C=C/c1ccccc1C(O)=O Amb17666459 [1,0,0,0,0,0|1,0,0]=2 184 B12R1.283 C=CCc1ccccc1C(N)=O Amb24106007 [1,0,0,0,0,0|2,0,1]=4 185 B12R1.283 C=COc1ccccc1C(N)=O Amb24101379 [1,0,0,0,0,0|1,0,1]=3 186 B12R1.283 C=COc1ccccc1C(O)=O Amb25716155 [1,0,0,0,0,0|0,0,1]=2 187 B12R1.283 CC#Cc1ccccc1C(=O)Cl Amb24070029 [1,0,0,0,0,0|2,0,1]=4 188 B12R1.283 CC#Cc1ccccc1C(N)=O Amb24070026 [1,0,0,0,0,0|2,0,1]=4 189 B12R1.283 CC#Cc1ccccc1C(O)=O Amb24070028 [1,0,0,0,0,0|1,0,1]=3 190 B12R1.283 CC(=C)c1ccccc1NC=O Amb24381922 [1,0,0,0,0,0|3,0,0]=4 191 B12R1.283 CC(=C)c1ccccc1OCC Amb25724273 [1,0,0,0,0,0|2,0,1]=4 192 B12R1.283 CC(=O)c1[n]cccc1OCC Amb22755006 [1,0,0,0,0,0|2,0,1]=4 193 B12R1.283 CC(=O)c1c[n]ccc1OCC Amb23401176 [1,0,0,0,0,0|2,0,1]=4 194 B12R1.283 CC(=O)c1ccc[n]c1OCC Amb23571472 [1,0,0,0,0,0|2,0,1]=4 195 B12R1.283 CC(=O)c1ccccc1C#CC Amb25044342 [1,0,0,0,0,0|2,0,1]=4 196 B12R1.283 CC(=O)c1ccccc1CC=O Amb24100336 [1,0,0,0,0,0|2,0,0]=3 197 B12R1.283 CC(=O)c1ccccc1OC=C Amb24647161 [1,0,0,0,0,0|1,0,1]=3 198 B12R1.283 CC(=O)c1ccccc1\C=C/C Amb24649748 [1,0,0,0,0,0|2,0,0]=3 199 B12R1.283 CC(=O)c1ccccc1\C=C\C Amb25210598 [1,0,0,0,0,0|2,0,0]=3 200 B12R1.283 CC(O)c1ccccc1NC=O Amb18792637 [1,0,0,0,0,0|2,0,1]=4 201 B12R1.283 CCCc1cc[n]cc1C(O)=O Amb18828434 [1,0,0,0,0,0|2,0,1]=4 202 B12R1.283 CCCc1ccc[n]c1C(O)=O Amb24102501 [1,0,0,0,0,0|2,0,1]=4 203 B12R1.283 CCCc1ccccc1C(=O)Cl Amb24084964 [1,0,0,0,0,0|2,0,1]=4 204 B12R1.283 CCCc1ccccc1C(N)=O Amb20000968 [1,0,0,0,0,0|2,0,1]=4 205 B12R1.283 CCCc1ccccc1C(O)=O Amb18646088 [1,0,0,0,0,0|1,0,1]=3 206 B12R1.283 CCNc1c[n]ccc1C(O)=O Amb24664847 [1,0,0,0,0,0|2,0,1]=4 207 B12R1.283 CCNc1cc[n]cc1C(O)=O Amb23571338 [1,0,0,0,0,0|2,0,1]=4 208 B12R1.283 CCNc1ccccc1C(N)=O Amb18295783 [1,0,0,0,0,0|2,0,1]=4 209 B12R1.283 CCOc1[n]c[n]cc1C(O)=O Amb18646863 [1,0,0,0,0,0|2,0,1]=4 210 B12R1.283 CCOc1[n]cc[n]c1C(O)=O Amb18300469 [1,0,0,0,0,0|2,0,1]=4 211 B12R1.283 CCOc1cc[n]cc1C(O)=O Amb22750117 [1,0,0,0,0,0|1,0,1]=3 212 B12R1.283 CCOc1ccc[n]c1C(O)=O Amb18298125 [1,0,0,0,0,0|1,0,1]=3 213 B12R1.283 CCOc1ccccc1C(=O)C Amb1209774 [1,0,0,0,0,0|1,0,1]=3 214 B12R1.283 CCOc1ccccc1C(O)C Amb1109862 [1,0,0,0,0,0|1,0,2]=4 215 B12R1.283 CCOc1ccccc1N(=O)=O Amb20621865 [1,0,0,0,0,0|1,0,2]=4 216 B12R1.283 CCOc1cnccc1C(=O)O Amb16230608 [1,0,0,0,0,0|1,0,1]=3 217 B12R1.283 CCOc1ncccc1C(=O)N Amb13994963 [1,0,0,0,0,0|2,0,1]=4 218 B12R1.283 CCSc1cc[nH+]cc1C(O)=O Amb24085896 [1,0,0,0,0,0|1,1,1]=4 219 B12R1.283 CCSc1ccc[n]c1C(O)=O Amb25053869 [1,0,0,0,0,0|1,1,1]=4 220 B12R1.283 CCSc1ccccc1C(=O)Cl Amb10879592 [1,0,0,0,0,0|1,1,1]=4 221 B12R1.283 CCSc1ccccc1C(=O)O Amb1928152 [1,0,0,0,0,0|0,1,1]=3 222 B12R1.283 CCSc1ccccc1C(N)=O Amb24710260 [1,0,0,0,0,0|1,1,1]=4 223 B12R1.283 CCSc1ncccc1C(=O)O Amb1126492 [1,0,0,0,0,0|1,1,1]=4 224 B12R1.283 CNCc1[n]cccc1C(O)=O Amb25089548 [1,0,0,0,0,0|3,0,0]=4 225 B12R1.283 CNCc1ccccc1C(=O)O Amb2119454 [1,0,0,0,0,0|2,0,0]=3 226 B12R1.283 CNCc1ccccc1C(O)=O Amb19649750 [1,0,0,0,0,0|2,0,0]=3 227 B12R1.283 COCc1c[n]ccc1C(O)=O Amb25760815 [1,0,0,0,0,0|3,0,0]=4 228 B12R1.283 COCc1ccc[n]c1C(O)=O Amb19002412 [1,0,0,0,0,0|3,0,0]=4 229 B12R1.283 COCc1ccccc1C(=O)Cl Amb24101335 [1,0,0,0,0,0|3,0,0]=4 230 B12R1.283 CONc1[n]cccc1C(O)=O Amb25787950 [1,0,0,0,0,0|3,0,0]=4 231 B12R1.283 CSCc1ccc[n]c1C(O)=O Amb18303078 [1,0,0,0,0,0|3,0,0]=4 232 B12R1.283 CSCc1ccccc1C(=O)O Amb17498201 [1,0,0,0,0,0|2,0,0]=3 233 B12R1.283 CSSc1ccccc1C(O)=O Amb25831302 [1,0,0,0,0,0|1,1,0]=3 234 B12R1.283 C\C=C\c1ccccc1C(N)=O Amb20248380 [1,0,0,0,0,0|2,0,0]=3 235 B12R1.283 C\C=C\c1ccccc1[C@H](C)O Amb25107632 [1,0,0,0,0,0|2,0,1]=4 236 B12R1.283 C\C=N\c1ccccc1C(N)=O Amb24106746 [1,0,0,0,0,0|2,0,0]=3 237 B12R1.283 C\C=N\c1ccccc1C(O)=O Amb24595764 [1,0,0,0,0,0|1,0,0]=2 238 B12R1.283 N=C(\N)/c1ccccc1OCC Amb20619399 [1,0,0,0,0,0|2,0,1]=4 239 B12R1.283 NCCc1ccccc1C(O)=O Amb21857779 [1,0,0,0,0,0|2,0,1]=4 240 B12R1.283 NOCc1ccccc1C(O)=O Amb24558153 [1,0,0,0,0,0|3,0,0]=4 241 B12R1.283 O=C=Nc1ccccc1C(=O)Cl Amb15741174 [1,0,0,0,0,0|2,0,1]=4 242 B12R1.283 O=CCc1ccccc1C(=O)O Amb17594062 [1,0,0,0,0,0|1,0,0]=2 243 B12R1.283 OC(=O)c1c[n]ccc1NC=O Amb24561920 [1,0,0,0,0,0|2,0,0]=3 244 B12R1.283 OC(=O)c1ccccc1CCO Amb18646472 [1,0,0,0,0,0|1,0,2]=4 245 B12R1.283 OC(=O)c1ccccc1CCS Amb25701712 [1,0,0,0,0,0|1,1,1]=4 246 B12R1.283 OC(=O)c1ccccc1CNO Amb25101603 [1,0,0,0,0,0|2,0,1]=4 247 B12R1.283 OC(=O)c1ccccc1COCl Amb25320975 [1,0,0,0,0,0|3,0,0]=4 248 B12R1.283 OC(=O)c1ccccc1\C=N/O Amb21811522 [1,0,0,0,0,0|2,0,1]=4 249 B12R1.283 OC(=O)c1ccccc1\N=N\O Amb24519485 [1,0,0,0,0,0|2,0,1]=4 250 B12R1.283 [N-]=[N+]=Nc1ccccc1C(O)=O Amb19889279 [1,0,0,0,0,0|3,0,0]=4 251 B12R1.283 [O-][N+](=O)c1ccccc1CC=O Amb25292155 [1,0,0,0,0,0|2,0,1]=4 252 B14R1.164 CC(=O)Cc1cc(Br)ccc1B(O)O Amb24679454 [0,1,0,0,0,0|2,0,1]=4 253 B14R1.164 CC(=O)Cc1cc(Br)ccc1C(O)=O Amb18692659 [0,1,0,0,0,0|1,0,0]=2 254 B14R1.164 CC(=O)Cc1cc(F)ccc1[N+]([O-])=O Amb24735602 [0,1,0,0,0,0|2,0,1]=4 255 B14R1.164 CC(=O)Cc1cc(I)ccc1[N+]([O-])=O Amb24656396 [0,1,0,0,0,0|2,0,1]=4 256 B14R1.164 CC(=O)Cc1cc(N)ccc1[N+]([O-])=O Amb24695662 [0,1,0,0,0,0|2,0,1]=4 257 B14R1.164 CC(=O)Cc1cc(O)ccc1B(O)O Amb25278670 [0,1,0,0,0,0|2,0,1]=4 258 B14R1.164 CC(=O)Cc1cc(S)ccc1[N+]([O-])=O Amb24754543 [0,1,0,0,0,0|2,0,1]=4 259 B14R1.164 CC(=O)Nc1[n]c(C)ccc1C(O)=O Amb24105953 [0,1,0,0,0,0|2,0,0]=3 260 B14R1.164 CC(=O)Nc1cc(Br)ccc1C(=O)O Amb13951513 [0,1,0,0,0,0|1,0,0]=2 261 B14R1.164 CC(=O)Nc1cc(Br)ccc1C(N)=O Amb25841440 [0,1,0,0,0,0|2,0,0]=3 262 B14R1.164 CC(=O)Nc1cc(C)ccc1C(O)=O Amb24105949 [0,1,0,0,0,0|1,0,0]=2 263 B14R1.164 CC(=O)Nc1cc(Cl)ccc1C(=O)O Amb1114653 [0,1,0,0,0,0|1,0,0]=2 264 B14R1.164 CC(=O)Nc1cc(F)ccc1B(O)O Amb25060598 [0,1,0,0,0,0|2,0,1]=4 265 B14R1.164 CC(=O)Nc1cc(F)ccc1C(=O)O Amb1141138 [0,1,0,0,0,0|1,0,0]=2 266 B14R1.164 CC(=O)Nc1cc(N)ccc1C(N)=O Amb18651448 [0,1,0,0,0,0|2,0,0]=3 267 B14R1.164 CC(=O)Nc1cc(N)ccc1C(O)=O Amb18651729 [0,1,0,0,0,0|1,0,0]=2 268 B14R1.164 CC(=O)Nc1cc(O)ccc1C(O)=O Amb24373128 [0,1,0,0,0,0|1,0,0]=2 269 B14R1.164 CC(=O)Nc1cc(O)ccc1[N+]([O-])=O Amb22363473 [0,1,0,0,0,0|2,0,1]=4 270 B14R1.164 CC(=O)Oc1cc(Br)ccc1C(O)=O Amb18137234 [0,1,0,0,0,0|0,0,0]=1 271 B14R1.164 CC(=O)Oc1cc(C)ccc1C(=O)Cl Amb25140989 [0,1,0,0,0,0|1,0,0]=2 272 B14R1.164 CC(=O)Oc1cc(C)ccc1C(O)=O Amb20668016 [0,1,0,0,0,0|0,0,0]=1 273 B14R1.164 CC(=O)Oc1cc(Cl)ccc1C(O)=O Amb22462311 [0,1,0,0,0,0|0,0,0]=1 274 B14R1.164 CC(=O)Oc1cc(F)ccc1C(O)=O Amb24092874 [0,1,0,0,0,0|0,0,0]=1 275 B14R1.164 CC(=O)Oc1cc(O)ccc1C(O)=O Amb25295513 [0,1,0,0,0,0|0,0,0]=1 276 B14R1.164 CC(=O)Sc1cc(N)ccc1C(O)=O Amb24469325 [0,1,0,0,0,0|0,1,0]=2 277 B14R1.164 CC(=O)c1c[n]c(C)cc1NC(C)=O Amb21963775 [0,1,0,0,0,0|3,0,0]=4 278 B14R1.164 CC(=O)c1ccc(Br)cc1OC(C)C Amb25812293 [0,1,0,0,0,0|2,0,1]=4 279 B14R1.164 CC(=O)c1ccc(F)cc1OC(C)C Amb19043619 [0,1,0,0,0,0|2,0,1]=4 280 B14R1.164 CC(=O)c1ccc(O)cc1NC(C)=O Amb25165958 [0,1,0,0,0,0|2,0,0]=3 281 B14R1.164 CC(=O)c1ccc(O)cc1OC(C)=O Amb18651686 [0,1,0,0,0,0|1,0,0]=2 282 B14R1.164 CC(C)Cc1cc(F)ccc1C(O)=O Amb25849083 [0,1,0,0,0,0|2,0,1]=4 283 B14R1.164 CC(C)Cc1cc(O)ccc1C(O)=O Amb25321011 [0,1,0,0,0,0|2,0,1]=4 284 B14R1.164 CC(C)Nc1cc(Br)ccc1C(O)=O Amb25094280 [0,1,0,0,0,0|2,0,1]=4 285 B14R1.164 CC(C)Nc1cc(Cl)ccc1C(O)=O Amb18303161 [0,1,0,0,0,0|2,0,1]=4 286 B14R1.164 CC(C)Oc1[n]c(Cl)ccc1C(O)=O Amb25795655 [0,1,0,0,0,0|2,0,1]=4 287 B14R1.164 CC(C)Oc1cc(Cl)ccc1C(O)=O Amb18292086 [0,1,0,0,0,0|1,0,1]=3 288 B14R1.164 CC(C)Oc1cc(F)ccc1C(O)=O Amb24500009 [0,1,0,0,0,0|1,0,1]=3 289 B14R1.164 CC(C)Oc1cc(N)c[n]c1C(O)=O Amb25348580 [0,1,0,0,0,0|2,0,1]=4 290 B14R1.164 CC(C)Oc1cc(O)ccc1C(N)=O Amb25808562 [0,1,0,0,0,0|2,0,1]=4 291 B14R1.164 CC(C)Sc1cc(Br)ccc1C(O)=O Amb25700758 [0,1,0,0,0,0|1,1,1]=4 292 B14R1.164 CC(C)Sc1cc(Cl)ccc1C(O)=O Amb25818755 [0,1,0,0,0,0|1,1,1]=4 293 B14R1.164 CC(N)Cc1cc(Br)ccc1C(O)=O Amb25695291 [0,1,0,0,0,0|2,0,1]=4 294 B14R1.164 CC(N)Cc1cc(F)ccc1C(O)=O Amb25829376 [0,1,0,0,0,0|2,0,1]=4 295 B14R1.164 CC(N)Cc1cc(N)ccc1C(O)=O Amb25772888 [0,1,0,0,0,0|2,0,1]=4 296 B14R1.164 CN(C)Cc1cc(Cl)ccc1C(O)=O Amb24758868 [0,1,0,0,0,0|3,0,0]=4 297 B14R1.164 CS(=O)Nc1cc(F)ccc1C(O)=O Amb24601473 [0,1,0,0,0,0|2,0,0]=3 298 B14R1.164 C[C@H](N)Cc1cc(N)ccc1C(O)=O Amb24347186 [0,1,0,0,0,0|2,0,1]=4 299 B14R1.164 C[C@H](N)Cc1cc(O)ccc1C(O)=O Amb24757836 [0,1,0,0,0,0|2,0,1]=4 300 B14R1.164 Cc1cc(NC(N)=O)c(cc1)C(O)=O Amb24677784 [0,1,0,0,0,0|2,0,0]=3 301 B14R1.164 Cc1cc(OC(F)F)c(cc1)C(O)=O Amb18977579 [0,1,0,0,0,0|2,0,1]=4 302 B14R1.164 Cc1ccc(c(CC(C)N)c1)C(O)=O Amb24498916 [0,1,0,0,0,0|2,0,1]=4 303 B14R1.164 Cc1ccc(c(C[C@H](C)N)c1)C(O)=O Amb25305743 [0,1,0,0,0,0|2,0,1]=4 304 B14R1.164 Cc1ccc(c([n]1)OC(C)C)C(O)=O Amb18995654 [0,1,0,0,0,0|2,0,1]=4 305 B14R1.164 Cc1ccc(c(c1)NC(C)C)C(O)=O Amb18995594 [0,1,0,0,0,0|2,0,1]=4 306 B14R1.164 Cc1ccc(c(c1)OC(C)C)C(O)=O Amb18977578 [0,1,0,0,0,0|1,0,1]=3 307 B14R1.164 Cc1ccc(c(c1)SC(C)C)C(O)=O Amb24525382 [0,1,0,0,0,0|1,1,1]=4 308 B14R1.164 NC(=O)Nc1cc(Cl)ccc1C(=O)O Amb1119142 [0,1,0,0,0,0|2,0,0]=3 309 B14R1.164 NC(=O)Nc1cc(F)ccc1C(=O)O Amb1134922 [0,1,0,0,0,0|2,0,0]=3 310 B14R1.164 NC(=O)Nc1cc(N)ccc1C(O)=O Amb24706105 [0,1,0,0,0,0|2,0,0]=3 311 B14R1.164 Nc1cc(CC(O)=O)c(cc1)C(O)=O Amb24091187 [0,1,0,0,0,0|2,0,0]=3 312 B14R1.164 Nc1cc(OC(F)F)c(cc1)C(O)=O Amb24687501 [0,1,0,0,0,0|2,0,1]=4 313 B14R1.164 OC(=O)C1=CNC(=O)C=C1CC(O)=O Amb18812693 [0,1,0,0,0,0|3,0,0]=4 314 B14R1.164 OC(=O)Cc1cc(C)ccc1C(=O)O Amb17190433 [0,1,0,0,0,0|2,0,0]=3 315 B14R1.164 OC(=O)c1ccc(Br)cc1CC(O)=O Amb22495493 [0,1,0,0,0,0|2,0,0]=3 316 B14R1.164 OC(=O)c1ccc(F)cc1CC(O)=O Amb22495676 [0,1,0,0,0,0|2,0,0]=3 317 B14R1.164 OC(=O)c1ccc(F)cc1OC(F)F Amb20622498 [0,1,0,0,0,0|2,0,1]=4 318 B14R1.164 OC(=O)c1ccc(O)[n]c1CC(O)=O Amb25665926 [0,1,0,0,0,0|3,0,0]=4 319 B14R1.164 OC(=O)c1ccc(O)cc1CC(O)=O Amb25363259 [0,1,0,0,0,0|2,0,0]=3 320 B14R1.429 CC(=O)C(=O)c1ccccc1[N+](=O)[O-] Amb17401697 [0,1,0,0,0,0|2,0,1]=4 321 B14R1.429 CC(=O)C(Br)c1ccccc1B(O)O Amb25376213 [0,1,0,0,0,0|2,0,1]=4 322 B14R1.429 CC(=O)C(Br)c1ccccc1[N+]([O-])=O Amb25365364 [0,1,0,0,0,0|2,0,1]=4 323 B14R1.429 CC(=O)C(C)c1ccccc1C(O)=O Amb25779999 [0,1,0,0,0,0|1,0,0]=2 324 B14R1.429 CC(=O)C(N)c1c[n]ccc1C(O)=O Amb24470660 [0,1,0,0,0,0|2,0,0]=3 325 B14R1.429 CC(=O)C(N)c1ccccc1C(O)=O Amb24714718 [0,1,0,0,0,0|1,0,0]=2 326 B14R1.429 CC(=O)C(c1ccccc1C(=O)O)Cl Amb17477656 [0,1,0,0,0,0|1,0,0]=2 327 B14R1.429 CC(=O)N(C)c1ccccc1B(O)O Amb25076823 [0,1,0,0,0,0|2,0,1]=4 328 B14R1.429 CC(=O)N(N)c1ccccc1[N+]([O-])=O Amb18565626 [0,1,0,0,0,0|2,0,1]=4 329 B14R1.429 CC(=O)N(c1ccccc1C(=O)O)C Amb1235492 [0,1,0,0,0,0|1,0,0]=2 330 B14R1.429 CC(=O)c1ccccc1C(=O)C(O)=O Amb24498217 [0,1,0,0,0,0|3,0,0]=4 331 B14R1.429 CC(=O)c1ccccc1C(C)C(O)=O Amb18651109 [0,1,0,0,0,0|3,0,0]=4 332 B14R1.429 CC(=O)c1ccccc1C(O)C(O)=O Amb17678765 [0,1,0,0,0,0|3,0,0]=4 333 B14R1.429 CC(=O)c1ccccc1[C@@H](O)C(O)=O Amb22744775 [0,1,0,0,0,0|3,0,0]=4 334 B14R1.429 CC(C(=O)c1ccccc1C(=O)O)C Amb17595033 [0,1,0,0,0,0|2,0,1]=4 335 B14R1.429 CC(C(O)=O)c1ccccc1C(N)=O Amb25116693 [0,1,0,0,0,0|3,0,0]=4 336 B14R1.429 CC(C)C(=C)c1ccccc1C(O)=O Amb25767319 [0,1,0,0,0,0|2,0,1]=4 337 B14R1.429 CC(C)S(=O)c1ccccc1C(O)=O Amb18289842 [0,1,0,0,0,0|1,1,1]=4 338 B14R1.429 CC(C)[C@@H](N)c1ccccc1C(O)=O Amb25771276 [0,1,0,0,0,0|2,0,1]=4 339 B14R1.429 CC(O)[C@@H](N)c1ccccc1C(O)=O Amb24682451 [0,1,0,0,0,0|1,0,2]=4 340 B14R1.429 CC(c1ccccc1C(O)=O)C(O)=O Amb18651689 [0,1,0,0,0,0|2,0,0]=3 341 B14R1.429 CN(C(=O)c1ccccc1C(=O)O)C Amb1131235 [0,1,0,0,0,0|3,0,0]=4 342 B14R1.429 CN(O)C(=O)c1ccccc1C(O)=O Amb22441621 [0,1,0,0,0,0|2,0,1]=4 343 B14R1.429 C[C@@H](O)[C@@H](N)c1ccccc1C(O)=O Amb25672566 [0,1,0,0,0,0|1,0,2]=4 344 B14R1.429 C[C@H](N)[C@@H](N)c1ccccc1C(O)=O Amb24610238 [0,1,0,0,0,0|2,0,1]=4 345 B14R1.429 C[C@H](O)[C@H](N)c1ccccc1C(O)=O Amb25749761 [0,1,0,0,0,0|1,0,2]=4 346 B14R1.429 ClC(=O)[C@@H](c1ccccc1C(=O)C)O Amb16231851 [0,1,0,0,0,0|3,0,0]=4 347 B14R1.429 NC(=O)N(c1ccccc1C(=O)O)C Amb1117915 [0,1,0,0,0,0|2,0,0]=3 348 B14R1.429 NC(=O)c1ccccc1C(=O)C(O)=O Amb25211671 [0,1,0,0,0,0|3,0,0]=4 349 B14R1.429 NC(=O)c1ccccc1C(N)C(O)=O Amb25731846 [0,1,0,0,0,0|3,0,0]=4 350 B14R1.429 NC(c1ccc[n]c1C(O)=O)C(O)=O Amb25183039 [0,1,0,0,0,0|3,0,0]=4 351 B14R1.429 NC(c1ccccc1C(O)=O)C(O)=O Amb24065083 [0,1,0,0,0,0|2,0,0]=3 352 B14R1.429 N[C@@H](c1[n]cccc1C(O)=O)C(O)=O Amb25760645 [0,1,0,0,0,0|3,0,0]=4 353 B14R1.429 N[C@@H](c1c[n]ccc1C(O)=O)C(O)=O Amb24737620 [0,1,0,0,0,0|3,0,0]=4 354 B14R1.429 N[C@H](c1[n]cccc1C(O)=O)C(O)=O Amb24559931 [0,1,0,0,0,0|3,0,0]=4 355 B14R1.429 N[C@H](c1c[n]ccc1C(O)=O)C(O)=O Amb24648724 [0,1,0,0,0,0|3,0,0]=4 356 B14R1.429 OC(=O)[C@H](c1ccccc1C(=O)C)O Amb16232558 [0,1,0,0,0,0|3,0,0]=4 357 B14R1.429 OC(=O)c1[n]cccc1C(=O)C(O)=O Amb22585941 [0,1,0,0,0,0|3,0,0]=4 358 B14R1.429 OC(c1ccccc1C(O)=O)C(O)=O Amb25181668 [0,1,0,0,0,0|2,0,0]=3 359 B14R1.744 CC(=C)Sc1ccccc1C(=O)NC Amb24383140 [0,1,0,0,0,0|2,1,0]=4 360 B14R1.744 CC(=O)Nc1[n]cccc1C(=O)OC Amb25712630 [0,1,0,0,0,0|2,0,0]=3 361 B14R1.744 CC(=O)Nc1cc[n]cc1C(=O)NN Amb24669057 [0,1,0,0,0,0|3,0,0]=4 362 B14R1.744 CC(=O)Nc1cc[n]cc1C(=O)OC Amb20248237 [0,1,0,0,0,0|2,0,0]=3 363 B14R1.744 CC(=O)Nc1ccc[n]c1C(=O)OC Amb25165740 [0,1,0,0,0,0|2,0,0]=3 364 B14R1.744 CC(=O)Nc1ccccc1C(=O)C=O Amb24630379 [0,1,0,0,0,0|1,0,1]=3 365 B14R1.744 CC(=O)Nc1ccccc1C(=O)CBr Amb17777321 [0,1,0,0,0,0|2,0,0]=3 366 B14R1.744 CC(=O)Nc1ccccc1C(=O)CCl Amb17843143 [0,1,0,0,0,0|2,0,0]=3 367 B14R1.744 CC(=O)Nc1ccccc1C(=O)CO Amb25036818 [0,1,0,0,0,0|1,0,0]=2 368 B14R1.744 CC(=O)Nc1ccccc1C(N)=NO Amb19050954 [0,1,0,0,0,0|2,0,0]=3 369 B14R1.744 CC(=O)Nc1ccccc1C(N)CO Amb25122728 [0,1,0,0,0,0|2,0,1]=4 370 B14R1.744 CC(=O)Nc1ccccc1C(O)C#C Amb24073046 [0,1,0,0,0,0|2,0,1]=4 371 B14R1.744 CC(=O)Nc1ccccc1C(O)CC Amb24441516 [0,1,0,0,0,0|2,0,1]=4 372 B14R1.744 CC(=O)Nc1ccccc1N(C)C=O Amb24743203 [0,1,0,0,0,0|3,0,0]=4 373 B14R1.744 CC(=O)Nc1ccccc1[C@@H](N)CO Amb25728078 [0,1,0,0,0,0|2,0,1]=4 374 B14R1.744 CC(=O)Nc1ccccc1\C(\F)=C/C Amb25219861 [0,1,0,0,0,0|3,0,0]=4 375 B14R1.744 CC(=O)Nc1ccccc1\C(\F)=C\C Amb25758018 [0,1,0,0,0,0|3,0,0]=4 376 B14R1.744 CC(=O)Sc1ccccc1C(=O)NC Amb24336750 [0,1,0,0,0,0|1,1,0]=3 377 B14R1.744 CC(=S)Nc1ccccc1C(=O)OC Amb25815553 [0,1,0,0,0,0|1,1,0]=3 378 B14R1.744 CC(C)=Nc1ccccc1C(=O)NN Amb25363811 [0,1,0,0,0,0|3,0,0]=4 379 B14R1.744 CC(C)Oc1ccccc1C(=O)NN Amb23452441 [0,1,0,0,0,0|2,0,1]=4 380 B14R1.744 CNC(=O)c1ccccc1OC(C)C Amb25665401 [0,1,0,0,0,0|2,0,1]=4 381 B14R1.744 COC(=O)c1ccccc1CC(O)=O Amb18651690 [0,1,0,0,0,0|2,0,0]=3 382 B14R1.744 COC(=O)c1ccccc1NC(=O)Cl Amb24530640 [0,1,0,0,0,0|2,0,0]=3 383 B14R1.744 COC(=O)c1ccccc1NC(N)=N Amb18565202 [0,1,0,0,0,0|3,0,0]=4 384 B14R1.744 COC(=O)c1ccccc1OC(F)F Amb1946242 [0,1,0,0,0,0|2,0,1]=4 385 B14R1.744 CSC(=O)c1ccccc1NC(N)=O Amb25678522 [0,1,0,0,0,0|2,1,0]=4 386 B14R1.744 C\C(=N\O)\c1ccccc1CC(O)=O Amb24373166 [0,1,0,0,0,0|3,0,0]=4 387 B14R1.744 C\C(=N\O)\c1ccccc1OS([O-])=O Amb24712655 [0,1,0,0,0,0|3,0,0]=4 388 B14R1.744 N\C(=N/O)\c1ccccc1NC(N)=O Amb19051483 [0,1,0,0,0,0|3,0,0]=4 389 B14R1.815 CC(=C)Cc1ccccc1[As](O)(O)=O Amb22367925 [0,1,0,0,0,0|3,0,0]=4 390 B14R1.815 CC(=O)Nc1ccccc1C(C)(C)O Amb24309876 [0,1,0,0,0,0|2,0,1]=4 391 B14R1.815 CC(=O)Nc1ccccc1S(=O)(=O)Cl Amb18560183 [0,1,0,0,0,0|2,0,1]=4 392 B14R1.815 CC(=O)Nc1ccccc1S(N)(=O)=O Amb25122412 [0,1,0,0,0,0|2,0,1]=4 393 B14R1.815 CC(=O)Nc1ccccc1S(O)(=O)=O Amb25081401 [0,1,0,0,0,0|2,0,0]=3 394 B14R1.815 CC(=O)Oc1ccccc1C(F)(F)F Amb10840591 [0,1,0,0,0,0|2,0,1]=4 395 B14R1.815 CC(=O)Oc1ccccc1S(=O)(=O)Cl Amb25707598 [0,1,0,0,0,0|1,0,1]=3 396 B14R1.815 CC(=O)Oc1ccccc1S(C)(=O)=O Amb24471440 [0,1,0,0,0,0|1,0,1]=3 397 B14R1.815 CC(=O)Oc1ccccc1[B-](F)(F)F Amb24503639 [0,1,0,0,0,0|3,0,0]=4 398 B14R1.815 CS(O)(=O)=C1C=CC=CC1=CC(O)=O Amb25185797 [0,1,0,0,0,0|3,0,0]=4 399 B14R1.3302 C=CC(=O)Nc1[n]cccc1C(O)=O Amb25163919 [0,1,0,0,0,0|2,0,1]=4 400 B14R1.3302 C=CC(=O)Nc1c[n]ccc1C(O)=O Amb24443685 [0,1,0,0,0,0|2,0,1]=4 401 B14R1.3302 C=CC(=O)Nc1ccc[n]c1C(O)=O Amb25742566 [0,1,0,0,0,0|2,0,1]=4 402 B14R1.3302 CC(=C)c1ccccc1NC(=O)CC Amb24462788 [0,1,0,0,0,0|3,0,0]=4 403 B14R1.3302 CC(=O)c1ccccc1NC(=O)C#C Amb25690280 [0,1,0,0,0,0|2,0,1]=4 404 B14R1.3302 CC(=O)c1ccccc1NC(=O)CN Amb25694749 [0,1,0,0,0,0|2,0,0]=3 405 B14R1.3302 CC(=O)c1ccccc1NS(=O)CC Amb24536729 [0,1,0,0,0,0|3,0,0]=4 406 B14R1.3302 CC(=O)c1ccccc1OC(C)C#N Amb19077656 [0,1,0,0,0,0|2,0,1]=4 407 B14R1.3302 CC(=O)c1ccccc1\C=C(/C)\C=O Amb24689468 [0,1,0,0,0,0|2,0,0]=3 408 B14R1.3302 CC(C#C)Nc1ccccc1C(O)=O Amb25042094 [0,1,0,0,0,0|2,0,1]=4 409 B14R1.3302 CC(C#C)Oc1c[n]ccc1C(O)=O Amb24674746 [0,1,0,0,0,0|2,0,1]=4 410 B14R1.3302 CC(C#N)Oc1ccc[n]c1C(O)=O Amb18981158 [0,1,0,0,0,0|2,0,1]=4 411 B14R1.3302 CC(C#N)Oc1ccccc1C(N)=O Amb19078136 [0,1,0,0,0,0|2,0,1]=4 412 B14R1.3302 CC(C#N)Oc1ccccc1C(O)=O Amb18294776 [0,1,0,0,0,0|1,0,1]=3 413 B14R1.3302 CC(C#N)Sc1ccccc1C(O)=O Amb18979408 [0,1,0,0,0,0|1,1,1]=4 414 B14R1.3302 CC(C=C)Nc1ccccc1C(O)=O Amb18650849 [0,1,0,0,0,0|2,0,1]=4 415 B14R1.3302 CC(CN)Nc1ccccc1C(O)=O Amb24371440 [0,1,0,0,0,0|2,0,1]=4 416 B14R1.3302 CC(O)c1ccccc1NC(=O)CBr Amb25070011 [0,1,0,0,0,0|2,0,1]=4 417 B14R1.3302 CC(O)c1ccccc1NC(=O)CCl Amb24367128 [0,1,0,0,0,0|2,0,1]=4 418 B14R1.3302 CC(O)c1ccccc1NC(=O)CN Amb18978684 [0,1,0,0,0,0|2,0,1]=4 419 B14R1.3302 CCC(=O)Cc1ccccc1C(=O)O Amb17477493 [0,1,0,0,0,0|1,0,0]=2 420 B14R1.3302 CCC(=O)Nc1cc[n]cc1C(O)=O Amb25214845 [0,1,0,0,0,0|2,0,0]=3 421 B14R1.3302 CCC(=O)Nc1ccccc1B(O)O Amb25081422 [0,1,0,0,0,0|2,0,1]=4 422 B14R1.3302 CCC(=O)Nc1ccccc1C(=O)O Amb1119058 [0,1,0,0,0,0|1,0,0]=2 423 B14R1.3302 CCC(=O)Oc1ccccc1C(=O)Cl Amb20620189 [0,1,0,0,0,0|1,0,0]=2 424 B14R1.3302 CCC(=O)Oc1ccccc1C(=O)O Amb17595080 [0,1,0,0,0,0|0,0,0]=1 425 B14R1.3302 CCC(Cc1ccccc1C(=O)O)Cl Amb17477466 [0,1,0,0,0,0|2,0,1]=4 426 B14R1.3302 CCC(Cc1ccccc1C(=O)O)O Amb17477452 [0,1,0,0,0,0|1,0,2]=4 427 B14R1.3302 CNC(=O)Nc1[n]cc[n]c1C(O)=O Amb25787035 [0,1,0,0,0,0|3,0,0]=4 428 B14R1.3302 CNC(=O)Nc1cc[n]cc1C(O)=O Amb25259481 [0,1,0,0,0,0|2,0,0]=3 429 B14R1.3302 CNC(=O)Nc1ccc[n]c1C(O)=O Amb25856564 [0,1,0,0,0,0|2,0,0]=3 430 B14R1.3302 CNC(=O)Nc1ccccc1C(N)=O Amb25689855 [0,1,0,0,0,0|2,0,0]=3 431 B14R1.3302 CNC(=O)Nc1ccccc1C(N)=S Amb25776420 [0,1,0,0,0,0|2,1,0]=4 432 B14R1.3302 CNC(=O)Nc1ccccc1C(O)=O Amb18951734 [0,1,0,0,0,0|1,0,0]=2 433 B14R1.3302 CNC(=O)Oc1ccc[n]c1[N+]([O-])=O Amb25269531 [0,1,0,0,0,0|2,0,1]=4 434 B14R1.3302 CNC(=O)Oc1ccccc1C(N)=O Amb24693990 [0,1,0,0,0,0|1,0,0]=2 435 B14R1.3302 CNC(=O)Oc1ccccc1N(C)C Amb25759092 [0,1,0,0,0,0|3,0,0]=4 436 B14R1.3302 CNC(=S)Nc1ccccc1C(O)=O Amb23129366 [0,1,0,0,0,0|1,1,0]=3 437 B14R1.3302 COC(=O)Cc1ccccc1C(=O)Cl Amb24095908 [0,1,0,0,0,0|2,0,0]=3 438 B14R1.3302 COC(=O)Cc1ccccc1[N+]([O-])=O Amb19958455 [0,1,0,0,0,0|2,0,1]=4 439 B14R1.3302 COC(=O)Nc1ccccc1B(O)O Amb25183393 [0,1,0,0,0,0|2,0,1]=4 440 B14R1.3302 COC(=O)Nc1ccccc1[N+]([O-])=O Amb17882805 [0,1,0,0,0,0|2,0,1]=4 441 B14R1.3302 C\C(=C\c1ccccc1[N+]([O-])=O)\C=O Amb25312827 [0,1,0,0,0,0|2,0,1]=4 442 B14R1.3302 C\C(=N\c1ccccc1C(O)=O)\OC Amb24106771 [0,1,0,0,0,0|1,0,1]=3 443 B14R1.3302 C\C(\Cc1ccccc1C(O)=O)=N/O Amb25077181 [0,1,0,0,0,0|1,0,1]=3 444 B14R1.3302 C\C(\NC)=N\c1ccccc1C(O)=O Amb24106946 [0,1,0,0,0,0|2,0,0]=3 445 B14R1.3302 C\C(\NO)=N\c1ccccc1C(O)=O Amb24518531 [0,1,0,0,0,0|1,0,1]=3 446 B14R1.3302 C\C(\Nc1ccccc1C(C)=O)=N\O Amb24562860 [0,1,0,0,0,0|2,0,1]=4 447 B14R1.3302 ClCC(=O)Nc1ccccc1C(=O)C Amb1643502 [0,1,0,0,0,0|2,0,0]=3 448 B14R1.3302 ClCC(=O)Nc1ccccc1C(=O)O Amb16205884 [0,1,0,0,0,0|1,0,0]=2 449 B14R1.3302 FCC(=O)Oc1ccccc1C(=O)O Amb17595238 [0,1,0,0,0,0|0,0,0]=1 450 B14R1.3302 NCC(=O)Nc1ccccc1C(O)=O Amb18972899 [0,1,0,0,0,0|1,0,0]=2 451 B14R1.3302 NCC(=O)Oc1ccccc1C(C)C Amb17336655 [0,1,0,0,0,0|2,0,1]=4 452 B14R1.3302 NCC(=O)Oc1ccccc1C(O)=O Amb23443835 [0,1,0,0,0,0|0,0,0]=1 453 B14R1.3302 NNC(=O)Cc1ccccc1C(O)=O Amb25074661 [0,1,0,0,0,0|2,0,0]=3 454 B14R1.3302 OC(=O)c1[n]cccc1NC(=O)CCl Amb24656722 [0,1,0,0,0,0|2,0,0]=3 455 B14R1.3302 OC(=O)c1ccccc1NC(=O)CBr Amb24104635 [0,1,0,0,0,0|1,0,0]=2 456 B14R1.3302 OC(=O)c1ccccc1NC(=O)CF Amb24498213 [0,1,0,0,0,0|1,0,0]=2 457 B14R1.3302 OC(=O)c1ccccc1NC(=O)CP Amb25183659 [0,1,0,0,0,0|1,0,0]=2 458 B14R1.3302 OC(=O)c1ccccc1NC(=O)CS Amb24464081 [0,1,0,0,0,0|1,0,0]=2 459 B14R1.3302 OC(=O)c1ccccc1NC(=O)NO Amb24106751 [0,1,0,0,0,0|2,0,0]=3 460 B14R1.3302 OC(=O)c1ccccc1OC(=O)NO Amb24355913 [0,1,0,0,0,0|1,0,0]=2 461 B14R1.3302 OCC(=O)Nc1ccccc1C(=O)C Amb1111281 [0,1,0,0,0,0|2,0,0]=3 462 B14R1.3302 [O-]N(=O)c1ccccc1NC(=O)CCl Amb22280621 [0,1,0,0,0,0|2,0,1]=4 463 B14R1.3302 [O-][N+](=O)c1ccccc1CC(=O)CCl Amb20673430 [0,1,0,0,0,0|2,0,1]=4 464 B14R1.3302 [O-][N+](=O)c1ccccc1NC(=O)CI Amb25069205 [0,1,0,0,0,0|2,0,1]=4 465 B14R1.4894 CC(=C)CN1C(=CC=CC1=O)C(O)=O Amb25287121 [0,1,0,0,0,0|3,0,0]=4 466 B14R1.4894 CC(=O)Cc1c(Cl)cccc1B(O)O Amb25270396 [0,1,0,0,0,0|2,0,1]=4 467 B14R1.4894 CC(=O)Cc1c(I)cccc1C(O)=O Amb24637080 [0,1,0,0,0,0|1,0,0]=2 468 B14R1.4894 CC(=O)Cc1c(S)cccc1[N+]([O-])=O Amb25376231 [0,1,0,0,0,0|2,0,1]=4 469 B14R1.4894 CC(=O)Cc1c(cccc1Br)C(=O)Cl Amb24679186 [0,1,0,0,0,0|2,0,0]=3 470 B14R1.4894 CC(=O)Cc1c(cccc1C)[N+]([O-])=O Amb24416805 [0,1,0,0,0,0|2,0,1]=4 471 B14R1.4894 CC(=O)Nc1c(Br)cccc1C(O)=O Amb24735443 [0,1,0,0,0,0|1,0,0]=2 472 B14R1.4894 CC(=O)Nc1c(C)cccc1[N+](=O)[O-] Amb1021869 [0,1,0,0,0,0|2,0,1]=4 473 B14R1.4894 CC(=O)Nc1c(Cl)cccc1C(=O)O Amb11184838 [0,1,0,0,0,0|1,0,0]=2 474 B14R1.4894 CC(=O)Nc1c(Cl)cccc1C(C)=C Amb24664119 [0,1,0,0,0,0|3,0,0]=4 475 B14R1.4894 CC(=O)Nc1c(Cl)cccc1C(C)=O Amb24336515 [0,1,0,0,0,0|2,0,0]=3 476 B14R1.4894 CC(=O)Nc1c(F)cccc1C(=O)O Amb10842045 [0,1,0,0,0,0|1,0,0]=2 477 B14R1.4894 CC(=O)Nc1c(F)cccc1[N+](=O)[O-] Amb16231161 [0,1,0,0,0,0|2,0,1]=4 478 B14R1.4894 CC(=O)Nc1c(cccc1Br)C(=O)Cl Amb24459752 [0,1,0,0,0,0|2,0,0]=3 479 B14R1.4894 CC(=O)Nc1c(cccc1C)C(C)=O Amb25253533 [0,1,0,0,0,0|2,0,0]=3 480 B14R1.4894 CC(=O)Nc1c(cccc1O)C(O)=O Amb24105945 [0,1,0,0,0,0|1,0,0]=2 481 B14R1.4894 CC(=O)Oc1c(C)cccc1C(=O)Cl Amb10789017 [0,1,0,0,0,0|1,0,0]=2 482 B14R1.4894 CC(=O)Oc1c(C)cccc1C(=O)N Amb10789016 [0,1,0,0,0,0|1,0,0]=2 483 B14R1.4894 CC(=O)Oc1c(Cl)cccc1C(O)=O Amb25081374 [0,1,0,0,0,0|0,0,0]=1 484 B14R1.4894 CC(=O)Oc1c(O)cccc1C(C)=O Amb24408456 [0,1,0,0,0,0|1,0,0]=2 485 B14R1.4894 CC(=O)Sc1c(Cl)cccc1C(O)=O Amb24439470 [0,1,0,0,0,0|0,1,0]=2 486 B14R1.4894 CC(=O)Sc1c(F)cccc1C(O)=O Amb25835708 [0,1,0,0,0,0|0,1,0]=2 487 B14R1.4894 CC(=O)Sc1c(cccc1C)C(O)=O Amb25063137 [0,1,0,0,0,0|0,1,0]=2 488 B14R1.4894 CC(C)Nc1c(F)cccc1C(O)=O Amb18994279 [0,1,0,0,0,0|2,0,1]=4 489 B14R1.4894 CC(C)Oc1c(F)cccc1C(O)=O Amb18994273 [0,1,0,0,0,0|1,0,1]=3 490 B14R1.4894 CC(C)Oc1c(N)cccc1C(O)=O Amb24646907 [0,1,0,0,0,0|1,0,1]=3 491 B14R1.4894 CC(C)Sc1c(F)cccc1C(O)=O Amb24510480 [0,1,0,0,0,0|1,1,1]=4 492 B14R1.4894 CC(N)Cc1c(Br)cccc1C(O)=O Amb25710350 [0,1,0,0,0,0|2,0,1]=4 493 B14R1.4894 CC(N)Cc1c(Cl)cccc1C(O)=O Amb25693137 [0,1,0,0,0,0|2,0,1]=4 494 B14R1.4894 CC(N)Cc1c(F)cccc1C(O)=O Amb25731856 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.4894 CC(Oc1c(C)cccc1C(=O)C)C Amb17235421 [0,1,0,0,0,0|2,0,1]=4 496 B14R1.4894 CC(Oc1c(Cl)cccc1C(=O)C)C Amb17241270 [0,1,0,0,0,0|2,0,1]=4 497 B14R1.4894 CN(C)Nc1c(F)cccc1C(O)=O Amb25765384 [0,1,0,0,0,0|3,0,0]=4 498 B14R1.4894 C[C@@H](N)Cc1c(Br)cccc1C(O)=O Amb24730661 [0,1,0,0,0,0|2,0,1]=4 499 B14R1.4894 C[C@@H](N)Cc1c(Cl)cccc1C(O)=O Amb25782972 [0,1,0,0,0,0|2,0,1]=4 500 B14R1.4894 C[C@@H](N)Cc1c(cccc1N)C(O)=O Amb25308368 [0,1,0,0,0,0|2,0,1]=4 501 B14R1.4894 C[C@H](N)Cc1c(Br)cccc1C(O)=O Amb25353925 [0,1,0,0,0,0|2,0,1]=4 502 B14R1.4894 C[C@H](N)Cc1c(I)cccc1C(O)=O Amb25352511 [0,1,0,0,0,0|2,0,1]=4 503 B14R1.4894 Cc1cccc(C(O)=O)c1OC(F)F Amb18289537 [0,1,0,0,0,0|2,0,1]=4 504 B14R1.4894 Cc1cccc(c1NN(C)C)C(O)=O Amb24647043 [0,1,0,0,0,0|3,0,0]=4 505 B14R1.4894 Cc1cccc(c1NS(C)=O)C(O)=O Amb24606969 [0,1,0,0,0,0|2,0,0]=3 506 B14R1.4894 Cc1cccc(c1OC(C)C)C(O)=O Amb23287268 [0,1,0,0,0,0|1,0,1]=3 507 B14R1.4894 Cc1cccc(c1SC(C)C)C(O)=O Amb18656938 [0,1,0,0,0,0|1,1,1]=4 508 B14R1.4894 NC(=O)CN1C(=CC=CC1=O)C(O)=O Amb24706337 [0,1,0,0,0,0|3,0,0]=4 509 B14R1.4894 NC(=O)Nc1c(C)cccc1C(=O)O Amb1119949 [0,1,0,0,0,0|2,0,0]=3 510 B14R1.4894 NC(=O)Nc1c(Cl)cccc1C(O)=O Amb25785341 [0,1,0,0,0,0|2,0,0]=3 511 B14R1.4894 Nc1cccc(C(O)=O)c1OC(F)F Amb25276998 [0,1,0,0,0,0|2,0,1]=4 512 B14R1.4894 Nc1cccc(c1CC(O)=O)C(O)=O Amb25121219 [0,1,0,0,0,0|2,0,0]=3 513 B14R1.4894 OC(=O)Cc1c(C)cccc1C(=O)O Amb17470871 [0,1,0,0,0,0|2,0,0]=3 514 B14R1.4894 OC(=O)Cc1c(Cl)cccc1C(=O)O Amb17471506 [0,1,0,0,0,0|2,0,0]=3 515 B14R1.4894 OC(=O)Cc1c(F)cccc1C(=O)O Amb17470969 [0,1,0,0,0,0|2,0,0]=3 516 B14R1.4894 OC(=O)c1cccc(Br)c1CC(O)=O Amb24414011 [0,1,0,0,0,0|2,0,0]=3 517 B14R1.4894 OC(=O)c1cccc(I)c1CC(O)=O Amb25723792 [0,1,0,0,0,0|2,0,0]=3 518 B14R1.4894 OC(=O)c1cccc(O)c1CC(O)=O Amb25301811 [0,1,0,0,0,0|2,0,0]=3 519 B14R1.4926 CC(=O)Cc1cccc(Br)c1C(=O)Cl Amb24695735 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.4926 CC(=O)Cc1cccc(Br)c1[N+]([O-])=O Amb25251127 [0,1,0,0,0,0|2,0,1]=4 521 B14R1.4926 CC(=O)Cc1cccc(C)c1[N+]([O-])=O Amb24405431 [0,1,0,0,0,0|2,0,1]=4 522 B14R1.4926 CC(=O)Cc1cccc(F)c1[N+]([O-])=O Amb25238777 [0,1,0,0,0,0|2,0,1]=4 523 B14R1.4926 CC(=O)Cc1cccc(I)c1B(O)O Amb24575004 [0,1,0,0,0,0|2,0,1]=4 524 B14R1.4926 CC(=O)Cc1cccc(N)c1[N+]([O-])=O Amb24637083 [0,1,0,0,0,0|2,0,1]=4 525 B14R1.4926 CC(=O)Cc1cccc(O)c1C(O)=O Amb23590101 [0,1,0,0,0,0|1,0,0]=2 526 B14R1.4926 CC(=O)Cc1cccc(S)c1B(O)O Amb24656449 [0,1,0,0,0,0|2,0,1]=4 527 B14R1.4926 CC(=O)Cc1cccc(S)c1[N+]([O-])=O Amb24637074 [0,1,0,0,0,0|2,0,1]=4 528 B14R1.4926 CC(=O)Nc1cccc(C)c1S(C)=O Amb25804050 [0,1,0,0,0,0|3,0,0]=4 529 B14R1.4926 CC(=O)Nc1cccc(C)c1[N+]([O-])=O Amb24309028 [0,1,0,0,0,0|2,0,1]=4 530 B14R1.4926 CC(=O)Nc1cccc(N)c1C(O)=O Amb20620176 [0,1,0,0,0,0|1,0,0]=2 531 B14R1.4926 CC(=O)Nc1cccc(O)c1C(N)=O Amb25814964 [0,1,0,0,0,0|2,0,0]=3 532 B14R1.4926 CC(=O)Nc1cccc(O)c1C(O)=O Amb24105952 [0,1,0,0,0,0|1,0,0]=2 533 B14R1.4926 CC(=O)Nc1cccc(c1C(=O)O)Cl Amb1039018 [0,1,0,0,0,0|1,0,0]=2 534 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])Br Amb16185695 [0,1,0,0,0,0|2,0,1]=4 535 B14R1.4926 CC(=O)Nc1cccc(c1[N+](=O)[O-])N Amb10552992 [0,1,0,0,0,0|2,0,1]=4 536 B14R1.4926 CC(=O)Oc1cccc(C)c1C(=O)Cl Amb24101208 [0,1,0,0,0,0|1,0,0]=2 537 B14R1.4926 CC(=O)Oc1cccc(C)c1[N+]([O-])=O Amb24063550 [0,1,0,0,0,0|1,0,1]=3 538 B14R1.4926 CC(=O)Oc1cccc(O)c1C(O)=O Amb25362276 [0,1,0,0,0,0|0,0,0]=1 539 B14R1.4926 CC(=O)Oc1cccc(c1C(=O)O)C Amb16230567 [0,1,0,0,0,0|0,0,0]=1 540 B14R1.4926 CC(=O)c1c(CC(O)=O)cccc1O Amb24367133 [0,1,0,0,0,0|3,0,0]=4 541 B14R1.4926 CC(=O)c1c(Cl)cccc1OC(C)C Amb25117543 [0,1,0,0,0,0|2,0,1]=4 542 B14R1.4926 CC(=O)c1c(O)cccc1OC(C)=O Amb18651673 [0,1,0,0,0,0|1,0,0]=2 543 B14R1.4926 CC(=O)c1c(O)cccc1OC(C)C Amb22912936 [0,1,0,0,0,0|2,0,1]=4 544 B14R1.4926 CC(=O)c1c(cccc1C)NC(C)=O Amb25827163 [0,1,0,0,0,0|2,0,0]=3 545 B14R1.4926 CC(C)Cc1cccc(F)c1C(O)=O Amb25314037 [0,1,0,0,0,0|2,0,1]=4 546 B14R1.4926 CC(C)Nc1cccc(Cl)c1C(O)=O Amb18995590 [0,1,0,0,0,0|2,0,1]=4 547 B14R1.4926 CC(C)Nc1cccc(F)c1C(O)=O Amb18565909 [0,1,0,0,0,0|2,0,1]=4 548 B14R1.4926 CC(C)Oc1c[n]cc(Br)c1C(O)=O Amb25771903 [0,1,0,0,0,0|2,0,1]=4 549 B14R1.4926 CC(C)Oc1cccc(N)c1C(N)=O Amb18651897 [0,1,0,0,0,0|2,0,1]=4 550 B14R1.4926 CC(C)Sc1cccc(Cl)c1C(O)=O Amb24745339 [0,1,0,0,0,0|1,1,1]=4 551 B14R1.4926 CC(C)Sc1cccc(F)c1C(O)=O Amb24498463 [0,1,0,0,0,0|1,1,1]=4 552 B14R1.4926 CC(N)Cc1cccc(Cl)c1C(O)=O Amb24724664 [0,1,0,0,0,0|2,0,1]=4 553 B14R1.4926 CC(O)Cc1cccc(O)c1C(O)=O Amb25181821 [0,1,0,0,0,0|1,0,2]=4 554 B14R1.4926 CN(C)Cc1cccc(Cl)c1C(O)=O Amb24458869 [0,1,0,0,0,0|3,0,0]=4 555 B14R1.4926 CN(C)Nc1cccc(Br)c1C(O)=O Amb25764681 [0,1,0,0,0,0|3,0,0]=4 556 B14R1.4926 CS(=O)Nc1cccc(Cl)c1C(O)=O Amb24601292 [0,1,0,0,0,0|2,0,0]=3 557 B14R1.4926 CS(=O)Nc1cccc(F)c1C(O)=O Amb24589732 [0,1,0,0,0,0|2,0,0]=3 558 B14R1.4926 C[C@@H](N)Cc1cccc(Cl)c1C(O)=O Amb24699069 [0,1,0,0,0,0|2,0,1]=4 559 B14R1.4926 C[C@@H](N)Cc1cccc(F)c1C(O)=O Amb25665158 [0,1,0,0,0,0|2,0,1]=4 560 B14R1.4926 C[C@H](N)Cc1cccc(F)c1C(O)=O Amb24564971 [0,1,0,0,0,0|2,0,1]=4 561 B14R1.4926 Cc1cc[n]c(OC(C)C)c1C(O)=O Amb25759252 [0,1,0,0,0,0|2,0,1]=4 562 B14R1.4926 Cc1cccc(CC(C)C)c1C(O)=O Amb25827909 [0,1,0,0,0,0|2,0,1]=4 563 B14R1.4926 Cc1cccc(CC(C)N)c1C(O)=O Amb25780032 [0,1,0,0,0,0|2,0,1]=4 564 B14R1.4926 Cc1cccc(CC(O)=O)c1C(O)=O Amb24415415 [0,1,0,0,0,0|2,0,0]=3 565 B14R1.4926 Cc1cccc(CC(O)=O)c1C(O)=S Amb24471380 [0,1,0,0,0,0|2,1,0]=4 566 B14R1.4926 Cc1cccc(C[C@H](C)N)c1C(O)=O Amb24499306 [0,1,0,0,0,0|2,0,1]=4 567 B14R1.4926 Cc1cccc(NC(C)C)c1C(O)=O Amb25664507 [0,1,0,0,0,0|2,0,1]=4 568 B14R1.4926 Cc1cccc(NC(N)=O)c1C(O)=O Amb18651741 [0,1,0,0,0,0|2,0,0]=3 569 B14R1.4926 Cc1cccc(SC(C)C)c1C(O)=O Amb25289225 [0,1,0,0,0,0|1,1,1]=4 570 B14R1.4926 NC(=O)Cc1cccc(O)c1C(O)=O Amb24734435 [0,1,0,0,0,0|2,0,0]=3 571 B14R1.4926 Nc1cccc(CC(O)=O)c1C(O)=O Amb24360682 [0,1,0,0,0,0|2,0,0]=3 572 B14R1.4926 OC(=O)CC=1C=CNC(=O)C1C(O)=O Amb18812694 [0,1,0,0,0,0|3,0,0]=4 573 B14R1.4926 OC(=O)c1c(Br)cccc1CC(O)=O Amb24591241 [0,1,0,0,0,0|2,0,0]=3 574 B14R1.4926 OC(=O)c1c(F)cccc1NC(O)=O Amb24101206 [0,1,0,0,0,0|2,0,0]=3 575 B14R1.4926 OC(=O)c1c(cccc1F)OC(F)F Amb25355522 [0,1,0,0,0,0|2,0,1]=4 576 B14R1.4926 Oc1cccc(OC(F)F)c1C(O)=O Amb22898830 [0,1,0,0,0,0|2,0,1]=4 577 B14R1.6074 CC(=O)Cc1ccc(Br)cc1[N+]([O-])=O Amb22001439 [0,1,0,0,0,0|2,0,1]=4 578 B14R1.6074 CC(=O)Cc1ccc(C)cc1[N+]([O-])=O Amb19516331 [0,1,0,0,0,0|2,0,1]=4 579 B14R1.6074 CC(=O)Cc1ccc(Cl)cc1[N+]([O-])=O Amb19516329 [0,1,0,0,0,0|2,0,1]=4 580 B14R1.6074 CC(=O)Cc1ccc(F)cc1C(O)=O Amb24611584 [0,1,0,0,0,0|1,0,0]=2 581 B14R1.6074 CC(=O)Cc1ccc(I)cc1B(O)O Amb25278651 [0,1,0,0,0,0|2,0,1]=4 582 B14R1.6074 CC(=O)Cc1ccc(O)cc1C(O)=O Amb18651687 [0,1,0,0,0,0|1,0,0]=2 583 B14R1.6074 CC(=O)Cc1ccc(S)cc1C(O)=O Amb24581365 [0,1,0,0,0,0|1,0,0]=2 584 B14R1.6074 CC(=O)Cc1ccc(S)cc1[N+]([O-])=O Amb24528089 [0,1,0,0,0,0|2,0,1]=4 585 B14R1.6074 CC(=O)Nc1[n]cc(C)cc1C(O)=O Amb24607311 [0,1,0,0,0,0|2,0,0]=3 586 B14R1.6074 CC(=O)Nc1[n]cc(F)cc1C(O)=O Amb22284568 [0,1,0,0,0,0|2,0,0]=3 587 B14R1.6074 CC(=O)Nc1c[n]c(Cl)cc1C(N)=O Amb22751265 [0,1,0,0,0,0|3,0,0]=4 588 B14R1.6074 CC(=O)Nc1ccc(Br)cc1N([O-])=O Amb22289970 [0,1,0,0,0,0|2,0,1]=4 589 B14R1.6074 CC(=O)Nc1ccc(C)[n]c1C(O)=O Amb25321948 [0,1,0,0,0,0|2,0,0]=3 590 B14R1.6074 CC(=O)Nc1ccc(Cl)cc1B(O)O Amb19959759 [0,1,0,0,0,0|2,0,1]=4 591 B14R1.6074 CC(=O)Nc1ccc(Cl)cc1C(N)=O Amb25326105 [0,1,0,0,0,0|2,0,0]=3 592 B14R1.6074 CC(=O)Nc1ccc(N)cc1C(O)=O Amb22904319 [0,1,0,0,0,0|1,0,0]=2 593 B14R1.6074 CC(=O)Nc1ccc(S)cc1C(O)=O Amb24638045 [0,1,0,0,0,0|1,0,0]=2 594 B14R1.6074 CC(=O)Nc1ccc(cc1B(O)O)N Amb17607234 [0,1,0,0,0,0|2,0,1]=4 595 B14R1.6074 CC(=O)Nc1ccc(cc1C(=O)O)Cl Amb1042259 [0,1,0,0,0,0|1,0,0]=2 596 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])Br Amb2389867 [0,1,0,0,0,0|2,0,1]=4 597 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])C Amb2222031 [0,1,0,0,0,0|2,0,1]=4 598 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])Cl Amb2389868 [0,1,0,0,0,0|2,0,1]=4 599 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])I Amb16192080 [0,1,0,0,0,0|2,0,1]=4 600 B14R1.6074 CC(=O)Nc1ccc(cc1[N+](=O)[O-])O Amb17618376 [0,1,0,0,0,0|2,0,1]=4 601 B14R1.6074 CC(=O)Oc1ccc(C)cc1C(=O)Cl Amb25716993 [0,1,0,0,0,0|1,0,0]=2 602 B14R1.6074 CC(=O)Oc1ccc(Cl)cc1C(=O)Cl Amb25699997 [0,1,0,0,0,0|1,0,0]=2 603 B14R1.6074 CC(=O)Oc1ccc(I)cc1C(=O)Cl Amb24520667 [0,1,0,0,0,0|1,0,0]=2 604 B14R1.6074 CC(=O)Oc1ccc(N)cc1C(O)=O Amb18652023 [0,1,0,0,0,0|0,0,0]=1 605 B14R1.6074 CC(=O)c1cc(Br)ccc1OC(O)=O Amb22228511 [0,1,0,0,0,0|2,0,0]=3 606 B14R1.6074 CC(=O)c1cc(C)ccc1OC(C)=O Amb22479818 [0,1,0,0,0,0|1,0,0]=2 607 B14R1.6074 CC(=O)c1cc(C)ccc1OC(N)=O Amb24399084 [0,1,0,0,0,0|2,0,0]=3 608 B14R1.6074 CC(=O)c1cc(C)ccc1SC(C)=O Amb25113032 [0,1,0,0,0,0|1,1,0]=3 609 B14R1.6074 CC(=O)c1cc(Cl)ccc1CC(O)=O Amb18657379 [0,1,0,0,0,0|3,0,0]=4 610 B14R1.6074 CC(=O)c1cc(I)ccc1CC(O)=O Amb24499382 [0,1,0,0,0,0|3,0,0]=4 611 B14R1.6074 CC(=O)c1cc(N)ccc1OC(C)C Amb25069220 [0,1,0,0,0,0|2,0,1]=4 612 B14R1.6074 CC(=O)c1cc(N)ccc1OC(N)=O Amb25172550 [0,1,0,0,0,0|2,0,0]=3 613 B14R1.6074 CC(=O)c1cc(S)ccc1NC(C)=O Amb25817801 [0,1,0,0,0,0|2,0,0]=3 614 B14R1.6074 CC(C)Cc1ccc(Br)cc1C(O)=O Amb25844252 [0,1,0,0,0,0|2,0,1]=4 615 B14R1.6074 CC(C)Cc1ccc(Cl)cc1C(O)=O Amb25726644 [0,1,0,0,0,0|2,0,1]=4 616 B14R1.6074 CC(C)Nc1ccc(F)cc1C(O)=O Amb18565915 [0,1,0,0,0,0|2,0,1]=4 617 B14R1.6074 CC(C)Nc1ccc(N)cc1C(O)=O Amb18970785 [0,1,0,0,0,0|2,0,1]=4 618 B14R1.6074 CC(C)Oc1[n]cc(Br)cc1C(O)=O Amb24124888 [0,1,0,0,0,0|2,0,1]=4 619 B14R1.6074 CC(C)Oc1c[n]c(N)cc1C(O)=O Amb25319404 [0,1,0,0,0,0|2,0,1]=4 620 B14R1.6074 CC(C)Oc1ccc(Br)[n]c1C(O)=O Amb23541705 [0,1,0,0,0,0|2,0,1]=4 621 B14R1.6074 CC(C)Oc1ccc(Br)cc1C(O)=O Amb21955135 [0,1,0,0,0,0|1,0,1]=3 622 B14R1.6074 CC(C)Oc1ccc(Cl)cc1C(=O)Cl Amb23443099 [0,1,0,0,0,0|2,0,1]=4 623 B14R1.6074 CC(C)Oc1ccc(F)cc1C(N)=O Amb18556522 [0,1,0,0,0,0|2,0,1]=4 624 B14R1.6074 CC(C)Sc1ccc(N)cc1C(O)=O Amb18970813 [0,1,0,0,0,0|1,1,1]=4 625 B14R1.6074 CC(N)Cc1ccc(Cl)cc1C(O)=O Amb24444137 [0,1,0,0,0,0|2,0,1]=4 626 B14R1.6074 CC(N)Cc1ccc(F)cc1C(O)=O Amb25181339 [0,1,0,0,0,0|2,0,1]=4 627 B14R1.6074 CC(Oc1ccc(cc1C(=O)C)Cl)C Amb17200450 [0,1,0,0,0,0|2,0,1]=4 628 B14R1.6074 CC(Oc1ccc(cc1C(=O)Cl)Br)C Amb16230208 [0,1,0,0,0,0|2,0,1]=4 629 B14R1.6074 CC(Oc1ccc(cc1C(=O)N)Br)C Amb2007682 [0,1,0,0,0,0|2,0,1]=4 630 B14R1.6074 CC(Oc1ccc(cc1C(=O)N)Cl)C Amb11255790 [0,1,0,0,0,0|2,0,1]=4 631 B14R1.6074 CC(Oc1ccc(cc1C(=O)O)C)C Amb17201433 [0,1,0,0,0,0|1,0,1]=3 632 B14R1.6074 CN(C)Cc1ccc(Br)cc1C(O)=O Amb24425317 [0,1,0,0,0,0|3,0,0]=4 633 B14R1.6074 CN(C)Cc1ccc(F)cc1C(O)=O Amb25299958 [0,1,0,0,0,0|3,0,0]=4 634 B14R1.6074 CS(=O)Nc1ccc(F)cc1C(O)=O Amb25177415 [0,1,0,0,0,0|2,0,0]=3 635 B14R1.6074 C[C@@H](N)Cc1ccc(Cl)cc1C(O)=O Amb24598309 [0,1,0,0,0,0|2,0,1]=4 636 B14R1.6074 C[C@@H](N)Cc1ccc(I)cc1C(O)=O Amb25665233 [0,1,0,0,0,0|2,0,1]=4 637 B14R1.6074 C[C@@H](N)Cc1ccc(N)cc1C(O)=O Amb24394417 [0,1,0,0,0,0|2,0,1]=4 638 B14R1.6074 C[C@H](N)Cc1ccc(Cl)cc1C(O)=O Amb24729370 [0,1,0,0,0,0|2,0,1]=4 639 B14R1.6074 Cc1cc(C(O)=O)c(cc1)OC(F)F Amb18977580 [0,1,0,0,0,0|2,0,1]=4 640 B14R1.6074 Cc1cc(C(O)=O)c(cc1)OC(N)=O Amb24710351 [0,1,0,0,0,0|1,0,0]=2 641 B14R1.6074 Cc1ccc(CC(C)C)c(c1)C(O)=O Amb24449736 [0,1,0,0,0,0|2,0,1]=4 642 B14R1.6074 Cc1ccc(CC(C)N)c(c1)C(O)=O Amb24355971 [0,1,0,0,0,0|2,0,1]=4 643 B14R1.6074 Cc1ccc(C[C@@H](C)N)c(c1)C(O)=O Amb25771092 [0,1,0,0,0,0|2,0,1]=4 644 B14R1.6074 Cc1ccc(C[C@H](C)N)c(c1)C(O)=O Amb24418963 [0,1,0,0,0,0|2,0,1]=4 645 B14R1.6074 Cc1ccc(NN(C)C)c(c1)C(O)=O Amb25265841 [0,1,0,0,0,0|3,0,0]=4 646 B14R1.6074 Cc1ccc(SC(C)C)c(c1)C(O)=O Amb24607198 [0,1,0,0,0,0|1,1,1]=4 647 B14R1.6074 ClC(=Cc1ccc(cc1C(=O)O)O)Cl Amb1098805 [0,1,0,0,0,0|3,0,0]=4 648 B14R1.6074 FC(Oc1ccc(cc1C(=O)O)Br)F Amb1935247 [0,1,0,0,0,0|2,0,1]=4 649 B14R1.6074 NC(=O)Nc1ccc(Br)cc1C(O)=O Amb19374063 [0,1,0,0,0,0|2,0,0]=3 650 B14R1.6074 NC(=O)Nc1ccc(N)cc1C(O)=O Amb24429488 [0,1,0,0,0,0|2,0,0]=3 651 B14R1.6074 NC(=O)Nc1ccc(O)cc1C(O)=O Amb18954497 [0,1,0,0,0,0|2,0,0]=3 652 B14R1.6074 NC(=O)Nc1ccc(cc1C(=O)O)Cl Amb1112549 [0,1,0,0,0,0|2,0,0]=3 653 B14R1.6074 NC(=S)Nc1ccc(Cl)cc1C(O)=O Amb25752345 [0,1,0,0,0,0|2,1,0]=4 654 B14R1.6074 NC(=S)Nc1ccc(F)cc1C(O)=O Amb25214021 [0,1,0,0,0,0|2,1,0]=4 655 B14R1.6074 NC(=S)Nc1ccc(cc1C(=O)O)Br Amb16229159 [0,1,0,0,0,0|2,1,0]=4 656 B14R1.6074 Nc1cc(C(O)=O)c(cc1)OC(F)F Amb19373525 [0,1,0,0,0,0|2,0,1]=4 657 B14R1.6074 Nc1cc(c(CC(O)=O)cc1)C(O)=O Amb18652022 [0,1,0,0,0,0|2,0,0]=3 658 B14R1.6074 Nc1ccc(NC(N)=S)c(c1)C(O)=O Amb25812921 [0,1,0,0,0,0|2,1,0]=4 659 B14R1.6074 OC(=O)Cc1ccc(Br)cc1N(O)=O Amb22043824 [0,1,0,0,0,0|3,0,0]=4 660 B14R1.6074 OC(=O)Cc1ccc(cc1C(=O)O)C Amb17470870 [0,1,0,0,0,0|2,0,0]=3 661 B14R1.6074 OC(=O)Cc1ccc(cc1C(=O)O)Cl Amb17471505 [0,1,0,0,0,0|2,0,0]=3 662 B14R1.6074 OC(=O)Cc1ccc(cc1C(=O)O)F Amb17470968 [0,1,0,0,0,0|2,0,0]=3 663 B14R1.6074 OC(=O)c1[n]c(Cl)ccc1CC(O)=O Amb25854271 [0,1,0,0,0,0|3,0,0]=4 664 B14R1.6074 OC(=O)c1cc(Br)ccc1CC(O)=O Amb21962765 [0,1,0,0,0,0|2,0,0]=3 665 B14R1.6074 OC(=O)c1cc(F)ccc1OC(F)F Amb22043624 [0,1,0,0,0,0|2,0,1]=4 666 B14R1.6074 OC(=O)c1cc(I)ccc1CC(O)=O Amb24664175 [0,1,0,0,0,0|2,0,0]=3 667 B14R1.6074 OC(=O)c1cc(I)ccc1OC(F)F Amb25790160 [0,1,0,0,0,0|2,0,1]=4 668 B14R1.6074 OC(=O)c1cc(O)ccc1CC(O)=O Amb18130260 [0,1,0,0,0,0|2,0,0]=3 669 B14R1.6074 OC(=O)c1cc(S)ccc1CC(O)=O Amb25747975 [0,1,0,0,0,0|2,0,0]=3 670 B14R1.6074 Oc1ccc(OC(F)F)c(c1)C(O)=O Amb24536102 [0,1,0,0,0,0|2,0,1]=4 671 B14R1.6312 CC(=O)c1ccccc1NS(=O)(=O)C Amb2409307 [0,1,0,0,0,0|3,0,0]=4 672 B14R1.6312 CC(C)(C)Nc1ccccc1C(O)=O Amb18987378 [0,1,0,0,0,0|2,0,1]=4 673 B14R1.6312 CC(C)(C)Oc1c[n]ccc1C(O)=O Amb25362830 [0,1,0,0,0,0|2,0,1]=4 674 B14R1.6312 CC(C)(C)Oc1ccccc1C(N)=O Amb22039485 [0,1,0,0,0,0|2,0,1]=4 675 B14R1.6312 CC(F)(F)Cc1ccccc1C(O)=O Amb24654223 [0,1,0,0,0,0|2,0,1]=4 676 B14R1.6312 CS(=O)(=O)Nc1[n]cccc1C(O)=O Amb25315943 [0,1,0,0,0,0|3,0,0]=4 677 B14R1.6312 CS(=O)(=O)Oc1ccccc1C(O)=O Amb25041988 [0,1,0,0,0,0|1,0,0]=2 678 B14R1.6312 C[Si](C)(C)Cc1ccccc1C(O)=O Amb17778358 [0,1,0,0,0,0|2,1,0]=4 679 B14R1.6312 C[Si](C)(C)Oc1ccccc1C(N)=O Amb25825167 [0,1,0,0,0,0|2,1,0]=4 680 B14R1.6312 NC(=O)c1ccccc1OS(O)(=O)=O Amb25186069 [0,1,0,0,0,0|3,0,0]=4 681 B14R1.6312 NS(=O)(=O)Oc1ccccc1C(O)=O Amb25036830 [0,1,0,0,0,0|2,0,0]=3 682 B14R1.6312 OC(=O)c1ccccc1CP(O)(O)=O Amb25185911 [0,1,0,0,0,0|3,0,0]=4 683 B14R1.6312 OC(=O)c1ccccc1CS(=O)(=O)C Amb17498200 [0,1,0,0,0,0|2,0,0]=3 684 B14R1.6312 OC(=O)c1ccccc1NS(O)(=O)=O Amb25103293 [0,1,0,0,0,0|3,0,0]=4 685 B14R1.6312 OC(=O)c1ccccc1OC(F)(F)F Amb2371914 [0,1,0,0,0,0|2,0,1]=4 686 B14R1.6312 OC(=O)c1ccccc1OP(=O)(O)[O-] Amb10845651 [0,1,0,0,0,0|2,0,0]=3 687 B14R1.6312 OC(=O)c1ccccc1OS(O)(=O)=O Amb21864854 [0,1,0,0,0,0|2,0,0]=3 688 B14R1.6312 [O-]C(=O)c1ccccc1OS([O-])(=O)=O Amb22354055 [0,1,0,0,0,0|2,0,1]=4 689 B14R2.287 CC1=NCC(=O)Nc2ccccc21 Amb22236112 [0,0,0,1,0,0|3,0,0]=4 690 B14R2.287 CC1=NN=C(O)c2ccccc2O1 Amb20466009 [0,0,0,1,0,0|2,0,0]=3 691 B14R2.287 CC1=NNC(=O)c2c(O1)cccc2 Amb2413907 [0,0,0,1,0,0|2,0,0]=3 692 B14R2.287 CC=1Cc2ccccc2C(=O)CC1 Amb24467578 [0,0,0,1,0,0|3,0,0]=4 693 B14R2.287 NC=1CNC(=O)c2ccccc2N1 Amb24433959 [0,0,0,1,0,0|3,0,0]=4 694 B14R2.287 O=C1C=CC(=O)Nc2ccccc12 Amb25338058 [0,0,0,1,0,0|2,0,1]=4 695 B14R2.287 O=C1C=CC(=O)Oc2ccccc12 Amb25073385 [0,0,0,1,0,0|1,0,1]=3 696 B14R2.287 O=C1C=NC(=O)c2ccccc2N1 Amb24597661 [0,0,0,1,0,0|2,0,1]=4 697 B14R2.287 O=C1CCC(=O)Nc2c[n]ccc12 Amb24426850 [0,0,0,1,0,0|3,0,0]=4 698 B14R2.287 O=C1CCC(=O)Nc2cc[n]cc12 Amb25076767 [0,0,0,1,0,0|3,0,0]=4 699 B14R2.287 O=C1CCC(=O)Oc2ccccc12 Amb25093669 [0,0,0,1,0,0|1,0,0]=2 700 B14R2.287 O=C1CCC(=O)c2c(N1)cccc2 Amb17608787 [0,0,0,1,0,0|2,0,0]=3 701 B14R2.287 O=C1CCC(=O)c2ccc[n]c2N1 Amb24351198 [0,0,0,1,0,0|3,0,0]=4 702 B14R2.287 O=C1Cc2ccccc2C(=O)CC1 Amb24492585 [0,0,0,1,0,0|2,0,0]=3 703 B14R2.287 O=C1NCC(Cl)=Nc2ccccc21 Amb18636457 [0,0,0,1,0,0|3,0,0]=4 704 B14R2.287 OC1=CCC(=O)Nc2ccccc21 Amb25827555 [0,0,0,1,0,0|2,0,0]=3 705 B14R2.712 CC(=O)c1cccc2CC(C)Oc21 Amb25755124 [0,0,0,1,0,0|2,0,1]=4 706 B14R2.712 CC(=O)c1cccc2NC(=O)Nc21 Amb23412229 [0,0,0,1,0,0|3,0,0]=4 707 B14R2.712 CC(=O)c1cccc2NC(=O)Oc12 Amb18547332 [0,0,0,1,0,0|2,0,0]=3 708 B14R2.712 CC(=O)c1cccc2OC(=O)Nc12 Amb20663539 [0,0,0,1,0,0|3,0,0]=4 709 B14R2.712 CC(=O)c1cccc2[n]c(I)oc12 Amb25223401 [0,0,0,1,0,0|3,0,0]=4 710 B14R2.712 CC(=O)c1cccc2[n]c([SH3])oc12 Amb18547371 [0,0,0,1,0,0|2,1,0]=4 711 B14R2.712 CC(C)c1cccc2CC(=O)Oc12 Amb24616099 [0,0,0,1,0,0|2,0,1]=4 712 B14R2.712 CC1Cc2c(cccc2C(O)=O)N1 Amb25775338 [0,0,0,1,0,0|2,0,1]=4 713 B14R2.712 CC1Cc2c(cccc2C(O)=O)S1 Amb24531490 [0,0,0,1,0,0|1,1,1]=4 714 B14R2.712 CC1Cc2cccc(C(=O)Cl)c2O1 Amb24092008 [0,0,0,1,0,0|2,0,1]=4 715 B14R2.712 CC1Cc2cccc(C(O)=O)c2N1 Amb24119182 [0,0,0,1,0,0|2,0,1]=4 716 B14R2.712 CC1Cc2cccc(C(O)=O)c2O1 Amb18128119 [0,0,0,1,0,0|1,0,1]=3 717 B14R2.712 CC1Oc2cccc(C(O)=O)c2O1 Amb24711585 [0,0,0,1,0,0|0,0,2]=3 718 B14R2.712 CN1Cc2cccc(C(O)=O)c2C1 Amb24640447 [0,0,0,1,0,0|3,0,0]=4 719 B14R2.712 C[C@@H]1Cc2c(cccc2C(O)=O)N1 Amb24588913 [0,0,0,1,0,0|2,0,1]=4 720 B14R2.712 C[C@@H]1Cc2cccc(C(O)=O)c2N1 Amb24659771 [0,0,0,1,0,0|2,0,1]=4 721 B14R2.712 C[C@H]1Cc2c(cccc2C(O)=O)N1 Amb24494764 [0,0,0,1,0,0|2,0,1]=4 722 B14R2.712 C[n]1[n]c2cccc(C(O)=O)c2[n]1 Amb23403588 [0,0,0,1,0,0|3,0,0]=4 723 B14R2.712 C[n]1cc2c(cccc2C(O)=O)[n]1 Amb21928007 [0,0,0,1,0,0|3,0,0]=4 724 B14R2.712 C[n]1cc2cccc(C(O)=O)c2[n]1 Amb21928010 [0,0,0,1,0,0|3,0,0]=4 725 B14R2.712 Cc1[nH]c2c([n]1)[n]ccc2C(O)=O Amb24605720 [0,0,0,1,0,0|3,0,0]=4 726 B14R2.712 Cc1[nH]c2cc[n]c(C(O)=O)c2[n]1 Amb18196297 [0,0,0,1,0,0|3,0,0]=4 727 B14R2.712 Cc1[nH]c2cccc(C(N)=O)c2[n]1 Amb24088899 [0,0,0,1,0,0|3,0,0]=4 728 B14R2.712 Cc1[nH]c2cccc(C(O)=O)c2[n]1 Amb22587110 [0,0,0,1,0,0|2,0,0]=3 729 B14R2.712 Cc1[n]c2c([n]ccc2[s]1)C(O)=O Amb18189981 [0,0,0,1,0,0|2,1,0]=4 730 B14R2.712 Cc1[n]c2c(ccc[n]2[n]1)C(O)=O Amb19095887 [0,0,0,1,0,0|3,0,0]=4 731 B14R2.712 Cc1[n]c2c(cccc2C(=O)Cl)[s]1 Amb24375488 [0,0,0,1,0,0|2,1,0]=4 732 B14R2.712 Cc1[n]c2cc[n]c(C(O)=O)c2[s]1 Amb18130076 [0,0,0,1,0,0|2,1,0]=4 733 B14R2.712 Cc1[n]c2cccc(C(=O)Cl)c2[s]1 Amb24731228 [0,0,0,1,0,0|2,1,0]=4 734 B14R2.712 Cc1[n]c2cccc(C(=O)Cl)c2o1 Amb25208719 [0,0,0,1,0,0|2,0,0]=3 735 B14R2.712 Cc1[n]c2cccc(C(N)=O)c2o1 Amb24697110 [0,0,0,1,0,0|2,0,0]=3 736 B14R2.712 Cc1[n]c2cccc(C(O)=O)[n]2[n]1 Amb18341485 [0,0,0,1,0,0|3,0,0]=4 737 B14R2.712 Cc1[n]c2cccc(C(O)=O)c2[s]1 Amb22886600 [0,0,0,1,0,0|1,1,0]=3 738 B14R2.712 Cc1[n]c2cccc(c2o1)[N+]([O-])=O Amb25802787 [0,0,0,1,0,0|2,0,1]=4 739 B14R2.712 Cc1c[n]2cccc(C(O)=O)c2[n]1 Amb22587716 [0,0,0,1,0,0|3,0,0]=4 740 B14R2.712 Cc1cc2c([nH]1)[n]ccc2C(O)=O Amb25157494 [0,0,0,1,0,0|3,0,0]=4 741 B14R2.712 Cc1cc2c([n]ccc2[nH]1)C(O)=O Amb24404991 [0,0,0,1,0,0|3,0,0]=4 742 B14R2.712 Cc1cc2c(ccc[n]2c1)C(O)=O Amb18197481 [0,0,0,1,0,0|3,0,0]=4 743 B14R2.712 Cc1cc2c(cccc2[nH]1)C(O)=O Amb22899098 [0,0,0,1,0,0|2,0,0]=3 744 B14R2.712 Cc1cc2cc[n]c(C(O)=O)c2o1 Amb25144465 [0,0,0,1,0,0|2,0,0]=3 745 B14R2.712 Cc1cc2cccc(B(O)O)c2o1 Amb25334718 [0,0,0,1,0,0|2,0,1]=4 746 B14R2.712 Cc1cc2cccc(C(O)=O)c2[s]1 Amb18129960 [0,0,0,1,0,0|1,1,0]=3 747 B14R2.712 Cc1cn2c(n1)c(ccc2)C(=O)O Amb17128326 [0,0,0,1,0,0|3,0,0]=4 748 B14R2.712 Cc1cn2c(n1)cccc2C(=O)O Amb17128327 [0,0,0,1,0,0|3,0,0]=4 749 B14R2.712 Cc1nc2c(o1)c(ccc2)C(=O)O Amb1050755 [0,0,0,1,0,0|1,0,0]=2 750 B14R2.712 Cc1oc2c(n1)c(ccc2)C(=O)O Amb17130930 [0,0,0,1,0,0|1,0,1]=3 751 B14R2.712 N=C1Sc2cccc(C(O)=O)c2S1 Amb24389104 [0,0,0,1,0,0|1,2,0]=4 752 B14R2.712 NC(=N)c1cccc2CC(=O)Nc12 Amb24613108 [0,0,0,1,0,0|3,0,0]=4 753 B14R2.712 NC(=O)c1cccc2CC(=O)Oc12 Amb24369790 [0,0,0,1,0,0|1,0,0]=2 754 B14R2.712 NC(=O)c1cccc2[n]c(O)oc12 Amb24536816 [0,0,0,1,0,0|2,0,1]=4 755 B14R2.712 Nc1[nH]c2cccc(C(O)=O)c2[n]1 Amb24088902 [0,0,0,1,0,0|3,0,0]=4 756 B14R2.712 Nc1[n]c2c(cccc2C(O)=O)o1 Amb24659924 [0,0,0,1,0,0|2,0,1]=4 757 B14R2.712 Nc1[n]c2cccc(C(O)=O)c2[s]1 Amb19957785 [0,0,0,1,0,0|2,1,0]=4 758 B14R2.712 Nc1nc2c(o1)c(ccc2)C(=O)C Amb17570177 [0,0,0,1,0,0|3,0,0]=4 759 B14R2.712 O=C1Cc2cccc(c2N1)N(=O)=O Amb22396529 [0,0,0,1,0,0|2,0,1]=4 760 B14R2.712 OC(=O)c1[n]ccc2CC(=O)Nc12 Amb24330024 [0,0,0,1,0,0|2,0,0]=3 761 B14R2.712 OC(=O)c1c[n]cc2NC(=O)Cc12 Amb24330078 [0,0,0,1,0,0|3,0,0]=4 762 B14R2.712 OC(=O)c1cc[n]c2CC(=O)Nc12 Amb24329886 [0,0,0,1,0,0|2,0,0]=3 763 B14R2.712 OC(=O)c1cc[n]c2NC(=O)Cc12 Amb24090874 [0,0,0,1,0,0|3,0,0]=4 764 B14R2.712 OC(=O)c1cccc2CC(=O)Cc21 Amb25056659 [0,0,0,1,0,0|1,0,0]=2 765 B14R2.712 OC(=O)c1cccc2CC(=O)Oc12 Amb24429091 [0,0,0,1,0,0|0,0,0]=1 766 B14R2.712 OC(=O)c1cccc2CC(F)Cc21 Amb25208075 [0,0,0,1,0,0|2,0,1]=4 767 B14R2.712 OC(=O)c1cccc2NC(=O)Cc12 Amb21856170 [0,0,0,1,0,0|2,0,0]=3 768 B14R2.712 OC(=O)c1cccc2NC(=O)Nc21 Amb22001975 [0,0,0,1,0,0|2,0,0]=3 769 B14R2.712 OC(=O)c1cccc2NC(=S)Nc21 Amb22728875 [0,0,0,1,0,0|2,1,0]=4 770 B14R2.712 OC(=O)c1cccc2OC(=O)Cc12 Amb22755936 [0,0,0,1,0,0|2,0,0]=3 771 B14R2.712 OC(=O)c1cccc2OC(=O)Nc12 Amb18061750 [0,0,0,1,0,0|2,0,0]=3 772 B14R2.712 OC(=O)c1cccc2SC(=O)Nc12 Amb25037382 [0,0,0,1,0,0|2,0,0]=3 773 B14R2.712 OC(=O)c1cccc2[nH]c(=O)[s]c12 Amb24084920 [0,0,0,1,0,0|1,1,0]=3 774 B14R2.712 OC(=O)c1cccc2[n]c(Br)[s]c12 Amb22497964 [0,0,0,1,0,0|2,1,0]=4 775 B14R2.712 OC(=O)c1cccc2[n]c(Br)oc12 Amb25192165 [0,0,0,1,0,0|2,0,0]=3 776 B14R2.712 OC(=O)c1cccc2[n]c(Cl)[s]c12 Amb22436765 [0,0,0,1,0,0|2,1,0]=4 777 B14R2.712 OC(=O)c1cccc2[n]c(F)oc12 Amb25292883 [0,0,0,1,0,0|2,0,0]=3 778 B14R2.712 OC(=O)c1cccc2[n]c(S)[s]c12 Amb25670278 [0,0,0,1,0,0|1,2,0]=4 779 B14R2.712 OC(=O)c1cccc2[s]c(Br)cc12 Amb24579798 [0,0,0,1,0,0|2,1,0]=4 780 B14R2.712 OC(=O)c1cccc2[s]c(Cl)[n]c12 Amb22490609 [0,0,0,1,0,0|2,1,0]=4 781 B14R2.712 OC(=O)c1cccc2[s]c(S)[n]c12 Amb22490560 [0,0,0,1,0,0|2,1,0]=4 782 B14R2.712 OC(=O)c1cccc2c1cc([nH]2)C Amb17594439 [0,0,0,1,0,0|2,0,0]=3 783 B14R2.712 OC(=O)c1cccc2c1nc([nH]2)S Amb10605655 [0,0,0,1,0,0|2,1,0]=4 784 B14R2.712 OC(=O)c1cccc2oc(Br)[n]c12 Amb24610816 [0,0,0,1,0,0|2,0,1]=4 785 B14R2.712 OC(=O)c1cccc2oc(S)[n]c12 Amb25687263 [0,0,0,1,0,0|2,0,1]=4 786 B14R2.712 Oc1[n]c2cccc(C(=O)Cl)c2o1 Amb24637297 [0,0,0,1,0,0|2,0,1]=4 787 B14R2.712 Oc1[n]c2cccc(c2o1)C(O)=O Amb22059707 [0,0,0,1,0,0|1,0,1]=3 788 B14R2.712 Sc1nc2c(o1)c(ccc2)C(=O)C Amb17570741 [0,0,0,1,0,0|2,1,0]=4 789 B14R2.712 [O-][N+](=O)c1cccc2CC(=O)Cc21 Amb19958388 [0,0,0,1,0,0|2,0,1]=4 790 B14R2.8189 CC1=CS(=O)(=O)c2ccccc2O1 Amb19942541 [0,0,0,1,0,0|2,0,1]=4 791 B14R2.8189 CC1=Cc2ccccc2S(O)(=O)=N1 Amb23590823 [0,0,0,1,0,0|3,0,0]=4 792 B14R2.8189 O=C1Nc2ccccc2S(=O)(=O)C1 Amb2415972 [0,0,0,1,0,0|2,0,1]=4 793 B14R2.9513 CC(=O)c1ccccc1OC2CC2 Amb25299383 [0,0,0,1,0,0|2,0,1]=4 794 B14R2.9513 NC(=O)c1ccccc1OC2CC2 Amb25359397 [0,0,0,1,0,0|2,0,1]=4 795 B14R2.9513 OC(=O)c1[n]cccc1OC2CC2 Amb24738539 [0,0,0,1,0,0|2,0,1]=4 796 B14R2.9513 OC(=O)c1ccccc1NC2CC2 Amb18987379 [0,0,0,1,0,0|2,0,1]=4 797 B14R2.9513 OC(=O)c1ccccc1OC2CC2 Amb25367028 [0,0,0,1,0,0|1,0,1]=3 798 B14R2.25733 CC(=O)C1=CC(=O)c2ccccc12 Amb24434540 [0,0,0,1,0,0|2,0,0]=3 799 B14R2.25733 CC(=O)C1OC(=O)c2ccc[n]c21 Amb24700740 [0,0,0,1,0,0|2,0,0]=3 800 B14R2.25733 CC(=O)N1CC(=O)c2c1nccc2 Amb17607513 [0,0,0,1,0,0|3,0,0]=4 801 B14R2.25733 CC(=O)N1NC(=O)c2ccccc12 Amb24086438 [0,0,0,1,0,0|2,0,0]=3 802 B14R2.25733 CC(=O)N1OC(O)c2ccccc12 Amb25058516 [0,0,0,1,0,0|1,0,2]=4 803 B14R2.25733 CC(=O)[n]1cc(I)c2ccccc12 Amb24067502 [0,0,0,1,0,0|3,0,0]=4 804 B14R2.25733 CC(=O)n1cc(Br)c2ccccc12 Amb17943393 [0,0,0,1,0,0|3,0,0]=4 805 B14R2.25733 CC(=O)n1cc(C)c2ccccc12 Amb17778657 [0,0,0,1,0,0|3,0,0]=4 806 B14R2.25733 CC1=CC(c2ccccc12)C(C)=O Amb24576042 [0,0,0,1,0,0|3,0,0]=4 807 B14R2.25733 CC1=C[C@@H](c2ccccc12)C(C)=O Amb25792958 [0,0,0,1,0,0|3,0,0]=4 808 B14R2.25733 C[C@H](O)[C@@H]1OC(=O)c2ccccc21 Amb25346142 [0,0,0,1,0,0|1,0,2]=4 809 B14R2.25733 C[C@H](O)[C@H]1OC(=O)c2ccccc21 Amb25284265 [0,0,0,1,0,0|1,0,2]=4 810 B14R2.25733 C\C(\O)=C/1\OC(=O)c2ccccc21 Amb24712686 [0,0,0,1,0,0|1,0,1]=3 811 B14R2.25733 Cc1[nH]c(c2ccccc12)C(C)=O Amb24490059 [0,0,0,1,0,0|3,0,0]=4 812 B14R2.25733 Cc1[n][n](c2ccccc12)C(C)=O Amb25831651 [0,0,0,1,0,0|3,0,0]=4 813 B14R2.25733 NC(=O)C1OC(=O)c2ccccc21 Amb25097155 [0,0,0,1,0,0|2,0,0]=3 814 B14R2.25733 O=C1NC(c2ccccc12)C(=O)Cl Amb24390803 [0,0,0,1,0,0|3,0,0]=4 815 B14R2.25733 OC(=O)C1=CC(=O)c2ccccc12 Amb25127805 [0,0,0,1,0,0|3,0,0]=4 816 B14R2.25733 OC(=O)C1=NC(=O)c2ccccc12 Amb24650988 [0,0,0,1,0,0|3,0,0]=4 817 B14R2.25733 OC(=O)C1NC(=O)c2ccccc21 Amb18127821 [0,0,0,1,0,0|3,0,0]=4 818 B14R2.25733 OC(=O)[C@H]1CC(=O)c2ccccc21 Amb25295474 [0,0,0,1,0,0|3,0,0]=4 819 B14R2.25733 [O-][N+](=O)C1OC(=O)c2ccccc21 Amb25770193 [0,0,0,1,0,0|3,0,0]=4 820 B14R2.28331 CC(C)Oc1cccc2CC(=O)c12 Amb25066434 [0,0,0,1,0,0|2,0,1]=4 821 B14R2.29496 CC1(O)CC(=O)c2ccccc2O1 Amb24570472 [0,0,0,1,0,0|1,0,2]=4 822 B14R2.29496 O=C1CC(C)(C)Oc2c1cccc2 Amb1397720 [0,0,0,1,0,0|2,0,1]=4 823 B14R2.29496 O=C1CS(=O)(=O)Oc2c1cccc2 Amb10071992 [0,0,0,1,0,0|3,0,0]=4 824 B14R2.29496 O=C1OP(=O)(Cl)Oc2c1cccc2 Amb17608407 [0,0,0,1,0,0|2,0,0]=3 825 B12R1.261 CC(=C)c1ccccc1B(O)O Amb24436587 [0,0,0,0,1,0|2,0,1]=4 826 B12R1.261 CC(=C)c1ccccc1C(C)O Amb25215724 [0,0,0,0,1,0|2,0,1]=4 827 B12R1.261 CC(=C)c1ccccc1C(O)=O Amb18126330 [0,0,0,0,1,0|1,0,0]=2 828 B12R1.261 CC(=O)c1[n]cc[n]c1C(O)=O Amb25667033 [0,0,0,0,1,0|2,0,0]=3 829 B12R1.261 CC(=O)c1[n]cccc1C(=O)Cl Amb25238936 [0,0,0,0,1,0|2,0,0]=3 830 B12R1.261 CC(=O)c1[n]cccc1C(C)=O Amb25736342 [0,0,0,0,1,0|2,0,0]=3 831 B12R1.261 CC(=O)c1[n]cccc1S(C)=O Amb23402723 [0,0,0,0,1,0|3,0,0]=4 832 B12R1.261 CC(=O)c1[n]cccc1[N+]([O-])=O Amb23401215 [0,0,0,0,1,0|2,0,1]=4 833 B12R1.261 CC(=O)c1c[n][n]cc1C(C)=O Amb25094311 [0,0,0,0,1,0|3,0,0]=4 834 B12R1.261 CC(=O)c1c[n]c[n]c1C(O)=O Amb24099651 [0,0,0,0,1,0|2,0,0]=3 835 B12R1.261 CC(=O)c1ccc[n]c1[N+]([O-])=O Amb23403028 [0,0,0,0,1,0|2,0,1]=4 836 B12R1.261 CC(=O)c1ccccc1C(=O)Cl Amb20673428 [0,0,0,0,1,0|1,0,0]=2 837 B12R1.261 CC(=O)c1ccccc1C(C)C Amb17470432 [0,0,0,0,1,0|2,0,1]=4 838 B12R1.261 CC(=O)c1ccccc1C(C)F Amb25248566 [0,0,0,0,1,0|2,0,1]=4 839 B12R1.261 CC(=O)c1ccccc1C(C)O Amb25826967 [0,0,0,0,1,0|1,0,1]=3 840 B12R1.261 CC(=O)c1ccccc1C(F)F Amb23400927 [0,0,0,0,1,0|2,0,1]=4 841 B12R1.261 CC(=O)c1ccccc1C(O)=O Amb22337995 [0,0,0,0,1,0|0,0,0]=1 842 B12R1.261 CC(=O)c1ccccc1[C@H](C)N Amb24341768 [0,0,0,0,1,0|2,0,1]=4 843 B12R1.261 CC(=O)c1cccnc1C(=O)O Amb15695142 [0,0,0,0,1,0|1,0,0]=2 844 B12R1.261 CC(C)=C/1C=CC=C\C1=C(\C)/O Amb25152404 [0,0,0,0,1,0|2,0,0]=3 845 B12R1.261 CC(C)c1[n]cccc1C(O)=O Amb18828451 [0,0,0,0,1,0|2,0,1]=4 846 B12R1.261 CC(C)c1c[n]ccc1C(O)=O Amb24102305 [0,0,0,0,1,0|2,0,1]=4 847 B12R1.261 CC(C)c1ccccc1C(=O)Cl Amb24084515 [0,0,0,0,1,0|2,0,1]=4 848 B12R1.261 CC(C)c1ccccc1C(N)=O Amb24095782 [0,0,0,0,1,0|2,0,1]=4 849 B12R1.261 CC(N)c1cc[n]cc1C(O)=O Amb25118013 [0,0,0,0,1,0|2,0,1]=4 850 B12R1.261 CC(N)c1ccc[n]c1C(O)=O Amb24761502 [0,0,0,0,1,0|2,0,1]=4 851 B12R1.261 CC(N)c1ccccc1C(O)=O Amb22755630 [0,0,0,0,1,0|1,0,1]=3 852 B12R1.261 CC(N)c1ccccc1C(O)=O Amb22831575 [0,0,0,0,1,0|1,0,1]=3 853 B12R1.261 CC(O)c1[n]cccc1C(O)=O Amb24062408 [0,0,0,0,1,0|1,0,2]=4 854 B12R1.261 CC(O)c1ccccc1C(O)=O Amb25360947 [0,0,0,0,1,0|0,0,2]=3 855 B12R1.261 CN(C)c1ccc[n]c1C(O)=O Amb25777505 [0,0,0,0,1,0|3,0,0]=4 856 B12R1.261 CN(C)c1ccccc1C(N)=O Amb21857810 [0,0,0,0,1,0|3,0,0]=4 857 B12R1.261 CN(C)c1ccccc1C(O)=O Amb21964350 [0,0,0,0,1,0|2,0,0]=3 858 B12R1.261 CN(O)c1ccccc1C(O)=O Amb24470136 [0,0,0,0,1,0|1,0,1]=3 859 B12R1.261 CS(=O)c1[n]cccc1C(N)=O Amb25858928 [0,0,0,0,1,0|3,0,0]=4 860 B12R1.261 CS(=O)c1ccc[n]c1C(O)=O Amb18649090 [0,0,0,0,1,0|2,0,0]=3 861 B12R1.261 CS(=O)c1ccccc1B(O)O Amb2456027 [0,0,0,0,1,0|2,0,1]=4 862 B12R1.261 CS(=O)c1ccccc1C(=O)Cl Amb24528503 [0,0,0,0,1,0|2,0,0]=3 863 B12R1.261 CS(=O)c1ccccc1C(=O)O Amb1216535 [0,0,0,0,1,0|1,0,0]=2 864 B12R1.261 C[C@@H](N)c1c[n]ccc1C(O)=O Amb25062569 [0,0,0,0,1,0|2,0,1]=4 865 B12R1.261 C[C@@H](N)c1ccccc1C(N)=O Amb24589673 [0,0,0,0,1,0|2,0,1]=4 866 B12R1.261 C[C@@H](N)c1ccccc1C(O)=O Amb25149917 [0,0,0,0,1,0|1,0,1]=3 867 B12R1.261 C[C@@H](O)c1ccccc1C(O)=O Amb24101896 [0,0,0,0,1,0|0,0,2]=3 868 B12R1.261 C[C@H](N)c1[n]cccc1C(O)=O Amb25064354 [0,0,0,0,1,0|2,0,1]=4 869 B12R1.261 C[C@H](N)c1c[n]ccc1C(O)=O Amb24453273 [0,0,0,0,1,0|2,0,1]=4 870 B12R1.261 C[C@H](N)c1ccc[n]c1C(O)=O Amb24550464 [0,0,0,0,1,0|2,0,1]=4 871 B12R1.261 C[S+](C)c1ccccc1C(O)=O Amb24759101 [0,0,0,0,1,0|2,0,0]=3 872 B12R1.261 ClC(=O)c1ccccc1C(=O)O Amb17477823 [0,0,0,0,1,0|1,0,0]=2 873 B12R1.261 NC(=O)c1ccccc1B(O)O Amb2455624 [0,0,0,0,1,0|2,0,1]=4 874 B12R1.261 NC(=O)c1ccccc1C(=O)N Amb1929307 [0,0,0,0,1,0|2,0,0]=3 875 B12R1.261 NC(=O)c1ccccc1C([O-])=O Amb22339497 [0,0,0,0,1,0|1,0,1]=3 876 B12R1.261 NC(=O)c1cccnc1C(=O)O Amb10844834 [0,0,0,0,1,0|2,0,0]=3 877 B12R1.261 NC(=S)c1ccccc1C(=O)O Amb1113491 [0,0,0,0,1,0|1,1,0]=3 878 B12R1.261 O=C(Cl)c1[n]cccc1C(=O)Cl Amb24517081 [0,0,0,0,1,0|3,0,0]=4 879 B12R1.261 O=C(Cl)c1cc[n]cc1C(=O)Cl Amb24082758 [0,0,0,0,1,0|3,0,0]=4 880 B12R1.261 O=C(F)c1ccccc1C(=O)F Amb24060503 [0,0,0,0,1,0|2,0,0]=3 881 B12R1.261 OC(=O)C1=C(CC=CC1)C(=O)O Amb17594192 [0,0,0,0,1,0|1,0,2]=4 882 B12R1.261 OC(=O)C1C=CC=CC1C(=O)O Amb17594193 [0,0,0,0,1,0|1,0,2]=4 883 B12R1.261 OC(=O)c1[n][n]ccc1C(O)=O Amb24061646 [0,0,0,0,1,0|3,0,0]=4 884 B12R1.261 OC(=O)c1[n]cccc1N(=O)=O Amb20621913 [0,0,0,0,1,0|3,0,0]=4 885 B12R1.261 OC(=O)c1cc[n]cc1N(=O)=O Amb20621861 [0,0,0,0,1,0|3,0,0]=4 886 B12R1.261 OC(=O)c1ccccc1B(O)O Amb22411503 [0,0,0,0,1,0|2,0,1]=4 887 B12R1.261 OC(=O)c1ccccc1B(O)O Amb2455715 [0,0,0,0,1,0|2,0,1]=4 888 B12R1.261 OC(=O)c1ccccc1C(=O)O Amb2556636 [0,0,0,0,1,0|1,0,0]=2 889 B12R1.261 OC(=O)c1ccccc1C(=O)[O-] Amb10844826 [0,0,0,0,1,0|1,0,0]=2 890 B12R1.261 OC(=O)c1ccccc1C(Cl)Cl Amb25770027 [0,0,0,0,1,0|2,0,1]=4 891 B12R1.261 OC(=O)c1ccccc1C(F)F Amb20670211 [0,0,0,0,1,0|2,0,1]=4 892 B12R1.261 OC(=O)c1ccccc1C(O)=O Amb22338462 [0,0,0,0,1,0|1,0,0]=2 893 B12R1.261 OC(=O)c1ccccc1S(=O)Cl Amb25835707 [0,0,0,0,1,0|2,0,0]=3 894 B12R1.261 OC(=S)c1ccccc1C(O)=O Amb25362290 [0,0,0,0,1,0|1,0,1]=3 895 B12R1.261 O[13C](=O)c1ccccc1[13C](O)=O Amb22056065 [0,0,0,0,1,0|1,0,0]=2 896 B12R1.261 [O-]C(=O)c1ccccc1C(O)=O Amb22045764 [0,0,0,0,1,0|1,0,0]=2 897 B12R1.261 [O-]C(=O)c1ccccc1C(O)=O Amb22732934 [0,0,0,0,1,0|1,0,0]=2 898 B12R1.261 [O-]C(=O)c1ccccc1C(O)=O Amb23496190 [0,0,0,0,1,0|1,0,0]=2 899 B12R1.261 [O-]C(=O)c1ccccc1C([O-])=O Amb22263079 [0,0,0,0,1,0|1,0,1]=3 900 B12R1.261 [O-]C(=O)c1ccccc1C([O-])=O Amb22491164 [0,0,0,0,1,0|1,0,1]=3 901 B12R1.261 [O-]C(=O)c1ccccc1C([O-])=O Amb24323292 [0,0,0,0,1,0|1,0,1]=3 902 B12R1.261 [O-]C(=O)c1ccccc1[N+]([O-])=O Amb24309021 [0,0,0,0,1,0|2,0,1]=4 903 B12R1.261 [O-][N+](=O)c1cccnc1C(=O)O Amb10603711 [0,0,0,0,1,0|3,0,0]=4 904 B12R1.261 [O-][N+](=O)c1ccncc1C(=O)O Amb10602769 [0,0,0,0,1,0|3,0,0]=4 905 B12R1.261 [O-][N+](=O)c1cnccc1C(=O)C Amb10573617 [0,0,0,0,1,0|2,0,1]=4 906 B12R1.261 [O-][N+](=O)c1cnccc1C(=O)O Amb10602342 [0,0,0,0,1,0|3,0,0]=4 907 B12R1.392 CC(=C)C[n]1cccc1C(O)=O Amb25361933 [0,0,0,0,1,0|3,0,0]=4 908 B12R1.392 CC(=O)Cc1c[s]cc1C(O)=O Amb18648892 [0,0,0,0,1,0|2,0,0]=3 909 B12R1.392 CC(=O)Nc1[n][nH]cc1C(O)=O Amb24426073 [0,0,0,0,1,0|3,0,0]=4 910 B12R1.392 CC(=O)Nc1[s]ccc1C(C)=O Amb24072110 [0,0,0,0,1,0|3,0,0]=4 911 B12R1.392 CC(=O)Nc1c[n][nH]c1C(O)=O Amb25826412 [0,0,0,0,1,0|3,0,0]=4 912 B12R1.392 CC(=O)Nc1c[s]cc1C(N)=O Amb25138597 [0,0,0,0,1,0|3,0,0]=4 913 B12R1.392 CC(=O)Nc1c[s]cc1C(O)=O Amb18123714 [0,0,0,0,1,0|2,0,0]=3 914 B12R1.392 CC(=O)Nc1cc[s]c1C(N)=O Amb25350474 [0,0,0,0,1,0|3,0,0]=4 915 B12R1.392 CC(=O)Nc1ccsc1C(=O)O Amb1117704 [0,0,0,0,1,0|2,0,0]=3 916 B12R1.392 CC(=O)Nc1sccc1C(=O)O Amb1099198 [0,0,0,0,1,0|2,0,0]=3 917 B12R1.392 CC(=O)Oc1[nH]c[n]c1C(N)=O Amb25751383 [0,0,0,0,1,0|3,0,0]=4 918 B12R1.392 CC(=O)Oc1c[s]cc1C(O)=O Amb18649251 [0,0,0,0,1,0|1,0,0]=2 919 B12R1.392 CC(=O)c1occc1NC(C)=O Amb24728454 [0,0,0,0,1,0|3,0,0]=4 920 B12R1.392 CC(C)Oc1cc[s]c1C(O)=O Amb25309270 [0,0,0,0,1,0|2,0,1]=4 921 B12R1.392 CS(=O)Cc1cc[s]c1C(O)=O Amb24740256 [0,0,0,0,1,0|3,0,0]=4 922 B12R1.392 CS(=O)Cc1ccoc1C(O)=O Amb18974541 [0,0,0,0,1,0|3,0,0]=4 923 B12R1.392 CS(=O)Cc1occc1C(O)=O Amb18974544 [0,0,0,0,1,0|3,0,0]=4 924 B12R1.392 CS(=O)Nc1cc[s]c1C(O)=O Amb24620384 [0,0,0,0,1,0|3,0,0]=4 925 B12R1.392 NC(=O)Cc1[nH]ccc1C(O)=O Amb18646868 [0,0,0,0,1,0|3,0,0]=4 926 B12R1.392 NC(=O)Cc1[s]ccc1C(O)=O Amb18649088 [0,0,0,0,1,0|3,0,0]=4 927 B12R1.392 NC(=O)Cc1c[s]cc1C(O)=O Amb18649089 [0,0,0,0,1,0|3,0,0]=4 928 B12R1.392 NC(=O)Nc1ccsc1C(=O)O Amb1135658 [0,0,0,0,1,0|3,0,0]=4 929 B12R1.392 NC(=O)Nc1cocc1C(O)=O Amb25273932 [0,0,0,0,1,0|3,0,0]=4 930 B12R1.392 NC(=O)Nc1sccc1C(=O)O Amb1133355 [0,0,0,0,1,0|3,0,0]=4 931 B12R1.392 OC(=O)c1[nH]ccc1CC(O)=O Amb18826220 [0,0,0,0,1,0|3,0,0]=4 932 B12R1.392 OC(=O)c1[s]ccc1CC(O)=O Amb18649246 [0,0,0,0,1,0|3,0,0]=4 933 B12R1.392 OC(=O)c1[s]ccc1NC(O)=O Amb24061379 [0,0,0,0,1,0|3,0,0]=4 934 B12R1.392 OC(=O)c1c[nH]cc1CC(O)=O Amb18826218 [0,0,0,0,1,0|3,0,0]=4 935 B12R1.392 OC(=O)c1c[s]cc1CC(O)=O Amb18649249 [0,0,0,0,1,0|3,0,0]=4 936 B12R1.392 OC(=O)c1cc[nH]c1CC(O)=O Amb18826219 [0,0,0,0,1,0|3,0,0]=4 937 B12R1.392 OC(=O)c1cc[s]c1CC(O)=O Amb18822221 [0,0,0,0,1,0|3,0,0]=4 938 B12R1.392 OC(=O)c1cocc1CC(O)=O Amb18198947 [0,0,0,0,1,0|3,0,0]=4 939 B12R1.392 OC(=O)c1occc1CC(O)=O Amb18198948 [0,0,0,0,1,0|3,0,0]=4 940 B14R1.814 CC(=O)Nc1ccccc1CC(N)=O Amb24388800 [0,0,0,0,0,1|2,0,0]=3 941 B14R1.814 CC(=O)Nc1ccccc1CC(O)=O Amb18299369 [0,0,0,0,0,1|1,0,0]=2 942 B14R1.814 CC(=O)Nc1ccccc1NC(=O)C Amb1070765 [0,0,0,0,0,1|2,0,0]=3 943 B14R1.814 CC(=O)Oc1ccccc1CN(C)C Amb21873345 [0,0,0,0,0,1|3,0,0]=4 944 B14R1.814 CC(=O)Oc1ccccc1OC(=O)C Amb16193263 [0,0,0,0,0,1|1,0,0]=2 945 B14R1.814 C\C(\Cl)=N\c1ccccc1NC(C)=O Amb24618873 [0,0,0,0,0,1|3,0,0]=4 946 B14R1.814 NC(=O)Cc1ccccc1CC(N)=O Amb24080795 [0,0,0,0,0,1|3,0,0]=4 947 B14R1.814 NC(=O)Nc1ccccc1CC(O)=O Amb18299371 [0,0,0,0,0,1|2,0,0]=3 948 B14R1.814 NC(=O)Nc1ccccc1OC(C)C Amb17235923 [0,0,0,0,0,1|2,0,1]=4 949 B14R1.814 OC(=O)Cc1ccccc1OC(C)C Amb13952034 [0,0,0,0,0,1|1,0,1]=3 950 B14R1.1475 CC(=O)OC=1CC(=CC=CC1)C(O)=O Amb25818738 [0,0,0,0,0,1|0,0,0]=1 951 B14R1.4522 BrC(=C)COc1ccccc1C(=O)N Amb11183666 [0,0,0,0,0,1|2,0,1]=4 952 B14R1.4522 C=C(F)COc1ccccc1C(O)=O Amb23570551 [0,0,0,0,0,1|1,0,1]=3 953 B14R1.4522 CC(=C)CNc1c[n]ccc1C(O)=O Amb25856462 [0,0,0,0,0,1|3,0,0]=4 954 B14R1.4522 CC(=C)CNc1ccc[n]c1C(O)=O Amb25316402 [0,0,0,0,0,1|3,0,0]=4 955 B14R1.4522 CC(=C)CNc1ccccc1C(N)=O Amb24347935 [0,0,0,0,0,1|3,0,0]=4 956 B14R1.4522 CC(=C)CNc1ccccc1C(O)=O Amb18650847 [0,0,0,0,0,1|2,0,0]=3 957 B14R1.4522 CC(=C)COc1ccccc1C(=O)O Amb2081547 [0,0,0,0,0,1|1,0,0]=2 958 B14R1.4522 CC(=O)COc1ccc[n]c1C(O)=O Amb24082665 [0,0,0,0,0,1|1,0,0]=2 959 B14R1.4522 CC(=O)COc1ccc[n]c1[N+]([O-])=O Amb19081451 [0,0,0,0,0,1|2,0,1]=4 960 B14R1.4522 CC(=O)NCc1ccccc1C(C)=C Amb24072013 [0,0,0,0,0,1|3,0,0]=4 961 B14R1.4522 CC(=O)NNc1ccccc1C(O)=O Amb18651739 [0,0,0,0,0,1|1,0,0]=2 962 B14R1.4522 CC(=O)OCc1ccccc1C(O)=O Amb24065074 [0,0,0,0,0,1|0,0,0]=1 963 B14R1.4522 CC(=O)\C=C\c1ccccc1C(=O)O Amb17477544 [0,0,0,0,0,1|1,0,0]=2 964 B14R1.4522 CC(=O)\C=C\c1ccccc1[N+]([O-])=O Amb18564808 [0,0,0,0,0,1|2,0,1]=4 965 B14R1.4522 CC(=O)c1ccccc1NCC(O)=O Amb24692784 [0,0,0,0,0,1|3,0,0]=4 966 B14R1.4522 CC(=O)c1ccccc1OCC(C)=O Amb18604479 [0,0,0,0,0,1|1,0,0]=2 967 B14R1.4522 CC(=O)c1ccccc1\C=C\C(N)=O Amb25753580 [0,0,0,0,0,1|3,0,0]=4 968 B14R1.4522 CC(C)=NNc1ccccc1C(O)=O Amb18651190 [0,0,0,0,0,1|2,0,0]=3 969 B14R1.4522 CC(C)C#Cc1ccccc1C(O)=O Amb25818588 [0,0,0,0,0,1|2,0,1]=4 970 B14R1.4522 CC(C)NCc1ccccc1C(O)=O Amb19649751 [0,0,0,0,0,1|2,0,1]=4 971 B14R1.4522 CC(C)\C=C\c1ccccc1C(O)=O Amb24693964 [0,0,0,0,0,1|2,0,1]=4 972 B14R1.4522 CC(C)\C=N\c1ccccc1C(O)=O Amb24366619 [0,0,0,0,0,1|2,0,1]=4 973 B14R1.4522 CC(CNc1ccccc1C(=O)O)C Amb1109731 [0,0,0,0,0,1|2,0,1]=4 974 B14R1.4522 CC(COc1ccccc1C(=O)Cl)C Amb17477464 [0,0,0,0,0,1|2,0,1]=4 975 B14R1.4522 CC(COc1ccccc1C(=O)N)C Amb10671227 [0,0,0,0,0,1|2,0,1]=4 976 B14R1.4522 CC(COc1ccccc1C(=O)O)C Amb1124927 [0,0,0,0,0,1|1,0,1]=3 977 B14R1.4522 CC(CSc1ccccc1C(=O)O)C Amb1135348 [0,0,0,0,0,1|1,1,1]=4 978 B14R1.4522 CC(F)CNc1ccccc1C(O)=O Amb25194941 [0,0,0,0,0,1|2,0,1]=4 979 B14R1.4522 CC(N)CNc1ccccc1C(O)=O Amb24101942 [0,0,0,0,0,1|2,0,1]=4 980 B14R1.4522 CC(NCc1ccccc1C(=O)O)C Amb2119060 [0,0,0,0,0,1|2,0,1]=4 981 B14R1.4522 CC(O)CNc1ccccc1C(O)=O Amb18933513 [0,0,0,0,0,1|1,0,2]=4 982 B14R1.4522 CN(C)\C=N/c1ccccc1C(O)=O Amb25793489 [0,0,0,0,0,1|3,0,0]=4 983 B14R1.4522 CN(C)\C=N\c1ccccc1C(O)=O Amb24106938 [0,0,0,0,0,1|3,0,0]=4 984 B14R1.4522 CN(\N=N\c1ccccc1C(=O)O)C Amb1228451 [0,0,0,0,0,1|3,0,0]=4 985 B14R1.4522 C\[N+](\[O-])=N\Nc1ccccc1C(O)=O Amb24102001 [0,0,0,0,0,1|2,0,1]=4 986 B14R1.4522 NC(=O)COc1ccc[n]c1C(O)=O Amb19015795 [0,0,0,0,0,1|2,0,0]=3 987 B14R1.4522 NC(=O)COc1ccccc1C(=O)O Amb1245993 [0,0,0,0,0,1|1,0,0]=2 988 B14R1.4522 NC(=O)CSc1ccccc1C(=O)O Amb1220938 [0,0,0,0,0,1|1,1,0]=3 989 B14R1.4522 NC(=O)CSc1ncccc1C(=O)O Amb2357885 [0,0,0,0,0,1|2,1,0]=4 990 B14R1.4522 NC(=O)\N=N\c1ccccc1C(O)=O Amb24634153 [0,0,0,0,0,1|2,0,0]=3 991 B14R1.4522 NC(=O)c1ccccc1OCC([O-])=O Amb22167464 [0,0,0,0,0,1|2,0,0]=3 992 B14R1.4522 NC(=O)c1ccccc1\C=C\C(O)=O Amb20248384 [0,0,0,0,0,1|3,0,0]=4 993 B14R1.4522 OC(=O)CNc1ccccc1C(=O)O Amb1017148 [0,0,0,0,0,1|2,0,0]=3 994 B14R1.4522 OC(=O)CNc1ncccc1C(=O)O Amb17610568 [0,0,0,0,0,1|3,0,0]=4 995 B14R1.4522 OC(=O)COc1ccccc1C(=O)C Amb1280479 [0,0,0,0,0,1|2,0,0]=3 996 B14R1.4522 OC(=O)COc1ccccc1C(=O)Cl Amb24069028 [0,0,0,0,0,1|2,0,0]=3 997 B14R1.4522 OC(=O)COc1ccccc1C(=O)N Amb1201244 [0,0,0,0,0,1|2,0,0]=3 998 B14R1.4522 OC(=O)COc1ccccc1N(=O)=O Amb20621868 [0,0,0,0,0,1|2,0,1]=4 999 B14R1.4522 OC(=O)CSc1ncccc1C(=O)O Amb2522699 [0,0,0,0,0,1|2,1,0]=4 1000 B14R1.4522 OC(=O)\C=C\c1cc[n]cc1C(O)=O Amb25685334 [0,0,0,0,0,1|3,0,0]=4 1001 B14R1.4522 OC(=O)c1[n]cccc1NCC(O)=O Amb24634032 [0,0,0,0,0,1|3,0,0]=4 1002 B14R1.4522 [O-]C(=O)CNc1ccccc1C(=O)O Amb17610583 [0,0,0,0,0,1|2,0,0]=3 1003 B14R1.4522 [O-][N+](=O)\C=C\c1ccccc1C(O)=O Amb25781183 [0,0,0,0,0,1|3,0,0]=4 1004 B11R0.148 C\C=C\C=C\C=C\C=C\C(=O)O Amb10069454 [1,0,1,0,0,0|1,0,0]=3 1005 B11R1.41 C#COc1ccccc1C=O Amb24101295 [2,0,0,0,0,0|0,0,2]=4 1006 B11R1.41 C=CCc1ccccc1C=O Amb18124788 [2,0,0,0,0,0|1,0,1]=4 1007 B11R1.41 C=COc1ccccc1CO Amb24069036 [2,0,0,0,0,0|0,0,2]=4 1008 B11R1.41 CC#Cc1ccccc1C=O Amb24070025 [2,0,0,0,0,0|1,0,1]=4 1009 B11R1.41 CCCc1ccccc1C=O Amb18124934 [2,0,0,0,0,0|1,0,1]=4 1010 B11R1.41 CCNc1ccccc1C=O Amb18125011 [2,0,0,0,0,0|1,0,1]=4 1011 B11R1.41 CCOc1cc[n]cc1C=O Amb21959251 [2,0,0,0,0,0|1,0,1]=4 1012 B11R1.41 CCOc1ccc[n]c1C=O Amb18125260 [2,0,0,0,0,0|1,0,1]=4 1013 B11R1.41 CCSc1ccccc1C=O Amb18126446 [2,0,0,0,0,0|0,1,1]=4 1014 B11R1.41 COCc1ccccc1C=O Amb18644422 [2,0,0,0,0,0|2,0,0]=4 1015 B11R1.41 C\C=C/c1ccccc1C=O Amb24430138 [2,0,0,0,0,0|1,0,0]=3 1016 B11R1.41 C\C=C\c1ccccc1C=O Amb18124786 [2,0,0,0,0,0|1,0,0]=3 1017 B11R1.41 C\C=C\c1ccccc1CO Amb24749680 [2,0,0,0,0,0|1,0,1]=4 1018 B11R1.41 N#COc1ccccc1C=O Amb25700946 [2,0,0,0,0,0|1,0,1]=4 1019 B11R1.41 O=CCc1ccccc1C=O Amb17593688 [2,0,0,0,0,0|1,0,0]=3 1020 B11R1.41 O=CNc1[n]cccc1C=O Amb24072196 [2,0,0,0,0,0|2,0,0]=4 1021 B11R1.41 O=CNc1ccccc1C=O Amb18124947 [2,0,0,0,0,0|1,0,0]=3 1022 B11R1.41 O=Cc1ccccc1C=C=O Amb24070193 [2,0,0,0,0,0|1,0,1]=4 1023 B11R1.41 O=Cc1ccccc1N=C=O Amb24084436 [2,0,0,0,0,0|1,0,1]=4 1024 B11R1.41 O=Cc1ccccc1OCF Amb24101296 [2,0,0,0,0,0|1,0,1]=4 1025 B11R1.41 OCOc1ccccc1C=O Amb25833595 [2,0,0,0,0,0|0,0,2]=4 1026 B11R1.41 OCc1ccccc1NC=O Amb18791472 [2,0,0,0,0,0|1,0,1]=4 1027 B11R1.41 O\C=C/c1ccccc1C=O Amb24106774 [2,0,0,0,0,0|1,0,1]=4 1028 B11R1.86 CB(C)Oc1ccccc1O Amb24513752 [2,0,0,0,0,0|2,0,0]=4 1029 B11R1.86 CC(=C)Cc1ccccc1O Amb18124924 [2,0,0,0,0,0|2,0,0]=4 1030 B11R1.86 CC(=C)Sc1ccccc1O Amb18646620 [2,0,0,0,0,0|1,1,0]=4 1031 B11R1.86 CC(=O)CN1C=CC=CC1=O Amb18177167 [2,0,0,0,0,0|2,0,0]=4 1032 B11R1.86 CC(=O)Cc1cc[n]cc1O Amb24579005 [2,0,0,0,0,0|2,0,0]=4 1033 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [2,0,0,0,0,0|2,0,0]=4 1034 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [2,0,0,0,0,0|1,0,0]=3 1035 B11R1.86 CC(=O)Cc1ccccc1S Amb25312284 [2,0,0,0,0,0|1,1,0]=4 1036 B11R1.86 CC(=O)NC1=CC=CNC1=O Amb22747067 [2,0,0,0,0,0|2,0,0]=4 1037 B11R1.86 CC(=O)NC1=COC=CC1=O Amb25287593 [2,0,0,0,0,0|2,0,0]=4 1038 B11R1.86 CC(=O)Nc1ccccc1F Amb2444091 [2,0,0,0,0,0|2,0,0]=4 1039 B11R1.86 CC(=O)Nc1ccccc1N Amb1121033 [2,0,0,0,0,0|2,0,0]=4 1040 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [2,0,0,0,0,0|1,0,0]=3 1041 B11R1.86 CC(=O)Nc1ccccc1S Amb16186713 [2,0,0,0,0,0|1,1,0]=4 1042 B11R1.86 CC(=O)Nc1cccnc1O Amb13889927 [2,0,0,0,0,0|2,0,0]=4 1043 B11R1.86 CC(=O)Nc1cccoc1=O Amb24072052 [2,0,0,0,0,0|2,0,0]=4 1044 B11R1.86 CC(=O)Nc1ccncc1O Amb13889918 [2,0,0,0,0,0|2,0,0]=4 1045 B11R1.86 CC(=O)Nc1cnccc1O Amb13889919 [2,0,0,0,0,0|2,0,0]=4 1046 B11R1.86 CC(=O)OC1=CC=CNC1=O Amb20660071 [2,0,0,0,0,0|1,0,0]=3 1047 B11R1.86 CC(=O)OC1=CC=CNC1=S Amb24677788 [2,0,0,0,0,0|1,1,0]=4 1048 B11R1.86 CC(=O)OC1=CN=CNC1=O Amb25201619 [2,0,0,0,0,0|2,0,0]=4 1049 B11R1.86 CC(=O)OC1=COC=CC1=O Amb25288533 [2,0,0,0,0,0|1,0,0]=3 1050 B11R1.86 CC(=O)ON1C=CC=CC1=O Amb24713195 [2,0,0,0,0,0|1,0,0]=3 1051 B11R1.86 CC(=O)Oc1[n]cccc1Br Amb25258912 [2,0,0,0,0,0|2,0,0]=4 1052 B11R1.86 CC(=O)Oc1c[n]ccc1Br Amb23412302 [2,0,0,0,0,0|2,0,0]=4 1053 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [2,0,0,0,0,0|1,0,0]=3 1054 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [2,0,0,0,0,0|1,0,0]=3 1055 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [2,0,0,0,0,0|1,0,0]=3 1056 B11R1.86 CC(=O)Oc1ccccc1N Amb18644456 [2,0,0,0,0,0|1,0,0]=3 1057 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [2,0,0,0,0,0|0,0,0]=2 1058 B11R1.86 CC(=O)Oc1cccnc1I Amb2405507 [2,0,0,0,0,0|2,0,0]=4 1059 B11R1.86 CC(C)=Cc1ccccc1O Amb18124916 [2,0,0,0,0,0|2,0,0]=4 1060 B11R1.86 CC(C)=Nc1ccccc1O Amb25370803 [2,0,0,0,0,0|2,0,0]=4 1061 B11R1.86 CS(=O)Cc1ccccc1O Amb24486438 [2,0,0,0,0,0|2,0,0]=4 1062 B11R1.86 CS(=O)Nc1ccccc1O Amb25177210 [2,0,0,0,0,0|2,0,0]=4 1063 B11R1.86 Cc1[n]cccc1OC(C)=O Amb24485974 [2,0,0,0,0,0|1,0,1]=4 1064 B11R1.86 Cc1cc[n]cc1OC(C)=O Amb24102576 [2,0,0,0,0,0|1,0,1]=4 1065 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [2,0,0,0,0,0|1,0,1]=4 1066 B11R1.86 Cc1ccccc1SC(C)=O Amb25189277 [2,0,0,0,0,0|0,1,1]=4 1067 B11R1.86 ClC(=O)Oc1ccccc1Cl Amb10844668 [2,0,0,0,0,0|2,0,0]=4 1068 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [2,0,0,0,0,0|2,0,0]=4 1069 B11R1.86 NC(=O)Oc1ccccc1C Amb10576081 [2,0,0,0,0,0|1,0,1]=4 1070 B11R1.86 NC(=O)Oc1ccccc1Cl Amb10575594 [2,0,0,0,0,0|2,0,0]=4 1071 B11R1.86 NC(=O)Oc1ccccc1F Amb16227453 [2,0,0,0,0,0|2,0,0]=4 1072 B11R1.86 Nc1ccccc1OC(N)=O Amb24636357 [2,0,0,0,0,0|2,0,0]=4 1073 B11R1.86 OC(=O)Cc1ccccc1O Amb2388914 [2,0,0,0,0,0|2,0,0]=4 1074 B11R1.86 Oc1ccccc1OC(=O)Cl Amb25284326 [2,0,0,0,0,0|1,0,0]=3 1075 B11R1.53 BrCc1ccccc1C(=O)O Amb1935113 [2,0,0,0,0,0|1,0,1]=4 1076 B11R1.53 C#Cc1ccccc1C(=O)O Amb10068419 [2,0,0,0,0,0|0,0,2]=4 1077 B11R1.53 C=Cc1[n]cccc1C(O)=O Amb25085304 [2,0,0,0,0,0|1,0,1]=4 1078 B11R1.53 C=Cc1c[n]ccc1C(O)=O Amb24704362 [2,0,0,0,0,0|1,0,1]=4 1079 B11R1.53 C=Cc1ccccc1C(=O)C Amb17593659 [2,0,0,0,0,0|1,0,1]=4 1080 B11R1.53 C=Cc1ccccc1C(=O)Cl Amb24085077 [2,0,0,0,0,0|1,0,1]=4 1081 B11R1.53 C=Cc1ccccc1C(=O)O Amb16185425 [2,0,0,0,0,0|0,0,1]=3 1082 B11R1.53 C=Cc1ccccc1C(N)=O Amb24085075 [2,0,0,0,0,0|1,0,1]=4 1083 B11R1.53 C=Nc1ccccc1C(N)=O Amb24101343 [2,0,0,0,0,0|2,0,0]=4 1084 B11R1.53 C=Nc1ccccc1C(O)=O Amb25102081 [2,0,0,0,0,0|1,0,0]=3 1085 B11R1.53 CC(=C)c1ccccc1C=O Amb18644271 [2,0,0,0,0,0|2,0,0]=4 1086 B11R1.53 CC(=C)c1ccccc1OC Amb25074238 [2,0,0,0,0,0|2,0,0]=4 1087 B11R1.53 CC(=O)c1[n]cccc1C=O Amb24105979 [2,0,0,0,0,0|2,0,0]=4 1088 B11R1.53 CC(=O)c1[n]cccc1OC Amb21963735 [2,0,0,0,0,0|2,0,0]=4 1089 B11R1.53 CC(=O)c1c[n]ccc1OC Amb22728571 [2,0,0,0,0,0|2,0,0]=4 1090 B11R1.53 CC(=O)c1cc[n]cc1OC Amb21857120 [2,0,0,0,0,0|2,0,0]=4 1091 B11R1.53 CC(=O)c1ccc[n]c1C=O Amb24571669 [2,0,0,0,0,0|2,0,0]=4 1092 B11R1.53 CC(=O)c1ccc[n]c1OC Amb18201742 [2,0,0,0,0,0|2,0,0]=4 1093 B11R1.53 CC(=O)c1ccccc1C=O Amb18124879 [2,0,0,0,0,0|1,0,0]=3 1094 B11R1.53 CC(=O)c1ccccc1N=O Amb25695758 [2,0,0,0,0,0|2,0,0]=4 1095 B11R1.53 CC(=O)c1ccccc1NC Amb22057822 [2,0,0,0,0,0|2,0,0]=4 1096 B11R1.53 CC(=O)c1ccccc1SC Amb18180109 [2,0,0,0,0,0|1,1,0]=4 1097 B11R1.53 CCc1[n]cccc1C(O)=O Amb18201760 [2,0,0,0,0,0|1,0,1]=4 1098 B11R1.53 CCc1c[n]ccc1C(O)=O Amb21857954 [2,0,0,0,0,0|1,0,1]=4 1099 B11R1.53 CCc1cc[n]cc1C(O)=O Amb18201753 [2,0,0,0,0,0|1,0,1]=4 1100 B11R1.53 CCc1ccc[n]c1C(O)=O Amb24102089 [2,0,0,0,0,0|1,0,1]=4 1101 B11R1.53 CCc1ccccc1C(=O)C Amb17470383 [2,0,0,0,0,0|1,0,1]=4 1102 B11R1.53 CCc1ccccc1C(=O)Cl Amb19895588 [2,0,0,0,0,0|1,0,1]=4 1103 B11R1.53 CCc1ccccc1C(N)=O Amb24084095 [2,0,0,0,0,0|1,0,1]=4 1104 B11R1.53 CNc1cc[n]cc1C(O)=O Amb23440762 [2,0,0,0,0,0|2,0,0]=4 1105 B11R1.53 CNc1ccc[n]c1C(O)=O Amb22396326 [2,0,0,0,0,0|2,0,0]=4 1106 B11R1.53 CNc1ccccc1C(=O)Cl Amb24101342 [2,0,0,0,0,0|2,0,0]=4 1107 B11R1.53 CNc1ccccc1C(=O)N Amb1209391 [2,0,0,0,0,0|2,0,0]=4 1108 B11R1.53 CNc1ccccc1C(=O)O Amb1209109 [2,0,0,0,0,0|1,0,0]=3 1109 B11R1.53 CNc1ccccc1C(=O)S Amb25055668 [2,0,0,0,0,0|1,1,0]=4 1110 B11R1.53 COc1[n]c[n]cc1C(O)=O Amb18125642 [2,0,0,0,0,0|2,0,0]=4 1111 B11R1.53 COc1[n]cc[n]c1C(O)=O Amb18287071 [2,0,0,0,0,0|2,0,0]=4 1112 B11R1.53 COc1[n]cccc1C(=O)Cl Amb18965129 [2,0,0,0,0,0|2,0,0]=4 1113 B11R1.53 COc1c[n]ccc1C(=O)Cl Amb24655306 [2,0,0,0,0,0|2,0,0]=4 1114 B11R1.53 COc1c[n]ccc1C(N)=O Amb23412272 [2,0,0,0,0,0|2,0,0]=4 1115 B11R1.53 COc1cc[n]cc1C(=O)Cl Amb24070472 [2,0,0,0,0,0|2,0,0]=4 1116 B11R1.53 COc1cc[n]cc1C(N)=O Amb21964811 [2,0,0,0,0,0|2,0,0]=4 1117 B11R1.53 COc1cc[n]cc1C(O)=O Amb21964513 [2,0,0,0,0,0|1,0,0]=3 1118 B11R1.53 COc1ccc[n]c1C(N)=O Amb24082661 [2,0,0,0,0,0|2,0,0]=4 1119 B11R1.53 COc1ccc[n]c1C(O)=O Amb22490742 [2,0,0,0,0,0|1,0,0]=3 1120 B11R1.53 COc1ccccc1B(O)O Amb2383496 [2,0,0,0,0,0|1,0,1]=4 1121 B11R1.53 COc1ccccc1C(=C)Br Amb22736847 [2,0,0,0,0,0|2,0,0]=4 1122 B11R1.53 COc1ccccc1C(=C)F Amb25147970 [2,0,0,0,0,0|2,0,0]=4 1123 B11R1.53 COc1ccccc1C(=O)Br Amb24084579 [2,0,0,0,0,0|1,0,0]=3 1124 B11R1.53 COc1ccccc1C(=O)C Amb2209367 [2,0,0,0,0,0|1,0,0]=3 1125 B11R1.53 COc1ccccc1C(=S)N Amb1216517 [2,0,0,0,0,0|1,1,0]=4 1126 B11R1.53 COc1ccccc1C(N)=N Amb22494243 [2,0,0,0,0,0|2,0,0]=4 1127 B11R1.53 COc1ccccc1C([O-])=O Amb19879368 [2,0,0,0,0,0|0,0,1]=3 1128 B11R1.53 COc1ccccc1S(=O)[O-] Amb10610173 [2,0,0,0,0,0|1,0,1]=4 1129 B11R1.53 COc1ccccc1S(C)=O Amb19892204 [2,0,0,0,0,0|2,0,0]=4 1130 B11R1.53 COc1ccccc1S(O)=O Amb18862871 [2,0,0,0,0,0|1,0,0]=3 1131 B11R1.53 COc1cccnc1C(=O)O Amb10842137 [2,0,0,0,0,0|1,0,0]=3 1132 B11R1.53 COc1cnccc1C(=O)O Amb16230607 [2,0,0,0,0,0|1,0,0]=3 1133 B11R1.53 COc1ncccc1C(=O)O Amb1130324 [2,0,0,0,0,0|1,0,0]=3 1134 B11R1.53 CS(=O)c1ccccc1C=O Amb18126524 [2,0,0,0,0,0|2,0,0]=4 1135 B11R1.53 CSc1cc[n]cc1C(O)=O Amb24760951 [2,0,0,0,0,0|1,1,0]=4 1136 B11R1.53 CSc1ccc[n]c1C(O)=O Amb25138723 [2,0,0,0,0,0|1,1,0]=4 1137 B11R1.53 CSc1ccccc1C(=O)Cl Amb10879591 [2,0,0,0,0,0|1,1,0]=4 1138 B11R1.53 CSc1ncccc1C(=O)O Amb1242848 [2,0,0,0,0,0|1,1,0]=4 1139 B11R1.53 C[C@H](O)c1ccccc1C=O Amb24101900 [2,0,0,0,0,0|1,0,1]=4 1140 B11R1.53 C\C(\O)=C/1\C=CC=C\C1=C/C Amb24509245 [2,0,0,0,0,0|1,0,0]=3 1141 B11R1.53 N#Cc1ccccc1C(=O)O Amb1971492 [2,0,0,0,0,0|1,0,1]=4 1142 B11R1.53 N=Nc1ccccc1C(O)=O Amb24104370 [2,0,0,0,0,0|2,0,0]=4 1143 B11R1.53 NC(=O)c1[n]cccc1C=O Amb24102187 [2,0,0,0,0,0|2,0,0]=4 1144 B11R1.53 NC(=O)c1cc[n]cc1C=O Amb24102191 [2,0,0,0,0,0|2,0,0]=4 1145 B11R1.53 NC(=O)c1ccccc1N=O Amb24092548 [2,0,0,0,0,0|2,0,0]=4 1146 B11R1.53 NCc1ccccc1C(=O)O Amb1092013 [2,0,0,0,0,0|1,0,1]=4 1147 B11R1.53 NCc1ccccc1C(O)=O Amb21955326 [2,0,0,0,0,0|1,0,1]=4 1148 B11R1.53 NNc1ccccc1C(=O)O Amb1202653 [2,0,0,0,0,0|2,0,0]=4 1149 B11R1.53 NNc1ccccc1C(=O)O Amb2235199 [2,0,0,0,0,0|2,0,0]=4 1150 B11R1.53 O=C(Cl)c1ccccc1C=O Amb24084248 [2,0,0,0,0,0|1,0,0]=3 1151 B11R1.53 O=C(Cl)c1ccccc1N=O Amb24084908 [2,0,0,0,0,0|2,0,0]=4 1152 B11R1.53 O=Cc1ccccc1B(O)O Amb2447093 [2,0,0,0,0,0|1,0,1]=4 1153 B11R1.53 O=Cc1ccccc1C(=O)O Amb2568292 [2,0,0,0,0,0|0,0,0]=2 1154 B11R1.53 O=Cc1ccccc1N(=O)=O Amb20621765 [2,0,0,0,0,0|1,0,1]=4 1155 B11R1.53 O=Nc1ccccc1C(=O)O Amb17593754 [2,0,0,0,0,0|1,0,0]=3 1156 B11R1.53 OC(=O)C1C=CC=CC1=C=O Amb24061171 [2,0,0,0,0,0|0,0,2]=4 1157 B11R1.53 OC(=O)c1[n]c[n]cc1C=O Amb24099653 [2,0,0,0,0,0|2,0,0]=4 1158 B11R1.53 OC(=O)c1[n]cccc1C=O Amb20247832 [2,0,0,0,0,0|1,0,0]=3 1159 B11R1.53 OC(=O)c1cc[n]cc1C=O Amb23559759 [2,0,0,0,0,0|1,0,0]=3 1160 B11R1.53 OC(=O)c1ccc[n]c1C=O Amb22001968 [2,0,0,0,0,0|1,0,0]=3 1161 B11R1.53 OC(=O)c1ccc[n]c1C=O Amb23399554 [2,0,0,0,0,0|1,0,0]=3 1162 B11R1.53 OC(=O)c1ccccc1CF Amb25109949 [2,0,0,0,0,0|1,0,1]=4 1163 B11R1.53 OC(=O)c1ccccc1OI Amb22492728 [2,0,0,0,0,0|1,0,0]=3 1164 B11R1.53 OCc1ccccc1C(=O)O Amb1789360 [2,0,0,0,0,0|0,0,2]=4 1165 B11R1.53 SCc1ccccc1C(=O)O Amb17498634 [2,0,0,0,0,0|0,1,1]=4 1166 B13R1.51 CC(=O)Cc1ccc(Br)cc1C=O Amb24696769 [1,1,0,0,0,0|1,0,0]=3 1167 B13R1.51 CC(=O)Cc1ccc(C)cc1C=O Amb24528061 [1,1,0,0,0,0|1,0,0]=3 1168 B13R1.51 CC(=O)Cc1ccc(Cl)cc1C=O Amb25267990 [1,1,0,0,0,0|1,0,0]=3 1169 B13R1.51 CC(=O)Cc1ccc(Cl)cc1CO Amb24541286 [1,1,0,0,0,0|1,0,1]=4 1170 B13R1.51 CC(=O)Cc1ccc(F)cc1C=O Amb25253249 [1,1,0,0,0,0|1,0,0]=3 1171 B13R1.51 CC(=O)Cc1ccc(F)cc1CO Amb24603423 [1,1,0,0,0,0|1,0,1]=4 1172 B13R1.51 CC(=O)Cc1ccc(S)cc1C=O Amb24528036 [1,1,0,0,0,0|1,0,0]=3 1173 B13R1.51 CC(=O)Nc1ccc(Br)cc1CO Amb25042665 [1,1,0,0,0,0|1,0,1]=4 1174 B13R1.51 CC(=O)Nc1ccc(C)cc1C=O Amb18127904 [1,1,0,0,0,0|1,0,0]=3 1175 B13R1.51 CC(=O)Nc1ccc(Cl)cc1C=C Amb24561054 [1,1,0,0,0,0|2,0,0]=4 1176 B13R1.51 CC(=O)Nc1ccc(Cl)cc1C=O Amb18130448 [1,1,0,0,0,0|1,0,0]=3 1177 B13R1.51 CC(=O)Nc1ccc(Cl)cc1CO Amb24356683 [1,1,0,0,0,0|1,0,1]=4 1178 B13R1.51 CC(=O)Nc1ccc(N)cc1CO Amb25288110 [1,1,0,0,0,0|1,0,1]=4 1179 B13R1.51 CC(=O)Oc1ccc(Br)cc1CC Amb22551030 [1,1,0,0,0,0|1,0,1]=4 1180 B13R1.51 CC(=O)Oc1ccc(Br)cc1CO Amb24613699 [1,1,0,0,0,0|0,0,1]=3 1181 B13R1.51 CC(=O)Oc1ccc(Br)cc1OC Amb23590110 [1,1,0,0,0,0|2,0,0]=4 1182 B13R1.51 CC(=O)Oc1ccc(C)cc1C=O Amb25758665 [1,1,0,0,0,0|0,0,0]=2 1183 B13R1.51 CC(=O)Oc1ccc(Cl)cc1C=O Amb18652967 [1,1,0,0,0,0|0,0,0]=2 1184 B13R1.51 CC(=O)Oc1ccc(Cl)cc1CCl Amb24096853 [1,1,0,0,0,0|1,0,1]=4 1185 B13R1.51 CC(=O)Oc1ccc(Cl)cc1OC Amb20242654 [1,1,0,0,0,0|2,0,0]=4 1186 B13R1.51 CC(=O)Oc1ccc(F)cc1OC Amb20621498 [1,1,0,0,0,0|2,0,0]=4 1187 B13R1.51 CC(=O)Oc1ccc(O)cc1CC Amb24089414 [1,1,0,0,0,0|1,0,1]=4 1188 B13R1.51 CC(=O)Oc1ccc(O)cc1OC Amb20621499 [1,1,0,0,0,0|2,0,0]=4 1189 B13R1.51 Cc1ccc(NC(C)=O)c(CO)c1 Amb25816120 [1,1,0,0,0,0|1,0,1]=4 1190 B13R1.51 Cc1ccc(OC(C)=O)c(CCl)c1 Amb24391543 [1,1,0,0,0,0|1,0,1]=4 1191 B13R1.51 Cc1ccc(OC(C)C)c(c1)C=O Amb19962147 [1,1,0,0,0,0|1,0,1]=4 1192 B13R1.51 OC(=O)Cc1ccc(Br)cc1C=O Amb24366234 [1,1,0,0,0,0|2,0,0]=4 1193 B13R1.89 CC(=O)N(O)c1ccccc1C=O Amb25290262 [1,1,0,0,0,0|1,0,0]=3 1194 B13R1.89 CN(C(N)=O)c1ccccc1C=O Amb24541217 [1,1,0,0,0,0|2,0,0]=4 1195 B13R1.89 CN(c1ccccc1C=O)C(=O)Cl Amb25712205 [1,1,0,0,0,0|2,0,0]=4 1196 B13R1.89 OC(=O)C(=O)c1ccccc1C=O Amb25109222 [1,1,0,0,0,0|2,0,0]=4 1197 B13R1.89 OC(=O)C(O)c1ccccc1C=O Amb24489101 [1,1,0,0,0,0|2,0,0]=4 1198 B13R1.89 OC(c1ccccc1C=O)C(=O)Cl Amb25784067 [1,1,0,0,0,0|2,0,0]=4 1199 B13R1.91 BrCC(=O)Nc1ccccc1CO Amb17325844 [1,1,0,0,0,0|1,0,1]=4 1200 B13R1.91 CC(C#N)Oc1ccccc1C=O Amb18808643 [1,1,0,0,0,0|1,0,1]=4 1201 B13R1.91 CC(C=C)Oc1ccccc1C=O Amb18804547 [1,1,0,0,0,0|1,0,1]=4 1202 B13R1.91 CC(Cc1ccccc1C=O)=C=C Amb24456669 [1,1,0,0,0,0|2,0,0]=4 1203 B13R1.91 CCC(=O)Nc1ccccc1C=O Amb24611733 [1,1,0,0,0,0|1,0,0]=3 1204 B13R1.91 CCC(=O)Oc1ccccc1C#N Amb24121412 [1,1,0,0,0,0|1,0,1]=4 1205 B13R1.91 CCC(=O)Oc1ccccc1C=O Amb17129203 [1,1,0,0,0,0|0,0,0]=2 1206 B13R1.91 CNC(=O)Nc1ccccc1C=O Amb25082846 [1,1,0,0,0,0|1,0,0]=3 1207 B13R1.91 CNC(=O)Nc1ccccc1CO Amb25794726 [1,1,0,0,0,0|1,0,1]=4 1208 B13R1.91 CNC(=O)Oc1ccccc1CO Amb23440453 [1,1,0,0,0,0|0,0,1]=3 1209 B13R1.91 CNC(=O)Oc1ccccc1SC Amb25054788 [1,1,0,0,0,0|2,0,0]=4 1210 B13R1.91 COC(=O)Cc1ccccc1C=O Amb16233254 [1,1,0,0,0,0|1,0,0]=3 1211 B13R1.91 COC(=O)Cc1ccccc1CO Amb22751847 [1,1,0,0,0,0|1,0,1]=4 1212 B13R1.91 COC(=O)Nc1c[n]ccc1C=O Amb24095877 [1,1,0,0,0,0|2,0,0]=4 1213 B13R1.91 COC(=O)Nc1ccccc1C=C Amb25270045 [1,1,0,0,0,0|2,0,0]=4 1214 B13R1.91 COC(=O)Nc1ccccc1C=O Amb24095849 [1,1,0,0,0,0|1,0,0]=3 1215 B13R1.91 COC(=O)Nc1ccccc1CO Amb18181289 [1,1,0,0,0,0|1,0,1]=4 1216 B13R1.91 COC(=O)Oc1ccccc1C#N Amb25821094 [1,1,0,0,0,0|1,0,1]=4 1217 B13R1.91 COc1ccccc1OC(=O)CC Amb24079979 [1,1,0,0,0,0|2,0,0]=4 1218 B13R1.91 COc1ccccc1OC(=O)CN Amb19115310 [1,1,0,0,0,0|2,0,0]=4 1219 B13R1.91 C\C(\CO)=C\c1ccccc1C=O Amb24632257 [1,1,0,0,0,0|1,0,1]=4 1220 B13R1.91 ClCC(=O)Oc1ccccc1C=O Amb17129248 [1,1,0,0,0,0|0,0,0]=2 1221 B13R1.91 NCC(=O)Oc1ccccc1CC Amb17335317 [1,1,0,0,0,0|1,0,1]=4 1222 B13R1.91 O=C(CCl)Nc1ccccc1C=O Amb18130449 [1,1,0,0,0,0|1,0,0]=3 1223 B13R1.115 CC(=O)Cc1cccc(C)c1C=O Amb24539772 [1,1,0,0,0,0|1,0,0]=3 1224 B13R1.115 CC(=O)Cc1cccc(F)c1C=O Amb24591045 [1,1,0,0,0,0|1,0,0]=3 1225 B13R1.115 CC(=O)Cc1cccc(F)c1CO Amb25237995 [1,1,0,0,0,0|1,0,1]=4 1226 B13R1.115 CC(=O)Cc1cccc(I)c1CO Amb24667933 [1,1,0,0,0,0|1,0,1]=4 1227 B13R1.115 CC(=O)Cc1cccc(S)c1C=O Amb24528035 [1,1,0,0,0,0|1,0,0]=3 1228 B13R1.115 CC(=O)Nc1cccc(Br)c1CO Amb24458364 [1,1,0,0,0,0|1,0,1]=4 1229 B13R1.115 CC(=O)Nc1cccc(Cl)c1C=O Amb25278220 [1,1,0,0,0,0|1,0,0]=3 1230 B13R1.115 CC(=O)Nc1cccc(O)c1C=O Amb25308830 [1,1,0,0,0,0|1,0,0]=3 1231 B13R1.115 CC(=O)Oc1cccc(Cl)c1C#N Amb25762498 [1,1,0,0,0,0|1,0,1]=4 1232 B13R1.115 CC(=O)Oc1cccc(O)c1C=C Amb24492760 [1,1,0,0,0,0|1,0,0]=3 1233 B13R1.115 CC(C)Oc1cccc(F)c1C=O Amb25763392 [1,1,0,0,0,0|1,0,1]=4 1234 B13R1.115 CC(C)Oc1cccc(O)c1C=O Amb24496908 [1,1,0,0,0,0|1,0,1]=4 1235 B13R1.115 Cc1cccc(CC(O)=O)c1C=O Amb18195566 [1,1,0,0,0,0|2,0,0]=4 1236 B13R1.115 OC(=O)Cc1cccc(F)c1C=O Amb18823851 [1,1,0,0,0,0|2,0,0]=4 1237 B13R1.380 Br\C=C\c1ccccc1NC(=O)C Amb2237495 [1,1,0,0,0,0|2,0,0]=4 1238 B13R1.380 CC(=O)Nc1ccccc1CC=C Amb25725956 [1,1,0,0,0,0|2,0,0]=4 1239 B13R1.380 CC(=O)Nc1ccccc1CC=O Amb24432739 [1,1,0,0,0,0|1,0,0]=3 1240 B13R1.380 CC(=O)Nc1ccccc1CCO Amb22523486 [1,1,0,0,0,0|1,0,1]=4 1241 B13R1.380 CC(=O)Nc1ccccc1CNO Amb24494700 [1,1,0,0,0,0|1,0,1]=4 1242 B13R1.380 CC(=O)Nc1ccccc1COC Amb25725831 [1,1,0,0,0,0|1,0,1]=4 1243 B13R1.380 CC(=O)Nc1ccccc1NC=S Amb25696023 [1,1,0,0,0,0|1,1,0]=4 1244 B13R1.380 CC(=O)Nc1ccccc1OC=C Amb24086649 [1,1,0,0,0,0|2,0,0]=4 1245 B13R1.380 CC(=O)Nc1ccccc1SC=C Amb24680279 [1,1,0,0,0,0|2,0,0]=4 1246 B13R1.380 CC(=O)Nc1ccccc1\C=N\N Amb24416314 [1,1,0,0,0,0|2,0,0]=4 1247 B13R1.380 CC(=O)Oc1ccccc1N=C=O Amb25351428 [1,1,0,0,0,0|0,0,1]=3 1248 B13R1.380 CC(=O)Oc1ccccc1N=C=S Amb24754205 [1,1,0,0,0,0|0,1,1]=4 1249 B13R1.380 CC(C)Oc1ccccc1NC=O Amb25362983 [1,1,0,0,0,0|1,0,1]=4 1250 B13R1.380 OC(=O)Cc1ccccc1NC=O Amb18992618 [1,1,0,0,0,0|2,0,0]=4 1251 B13R1.380 OC(=O)Cc1ccccc1\C=N/O Amb25189803 [1,1,0,0,0,0|2,0,0]=4 1252 B13R1.622 CS(=O)(=O)Nc1ccccc1C=O Amb17935682 [1,1,0,0,0,0|2,0,0]=4 1253 B13R1.622 CS(=O)(=O)Oc1ccc[n]c1C=O Amb25853380 [1,1,0,0,0,0|2,0,0]=4 1254 B13R1.622 CS(=O)(=O)Oc1ccccc1C=O Amb22450082 [1,1,0,0,0,0|1,0,0]=3 1255 B13R1.622 O=Cc1ccccc1O[Si](C)(C)C Amb10071256 [1,1,0,0,0,0|1,1,0]=4 1256 B13R1.2135 CC(=O)Cc1c(Br)cccc1CO Amb25268575 [1,1,0,0,0,0|1,0,1]=4 1257 B13R1.2135 CC(=O)Cc1c(cccc1Cl)C=O Amb24727410 [1,1,0,0,0,0|1,0,0]=3 1258 B13R1.2135 CC(=O)Cc1c(cccc1S)C=O Amb24598620 [1,1,0,0,0,0|1,0,0]=3 1259 B13R1.2135 CC(=O)Nc1c(cccc1F)C=O Amb25222841 [1,1,0,0,0,0|1,0,0]=3 1260 B13R1.2135 CC(=O)Oc1c(Br)cccc1OC Amb24718195 [1,1,0,0,0,0|2,0,0]=4 1261 B13R1.2135 CC(=O)Oc1c(F)cccc1OC Amb24474934 [1,1,0,0,0,0|2,0,0]=4 1262 B13R1.2135 CC(=O)Oc1c(F)cccc1SC Amb25174143 [1,1,0,0,0,0|2,0,0]=4 1263 B13R1.2135 CC(=O)Oc1c(cccc1C)C=O Amb23575820 [1,1,0,0,0,0|0,0,0]=2 1264 B13R1.2135 CC(C)Oc1c(Br)cccc1C=O Amb25817418 [1,1,0,0,0,0|1,0,1]=4 1265 B13R1.2135 CC(C)Oc1c(Cl)cccc1C=O Amb25370769 [1,1,0,0,0,0|1,0,1]=4 1266 B13R1.2135 CC(C)Oc1c(F)cccc1C=O Amb24443552 [1,1,0,0,0,0|1,0,1]=4 1267 B13R1.2135 CC(C)Oc1c(O)cccc1C=O Amb24102230 [1,1,0,0,0,0|1,0,1]=4 1268 B13R1.2135 Cc1cccc(C#N)c1OC(C)=O Amb23596365 [1,1,0,0,0,0|1,0,1]=4 1269 B13R1.2135 Cc1cccc(C=O)c1OC(C)C Amb23287034 [1,1,0,0,0,0|1,0,1]=4 1270 B13R1.2135 Nc1cccc(C=O)c1CC(O)=O Amb18194796 [1,1,0,0,0,0|2,0,0]=4 1271 B13R1.3089 CC(=O)Cc1cc(C)ccc1C=O Amb24528060 [1,1,0,0,0,0|1,0,0]=3 1272 B13R1.3089 CC(=O)Cc1cc(I)ccc1C=O Amb25230144 [1,1,0,0,0,0|1,0,0]=3 1273 B13R1.3089 CC(=O)Cc1cc(I)ccc1CO Amb24539771 [1,1,0,0,0,0|1,0,1]=4 1274 B13R1.3089 CC(=O)Cc1cc(O)ccc1CO Amb25249933 [1,1,0,0,0,0|1,0,1]=4 1275 B13R1.3089 CC(=O)Nc1cc(Cl)ccc1C=C Amb25702374 [1,1,0,0,0,0|2,0,0]=4 1276 B13R1.3089 CC(=O)Nc1cc(F)ccc1C=O Amb25255592 [1,1,0,0,0,0|1,0,0]=3 1277 B13R1.3089 CC(=O)Nc1cc(O)ccc1C=O Amb18648221 [1,1,0,0,0,0|1,0,0]=3 1278 B13R1.3089 CC(=O)Oc1cc(Br)ccc1OC Amb22463042 [1,1,0,0,0,0|2,0,0]=4 1279 B13R1.3089 CC(=O)Oc1cc(I)ccc1OC Amb20243464 [1,1,0,0,0,0|2,0,0]=4 1280 B13R1.3089 CC(=O)Oc1cc(O)ccc1OC Amb22055683 [1,1,0,0,0,0|2,0,0]=4 1281 B13R1.3089 CC(C)=Cc1cc(F)ccc1C=O Amb25730077 [1,1,0,0,0,0|2,0,0]=4 1282 B13R1.3089 CC(C)Oc1cc(F)ccc1C=O Amb25083516 [1,1,0,0,0,0|1,0,1]=4 1283 B13R1.3089 CC(C)Oc1cc(O)ccc1C=O Amb23569449 [1,1,0,0,0,0|1,0,1]=4 1284 B13R1.3089 Cc1cc(OC(C)=O)c(CO)c[n]1 Amb25734386 [1,1,0,0,0,0|1,0,1]=4 1285 B13R1.3089 Cc1ccc(C#N)c(c1)OC(C)=O Amb24104340 [1,1,0,0,0,0|1,0,1]=4 1286 B13R1.3089 Cc1ccc(CC)c(c1)OC(C)=O Amb24414771 [1,1,0,0,0,0|1,0,1]=4 1287 B13R1.3089 Nc1cc(CC(O)=O)c(cc1)C=O Amb18194802 [1,1,0,0,0,0|2,0,0]=4 1288 B13R1.3089 OC(=O)Cc1cc(O)ccc1C=O Amb24526615 [1,1,0,0,0,0|2,0,0]=4 1289 B13R1.141 C=CCc1ccc(O)cc1C(O)=O Amb24429187 [1,1,0,0,0,0|1,0,1]=4 1290 B13R1.141 CC(=O)c1cc(Cl)ccc1NC=O Amb25667745 [1,1,0,0,0,0|2,0,0]=4 1291 B13R1.141 CC(=O)c1cc(Cl)ccc1OC=C Amb25821542 [1,1,0,0,0,0|1,0,1]=4 1292 B13R1.141 CC(=O)c1cc(F)ccc1OC=C Amb25355286 [1,1,0,0,0,0|1,0,1]=4 1293 B13R1.141 CC(=O)c1cc(O)ccc1NC=O Amb18128313 [1,1,0,0,0,0|2,0,0]=4 1294 B13R1.141 CCNc1ccc(F)cc1C(O)=O Amb18066098 [1,1,0,0,0,0|1,0,1]=4 1295 B13R1.141 CCNc1ccc(N)cc1C(O)=O Amb18970792 [1,1,0,0,0,0|1,0,1]=4 1296 B13R1.141 CCOc1[n]cc(N)cc1C(O)=O Amb24563819 [1,1,0,0,0,0|1,0,1]=4 1297 B13R1.141 CCOc1c[n]c(N)cc1C(O)=O Amb24731199 [1,1,0,0,0,0|1,0,1]=4 1298 B13R1.141 CCOc1ccc(Br)[n]c1C(O)=O Amb23541704 [1,1,0,0,0,0|1,0,1]=4 1299 B13R1.141 CCOc1ccc(F)cc1C(=O)Cl Amb25726430 [1,1,0,0,0,0|1,0,1]=4 1300 B13R1.141 CCOc1ccc(I)cc1C(O)=O Amb18555907 [1,1,0,0,0,0|0,0,1]=3 1301 B13R1.141 CCOc1ccc(cc1C(=O)C)Br Amb2209254 [1,1,0,0,0,0|1,0,1]=4 1302 B13R1.141 CCOc1ccc(cc1C(=O)C)C Amb2209256 [1,1,0,0,0,0|1,0,1]=4 1303 B13R1.141 CCOc1ccc(cc1C(=O)Cl)Br Amb16230170 [1,1,0,0,0,0|1,0,1]=4 1304 B13R1.141 CCOc1ccc(cc1C(=O)Cl)Cl Amb16230220 [1,1,0,0,0,0|1,0,1]=4 1305 B13R1.141 CCOc1ccc(cc1C(=O)O)C Amb17109112 [1,1,0,0,0,0|0,0,1]=3 1306 B13R1.141 CCOc1ccc(cc1C(=O)O)N Amb13949220 [1,1,0,0,0,0|0,0,1]=3 1307 B13R1.141 CCOc1ccc(cc1C(=O)O)O Amb17201823 [1,1,0,0,0,0|0,0,1]=3 1308 B13R1.141 CCOc1ncc(cc1C(=O)O)Br Amb10069951 [1,1,0,0,0,0|1,0,1]=4 1309 B13R1.141 CCOc1ncc(cc1C(=O)O)Cl Amb1092000 [1,1,0,0,0,0|1,0,1]=4 1310 B13R1.141 CCOc1ncc(cc1C(=O)O)I Amb10069949 [1,1,0,0,0,0|1,0,1]=4 1311 B13R1.141 CCSc1ccc(Cl)cc1C(O)=O Amb20629931 [1,1,0,0,0,0|0,1,1]=4 1312 B13R1.141 CCSc1ccc(F)cc1C(O)=O Amb25836638 [1,1,0,0,0,0|0,1,1]=4 1313 B13R1.141 CCSc1ccc(N)cc1C(O)=O Amb18970756 [1,1,0,0,0,0|0,1,1]=4 1314 B13R1.141 CNCc1ccc(Br)cc1C(O)=O Amb24123121 [1,1,0,0,0,0|2,0,0]=4 1315 B13R1.141 CNCc1ccc(Cl)cc1C(O)=O Amb24123116 [1,1,0,0,0,0|2,0,0]=4 1316 B13R1.141 CNCc1ccc(F)cc1C(O)=O Amb24123126 [1,1,0,0,0,0|2,0,0]=4 1317 B13R1.141 CNCc1ccc(I)cc1C(O)=O Amb24123111 [1,1,0,0,0,0|2,0,0]=4 1318 B13R1.141 COCc1ccc(Br)cc1C(O)=O Amb23443128 [1,1,0,0,0,0|2,0,0]=4 1319 B13R1.141 COCc1ccc(F)cc1C(O)=O Amb24644398 [1,1,0,0,0,0|2,0,0]=4 1320 B13R1.141 COCc1ccc(N)cc1C(O)=O Amb23443142 [1,1,0,0,0,0|2,0,0]=4 1321 B13R1.141 CSCc1ccc(Br)cc1C(O)=O Amb23443139 [1,1,0,0,0,0|2,0,0]=4 1322 B13R1.141 Cc1cc(C(O)=O)c(CC=C)cc1 Amb25725890 [1,1,0,0,0,0|1,0,1]=4 1323 B13R1.141 Cc1cc(C(O)=O)c(\C=C\C)cc1 Amb24490189 [1,1,0,0,0,0|1,0,0]=3 1324 B13R1.141 Cc1cc(C(O)=O)c(cc1)NC=O Amb18951586 [1,1,0,0,0,0|1,0,0]=3 1325 B13R1.141 Cc1ccc(OC=C)c(c1)C(C)=O Amb24640113 [1,1,0,0,0,0|1,0,1]=4 1326 B13R1.141 Cc1ccc(OCC)c(c1)C(=O)Cl Amb24083928 [1,1,0,0,0,0|1,0,1]=4 1327 B13R1.141 Cc1ccc(OCC)c(c1)C(N)=O Amb18054461 [1,1,0,0,0,0|1,0,1]=4 1328 B13R1.141 Cc1ccc(SCC)c(c1)C(O)=O Amb18992254 [1,1,0,0,0,0|0,1,1]=4 1329 B13R1.141 OC(=O)c1cc(Br)ccc1NC=O Amb18958006 [1,1,0,0,0,0|1,0,0]=3 1330 B13R1.141 OC(=O)c1cc(Cl)ccc1NC=O Amb18951580 [1,1,0,0,0,0|1,0,0]=3 1331 B13R1.141 OC(=O)c1cc(Cl)ccc1NN=O Amb25309544 [1,1,0,0,0,0|2,0,0]=4 1332 B13R1.141 OC(=O)c1cc(F)ccc1NC=O Amb18951587 [1,1,0,0,0,0|1,0,0]=3 1333 B13R1.141 OC(=O)c1cc(O)ccc1NC=O Amb18282958 [1,1,0,0,0,0|1,0,0]=3 1334 B13R1.356 C=CCc1cc(Cl)ccc1C(O)=O Amb18130363 [1,1,0,0,0,0|1,0,1]=4 1335 B13R1.356 CC(=O)c1ccc(Cl)cc1NC=O Amb24649677 [1,1,0,0,0,0|2,0,0]=4 1336 B13R1.356 CC(=O)c1ccc(Cl)cc1OCC Amb24407258 [1,1,0,0,0,0|1,0,1]=4 1337 B13R1.356 CC(=O)c1ccc(F)cc1OCC Amb18179261 [1,1,0,0,0,0|1,0,1]=4 1338 B13R1.356 CC(=O)c1ccc(O)cc1OCC Amb24491437 [1,1,0,0,0,0|1,0,1]=4 1339 B13R1.356 CCCc1cc(N)ccc1C(O)=O Amb24496284 [1,1,0,0,0,0|1,0,1]=4 1340 B13R1.356 CCCc1cc(O)ccc1C(O)=O Amb17942865 [1,1,0,0,0,0|1,0,1]=4 1341 B13R1.356 CCNc1cc(Br)ccc1C(O)=O Amb25809727 [1,1,0,0,0,0|1,0,1]=4 1342 B13R1.356 CCNc1cc(Cl)ccc1C(O)=O Amb18303162 [1,1,0,0,0,0|1,0,1]=4 1343 B13R1.356 CCNc1cc(F)ccc1C(O)=O Amb19515461 [1,1,0,0,0,0|1,0,1]=4 1344 B13R1.356 CCOc1[n]c(Cl)ccc1C(O)=O Amb22276112 [1,1,0,0,0,0|1,0,1]=4 1345 B13R1.356 CCOc1cc(Br)ccc1C(N)=O Amb22229684 [1,1,0,0,0,0|1,0,1]=4 1346 B13R1.356 CCOc1cc(C)ccc1C(=O)C Amb2209255 [1,1,0,0,0,0|1,0,1]=4 1347 B13R1.356 CCOc1cc(Cl)ccc1C(O)=O Amb18295312 [1,1,0,0,0,0|0,0,1]=3 1348 B13R1.356 CCOc1cc(N)ccc1C(N)=O Amb24092570 [1,1,0,0,0,0|1,0,1]=4 1349 B13R1.356 CCOc1cc(O)ccc1C(N)=O Amb25711449 [1,1,0,0,0,0|1,0,1]=4 1350 B13R1.356 CCSc1cc(F)ccc1C(O)=O Amb25192462 [1,1,0,0,0,0|0,1,1]=4 1351 B13R1.356 CCSc1cc(I)ccc1C(O)=O Amb24402350 [1,1,0,0,0,0|0,1,1]=4 1352 B13R1.356 CCSc1cc(N)ccc1C(O)=O Amb25350010 [1,1,0,0,0,0|0,1,1]=4 1353 B13R1.356 CCSc1cc(O)ccc1C(O)=O Amb25049559 [1,1,0,0,0,0|0,1,1]=4 1354 B13R1.356 Cc1cc(OCC)c(c[n]1)C(O)=O Amb24556147 [1,1,0,0,0,0|1,0,1]=4 1355 B13R1.356 Cc1ccc(C(O)=O)c(CC=C)c1 Amb25365138 [1,1,0,0,0,0|1,0,1]=4 1356 B13R1.356 Cc1ccc(c(CCC)c1)C(O)=O Amb24426132 [1,1,0,0,0,0|1,0,1]=4 1357 B13R1.356 Cc1ccc(c([n]1)OCC)C(O)=O Amb18995650 [1,1,0,0,0,0|1,0,1]=4 1358 B13R1.356 Cc1ccc(c(c1)NCC)C(O)=O Amb18300466 [1,1,0,0,0,0|1,0,1]=4 1359 B13R1.356 Cc1ccc(c(c1)OCC)C(=O)Cl Amb24104431 [1,1,0,0,0,0|1,0,1]=4 1360 B13R1.356 Cc1ccc(c(c1)OCC)C(O)=O Amb18291991 [1,1,0,0,0,0|0,0,1]=3 1361 B13R1.356 Cc1ccc(c(c1)SCC)C(O)=O Amb18300481 [1,1,0,0,0,0|0,1,1]=4 1362 B13R1.356 OC(=O)c1ccc(Br)cc1NC=O Amb18281872 [1,1,0,0,0,0|1,0,0]=3 1363 B13R1.356 OC(=O)c1ccc(Cl)cc1NC=O Amb18281865 [1,1,0,0,0,0|1,0,0]=3 1364 B13R1.356 OC(=O)c1ccc(F)cc1NC=O Amb18951583 [1,1,0,0,0,0|1,0,0]=3 1365 B13R1.356 OC(=O)c1ccc(O)cc1NC=O Amb25264436 [1,1,0,0,0,0|1,0,0]=3 1366 B13R1.382 CCC(=O)c1ccccc1NC=O Amb25252910 [1,1,0,0,0,0|2,0,0]=4 1367 B13R1.382 CCOc1ccccc1C(=O)C#C Amb24662799 [1,1,0,0,0,0|1,0,1]=4 1368 B13R1.382 CCOc1ccccc1C(=O)CCl Amb19084559 [1,1,0,0,0,0|1,0,1]=4 1369 B13R1.382 CCOc1ccccc1C(=O)NN Amb1141348 [1,1,0,0,0,0|1,0,1]=4 1370 B13R1.382 CNC(=O)c1ccccc1NC=O Amb24496746 [1,1,0,0,0,0|2,0,0]=4 1371 B13R1.382 CNCc1ccccc1C(=O)OC Amb19346337 [1,1,0,0,0,0|2,0,0]=4 1372 B13R1.382 COC(=O)c1c[n]ccc1OCC Amb23412040 [1,1,0,0,0,0|1,0,1]=4 1373 B13R1.382 COC(=O)c1ccc[n]c1NC=O Amb25843904 [1,1,0,0,0,0|2,0,0]=4 1374 B13R1.382 COC(=O)c1ccccc1NC=O Amb19515947 [1,1,0,0,0,0|1,0,0]=3 1375 B13R1.382 COC(=O)c1ccccc1\C=C\Cl Amb25337728 [1,1,0,0,0,0|2,0,0]=4 1376 B13R1.382 COC(=O)c1ccccc1\C=C\I Amb22497458 [1,1,0,0,0,0|2,0,0]=4 1377 B13R1.382 COCc1ccccc1C(=O)NO Amb24397759 [1,1,0,0,0,0|2,0,0]=4 1378 B13R1.382 N#COc1ccccc1C(=O)OC Amb10576345 [1,1,0,0,0,0|1,0,1]=4 1379 B13R1.547 C=CC(=O)c1ccccc1C(O)=O Amb25772792 [1,1,0,0,0,0|1,0,1]=4 1380 B13R1.547 C=CC(N)c1ccccc1C(O)=O Amb25824601 [1,1,0,0,0,0|1,0,1]=4 1381 B13R1.547 C=C[C@H](N)c1ccccc1C(O)=O Amb25715555 [1,1,0,0,0,0|1,0,1]=4 1382 B13R1.547 CCC(=C)c1ccccc1C(O)=O Amb25280073 [1,1,0,0,0,0|1,0,1]=4 1383 B13R1.547 CCC(C)c1ccccc1C(O)=O Amb18128233 [1,1,0,0,0,0|1,0,1]=4 1384 B13R1.547 CCC(O)c1ccccc1C(O)=O Amb24398674 [1,1,0,0,0,0|1,0,1]=4 1385 B13R1.547 CC[C@@H](O)c1ccccc1C(O)=O Amb24442973 [1,1,0,0,0,0|1,0,1]=4 1386 B13R1.547 CC[C@H](O)c1ccccc1C(O)=O Amb25337792 [1,1,0,0,0,0|1,0,1]=4 1387 B13R1.547 CN(C=O)c1ccccc1C(O)=O Amb18281866 [1,1,0,0,0,0|1,0,0]=3 1388 B13R1.547 CN(N=O)c1ccccc1C(O)=O Amb25677034 [1,1,0,0,0,0|2,0,0]=4 1389 B13R1.547 CNC(C)c1ccccc1C(O)=O Amb25124811 [1,1,0,0,0,0|2,0,0]=4 1390 B13R1.547 CN[C@H](C)c1ccccc1C(O)=O Amb25088324 [1,1,0,0,0,0|2,0,0]=4 1391 B13R1.547 COC(C)c1ccccc1C(O)=O Amb25061346 [1,1,0,0,0,0|2,0,0]=4 1392 B13R1.547 C\C(=C\C)\c1ccccc1C(O)=O Amb25101533 [1,1,0,0,0,0|1,0,0]=3 1393 B13R1.547 OC(=O)c1ccccc1C(=O)C=O Amb25783947 [1,1,0,0,0,0|1,0,0]=3 1394 B13R1.572 BrCCOc1ccccc1C(=O)C Amb1105087 [1,1,0,0,0,0|1,0,1]=4 1395 B13R1.572 C=CCNc1ccccc1C(=O)O Amb1206080 [1,1,0,0,0,0|1,0,1]=4 1396 B13R1.572 C=CCOc1ccc[n]c1C(O)=O Amb18178631 [1,1,0,0,0,0|1,0,1]=4 1397 B13R1.572 C=C\C=C\c1ccccc1C(O)=O Amb25269472 [1,1,0,0,0,0|1,0,1]=4 1398 B13R1.572 CC#CSc1ccccc1C(O)=O Amb25138792 [1,1,0,0,0,0|0,1,1]=4 1399 B13R1.572 CC(=O)c1ccccc1CCC=O Amb24092997 [1,1,0,0,0,0|2,0,0]=4 1400 B13R1.572 CC(=O)c1ccccc1C\C=C\C Amb24491385 [1,1,0,0,0,0|2,0,0]=4 1401 B13R1.572 CC(=O)c1ccccc1OCOC Amb18092918 [1,1,0,0,0,0|1,0,1]=4 1402 B13R1.572 CCCNc1ccccc1C(=O)O Amb1110239 [1,1,0,0,0,0|1,0,1]=4 1403 B13R1.572 CCCOc1ccccc1C(=O)O Amb1140823 [1,1,0,0,0,0|0,0,1]=3 1404 B13R1.572 CCCSc1ccccc1C(=O)O Amb1138545 [1,1,0,0,0,0|0,1,1]=4 1405 B13R1.572 CCNCc1ccccc1C(=O)O Amb10242754 [1,1,0,0,0,0|1,0,1]=4 1406 B13R1.572 CCNCc1ccccc1C(=O)O Amb2119471 [1,1,0,0,0,0|1,0,1]=4 1407 B13R1.572 CCONc1[n]cccc1C(O)=O Amb24408253 [1,1,0,0,0,0|1,0,1]=4 1408 B13R1.572 CC\C=N\c1ccccc1C(O)=O Amb24711280 [1,1,0,0,0,0|1,0,0]=3 1409 B13R1.572 COCOc1ccccc1C(O)=O Amb22055712 [1,1,0,0,0,0|0,0,1]=3 1410 B13R1.572 CO\N=C\c1ccccc1C(O)=O Amb24541447 [1,1,0,0,0,0|2,0,0]=4 1411 B13R1.572 C\C=C\Cc1ccccc1C(O)=O Amb24426260 [1,1,0,0,0,0|1,0,0]=3 1412 B13R1.572 C\C=C\Sc1ccccc1C(O)=O Amb25188029 [1,1,0,0,0,0|0,1,0]=3 1413 B13R1.572 N#C\C=C\c1ccccc1C(=O)O Amb17477684 [1,1,0,0,0,0|1,0,1]=4 1414 B13R1.572 NC(=O)c1ccccc1\C=C\CO Amb20248381 [1,1,0,0,0,0|2,0,0]=4 1415 B13R1.572 NCC#Cc1ccccc1C(O)=O Amb24494529 [1,1,0,0,0,0|1,0,1]=4 1416 B13R1.572 NCCNc1ccccc1C(O)=O Amb18186560 [1,1,0,0,0,0|1,0,1]=4 1417 B13R1.572 NCCNc1ccccc1C(O)=O Amb22756939 [1,1,0,0,0,0|1,0,1]=4 1418 B13R1.572 O=C(Cl)c1ccccc1OCCF Amb24070129 [1,1,0,0,0,0|1,0,1]=4 1419 B13R1.572 O=C(Cl)c1ccccc1\C=C\C=O Amb25130560 [1,1,0,0,0,0|2,0,0]=4 1420 B13R1.572 O=CCOc1ccccc1[N+](=O)[O-] Amb17099947 [1,1,0,0,0,0|1,0,1]=4 1421 B13R1.572 OC(=O)c1[n]cccc1OCCO Amb19015805 [1,1,0,0,0,0|1,0,1]=4 1422 B13R1.572 OC(=O)c1[n]cccc1OCCO Amb21963147 [1,1,0,0,0,0|1,0,1]=4 1423 B13R1.572 OC(=O)c1ccc[n]c1NCC=O Amb18128572 [1,1,0,0,0,0|2,0,0]=4 1424 B13R1.572 OC(=O)c1ccccc1C#CCCl Amb24492262 [1,1,0,0,0,0|1,0,1]=4 1425 B13R1.572 OC(=O)c1ccccc1C#CCI Amb24437559 [1,1,0,0,0,0|1,0,1]=4 1426 B13R1.572 OC(=O)c1ccccc1NCCCl Amb24652399 [1,1,0,0,0,0|1,0,1]=4 1427 B13R1.572 OC(=O)c1ccccc1NCCF Amb24463361 [1,1,0,0,0,0|1,0,1]=4 1428 B13R1.572 OC(=O)c1ccccc1NNC=O Amb18128573 [1,1,0,0,0,0|1,0,0]=3 1429 B13R1.572 OC(=O)c1ccccc1\N=C\CO Amb25109239 [1,1,0,0,0,0|1,0,0]=3 1430 B13R1.572 OCCNc1ccccc1C(=O)O Amb1102882 [1,1,0,0,0,0|1,0,1]=4 1431 B13R1.2897 C=CCc1cccc(N)c1C(O)=O Amb25360993 [1,1,0,0,0,0|1,0,1]=4 1432 B13R1.2897 C=CCc1cccc(O)c1C(O)=O Amb25258033 [1,1,0,0,0,0|1,0,1]=4 1433 B13R1.2897 CC(=O)c1c(Cl)cccc1OCC Amb25153339 [1,1,0,0,0,0|1,0,1]=4 1434 B13R1.2897 CC(=O)c1c(O)cccc1OCC Amb22264780 [1,1,0,0,0,0|1,0,1]=4 1435 B13R1.2897 CCNc1cccc(Br)c1C(O)=O Amb25305201 [1,1,0,0,0,0|1,0,1]=4 1436 B13R1.2897 CCNc1cccc(Cl)c1C(O)=O Amb18995610 [1,1,0,0,0,0|1,0,1]=4 1437 B13R1.2897 CCNc1cccc(F)c1C(O)=O Amb18066095 [1,1,0,0,0,0|1,0,1]=4 1438 B13R1.2897 CCOc1cc[n]c(Cl)c1C(O)=O Amb24473348 [1,1,0,0,0,0|1,0,1]=4 1439 B13R1.2897 CCOc1cccc(Br)c1C(O)=O Amb21959258 [1,1,0,0,0,0|0,0,1]=3 1440 B13R1.2897 CCOc1cccc(F)c1C(O)=O Amb25180885 [1,1,0,0,0,0|0,0,1]=3 1441 B13R1.2897 CCOc1cccc(I)c1C(O)=O Amb22011718 [1,1,0,0,0,0|0,0,1]=3 1442 B13R1.2897 CCOc1cccc(N)c1C(N)=O Amb18128677 [1,1,0,0,0,0|1,0,1]=4 1443 B13R1.2897 CCOc1cccc(N)c1C(O)=O Amb22490736 [1,1,0,0,0,0|0,0,1]=3 1444 B13R1.2897 CCSc1cccc(Cl)c1C(O)=O Amb25070911 [1,1,0,0,0,0|0,1,1]=4 1445 B13R1.2897 CCSc1cccc(F)c1C(O)=O Amb25790740 [1,1,0,0,0,0|0,1,1]=4 1446 B13R1.2897 CCSc1cccc(S)c1C(O)=O Amb25156319 [1,1,0,0,0,0|0,1,1]=4 1447 B13R1.2897 CSCc1cccc(N)c1C(O)=O Amb25153663 [1,1,0,0,0,0|2,0,0]=4 1448 B13R1.2897 C\C=C\c1cccc(Cl)c1C(O)=O Amb24371125 [1,1,0,0,0,0|1,0,0]=3 1449 B13R1.2897 C\C=C\c1cccc(O)c1C(O)=O Amb24737142 [1,1,0,0,0,0|1,0,0]=3 1450 B13R1.2897 Cc1cc[n]c(OCC)c1C(O)=O Amb24494051 [1,1,0,0,0,0|1,0,1]=4 1451 B13R1.2897 Cc1cccc(CC=C)c1C(O)=O Amb25041082 [1,1,0,0,0,0|1,0,1]=4 1452 B13R1.2897 Cc1cccc(OCC)c1C(N)=O Amb22500484 [1,1,0,0,0,0|1,0,1]=4 1453 B13R1.2897 Cc1cccc(OCC)c1C(O)=O Amb18648351 [1,1,0,0,0,0|0,0,1]=3 1454 B13R1.2897 Nc1cccc(NC=O)c1C(O)=O Amb25774922 [1,1,0,0,0,0|1,0,0]=3 1455 B13R1.2897 OC(=O)c1c(Cl)cccc1NC=O Amb25128521 [1,1,0,0,0,0|1,0,0]=3 1456 B13R1.2897 OC(=O)c1c(F)cccc1NC=O Amb18951592 [1,1,0,0,0,0|1,0,0]=3 1457 B13R1.4012 C=CCc1c(cccc1O)C(O)=O Amb25076760 [1,1,0,0,0,0|1,0,1]=4 1458 B13R1.4012 CC(=O)c1cccc(F)c1OCC Amb25743819 [1,1,0,0,0,0|1,0,1]=4 1459 B13R1.4012 CC(=O)c1cccc(O)c1\C=C/C Amb25319913 [1,1,0,0,0,0|2,0,0]=4 1460 B13R1.4012 CCCc1c(cccc1Br)C(O)=O Amb22497463 [1,1,0,0,0,0|1,0,1]=4 1461 B13R1.4012 CCCc1c(cccc1Cl)C(O)=O Amb24635782 [1,1,0,0,0,0|1,0,1]=4 1462 B13R1.4012 CCCc1c(cccc1O)C(O)=O Amb24423841 [1,1,0,0,0,0|1,0,1]=4 1463 B13R1.4012 CCNc1c(Br)cccc1C(O)=O Amb24685280 [1,1,0,0,0,0|1,0,1]=4 1464 B13R1.4012 CCNc1c(F)cccc1C(O)=O Amb18994282 [1,1,0,0,0,0|1,0,1]=4 1465 B13R1.4012 CCOc1c(Br)cccc1C(O)=O Amb18977690 [1,1,0,0,0,0|0,0,1]=3 1466 B13R1.4012 CCOc1c(C)cccc1C(=O)C Amb17233419 [1,1,0,0,0,0|1,0,1]=4 1467 B13R1.4012 CCOc1c(Cl)cccc1C(=O)C Amb17236838 [1,1,0,0,0,0|1,0,1]=4 1468 B13R1.4012 CCOc1c(Cl)cccc1C(O)=O Amb25351106 [1,1,0,0,0,0|0,0,1]=3 1469 B13R1.4012 CCOc1c(F)cccc1C(O)=O Amb18994272 [1,1,0,0,0,0|0,0,1]=3 1470 B13R1.4012 CCOc1c(S)cccc1C(O)=O Amb25091126 [1,1,0,0,0,0|0,0,1]=3 1471 B13R1.4012 CCOc1c(cccc1N)C(N)=O Amb25737497 [1,1,0,0,0,0|1,0,1]=4 1472 B13R1.4012 CCSc1c(Cl)cccc1C(O)=O Amb25324143 [1,1,0,0,0,0|0,1,1]=4 1473 B13R1.4012 CCSc1c(F)cccc1C(O)=O Amb18994300 [1,1,0,0,0,0|0,1,1]=4 1474 B13R1.4012 Cc1cccc(C(O)=O)c1CC=O Amb25188025 [1,1,0,0,0,0|1,0,0]=3 1475 B13R1.4012 Cc1cccc(c1OCC)C(=O)Cl Amb24104413 [1,1,0,0,0,0|1,0,1]=4 1476 B13R1.4012 Cc1cccc(c1OCC)C(O)=O Amb18969757 [1,1,0,0,0,0|0,0,1]=3 1477 B13R1.4012 OC(=O)c1cccc(Br)c1NC=O Amb25086178 [1,1,0,0,0,0|1,0,0]=3 1478 B13R1.4012 OC(=O)c1cccc(O)c1NC=O Amb25674719 [1,1,0,0,0,0|1,0,0]=3 1479 B13R1.165 Brc1ccc(c(c1)N(C)C)C(=O)O Amb10610263 [0,1,0,0,1,0|2,0,0]=4 1480 B13R1.165 CC(=O)c1[n]c(O)[n]cc1C(O)=O Amb22755344 [0,1,0,0,1,0|2,0,0]=4 1481 B13R1.165 CC(=O)c1[n]c(S)[n]cc1C(O)=O Amb24342456 [0,1,0,0,1,0|2,0,0]=4 1482 B13R1.165 CC(=O)c1cc(Br)ccc1C(O)=O Amb18155971 [0,1,0,0,1,0|0,0,0]=2 1483 B13R1.165 CC(=O)c1cc(Br)ccc1N(=O)=O Amb22371054 [0,1,0,0,1,0|1,0,1]=4 1484 B13R1.165 CC(=O)c1cc(Br)ccc1[N+]([O-])=O Amb19944582 [0,1,0,0,1,0|1,0,1]=4 1485 B13R1.165 CC(=O)c1cc(Cl)[n]cc1C(O)=O Amb24488908 [0,1,0,0,1,0|1,0,0]=3 1486 B13R1.165 CC(=O)c1cc(Cl)ccc1C(O)=O Amb25304211 [0,1,0,0,1,0|0,0,0]=2 1487 B13R1.165 CC(=O)c1cc(Cl)cnc1C(=O)O Amb15695202 [0,1,0,0,1,0|1,0,0]=3 1488 B13R1.165 CC(=O)c1cc(F)ccc1[N+]([O-])=O Amb22274620 [0,1,0,0,1,0|1,0,1]=4 1489 B13R1.165 CC(=O)c1cc(I)ccc1C(O)=O Amb24659770 [0,1,0,0,1,0|0,0,0]=2 1490 B13R1.165 CC(=O)c1cc(N)c[n]c1C(O)=O Amb25238984 [0,1,0,0,1,0|1,0,0]=3 1491 B13R1.165 CC(=O)c1cc(N)ccc1C(O)=O Amb24454553 [0,1,0,0,1,0|0,0,0]=2 1492 B13R1.165 CC(=O)c1cc(O)ccc1[N+]([O-])=O Amb21962931 [0,1,0,0,1,0|1,0,1]=4 1493 B13R1.165 CC(=O)c1ccc(Br)cc1[N+]([O-])=O Amb20241811 [0,1,0,0,1,0|1,0,1]=4 1494 B13R1.165 CC(=O)c1ccc(C)cc1[N+]([O-])=O Amb24634708 [0,1,0,0,1,0|1,0,1]=4 1495 B13R1.165 CC(=O)c1ccc(Cl)cc1C(C)=O Amb24490495 [0,1,0,0,1,0|1,0,0]=3 1496 B13R1.165 CC(=O)c1ccc(Cl)cc1C(O)=O Amb25724877 [0,1,0,0,1,0|0,0,0]=2 1497 B13R1.165 CC(=O)c1ccc(F)cc1B(O)O Amb24725396 [0,1,0,0,1,0|1,0,1]=4 1498 B13R1.165 CC(=O)c1ccc(F)cc1C(O)=O Amb24435413 [0,1,0,0,1,0|0,0,0]=2 1499 B13R1.165 CC(=O)c1ccc(F)cc1[N+]([O-])=O Amb22497637 [0,1,0,0,1,0|1,0,1]=4 1500 B13R1.165 CC(=O)c1ccc(I)cc1[N+]([O-])=O Amb22498969 [0,1,0,0,1,0|1,0,1]=4 1501 B13R1.165 CC(=O)c1ccc(O)cc1C(O)=O Amb24366036 [0,1,0,0,1,0|0,0,0]=2 1502 B13R1.165 CC(C)c1cc(Br)ccc1C(O)=O Amb19892741 [0,1,0,0,1,0|1,0,1]=4 1503 B13R1.165 CC(C)c1cc(F)ccc1C(O)=O Amb24105440 [0,1,0,0,1,0|1,0,1]=4 1504 B13R1.165 CC(C)c1ccc(Br)cc1C(O)=O Amb24081403 [0,1,0,0,1,0|1,0,1]=4 1505 B13R1.165 CC(N)c1ccc(Cl)cc1C(O)=O Amb25732257 [0,1,0,0,1,0|1,0,1]=4 1506 B13R1.165 CC(N)c1ccc(F)cc1C(O)=O Amb24495153 [0,1,0,0,1,0|1,0,1]=4 1507 B13R1.165 CC(N)c1ccc(I)cc1C(O)=O Amb24435993 [0,1,0,0,1,0|1,0,1]=4 1508 B13R1.165 CC(N)c1ccc(O)cc1C(O)=O Amb24596894 [0,1,0,0,1,0|1,0,1]=4 1509 B13R1.165 CN(C)c1cc(Cl)ccc1C(O)=O Amb18967535 [0,1,0,0,1,0|2,0,0]=4 1510 B13R1.165 CN(C)c1cc(N)ccc1C(O)=O Amb25227787 [0,1,0,0,1,0|2,0,0]=4 1511 B13R1.165 CN(C)c1ccc(Br)cc1C(O)=O Amb23401967 [0,1,0,0,1,0|2,0,0]=4 1512 B13R1.165 CN(C)c1ccc(Cl)cc1C(O)=O Amb18955632 [0,1,0,0,1,0|2,0,0]=4 1513 B13R1.165 CN(C)c1ccc(I)cc1C(O)=O Amb25767367 [0,1,0,0,1,0|2,0,0]=4 1514 B13R1.165 CS(=O)c1cc(Br)ccc1C(O)=O Amb25112403 [0,1,0,0,1,0|1,0,0]=3 1515 B13R1.165 C[C@@H](N)c1cc(N)ccc1C(O)=O Amb25669194 [0,1,0,0,1,0|1,0,1]=4 1516 B13R1.165 C[C@@H](N)c1cc(O)ccc1C(O)=O Amb24419053 [0,1,0,0,1,0|1,0,1]=4 1517 B13R1.165 C[C@@H](N)c1ccc(I)cc1C(O)=O Amb24446489 [0,1,0,0,1,0|1,0,1]=4 1518 B13R1.165 C[C@@H](N)c1ccc(N)cc1C(O)=O Amb25727286 [0,1,0,0,1,0|1,0,1]=4 1519 B13R1.165 C[C@H](N)c1cc(Br)ccc1C(O)=O Amb25822486 [0,1,0,0,1,0|1,0,1]=4 1520 B13R1.165 C[C@H](N)c1cc(Cl)ccc1C(O)=O Amb24377602 [0,1,0,0,1,0|1,0,1]=4 1521 B13R1.165 C[C@H](N)c1cc(F)ccc1C(O)=O Amb24646755 [0,1,0,0,1,0|1,0,1]=4 1522 B13R1.165 C[C@H](N)c1cc(N)ccc1C(O)=O Amb24540512 [0,1,0,0,1,0|1,0,1]=4 1523 B13R1.165 C[C@H](N)c1ccc(I)cc1C(O)=O Amb25732408 [0,1,0,0,1,0|1,0,1]=4 1524 B13R1.165 C[n+]1cc(C(O)=O)c(cc1)C([O-])=O Amb24634050 [0,1,0,0,1,0|2,0,0]=4 1525 B13R1.165 Cc1cc(C(O)=O)c(cc1)N(=O)=O Amb20621664 [0,1,0,0,1,0|2,0,0]=4 1526 B13R1.165 Cc1cc(c([n]c1)C(O)=O)C(O)=O Amb18128790 [0,1,0,0,1,0|2,0,0]=4 1527 B13R1.165 Cc1cc(c(c[n]1)C(O)=O)C(O)=O Amb22522562 [0,1,0,0,1,0|2,0,0]=4 1528 B13R1.165 Cc1cc(c(cc1)C(=O)Cl)C(=O)Cl Amb25339291 [0,1,0,0,1,0|2,0,0]=4 1529 B13R1.165 Cc1ccc([C@@H](C)N)c(c1)C(O)=O Amb25843817 [0,1,0,0,1,0|1,0,1]=4 1530 B13R1.165 Cc1ccc(c(c1)C(=O)C)[N+](=O)[O-] Amb10604706 [0,1,0,0,1,0|1,0,1]=4 1531 B13R1.165 Cc1ccc(c(c1)C(=O)O)C(C)C Amb17594551 [0,1,0,0,1,0|1,0,1]=4 1532 B13R1.165 Cc1ccc(c(c1)C(O)=O)N(C)C Amb18962239 [0,1,0,0,1,0|2,0,0]=4 1533 B13R1.165 Cc1ccc(c(c1)N(C)C)C(O)=O Amb18963562 [0,1,0,0,1,0|2,0,0]=4 1534 B13R1.165 Cc1ccc(c(c1)[C@H](C)N)C(O)=O Amb24341458 [0,1,0,0,1,0|1,0,1]=4 1535 B13R1.165 Clc1ccc(c(c1)C(=O)C)[N+](=O)[O-] Amb2423370 [0,1,0,0,1,0|1,0,1]=4 1536 B13R1.165 Clc1ncc(c(c1)C(=O)O)C(=O)O Amb10606278 [0,1,0,0,1,0|2,0,0]=4 1537 B13R1.165 Ic1ccc(c(c1)C(=O)O)C(=O)O Amb16231921 [0,1,0,0,1,0|1,0,0]=3 1538 B13R1.165 NC(=O)c1cc(O)ccc1C(O)=O Amb24599952 [0,1,0,0,1,0|1,0,0]=3 1539 B13R1.165 NC(=O)c1ccc(Cl)cc1C(N)=O Amb17940301 [0,1,0,0,1,0|2,0,0]=4 1540 B13R1.165 NC(=O)c1ccc(N)cc1C(N)=O Amb18128355 [0,1,0,0,1,0|2,0,0]=4 1541 B13R1.165 NC(=S)c1ccc(F)cc1C(O)=O Amb25327477 [0,1,0,0,1,0|1,1,0]=4 1542 B13R1.165 Nc1cc(c([n]c1)C(O)=O)C(O)=O Amb22546303 [0,1,0,0,1,0|2,0,0]=4 1543 B13R1.165 Nc1cc(c(c[n]1)C(O)=O)C(O)=O Amb25071687 [0,1,0,0,1,0|2,0,0]=4 1544 B13R1.165 Nc1ccc(c(c1)C(=O)O)C(=O)O Amb10560726 [0,1,0,0,1,0|1,0,0]=3 1545 B13R1.165 Nc1ccc(c(c1)[N+](=O)[O-])C(=O)O Amb1033061 [0,1,0,0,1,0|2,0,0]=4 1546 B13R1.165 OC(=O)C=1C=CC(=O)NC1C(O)=O Amb18129167 [0,1,0,0,1,0|2,0,0]=4 1547 B13R1.165 OC(=O)c1[n]c(Br)ccc1C(O)=O Amb25677445 [0,1,0,0,1,0|2,0,0]=4 1548 B13R1.165 OC(=O)c1[n]c(Cl)ccc1C(O)=O Amb17933306 [0,1,0,0,1,0|2,0,0]=4 1549 B13R1.165 OC(=O)c1[n]cc(Cl)cc1C(O)=O Amb24745137 [0,1,0,0,1,0|2,0,0]=4 1550 B13R1.165 OC(=O)c1[n]cc(F)cc1C(O)=O Amb22497501 [0,1,0,0,1,0|2,0,0]=4 1551 B13R1.165 OC(=O)c1[n]cc(O)cc1C(O)=O Amb24563338 [0,1,0,0,1,0|2,0,0]=4 1552 B13R1.165 OC(=O)c1cc(Br)ccc1N(=O)=O Amb20620550 [0,1,0,0,1,0|2,0,0]=4 1553 B13R1.165 OC(=O)c1cc(O)ccc1N(=O)=O Amb20621426 [0,1,0,0,1,0|2,0,0]=4 1554 B13R1.165 OC(=O)c1cc(S)[n]cc1C(O)=O Amb22730627 [0,1,0,0,1,0|2,0,0]=4 1555 B13R1.165 OC(=O)c1ccc(Br)cc1N(=O)=O Amb20620548 [0,1,0,0,1,0|2,0,0]=4 1556 B13R1.165 OC(=O)c1ccc(Cl)cc1C(O)=O Amb22351762 [0,1,0,0,1,0|1,0,0]=3 1557 B13R1.165 OC(=O)c1ccc(F)cc1N(=O)=O Amb20621324 [0,1,0,0,1,0|2,0,0]=4 1558 B13R1.165 Oc1ccc(c(c1)[N+](=O)[O-])C(=O)O Amb10602738 [0,1,0,0,1,0|2,0,0]=4 1559 B13R1.165 Sc1ccc(c(c1)C(=O)O)C(=O)O Amb10561452 [0,1,0,0,1,0|1,0,0]=3 1560 B13R1.165 [O-][N+](=O)c1cc(I)ccc1C(O)=O Amb19889775 [0,1,0,0,1,0|2,0,0]=4 1561 B13R1.165 [O-][N+](=O)c1ccc(I)cc1C(O)=O Amb21964727 [0,1,0,0,1,0|2,0,0]=4 1562 B13R1.165 [O-][N+](=O)c1ccc(S)cc1C(O)=O Amb18954047 [0,1,0,0,1,0|2,0,0]=4 1563 B13R1.295 CC(=O)c1[n]ccc(Cl)c1C(O)=O Amb25359880 [0,1,0,0,1,0|1,0,0]=3 1564 B13R1.295 CC(=O)c1[n]ccc(N)c1C(O)=O Amb25786334 [0,1,0,0,1,0|1,0,0]=3 1565 B13R1.295 CC(=O)c1c(Br)c[n]cc1C(O)=O Amb25323999 [0,1,0,0,1,0|1,0,0]=3 1566 B13R1.295 CC(=O)c1c(Br)cccc1[N+]([O-])=O Amb21857743 [0,1,0,0,1,0|1,0,1]=4 1567 B13R1.295 CC(=O)c1c(Cl)cccc1[N+]([O-])=O Amb22495688 [0,1,0,0,1,0|1,0,1]=4 1568 B13R1.295 CC(=O)c1c(F)cccc1[N+]([O-])=O Amb22500716 [0,1,0,0,1,0|1,0,1]=4 1569 B13R1.295 CC(=O)c1c(N)c[n]cc1C(C)=O Amb24686627 [0,1,0,0,1,0|2,0,0]=4 1570 B13R1.295 CC(=O)c1c(N)cccc1C(O)=O Amb25108640 [0,1,0,0,1,0|0,0,0]=2 1571 B13R1.295 CC(=O)c1c(N)cccc1[N+]([O-])=O Amb21857742 [0,1,0,0,1,0|1,0,1]=4 1572 B13R1.295 CC(=O)c1c(O)[n]ccc1C(C)=O Amb25281683 [0,1,0,0,1,0|2,0,0]=4 1573 B13R1.295 CC(=O)c1c(O)c[n]cc1C(C)=O Amb24491968 [0,1,0,0,1,0|2,0,0]=4 1574 B13R1.295 CC(=O)c1c(O)cccc1[N+]([O-])=O Amb23412336 [0,1,0,0,1,0|1,0,1]=4 1575 B13R1.295 CC(=O)c1c(cc[n]c1C)C(O)=O Amb24360940 [0,1,0,0,1,0|1,0,0]=3 1576 B13R1.295 CC(=O)c1c(cc[n]c1O)C(O)=O Amb24494576 [0,1,0,0,1,0|1,0,0]=3 1577 B13R1.295 CC(=O)c1c(cccc1C)C(O)=O Amb25337785 [0,1,0,0,1,0|0,0,0]=2 1578 B13R1.295 CC(=O)c1c(cccc1C)[N+]([O-])=O Amb25109557 [0,1,0,0,1,0|1,0,1]=4 1579 B13R1.295 CC(=O)c1c(cccc1O)C(O)=O Amb25310944 [0,1,0,0,1,0|0,0,0]=2 1580 B13R1.295 CC(=O)c1cc[n]c(N)c1C(O)=O Amb24492096 [0,1,0,0,1,0|1,0,0]=3 1581 B13R1.295 CC(=O)c1cccc(Br)c1C(O)=O Amb18155972 [0,1,0,0,1,0|0,0,0]=2 1582 B13R1.295 CC(=O)c1cccc(Br)c1[N+]([O-])=O Amb22500787 [0,1,0,0,1,0|1,0,1]=4 1583 B13R1.295 CC(=O)c1cccc(C)c1C(O)=O Amb24475274 [0,1,0,0,1,0|0,0,0]=2 1584 B13R1.295 CC(=O)c1cccc(Cl)c1C(O)=O Amb24677643 [0,1,0,0,1,0|0,0,0]=2 1585 B13R1.295 CC(=O)c1cccc(Cl)c1[N+]([O-])=O Amb24179121 [0,1,0,0,1,0|1,0,1]=4 1586 B13R1.295 CC(=O)c1cccc(F)c1[N+]([O-])=O Amb22274604 [0,1,0,0,1,0|1,0,1]=4 1587 B13R1.295 CC(=O)c1cccc(O)c1C(O)=O Amb25697153 [0,1,0,0,1,0|0,0,0]=2 1588 B13R1.295 CC(=O)c1cccc(O)c1N(=O)=O Amb20621427 [0,1,0,0,1,0|1,0,1]=4 1589 B13R1.295 CC(C)c1c(Cl)cccc1C(O)=O Amb25209310 [0,1,0,0,1,0|1,0,1]=4 1590 B13R1.295 CC(C)c1c(F)cccc1C(O)=O Amb24579728 [0,1,0,0,1,0|1,0,1]=4 1591 B13R1.295 CC(C)c1cccc(N)c1C(O)=O Amb18128407 [0,1,0,0,1,0|1,0,1]=4 1592 B13R1.295 CC(N)c1c(I)cccc1C(O)=O Amb25775381 [0,1,0,0,1,0|1,0,1]=4 1593 B13R1.295 CC(N)c1c(cccc1N)C(O)=O Amb24491224 [0,1,0,0,1,0|1,0,1]=4 1594 B13R1.295 CC(N)c1cccc(Cl)c1C(O)=O Amb24694217 [0,1,0,0,1,0|1,0,1]=4 1595 B13R1.295 CC(N)c1cccc(O)c1C(O)=O Amb24384202 [0,1,0,0,1,0|1,0,1]=4 1596 B13R1.295 CC(c1cccc(c1C(=O)O)C)C Amb17470582 [0,1,0,0,1,0|1,0,1]=4 1597 B13R1.295 CN(C)c1c(Br)cccc1C(O)=O Amb24723256 [0,1,0,0,1,0|2,0,0]=4 1598 B13R1.295 CN(C)c1c(Cl)cccc1C(O)=O Amb24749082 [0,1,0,0,1,0|2,0,0]=4 1599 B13R1.295 CN(C)c1c(F)cccc1C(O)=O Amb18962876 [0,1,0,0,1,0|2,0,0]=4 1600 B13R1.295 CN(C)c1c(N)cccc1C(O)=O Amb24660518 [0,1,0,0,1,0|2,0,0]=4 1601 B13R1.295 CN(C)c1c(cccc1O)C(O)=O Amb25689693 [0,1,0,0,1,0|2,0,0]=4 1602 B13R1.295 CN(C)c1cccc(Br)c1C(O)=O Amb25071842 [0,1,0,0,1,0|2,0,0]=4 1603 B13R1.295 CN(C)c1cccc(F)c1C(O)=O Amb18066096 [0,1,0,0,1,0|2,0,0]=4 1604 B13R1.295 CN(C)c1cccc(N)c1C(O)=O Amb25209311 [0,1,0,0,1,0|2,0,0]=4 1605 B13R1.295 C[C@@H](N)c1c(Br)cccc1C(O)=O Amb25669223 [0,1,0,0,1,0|1,0,1]=4 1606 B13R1.295 C[C@@H](N)c1c(F)cccc1C(O)=O Amb24401104 [0,1,0,0,1,0|1,0,1]=4 1607 B13R1.295 C[C@@H](N)c1c(cccc1N)C(O)=O Amb24401697 [0,1,0,0,1,0|1,0,1]=4 1608 B13R1.295 C[C@@H](N)c1cccc(Cl)c1C(O)=O Amb25679048 [0,1,0,0,1,0|1,0,1]=4 1609 B13R1.295 C[C@H](N)c1c(Br)cccc1C(O)=O Amb25112185 [0,1,0,0,1,0|1,0,1]=4 1610 B13R1.295 C[C@H](N)c1c(Cl)cccc1C(O)=O Amb25714680 [0,1,0,0,1,0|1,0,1]=4 1611 B13R1.295 C[C@H](N)c1c(cccc1N)C(O)=O Amb25342178 [0,1,0,0,1,0|1,0,1]=4 1612 B13R1.295 C[C@H](N)c1cccc(Cl)c1C(O)=O Amb25192702 [0,1,0,0,1,0|1,0,1]=4 1613 B13R1.295 Cc1[n]ccc(c1C(O)=O)C(O)=O Amb25039412 [0,1,0,0,1,0|2,0,0]=4 1614 B13R1.295 Cc1cc[n]c(C(N)=O)c1C(O)=O Amb24578980 [0,1,0,0,1,0|2,0,0]=4 1615 B13R1.295 Cc1cc[n]c(c1C(O)=O)C(O)=O Amb24726285 [0,1,0,0,1,0|2,0,0]=4 1616 B13R1.295 Cc1cccc(C(C)N)c1C(O)=O Amb24753943 [0,1,0,0,1,0|1,0,1]=4 1617 B13R1.295 Cc1cccc(C(O)=O)c1C(N)=O Amb24342321 [0,1,0,0,1,0|1,0,0]=3 1618 B13R1.295 Cc1cccc(c1C(=O)Cl)C(=O)Cl Amb25236869 [0,1,0,0,1,0|2,0,0]=4 1619 B13R1.295 Cc1cccc(c1C(C)C)C(O)=O Amb25242828 [0,1,0,0,1,0|1,0,1]=4 1620 B13R1.295 Cc1cccc(c1C(C)N)C(O)=O Amb24377587 [0,1,0,0,1,0|1,0,1]=4 1621 B13R1.295 Cc1cccc(c1C(O)=O)N(C)C Amb18128449 [0,1,0,0,1,0|2,0,0]=4 1622 B13R1.295 Cc1cccc(c1C(O)=S)C(O)=O Amb24686628 [0,1,0,0,1,0|1,0,1]=4 1623 B13R1.295 Cc1cccc(c1N(C)C)C(O)=O Amb25216912 [0,1,0,0,1,0|2,0,0]=4 1624 B13R1.295 Cc1cccc(c1[C@H](C)N)C(O)=O Amb25798378 [0,1,0,0,1,0|1,0,1]=4 1625 B13R1.295 NC(=O)c1c(Br)cccc1C(N)=O Amb23400093 [0,1,0,0,1,0|2,0,0]=4 1626 B13R1.295 NC(=O)c1c(Cl)cccc1C(O)=O Amb25112763 [0,1,0,0,1,0|1,0,0]=3 1627 B13R1.295 NC(=O)c1c(F)cccc1C(N)=O Amb21858644 [0,1,0,0,1,0|2,0,0]=4 1628 B13R1.295 NC(=O)c1c(F)cccc1C(O)=O Amb22495398 [0,1,0,0,1,0|1,0,0]=3 1629 B13R1.295 NC(=O)c1c(I)cccc1C(O)=O Amb24065082 [0,1,0,0,1,0|1,0,0]=3 1630 B13R1.295 NC(=O)c1c(O)cccc1C(N)=O Amb25798418 [0,1,0,0,1,0|2,0,0]=4 1631 B13R1.295 NC(=O)c1cccc(F)c1C(O)=O Amb22495397 [0,1,0,0,1,0|1,0,0]=3 1632 B13R1.295 NC(=S)c1c(F)cccc1C(O)=O Amb24702305 [0,1,0,0,1,0|1,1,0]=4 1633 B13R1.295 Nc1c[n]cc(c1C(O)=O)C(O)=O Amb25060710 [0,1,0,0,1,0|2,0,0]=4 1634 B13R1.295 Nc1cc[n]c(c1C(O)=O)C(O)=O Amb18128961 [0,1,0,0,1,0|2,0,0]=4 1635 B13R1.295 Nc1cccc(c1C(O)=O)C(O)=O Amb22047266 [0,1,0,0,1,0|1,0,0]=3 1636 B13R1.295 Nc1cccc(c1C(O)=O)N(=O)=O Amb20620305 [0,1,0,0,1,0|2,0,0]=4 1637 B13R1.295 OC(=O)C1=C(C=CNC1=O)C(O)=O Amb18192236 [0,1,0,0,1,0|2,0,0]=4 1638 B13R1.295 OC(=O)c1[n]ccc(Cl)c1C(O)=O Amb20247131 [0,1,0,0,1,0|2,0,0]=4 1639 B13R1.295 OC(=O)c1[n]ccc(O)c1C(O)=O Amb24679409 [0,1,0,0,1,0|2,0,0]=4 1640 B13R1.295 OC(=O)c1c(Br)cccc1C(O)=O Amb18665083 [0,1,0,0,1,0|1,0,0]=3 1641 B13R1.295 OC(=O)c1c(Br)cncc1C(=O)O Amb10602882 [0,1,0,0,1,0|2,0,0]=4 1642 B13R1.295 OC(=O)c1c(C)cccc1C(=O)O Amb17594608 [0,1,0,0,1,0|1,0,0]=3 1643 B13R1.295 OC(=O)c1c(Cl)c[n]cc1C(O)=O Amb22263325 [0,1,0,0,1,0|2,0,0]=4 1644 B13R1.295 OC(=O)c1c(Cl)cccc1N(=O)=O Amb20620782 [0,1,0,0,1,0|2,0,0]=4 1645 B13R1.295 OC(=O)c1c(Cl)nccc1C(=O)O Amb10602095 [0,1,0,0,1,0|2,0,0]=4 1646 B13R1.295 OC(=O)c1c(F)cccc1N(=O)=O Amb20621328 [0,1,0,0,1,0|2,0,0]=4 1647 B13R1.295 OC(=O)c1c(N)cccc1C(=O)O Amb10807573 [0,1,0,0,1,0|1,0,0]=3 1648 B13R1.295 OC(=O)c1c(O)cccc1C(=O)O Amb17594670 [0,1,0,0,1,0|1,0,0]=3 1649 B13R1.295 OC(=O)c1cccc(Br)c1N(=O)=O Amb22371050 [0,1,0,0,1,0|2,0,0]=4 1650 B13R1.295 Oc1cccc(c1C(=O)Cl)C(=O)Cl Amb25729178 [0,1,0,0,1,0|2,0,0]=4 1651 B13R1.295 [O-][N+](=O)c1c(Br)cccc1C(O)=O Amb22495494 [0,1,0,0,1,0|2,0,0]=4 1652 B13R1.295 [O-][N+](=O)c1c(F)cccc1C(=O)O Amb10838826 [0,1,0,0,1,0|2,0,0]=4 1653 B13R1.295 [O-][N+](=O)c1c(I)cccc1C(O)=O Amb25771544 [0,1,0,0,1,0|2,0,0]=4 1654 B13R1.295 [O-][N+](=O)c1c(N)cccc1C(=O)O Amb1022000 [0,1,0,0,1,0|2,0,0]=4 1655 B13R1.295 [O-][N+](=O)c1c(S)cccc1C(O)=O Amb25340721 [0,1,0,0,1,0|2,0,0]=4 1656 B13R1.295 [O-][N+](=O)c1cccc(Br)c1C(O)=O Amb19957870 [0,1,0,0,1,0|2,0,0]=4 1657 B13R1.295 [O-][N+](=O)c1cccc(O)c1C(O)=O Amb21856812 [0,1,0,0,1,0|2,0,0]=4 1658 B13R1.295 [O-][N+](=O)c1cccc(c1C(=O)O)Cl Amb1091173 [0,1,0,0,1,0|2,0,0]=4 1659 B13R1.349 CC(=O)c1ccccc1C(C)(C)O Amb25273133 [0,1,0,0,1,0|1,0,1]=4 1660 B13R1.349 CC(=O)c1ccccc1S(=O)(=O)Cl Amb1130970 [0,1,0,0,1,0|1,0,1]=4 1661 B13R1.349 CC(=O)c1ccccc1S(N)(=O)=O Amb25782594 [0,1,0,0,1,0|1,0,1]=4 1662 B13R1.349 CC(F)(F)c1ccccc1C(O)=O Amb24182094 [0,1,0,0,1,0|1,0,1]=4 1663 B13R1.349 CS(=O)(=O)c1ccc[n]c1C(O)=O Amb18653467 [0,1,0,0,1,0|2,0,0]=4 1664 B13R1.349 NC(=O)c1ccccc1S(O)(=O)=O Amb24490241 [0,1,0,0,1,0|2,0,0]=4 1665 B13R1.349 OC(=O)c1ccccc1S(=O)(=O)C Amb1212344 [0,1,0,0,1,0|1,0,0]=3 1666 B13R1.349 OC(=O)c1ccccc1S(=O)(=O)Cl Amb16232987 [0,1,0,0,1,0|2,0,0]=4 1667 B13R1.349 OC(=O)c1ccccc1S(=O)(=O)O Amb10807552 [0,1,0,0,1,0|2,0,0]=4 1668 B13R1.349 OC(=O)c1ccccc1S(=O)(=O)O Amb1196439 [0,1,0,0,1,0|2,0,0]=4 1669 B13R1.349 OC(=O)c1ccccc1S(O)(=O)=O Amb19883771 [0,1,0,0,1,0|2,0,0]=4 1670 B13R1.349 [O-]C(=O)c1ccccc1S(O)(=O)=O Amb22734266 [0,1,0,0,1,0|2,0,0]=4 1671 B13R1.349 [O-]S(=O)(=O)c1ccccc1C(O)=O Amb22484242 [0,1,0,0,1,0|2,0,0]=4 1672 B13R1.551 COC(=O)c1ccsc1NC(=O)C Amb2425813 [0,1,0,0,1,0|2,0,0]=4 1673 B13R1.551 COC(=O)c1cscc1OC(=O)C Amb17621436 [0,1,0,0,1,0|1,0,0]=3 1674 B13R1.551 COC(=O)c1sccc1NC(=O)C Amb2430999 [0,1,0,0,1,0|2,0,0]=4 1675 B13R1.2880 CCC(=O)Nc1c[s]cc1C(O)=O Amb18123715 [0,1,0,0,1,0|2,0,0]=4 1676 B13R1.2880 CCC(=O)Nc1ccsc1C(=O)O Amb1112500 [0,1,0,0,1,0|2,0,0]=4 1677 B13R1.2880 CCC(=O)Nc1sccc1C(=O)O Amb1114918 [0,1,0,0,1,0|2,0,0]=4 1678 B13R1.2880 CNC(=O)C[n]1cccc1C(O)=O Amb25855343 [0,1,0,0,1,0|2,0,0]=4 1679 B13R1.2880 CNC(=O)Cc1[nH]ccc1C(O)=O Amb18129014 [0,1,0,0,1,0|2,0,0]=4 1680 B13R1.2880 CNC(=O)Cc1[s]ccc1C(O)=O Amb25672219 [0,1,0,0,1,0|2,0,0]=4 1681 B13R1.2880 CNC(=O)Cc1c[s]cc1C(O)=O Amb18653054 [0,1,0,0,1,0|2,0,0]=4 1682 B13R1.2880 CNC(=O)Nc1[s]ccc1C(O)=O Amb25128534 [0,1,0,0,1,0|2,0,0]=4 1683 B13R1.2880 CNC(=O)Nc1cc[s]c1C(O)=O Amb24061382 [0,1,0,0,1,0|2,0,0]=4 1684 B13R1.2880 COC(=O)Cc1[s]ccc1C(O)=O Amb18130660 [0,1,0,0,1,0|2,0,0]=4 1685 B13R1.2880 NCC(=O)N[n]1cccc1C(O)=O Amb18192156 [0,1,0,0,1,0|2,0,0]=4 1686 B13R1.2880 OC(=O)c1cc[s]c1NC(=O)CBr Amb25049384 [0,1,0,0,1,0|2,0,0]=4 1687 B13R1.3487 CC(=O)Nc1cc(Br)[s]c1C(O)=O Amb18637666 [0,1,0,0,1,0|2,0,0]=4 1688 B13R1.3487 CC(=O)Nc1sc(cc1C(=O)O)Br Amb10975381 [0,1,0,0,1,0|2,0,0]=4 1689 B13R1.3487 CC(=O)Nc1sc(cc1C(=O)O)C Amb17068944 [0,1,0,0,1,0|2,0,0]=4 1690 B13R1.3487 CC(=O)Nc1sc(cc1C(=O)O)Cl Amb2429152 [0,1,0,0,1,0|2,0,0]=4 1691 B13R1.3487 CC(=O)O[C@@H]1CC(=O)C=C1C(O)=O Amb24711513 [0,1,0,0,1,0|0,0,2]=4 1692 B13R1.3534 CC(=O)Nc1c[nH]c(C)c1C(O)=O Amb22157310 [0,1,0,0,1,0|2,0,0]=4 1693 B15R1.1086 CC(=O)Nc1ccccc1C(=O)C(=O)[O-] Amb15772346 [0,1,0,0,0,1|1,0,1]=4 1694 B15R1.3845 C#CC(=O)Nc1ccccc1CC(O)=O Amb18299370 [0,1,0,0,0,1|1,0,1]=4 1695 B15R1.3845 C=CC(=O)Nc1ccccc1CC(O)=O Amb19024489 [0,1,0,0,0,1|1,0,1]=4 1696 B15R1.3845 CC(=O)Nc1ccccc1OC(=O)NC Amb22486990 [0,1,0,0,0,1|1,0,0]=3 1697 B15R1.3845 CCC(=O)Nc1ccccc1CC(O)=O Amb19027998 [0,1,0,0,0,1|1,0,0]=3 1698 B15R1.3845 CNC(=O)Nc1ccccc1CC(O)=O Amb18992624 [0,1,0,0,0,1|1,0,0]=3 1699 B15R1.3845 COC(=O)Nc1ccccc1CC(O)=O Amb19024490 [0,1,0,0,0,1|1,0,0]=3 1700 B15R1.3845 ClCC(=O)Nc1ccccc1NC(=O)C Amb10608657 [0,1,0,0,0,1|2,0,0]=4 1701 B15R1.3845 NCC(=O)Nc1ccccc1NC(=O)C Amb17125977 [0,1,0,0,0,1|2,0,0]=4 1702 B15R1.3845 OCC(=O)Nc1ccccc1OC(C)C Amb17339237 [0,1,0,0,0,1|1,0,1]=4 1703 B15R1.5836 CC(=O)Nc1cc(C)ccc1OC(=O)C Amb1395649 [0,1,0,0,0,1|1,0,0]=3 1704 B15R1.5836 CC(C)Oc1ccc(F)cc1CC(O)=O Amb18057902 [0,1,0,0,0,1|1,0,1]=4 1705 B15R1.8288 CC(=O)Nc1c(cccc1O)NC(=O)C Amb10560579 [0,1,0,0,0,1|2,0,0]=4 1706 B15R1.9074 CS(=O)(=O)Nc1ccccc1CC(O)=O Amb17935683 [0,1,0,0,0,1|2,0,0]=4 1707 B15R1.985 CC(=C)COc1ccccc1C(=O)NN Amb20203886 [0,1,0,0,0,1|2,0,0]=4 1708 B15R1.985 CC(=C)COc1ccccc1\C(\N)=N/O Amb19981170 [0,1,0,0,0,1|2,0,0]=4 1709 B15R1.985 CC(=O)CCc1cc[n]cc1C(=O)OC Amb24104939 [0,1,0,0,0,1|2,0,0]=4 1710 B15R1.985 CC(C)=NNc1ccccc1C(=O)OC Amb24095933 [0,1,0,0,0,1|2,0,0]=4 1711 B15R1.985 COC(=O)c1ccccc1CCC(=O)C Amb16755469 [0,1,0,0,0,1|1,0,0]=3 1712 B15R1.985 COC(=O)c1ccccc1CCC(O)=O Amb19651927 [0,1,0,0,0,1|2,0,0]=4 1713 B15R1.985 COC(=O)c1ccccc1OCC(N)=N Amb23116804 [0,1,0,0,0,1|2,0,0]=4 1714 B15R1.985 COC(=O)c1ccccc1OCC(N)=O Amb18368815 [0,1,0,0,0,1|1,0,0]=3 1715 B15R1.985 COC(=O)c1ccccc1OCC(O)=O Amb18656724 [0,1,0,0,0,1|1,0,0]=3 1716 B15R1.985 COC(=O)c1ccccc1SCC(=O)N Amb11264544 [0,1,0,0,0,1|1,1,0]=4 1717 B15R1.985 COC(=O)c1ccccc1SCC(O)=O Amb23591212 [0,1,0,0,0,1|1,1,0]=4 1718 B15R1.1108 CC(=O)c1ccccc1NCC(=O)OC Amb21540312 [0,1,0,0,0,1|2,0,0]=4 1719 B15R1.1108 CCC(=O)NNc1ccccc1C(O)=O Amb24070200 [0,1,0,0,0,1|1,0,0]=3 1720 B15R1.1108 CNC(=O)CNc1cc[n]cc1C(O)=O Amb25375578 [0,1,0,0,0,1|2,0,0]=4 1721 B15R1.1108 CNC(=O)CNc1ccccc1C(N)=O Amb20174586 [0,1,0,0,0,1|2,0,0]=4 1722 B15R1.1108 CNC(=O)COc1ccccc1C(=O)N Amb1167042 [0,1,0,0,0,1|1,0,0]=3 1723 B15R1.1108 COC(=O)CNc1ccccc1C(=O)N Amb1239886 [0,1,0,0,0,1|2,0,0]=4 1724 B15R1.1108 COC(=O)CNc1ccccc1C(=O)O Amb1200184 [0,1,0,0,0,1|1,0,0]=3 1725 B15R1.1108 COC(=O)COc1ccccc1C(=O)C Amb1923721 [0,1,0,0,0,1|1,0,0]=3 1726 B15R1.1108 C\C(\CC)=N/Nc1ccccc1C(O)=O Amb24101946 [0,1,0,0,0,1|2,0,0]=4 1727 B15R1.1108 NNC(=O)COc1ccccc1C(=O)C Amb2566792 [0,1,0,0,0,1|2,0,0]=4 1728 B15R1.5509 CC(OC(=O)c1ccccc1C(=O)O)C Amb1227865 [0,1,0,0,0,1|1,0,1]=4 1729 B15R1.5509 OC(=O)CN(c1ccccc1C(=O)O)C Amb1024937 [0,1,0,0,0,1|2,0,0]=4 1730 B15R1.6620 CC(=C)CNc1c(F)cccc1C(O)=O Amb24361023 [0,1,0,0,0,1|2,0,0]=4 1731 B15R1.6620 CC(=C)COc1c(C)cccc1C(=O)C Amb17238114 [0,1,0,0,0,1|2,0,0]=4 1732 B15R1.6620 CC(=C)COc1c(Cl)cccc1C(=O)C Amb17246772 [0,1,0,0,0,1|2,0,0]=4 1733 B15R1.6620 Cc1cccc(c1NCC(C)=C)C(O)=O Amb25850480 [0,1,0,0,0,1|2,0,0]=4 1734 B15R1.6620 Cc1cccc(c1OCC(C)C)C(O)=O Amb23287270 [0,1,0,0,0,1|1,0,1]=4 1735 B15R1.6620 NC(=O)CNc1c(F)cccc1C(O)=O Amb19027298 [0,1,0,0,0,1|2,0,0]=4 1736 B15R1.6620 OC(=O)CCc1c(C)cccc1C(=O)O Amb17595565 [0,1,0,0,0,1|2,0,0]=4 1737 B15R1.8265 CC(=C)CNc1cccc(Br)c1C(O)=O Amb24744253 [0,1,0,0,0,1|2,0,0]=4 1738 B15R1.8265 CC(=C)COc1cccc(F)c1C(N)=O Amb24282835 [0,1,0,0,0,1|2,0,0]=4 1739 B15R1.8265 CC(=O)c1c(cccc1O)OCC(O)=O Amb18656704 [0,1,0,0,0,1|2,0,0]=4 1740 B15R1.8415 CC(=C)CNc1ccc(cc1C(=O)O)Br Amb17307087 [0,1,0,0,0,1|2,0,0]=4 1741 B15R1.8415 CC(=C)COc1ccc(Cl)cc1C(O)=O Amb19962966 [0,1,0,0,0,1|1,0,0]=3 1742 B15R1.8415 CC(=C)COc1ccc(cc1C(=O)C)Cl Amb17246771 [0,1,0,0,0,1|2,0,0]=4 1743 B15R1.8415 CC(=O)COc1ccc(C)cc1[N+]([O-])=O Amb21623967 [0,1,0,0,0,1|1,0,1]=4 1744 B15R1.8415 CC(=O)COc1ccc(cc1C(=O)O)Cl Amb1224731 [0,1,0,0,0,1|0,0,0]=2 1745 B15R1.8415 CC(=O)c1cc(F)ccc1OCC(O)=O Amb21963736 [0,1,0,0,0,1|2,0,0]=4 1746 B15R1.8415 CC(C)OCc1ccc(Br)cc1C(O)=O Amb23443134 [0,1,0,0,0,1|1,0,1]=4 1747 B15R1.8415 CC(C)OCc1ccc(N)cc1C(O)=O Amb23443146 [0,1,0,0,0,1|1,0,1]=4 1748 B15R1.8415 CC(COc1ccc(cc1C(=O)O)C)C Amb17109110 [0,1,0,0,0,1|1,0,1]=4 1749 B15R1.8415 NC(=O)CNc1ccc(N)cc1C(O)=O Amb19007330 [0,1,0,0,0,1|2,0,0]=4 1750 B15R1.8415 NC(=O)COc1ccc(cc1C(=O)N)Cl Amb10429224 [0,1,0,0,0,1|2,0,0]=4 1751 B15R1.8415 NC(=O)c1cc(Br)ccc1OCC(O)=O Amb22167235 [0,1,0,0,0,1|2,0,0]=4 1752 B15R1.8415 OC(=O)CCc1ccc(cc1C(=O)O)C Amb17471306 [0,1,0,0,0,1|2,0,0]=4 1753 B15R1.8415 OC(=O)CCc1ccc(cc1C(=O)O)Cl Amb17472162 [0,1,0,0,0,1|2,0,0]=4 1754 B15R1.8415 OC(=O)CCc1ccc(cc1C(=O)O)F Amb17471449 [0,1,0,0,0,1|2,0,0]=4 1755 B15R1.8415 OC(=O)COc1ccc(cc1C(=O)C)C Amb2461060 [0,1,0,0,0,1|2,0,0]=4 1756 B15R1.8415 OC(=O)CSc1ccc(cc1C(=O)O)I Amb1146022 [0,1,0,0,0,1|1,1,0]=4 1757 B15R1.8415 OC(=O)c1cc(Cl)ccc1NCC(O)=O Amb20671519 [0,1,0,0,0,1|2,0,0]=4 1758 B15R1.8415 OC(=O)c1cc(F)ccc1OCC(O)=O Amb18657553 [0,1,0,0,0,1|1,0,0]=3 1759 B15R1.8435 CC(=C)CNc1cc(Br)ccc1C(O)=O Amb25101404 [0,1,0,0,0,1|2,0,0]=4 1760 B15R1.8435 CC(=C)CNc1cc(Cl)ccc1C(O)=O Amb24440608 [0,1,0,0,0,1|2,0,0]=4 1761 B15R1.8435 CC(=C)COc1cc(Cl)ccc1C(=O)N Amb11617098 [0,1,0,0,0,1|2,0,0]=4 1762 B15R1.8435 CC(C)=NOc1cc(F)ccc1C(C)=O Amb22465964 [0,1,0,0,0,1|2,0,0]=4 1763 B15R1.8435 CC(C)COc1cc(N)ccc1C(O)=O Amb24091203 [0,1,0,0,0,1|1,0,1]=4 1764 B15R1.8435 OC(=O)COc1cc(Br)ccc1C(=O)C Amb2490349 [0,1,0,0,0,1|2,0,0]=4 1765 B15R1.8435 OC(=O)COc1cc(Cl)ccc1C(=O)C Amb2490126 [0,1,0,0,0,1|2,0,0]=4 1766 B15R1.8435 OC(=O)c1ccc(F)cc1OCC(O)=O Amb22497056 [0,1,0,0,0,1|1,0,0]=3 1767 B15R1.8875 CC(=O)C(C)Oc1ccccc1C(C)=O Amb18092914 [0,1,0,0,0,1|1,0,0]=3 1768 B15R1.91 CC(=O)Nc1cc(ccc1C(O)=O)OC Amb25292005 [0,2,0,0,0,0|1,0,0]=3 1769 B15R1.91 CC(=O)Oc1cc(ccc1[N+]([O-])=O)C=O Amb22478734 [0,2,0,0,0,0|1,0,1]=4 1770 B15R1.91 COc1cc(NC(N)=O)c(cc1)C(O)=O Amb25702178 [0,2,0,0,0,0|2,0,0]=4 1771 B15R1.91 COc1ccc(c(c1)CC(=O)O)C(=O)O Amb17471396 [0,2,0,0,0,0|2,0,0]=4 1772 B15R1.134 CS(=O)(=O)Nc1cc(Br)ccc1C(O)=O Amb24736832 [0,2,0,0,0,0|2,0,0]=4 1773 B15R1.134 CS(=O)(=O)Oc1cc(Cl)ccc1C(O)=O Amb24517764 [0,2,0,0,0,0|1,0,0]=3 1774 B15R1.134 Cc1ccc(c(c1)OC(C)(C)C)C(O)=O Amb18995660 [0,2,0,0,0,0|1,0,1]=4 1775 B15R1.134 Cc1ccc(c(c1)OS(C)(=O)=O)C(O)=O Amb25044609 [0,2,0,0,0,0|1,0,0]=3 1776 B15R1.134 Clc1ccc(c(c1)NS(=O)(=O)C)C(=O)O Amb1116387 [0,2,0,0,0,0|2,0,0]=4 1777 B15R1.134 Fc1ccc(c(c1)NS(=O)(=O)C)C(=O)O Amb1131869 [0,2,0,0,0,0|2,0,0]=4 1778 B15R1.3550 CC(=O)Cc1cc(O)cc(O)c1C(O)=O Amb24090073 [0,2,0,0,0,0|1,0,0]=3 1779 B15R1.3550 CC(=O)OC1=CC(=O)NC(C)=C1C(C)=O Amb22466465 [0,2,0,0,0,0|2,0,0]=4 1780 B15R1.3550 CC(=O)Oc1cc(C)cc(C)c1C(O)=O Amb21981420 [0,2,0,0,0,0|0,0,0]=2 1781 B15R1.3550 CC(=O)Oc1cc(O)cc(c1C(=O)C)O Amb17607329 [0,2,0,0,0,0|1,0,0]=3 1782 B15R1.3825 C=CC(=O)Nc1cc(Br)ccc1C(O)=O Amb25735947 [0,2,0,0,0,0|1,0,1]=4 1783 B15R1.3825 CC(C#C)Oc1cc(Br)ccc1C(O)=O Amb25701626 [0,2,0,0,0,0|1,0,1]=4 1784 B15R1.3825 CC(C#C)Oc1cc(Cl)ccc1C(O)=O Amb24440737 [0,2,0,0,0,0|1,0,1]=4 1785 B15R1.3825 CC(C#N)Oc1cc(Br)ccc1C(O)=O Amb25767996 [0,2,0,0,0,0|1,0,1]=4 1786 B15R1.3825 CC(C#N)Oc1cc(Cl)ccc1C(O)=O Amb18981154 [0,2,0,0,0,0|1,0,1]=4 1787 B15R1.3825 CC(C#N)Oc1cc(F)ccc1C(O)=O Amb24338741 [0,2,0,0,0,0|1,0,1]=4 1788 B15R1.3825 CCC(=O)Nc1cc(F)ccc1C(=O)O Amb1131595 [0,2,0,0,0,0|1,0,0]=3 1789 B15R1.3825 CCS(=O)Nc1cc(Br)ccc1C(O)=O Amb24753156 [0,2,0,0,0,0|2,0,0]=4 1790 B15R1.3825 CCS(=O)Nc1cc(Cl)ccc1C(O)=O Amb25177288 [0,2,0,0,0,0|2,0,0]=4 1791 B15R1.3825 CCS(=O)Nc1cc(F)ccc1C(O)=O Amb24725125 [0,2,0,0,0,0|2,0,0]=4 1792 B15R1.3825 CNC(=O)Nc1cc(Cl)ccc1C(O)=O Amb18951732 [0,2,0,0,0,0|1,0,0]=3 1793 B15R1.3825 CNC(=O)Nc1cc(F)ccc1C(O)=O Amb18951735 [0,2,0,0,0,0|1,0,0]=3 1794 B15R1.3825 COC(=O)Oc1cc(F)ccc1[N+]([O-])=O Amb22441595 [0,2,0,0,0,0|1,0,1]=4 1795 B15R1.3825 Cc1ccc(c(c1)OC(C)C#C)C(O)=O Amb25326987 [0,2,0,0,0,0|1,0,1]=4 1796 B15R1.3825 Cc1ccc(c(c1)OC(C)C#N)C(O)=O Amb18981155 [0,2,0,0,0,0|1,0,1]=4 1797 B15R1.3825 ClCC(=O)Nc1cc(Cl)ccc1C(=O)O Amb2264594 [0,2,0,0,0,0|1,0,0]=3 1798 B15R1.8400 CC(=O)Nc1cc(Cl)c(C)cc1C(O)=O Amb22232245 [0,2,0,0,0,0|1,0,0]=3 1799 B15R1.8400 CC(=O)Nc1cc(F)c(F)cc1C(O)=O Amb18965419 [0,2,0,0,0,0|1,0,0]=3 1800 B15R1.8400 CC(=O)Oc1cc(C)c(C)cc1C(O)=O Amb21984879 [0,2,0,0,0,0|0,0,0]=2 1801 B15R1.8400 CC(C)Oc1cc(Cl)c(Cl)cc1C(O)=O Amb18277267 [0,2,0,0,0,0|1,0,1]=4 1802 B15R1.8400 CS(=O)Nc1cc(F)c(F)cc1C(O)=O Amb25177110 [0,2,0,0,0,0|2,0,0]=4 1803 B15R1.8400 Cc1cc(OC(C)C)c(cc1Cl)C(O)=O Amb18055916 [0,2,0,0,0,0|1,0,1]=4 1804 B15R1.8400 NC(=O)Nc1cc(F)c(F)cc1C(O)=O Amb18287629 [0,2,0,0,0,0|2,0,0]=4 1805 B15R1.8419 CC(=O)Oc1c(ccc(C)c1C)C(O)=O Amb21981419 [0,2,0,0,0,0|0,0,0]=2 1806 B15R1.11677 CC(=NO)c1ccc(Br)cc1OC(C)=O Amb24081381 [0,2,0,0,0,0|1,0,0]=3 1807 B15R1.11677 CC(=O)Nc1cc(Cl)ccc1C(=O)CCl Amb22054212 [0,2,0,0,0,0|2,0,0]=4 1808 B15R1.11677 COC(=O)c1ccc(cc1NC(=O)C)Br Amb15415332 [0,2,0,0,0,0|1,0,0]=3 1809 B15R1.11677 COC(=O)c1ccc(cc1NC(=O)C)I Amb10601389 [0,2,0,0,0,0|1,0,0]=3 1810 B15R1.984 COC(=O)c1ccccc1C(N)C(O)=O Amb20670121 [0,2,0,0,0,0|2,0,0]=4 1811 B15R1.1343 CCC(=O)C(c1ccccc1C(=O)O)Cl Amb17477508 [0,2,0,0,0,0|1,0,0]=3 1812 B15R1.1343 CCC(=O)N(c1ccccc1C(=O)O)C Amb1121157 [0,2,0,0,0,0|1,0,0]=3 1813 B15R1.1343 CNC(=O)N(C)c1ccccc1C(O)=O Amb18951728 [0,2,0,0,0,0|1,0,0]=3 1814 B15R1.1372 CCC(C(O)=O)c1ccccc1C(O)=O Amb17845072 [0,2,0,0,0,0|2,0,0]=4 1815 B15R1.1372 COC(c1ccccc1C(O)=O)C(O)=O Amb23580685 [0,2,0,0,0,0|2,0,0]=4 1816 B15R1.810 CC(=O)Oc1ccccc1C(=O)OCC Amb22277130 [0,2,0,0,0,0|0,0,0]=2 1817 B15R1.810 CCNC(=O)c1ccccc1NC(=O)C Amb11247455 [0,2,0,0,0,0|2,0,0]=4 1818 B15R1.810 CCOC(=O)c1ccccc1NC(=O)C Amb2551333 [0,2,0,0,0,0|1,0,0]=3 1819 B15R1.810 CCOC(=O)c1cccnc1NC(=O)C Amb16898229 [0,2,0,0,0,0|2,0,0]=4 1820 B15R1.810 CCOC(=O)c1ncccc1NC(=O)C Amb16200641 [0,2,0,0,0,0|2,0,0]=4 1821 B15R1.925 CC(=O)Nc1c[n]c(Cl)cc1C(=O)OC Amb22751263 [0,2,0,0,0,0|2,0,0]=4 1822 B15R1.925 CC(=O)Nc1ccc(N)cc1C(=O)OC Amb24086620 [0,2,0,0,0,0|1,0,0]=3 1823 B15R1.925 CC(=O)Oc1ccc(N)cc1C(=O)OC Amb24092877 [0,2,0,0,0,0|0,0,0]=2 1824 B15R1.925 COC(=O)c1cc(Cl)ccc1OC(C)C Amb18940394 [0,2,0,0,0,0|1,0,1]=4 1825 B15R1.925 COC(=O)c1cc(F)ccc1OC(C)C Amb18275926 [0,2,0,0,0,0|1,0,1]=4 1826 B15R1.925 COC(=O)c1cc(I)ccc1NC(=O)C Amb16232653 [0,2,0,0,0,0|1,0,0]=3 1827 B15R1.925 Cc1ccc(OC(C)C)c(c1)C(=O)OC Amb18940406 [0,2,0,0,0,0|1,0,1]=4 1828 B15R1.3847 CNC(=O)Oc1ccccc1C(=O)NN Amb22474535 [0,2,0,0,0,0|1,0,0]=3 1829 B15R1.3847 CNC(=O)c1ccccc1NC(=O)CBr Amb19981019 [0,2,0,0,0,0|2,0,0]=4 1830 B15R1.3847 COC(=O)c1ccccc1NC(=O)CI Amb22340601 [0,2,0,0,0,0|1,0,0]=3 1831 B15R1.3847 COC(=O)c1ccccc1NC(=O)NN Amb18568626 [0,2,0,0,0,0|2,0,0]=4 1832 B15R1.3847 ClCC(=O)Nc1ccccc1C(=O)OC Amb1208873 [0,2,0,0,0,0|1,0,0]=3 1833 B15R1.5832 CC(=O)Nc1ccc(N)cc1S(O)(=O)=O Amb22232246 [0,2,0,0,0,0|2,0,0]=4 1834 B15R1.1274 C#CCC(=O)Nc1[n]cccc1C(O)=O Amb24659324 [0,2,0,0,0,0|2,0,0]=4 1835 B15R1.1274 C#CCC(=O)Nc1c[n]ccc1C(O)=O Amb25345309 [0,2,0,0,0,0|2,0,0]=4 1836 B15R1.1274 C#CCC(=O)Nc1cc[n]cc1C(O)=O Amb25248179 [0,2,0,0,0,0|2,0,0]=4 1837 B15R1.1274 C=CCC(=O)Nc1[n]cccc1C(O)=O Amb25134375 [0,2,0,0,0,0|2,0,0]=4 1838 B15R1.1274 C=CCC(=O)Nc1ccc[n]c1C(O)=O Amb25296694 [0,2,0,0,0,0|2,0,0]=4 1839 B15R1.1274 C=CCC(=O)Nc1ccccc1C(O)=O Amb19028171 [0,2,0,0,0,0|1,0,0]=3 1840 B15R1.1274 CC#CC(=O)Nc1cc[n]cc1C(O)=O Amb24560589 [0,2,0,0,0,0|2,0,0]=4 1841 B15R1.1274 CC#CC(=O)Nc1ccc[n]c1C(O)=O Amb24447446 [0,2,0,0,0,0|2,0,0]=4 1842 B15R1.1274 CCCC(=O)Nc1c[n]ccc1C(O)=O Amb24351453 [0,2,0,0,0,0|2,0,0]=4 1843 B15R1.1274 CCCC(=O)Nc1ccc[n]c1C(O)=O Amb25164585 [0,2,0,0,0,0|2,0,0]=4 1844 B15R1.1274 CCCC(=O)Oc1ccccc1C(O)=O Amb20222799 [0,2,0,0,0,0|0,0,0]=2 1845 B15R1.1274 CCCC(=O)Oc1ccccc1[N+]([O-])=O Amb21964391 [0,2,0,0,0,0|1,0,1]=4 1846 B15R1.1274 CCNC(=O)Cc1ccccc1C(O)=O Amb25391402 [0,2,0,0,0,0|1,0,0]=3 1847 B15R1.1274 CCNC(=O)Nc1c[n]ccc1C(O)=O Amb25043107 [0,2,0,0,0,0|2,0,0]=4 1848 B15R1.1274 CCNC(=S)Nc1ccccc1C(O)=O Amb23129357 [0,2,0,0,0,0|1,1,0]=4 1849 B15R1.1274 CCOC(=O)Cc1ccccc1C(O)=O Amb18656070 [0,2,0,0,0,0|1,0,0]=3 1850 B15R1.1274 CCOC(=O)Cc1ncccc1C(=O)O Amb1233275 [0,2,0,0,0,0|2,0,0]=4 1851 B15R1.1274 CCOC(=O)Nc1c[n]ccc1C(O)=O Amb24426991 [0,2,0,0,0,0|2,0,0]=4 1852 B15R1.1274 CCOC(=O)Nc1ccc[n]c1C(O)=O Amb25140710 [0,2,0,0,0,0|2,0,0]=4 1853 B15R1.1274 CCOC(=O)Nc1ccccc1C(=O)N Amb1481354 [0,2,0,0,0,0|2,0,0]=4 1854 B15R1.1274 CCOC(=O)Nc1ccccc1C(=O)O Amb2550352 [0,2,0,0,0,0|1,0,0]=3 1855 B15R1.1274 COCC(=O)Nc1[n]cccc1C(O)=O Amb25716265 [0,2,0,0,0,0|2,0,0]=4 1856 B15R1.1274 COCC(=O)Nc1c[n]ccc1C(O)=O Amb24345375 [0,2,0,0,0,0|2,0,0]=4 1857 B15R1.1274 COCC(=O)Nc1cc[n]cc1C(O)=O Amb24580988 [0,2,0,0,0,0|2,0,0]=4 1858 B15R1.1274 COCC(=O)Nc1ccccc1C(=O)N Amb1868859 [0,2,0,0,0,0|2,0,0]=4 1859 B15R1.1274 COCC(=O)Nc1ccccc1C(=O)O Amb1118039 [0,2,0,0,0,0|1,0,0]=3 1860 B15R1.1274 CSCC(=O)Nc1c[n]ccc1C(O)=O Amb24727791 [0,2,0,0,0,0|2,0,0]=4 1861 B15R1.1274 CSCC(=O)Nc1cc[n]cc1C(O)=O Amb25245659 [0,2,0,0,0,0|2,0,0]=4 1862 B15R1.1274 CSCC(=O)Nc1ccccc1C(=O)C Amb11214604 [0,2,0,0,0,0|2,0,0]=4 1863 B15R1.1274 C\C(\NCC)=N\c1ccccc1C(O)=O Amb24106945 [0,2,0,0,0,0|2,0,0]=4 1864 B15R1.1274 C\C=C\C(=O)Nc1[n]cccc1C(O)=O Amb25286040 [0,2,0,0,0,0|2,0,0]=4 1865 B15R1.1274 C\C=C\C(=O)Nc1c[n]ccc1C(O)=O Amb24594300 [0,2,0,0,0,0|2,0,0]=4 1866 B15R1.1274 C\C=C\C(=O)Nc1ccc[n]c1C(O)=O Amb24346161 [0,2,0,0,0,0|2,0,0]=4 1867 B15R1.1274 ClCCC(=O)Nc1ccccc1C(=O)C Amb2111169 [0,2,0,0,0,0|2,0,0]=4 1868 B15R1.1274 N#CCC(=O)Nc1ccccc1C(=O)O Amb1207297 [0,2,0,0,0,0|1,0,0]=3 1869 B15R1.1274 N#CNC(=O)Cc1ccccc1C(O)=O Amb24653317 [0,2,0,0,0,0|1,0,1]=4 1870 B15R1.1274 NCCC(=O)Nc1ccccc1C(O)=O Amb18305470 [0,2,0,0,0,0|1,0,0]=3 1871 B15R1.1274 OC(=O)c1ccccc1NC(=O)C#CBr Amb24622413 [0,2,0,0,0,0|1,0,1]=4 1872 B15R1.1274 OC(=O)c1ccccc1NC(=O)C=NO Amb24092864 [0,2,0,0,0,0|1,0,1]=4 1873 B15R1.1274 O\N=C\C(=O)Nc1ccccc1C(=O)O Amb1017358 [0,2,0,0,0,0|1,0,1]=4 1874 B15R1.2996 C#CC(=O)Nc1ccc(O)cc1C(O)=O Amb18282957 [0,2,0,0,0,0|1,0,1]=4 1875 B15R1.2996 C=CC(=O)Nc1ccc(Br)cc1C(O)=O Amb25315587 [0,2,0,0,0,0|1,0,1]=4 1876 B15R1.2996 C=CC(=O)Nc1ccc(I)cc1C(O)=O Amb25340075 [0,2,0,0,0,0|1,0,1]=4 1877 B15R1.2996 C=CC(=O)Nc1ccc(O)cc1C(O)=O Amb18977849 [0,2,0,0,0,0|1,0,1]=4 1878 B15R1.2996 CC(C#C)Oc1ccc(Br)cc1C(O)=O Amb25302874 [0,2,0,0,0,0|1,0,1]=4 1879 B15R1.2996 CC(C#C)Oc1ccc(Cl)cc1C(O)=O Amb24392608 [0,2,0,0,0,0|1,0,1]=4 1880 B15R1.2996 CC(C#N)Oc1ccc(Br)cc1C(O)=O Amb25329374 [0,2,0,0,0,0|1,0,1]=4 1881 B15R1.2996 CC(C#N)Oc1ccc(Cl)cc1C(O)=O Amb18981156 [0,2,0,0,0,0|1,0,1]=4 1882 B15R1.2996 CC(C#N)Oc1ccc(F)cc1C(O)=O Amb25781965 [0,2,0,0,0,0|1,0,1]=4 1883 B15R1.2996 CC(C#N)Oc1ccc(N)cc1C(O)=O Amb18293464 [0,2,0,0,0,0|1,0,1]=4 1884 B15R1.2996 CCC(=O)Nc1ccc(cc1C(=O)O)Cl Amb1121593 [0,2,0,0,0,0|1,0,0]=3 1885 B15R1.2996 CCC(=O)Oc1ccc(Br)cc1C(O)=O Amb20089792 [0,2,0,0,0,0|0,0,0]=2 1886 B15R1.2996 CCC(=O)Oc1ccc(Cl)cc1C(O)=O Amb20222608 [0,2,0,0,0,0|0,0,0]=2 1887 B15R1.2996 CCC(=O)Oc1ccc(N)cc1C(O)=O Amb24071001 [0,2,0,0,0,0|0,0,0]=2 1888 B15R1.2996 CNC(=O)Nc1ccc(Br)cc1C(O)=O Amb25698481 [0,2,0,0,0,0|1,0,0]=3 1889 B15R1.2996 CNC(=O)Nc1ccc(Cl)cc1C(O)=O Amb18951726 [0,2,0,0,0,0|1,0,0]=3 1890 B15R1.2996 CNC(=O)Nc1ccc(F)cc1C(O)=O Amb18951738 [0,2,0,0,0,0|1,0,0]=3 1891 B15R1.2996 CNC(=O)Nc1ccc(O)cc1C(O)=O Amb18954499 [0,2,0,0,0,0|1,0,0]=3 1892 B15R1.2996 CNC(=S)Nc1ccc(Br)cc1C(O)=O Amb23494598 [0,2,0,0,0,0|1,1,0]=4 1893 B15R1.2996 CNC(=S)Nc1ccc(Cl)cc1C(O)=O Amb23494590 [0,2,0,0,0,0|1,1,0]=4 1894 B15R1.2996 COC(=O)Nc1ccc(I)cc1C(O)=O Amb25131476 [0,2,0,0,0,0|1,0,0]=3 1895 B15R1.2996 COC(=O)Nc1ccc(O)cc1C(O)=O Amb18977850 [0,2,0,0,0,0|1,0,0]=3 1896 B15R1.2996 Cc1ccc(NC(=O)NC)c(c1)C(O)=O Amb18951739 [0,2,0,0,0,0|1,0,0]=3 1897 B15R1.2996 Cc1ccc(OC(=O)CC)c(c1)C(O)=O Amb24092937 [0,2,0,0,0,0|0,0,0]=2 1898 B15R1.2996 Cc1ccc(OC(=O)CC)c(c1)[N+]([O-])=O Amb24063679 [0,2,0,0,0,0|1,0,1]=4 1899 B15R1.2996 Cc1ccc(OC(C)C#C)c(c1)C(O)=O Amb25064192 [0,2,0,0,0,0|1,0,1]=4 1900 B15R1.2996 Cc1ccc(OC(C)C#N)c(c1)C(O)=O Amb18981157 [0,2,0,0,0,0|1,0,1]=4 1901 B15R1.2996 ClCC(=O)Nc1ccc(cc1C(=O)O)Br Amb1231109 [0,2,0,0,0,0|1,0,0]=3 1902 B15R1.2996 ClCC(=O)Nc1ccc(cc1C(=O)O)Cl Amb1242851 [0,2,0,0,0,0|1,0,0]=3 1903 B15R1.5720 CCC(CC)=Nc1ccccc1C(O)=O Amb24100573 [0,2,0,0,0,0|2,0,0]=4 1904 B15R1.7707 CCS(=O)(=O)Nc1ccccc1C(=O)O Amb1111700 [0,2,0,0,0,0|2,0,0]=4 1905 B15R1.7707 CNS(=O)(=O)Nc1ccccc1C(O)=O Amb24543857 [0,2,0,0,0,0|2,0,0]=4 1906 B15R1.7707 OC(=O)c1ccccc1NS(=O)(=O)CBr Amb25266943 [0,2,0,0,0,0|2,0,0]=4 1907 B15R1.7707 OC(=O)c1ccccc1NS(=O)(=O)CCl Amb25288850 [0,2,0,0,0,0|2,0,0]=4 1908 B15R1.13377 C#CC(=O)Nc1cccc(Cl)c1C(O)=O Amb25787446 [0,2,0,0,0,0|1,0,1]=4 1909 B15R1.13377 CC(=O)c1c(cccc1C)NC(=O)CC Amb24203077 [0,2,0,0,0,0|2,0,0]=4 1910 B15R1.13377 CC(C#C)Oc1cccc(Cl)c1C(O)=O Amb25274844 [0,2,0,0,0,0|1,0,1]=4 1911 B15R1.13377 CC(C#C)Oc1cccc(F)c1C(O)=O Amb25124665 [0,2,0,0,0,0|1,0,1]=4 1912 B15R1.13377 CNC(=O)Nc1cccc(F)c1C(O)=O Amb18951736 [0,2,0,0,0,0|1,0,0]=3 1913 B15R1.13377 COC(=O)Nc1cccc(Cl)c1C(O)=O Amb25671377 [0,2,0,0,0,0|1,0,0]=3 1914 B15R1.13377 COC(=O)Oc1cccc(F)c1[N+]([O-])=O Amb22445831 [0,2,0,0,0,0|1,0,1]=4 1915 B15R1.13377 Cc1cccc(NC(=O)CC)c1C(O)=O Amb18655764 [0,2,0,0,0,0|1,0,0]=3 1916 B15R1.13377 Cc1cccc(NC(=O)NC)c1C(O)=O Amb24084828 [0,2,0,0,0,0|1,0,0]=3 1917 B15R1.13377 Cc1cccc(NC(=O)OC)c1C(O)=O Amb25808838 [0,2,0,0,0,0|1,0,0]=3 1918 B15R1.40363 C#CC(=O)Nc1c(Cl)cccc1C(O)=O Amb24338789 [0,2,0,0,0,0|1,0,1]=4 1919 B15R1.40363 C=CC(=O)Nc1c(F)cccc1C(O)=O Amb25281218 [0,2,0,0,0,0|1,0,1]=4 1920 B15R1.40363 CC(C#C)Oc1c(F)cccc1C(O)=O Amb25726811 [0,2,0,0,0,0|1,0,1]=4 1921 B15R1.40363 CC(C#N)Oc1c(Cl)cccc1C(O)=O Amb24503450 [0,2,0,0,0,0|1,0,1]=4 1922 B15R1.40363 CCC(=O)Nc1c(Br)cccc1C(O)=O Amb24508344 [0,2,0,0,0,0|1,0,0]=3 1923 B15R1.40363 CCC(=O)Nc1c(C)cccc1C(=O)O Amb1115040 [0,2,0,0,0,0|1,0,0]=3 1924 B15R1.40363 CCS(=O)Nc1c(Br)cccc1C(O)=O Amb25177289 [0,2,0,0,0,0|2,0,0]=4 1925 B15R1.40363 CCS(=O)Nc1c(Cl)cccc1C(O)=O Amb25177107 [0,2,0,0,0,0|2,0,0]=4 1926 B15R1.40363 CNC(=O)Nc1c(cccc1Cl)C(O)=O Amb24338631 [0,2,0,0,0,0|1,0,0]=3 1927 B15R1.40363 COC(=O)Nc1c(Cl)cccc1C(O)=O Amb24438771 [0,2,0,0,0,0|1,0,0]=3 1928 B15R1.40363 COC(=O)Nc1c(F)cccc1C(O)=O Amb25113794 [0,2,0,0,0,0|1,0,0]=3 1929 B15R1.40363 Cc1cccc(c1NC(=O)NC)C(O)=O Amb18951729 [0,2,0,0,0,0|1,0,0]=3 1930 B15R1.40363 Cc1cccc(c1OC(=O)OC)[N+]([O-])=O Amb22342708 [0,2,0,0,0,0|1,0,1]=4 1931 B15R1.40363 Cc1cccc(c1OC(C)C#N)C(O)=O Amb25759378 [0,2,0,0,0,0|1,0,1]=4 1932 B15R1.3560 CC(=O)Oc1c(Br)cc(C)cc1C(O)=O Amb21981430 [0,2,0,0,0,0|0,0,0]=2 1933 B15R1.3560 CC(=O)Oc1c(Cl)cc(C)cc1C(O)=O Amb21981424 [0,2,0,0,0,0|0,0,0]=2 1934 B15R1.3560 CC(=O)Oc1c(cc(C)cc1C)C(O)=O Amb21981422 [0,2,0,0,0,0|0,0,0]=2 1935 B15R1.3560 CC(C)Oc1c(Br)cc(F)cc1C(O)=O Amb23287241 [0,2,0,0,0,0|1,0,1]=4 1936 B15R1.3560 CC(C)Oc1c(Cl)cc(F)cc1C(O)=O Amb23287229 [0,2,0,0,0,0|1,0,1]=4 1937 B15R1.3560 CC(C)Oc1c(Cl)cc(N)cc1C(O)=O Amb25068075 [0,2,0,0,0,0|1,0,1]=4 1938 B15R1.3560 CC(C)Oc1c(I)cc(F)cc1C(O)=O Amb23287250 [0,2,0,0,0,0|1,0,1]=4 1939 B15R1.3560 CS(=O)Nc1c(cc(Br)cc1Br)C(O)=O Amb24551435 [0,2,0,0,0,0|2,0,0]=4 1940 B15R1.3560 CS(=O)Nc1c(cc(Cl)cc1Cl)C(O)=O Amb24551828 [0,2,0,0,0,0|2,0,0]=4 1941 B15R1.3560 Cc1cc(Br)cc(c1OC(C)C)C(O)=O Amb23287281 [0,2,0,0,0,0|1,0,1]=4 1942 B15R1.3560 Cc1cc(C(O)=O)c(NC(N)=O)c(C)c1 Amb25843576 [0,2,0,0,0,0|2,0,0]=4 1943 B15R1.3560 Cc1cc(C(O)=O)c(OC(C)C)c(C)c1 Amb18057417 [0,2,0,0,0,0|1,0,1]=4 1944 B15R1.3560 Cc1cc(Cl)cc(c1OC(C)C)C(O)=O Amb23287273 [0,2,0,0,0,0|1,0,1]=4 1945 B15R1.3560 Cc1cc(I)cc(c1OC(C)C)C(O)=O Amb23287288 [0,2,0,0,0,0|1,0,1]=4 1946 B15R1.3560 NC(=O)Nc1c(cc(Br)cc1Br)C(O)=O Amb25722655 [0,2,0,0,0,0|2,0,0]=4 1947 B15R1.6597 CC(C)(C)Oc1c(F)cccc1C(O)=O Amb18994274 [0,2,0,0,0,0|1,0,1]=4 1948 B15R1.6597 Cc1cccc(c1OS(C)(=O)=O)C(O)=O Amb24458431 [0,2,0,0,0,0|1,0,0]=3 1949 B15R1.6597 OC(=O)c1cccc(c1NS(=O)(=O)C)C Amb1114991 [0,2,0,0,0,0|2,0,0]=4 1950 B15R1.8425 CC(=O)Nc1c(C(O)=O)c(C)ccc1C Amb24105942 [0,2,0,0,0,0|1,0,0]=3 1951 B15R1.8425 CC(=O)Nc1c(C(O)=O)c(Cl)ccc1Cl Amb24403939 [0,2,0,0,0,0|1,0,0]=3 1952 B15R1.8425 CC(=O)Oc1c(C(O)=O)c(C)ccc1C Amb21981421 [0,2,0,0,0,0|0,0,0]=2 1953 B15R1.8425 Cc1ccc(C)c(C(O)=O)c1OC(C)C Amb18056967 [0,2,0,0,0,0|1,0,1]=4 1954 B15R1.8425 NC(=O)Nc1c(C(O)=O)c(Cl)ccc1Cl Amb24527200 [0,2,0,0,0,0|2,0,0]=4 1955 B15R1.12643 COc1cccc(c1CC(=O)O)C(=O)O Amb17471395 [0,2,0,0,0,0|2,0,0]=4 1956 B15R1.1647 CC(=O)Nc1cccc(CC)c1C(O)=O Amb20620177 [0,2,0,0,0,0|1,0,0]=3 1957 B15R1.8297 CC(C)(C)Oc1cccc(Br)c1C(O)=O Amb25704692 [0,2,0,0,0,0|1,0,1]=4 1958 B15R1.8297 CC(C)(C)Oc1cccc(F)c1C(O)=O Amb24459563 [0,2,0,0,0,0|1,0,1]=4 1959 B15R1.8297 CS(=O)(=O)Cc1cccc(N)c1C(O)=O Amb18985708 [0,2,0,0,0,0|2,0,0]=4 1960 B15R1.8297 CS(=O)(=O)Nc1cccc(Cl)c1C(O)=O Amb22497129 [0,2,0,0,0,0|2,0,0]=4 1961 B15R1.8297 CS(=O)(=O)Oc1cccc(Cl)c1C(O)=O Amb25333303 [0,2,0,0,0,0|1,0,0]=3 1962 B15R1.8456 OC(=O)Cc1ccc(c(c1C(=O)O)O)O Amb16210871 [0,2,0,0,0,0|2,0,0]=4 1963 B15R1.1927 CC(=O)Nc1ccc([n]c1C(O)=O)OC Amb24093817 [0,2,0,0,0,0|2,0,0]=4 1964 B15R1.1927 CC(=O)Oc1ccc(CC)cc1C(O)=O Amb18656058 [0,2,0,0,0,0|0,0,0]=2 1965 B15R1.1927 CC(=O)Oc1ccc(cc1C(O)=O)OC Amb18656729 [0,2,0,0,0,0|0,0,0]=2 1966 B15R1.1927 CC(=O)Oc1ccc(cc1N(=O)=O)C#N Amb24053078 [0,2,0,0,0,0|1,0,1]=4 1967 B15R1.1927 CC(C)Oc1ccc(cc1C(O)=O)C#N Amb22752770 [0,2,0,0,0,0|1,0,1]=4 1968 B15R1.1927 CCc1cc(C(O)=O)c(cc1)NC(N)=O Amb24563727 [0,2,0,0,0,0|2,0,0]=4 1969 B15R1.1927 CCc1ccc(c(c1)C(=O)O)CC(=O)O Amb17471305 [0,2,0,0,0,0|2,0,0]=4 1970 B15R1.1927 CCc1ccc(c(c1)C(=O)O)NC(=O)C Amb2582747 [0,2,0,0,0,0|1,0,0]=3 1971 B15R1.1927 COc1ccc(c(c1)C(=O)O)CC(=O)O Amb1102861 [0,2,0,0,0,0|2,0,0]=4 1972 B15R1.8453 Brc1ccc(c(c1)C(=O)O)NS(=O)(=O)C Amb17317864 [0,2,0,0,0,0|2,0,0]=4 1973 B15R1.8453 CC(C)(C)Oc1ccc(Br)cc1C(O)=O Amb25123173 [0,2,0,0,0,0|1,0,1]=4 1974 B15R1.8453 CC(C)(C)Oc1ccc(N)cc1C(O)=O Amb18970803 [0,2,0,0,0,0|1,0,1]=4 1975 B15R1.8453 CS(=O)(=O)Nc1ccc(I)cc1C(O)=O Amb24508248 [0,2,0,0,0,0|2,0,0]=4 1976 B15R1.8453 CS(=O)(=O)Nc1ccc(O)cc1C(O)=O Amb18977852 [0,2,0,0,0,0|2,0,0]=4 1977 B15R1.8453 CS(=O)(=O)Oc1ccc(Cl)cc1C(O)=O Amb24517765 [0,2,0,0,0,0|1,0,0]=3 1978 B15R1.8453 CS(=O)(=O)Oc1ccc(I)cc1C(O)=O Amb25833183 [0,2,0,0,0,0|1,0,0]=3 1979 B15R1.8453 CS(=O)(=O)Oc1ccc(N)cc1C(O)=O Amb24081342 [0,2,0,0,0,0|1,0,0]=3 1980 B15R1.8453 Cc1ccc(OC(C)(C)C)c(c1)C(O)=O Amb18992242 [0,2,0,0,0,0|1,0,1]=4 1981 B15R1.8453 Clc1ccc(c(c1)C(=O)O)NS(=O)(=O)C Amb1117057 [0,2,0,0,0,0|2,0,0]=4 1982 B13R1.13 CC(=O)c1cc(ccc1Br)C(O)=O Amb24379052 [0,0,1,1,0,0|2,0,0]=4 1983 B13R1.13 CC(=O)c1cc(ccc1Cl)C(O)=O Amb25244510 [0,0,1,1,0,0|2,0,0]=4 1984 B13R1.13 CC(=O)c1cc(ccc1I)C(O)=O Amb24658489 [0,0,1,1,0,0|2,0,0]=4 1985 B13R1.13 CC(=O)c1cc(ccc1N)C(O)=O Amb25775930 [0,0,1,1,0,0|2,0,0]=4 1986 B13R1.13 OC(=O)c1ccc(c(c1)C(=O)C)C Amb17201601 [0,0,1,1,0,0|1,0,1]=4 1987 B13R1.13 OC(=O)c1ccc(c(c1)C(=O)C)O Amb1139217 [0,0,1,1,0,0|2,0,0]=4 1988 B13R1.1060 CC(=O)C=1CC(=CC=CC1)C(O)=O Amb24342308 [0,0,1,1,0,0|1,0,1]=4 1989 B13R1.56 C=Cc1cc(OC(=O)C)cc(c1)O Amb17607354 [0,0,1,1,0,0|1,0,0]=3 1990 B13R1.128 Cc1[n]c(\C=C\C=CC(O)=O)c[s]1 Amb25341919 [0,0,1,1,0,0|1,1,0]=4 1991 B13R1.128 Cc1[n]cc(\C=C\C=CC(O)=O)[s]1 Amb24369020 [0,0,1,1,0,0|1,1,0]=4 1992 B13R1.128 Cc1ccc(\C=C\C=CC(O)=O)o1 Amb25229890 [0,0,1,1,0,0|1,0,1]=4 1993 B13R1.128 Cc1ccc(\C=C\C=C\C(O)=O)[s]1 Amb24701744 [0,0,1,1,0,0|1,1,0]=4 1994 B13R1.149 CC(=O)O\N=C\c1cccc(O)c1 Amb24587363 [0,0,1,1,0,0|2,0,0]=4 1995 B13R1.201 CC(=O)OC(=O)c1ccccc1O Amb25707001 [0,0,1,1,0,0|2,0,0]=4 1996 B13R1.3801 CC(=O)c1cccc(C(O)=O)c1F Amb25157262 [0,0,1,1,0,0|2,0,0]=4 1997 B13R1.3801 CC(=O)c1cccc(c1O)C(O)=O Amb18128537 [0,0,1,1,0,0|2,0,0]=4 1998 B13R2.72 CC(=O)C1C=Cc2ccccc21 Amb25735092 [1,0,0,1,0,0|2,0,0]=4 1999 B13R2.72 CC(=O)[n]1[n]cc2ccccc12 Amb22235128 [1,0,0,1,0,0|2,0,0]=4 2000 B13R2.72 CC(=O)c1occ2ccccc21 Amb18199846 [1,0,0,1,0,0|1,0,0]=3 2001 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [1,0,0,1,0,0|1,0,1]=4 2002 B13R2.163 O=C1CN=Cc2ccccc2N1 Amb25667427 [1,0,0,1,0,0|2,0,0]=4 2003 B13R2.163 O=C1CN=Cc2ccccc2O1 Amb24060690 [1,0,0,1,0,0|1,0,0]=3 2004 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [1,0,0,1,0,0|1,0,1]=4 2005 B13R2.243 CC1(O)Oc2ccccc2C1=O Amb24380835 [1,0,0,1,0,0|0,0,2]=4 2006 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [1,0,0,1,0,0|1,0,1]=4 2007 B13R2.328 CC1=CC(=O)c2ccc[n]c2O1 Amb24408396 [1,0,0,1,0,0|2,0,0]=4 2008 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [1,0,0,1,0,0|2,0,0]=4 2009 B13R2.328 CC1=CC(=O)c2ccccc2O1 Amb19666848 [1,0,0,1,0,0|1,0,0]=3 2010 B13R2.328 CC1=CC(=O)c2ccccc2S1 Amb20414518 [1,0,0,1,0,0|1,1,0]=4 2011 B13R2.328 CC1=Cc2ccccc2C(=O)N1 Amb18349269 [1,0,0,1,0,0|2,0,0]=4 2012 B13R2.328 CC1=Cc2ccccc2C(=O)O1 Amb20247502 [1,0,0,1,0,0|1,0,1]=4 2013 B13R2.328 CC1=NC(=O)c2ccc[n]c2O1 Amb22301542 [1,0,0,1,0,0|2,0,0]=4 2014 B13R2.328 CC1=Nc2ccccc2C(=O)O1 Amb18800494 [1,0,0,1,0,0|1,0,1]=4 2015 B13R2.328 CC1NC(=O)c2c(O1)cccc2 Amb2184910 [1,0,0,1,0,0|1,0,1]=4 2016 B13R2.328 CC1Oc2ccccc2C(=O)O1 Amb24104592 [1,0,0,1,0,0|0,0,2]=4 2017 B13R2.328 CC=1CC(=O)c2ccccc2N1 Amb22228878 [1,0,0,1,0,0|2,0,0]=4 2018 B13R2.328 CC=1NC(=O)c2ccccc2N1 Amb17997717 [1,0,0,1,0,0|2,0,0]=4 2019 B13R2.328 CC=1NC(=O)c2ccccc2N1 Amb22494245 [1,0,0,1,0,0|2,0,0]=4 2020 B13R2.328 CC=1Nc2ccccc2C(=O)N1 Amb19844242 [1,0,0,1,0,0|2,0,0]=4 2021 B13R2.328 C[C@@H]1CC(=O)c2ccccc2O1 Amb25713529 [1,0,0,1,0,0|1,0,1]=4 2022 B13R2.328 C[C@H]1CC(=O)c2ccccc2O1 Amb24388644 [1,0,0,1,0,0|1,0,1]=4 2023 B13R2.328 Cc1cc(O)c2c(n1)cccc2 Amb1796824 [1,0,0,1,0,0|2,0,0]=4 2024 B13R2.328 Cc1cc2ccccc2c(O)[n]1 Amb18645154 [1,0,0,1,0,0|2,0,0]=4 2025 B13R2.328 Cc1cc2ccccc2c(O)c1 Amb18645049 [1,0,0,1,0,0|2,0,0]=4 2026 B13R2.328 Cc1nc2ccccc2c(=O)o1 Amb1216866 [1,0,0,1,0,0|1,0,1]=4 2027 B13R2.328 NC1=CC(=O)Oc2ccccc21 Amb18645456 [1,0,0,1,0,0|1,0,1]=4 2028 B13R2.328 NC1=CC(=O)c2ccccc2O1 Amb19870090 [1,0,0,1,0,0|1,0,1]=4 2029 B13R2.328 NC1=NC(=O)Oc2ccccc21 Amb25751273 [1,0,0,1,0,0|2,0,0]=4 2030 B13R2.328 NC1CC(=O)Oc2ccccc21 Amb25249264 [1,0,0,1,0,0|1,0,1]=4 2031 B13R2.328 O=C1C=C(Br)c2ccccc2O1 Amb20248285 [1,0,0,1,0,0|1,0,1]=4 2032 B13R2.328 O=C1C=C(Cl)c2ccccc2O1 Amb20414537 [1,0,0,1,0,0|1,0,1]=4 2033 B13R2.328 O=C1C=C(F)c2ccccc2O1 Amb24553071 [1,0,0,1,0,0|1,0,1]=4 2034 B13R2.328 O=C1C=C(S)c2ccccc2O1 Amb24446596 [1,0,0,1,0,0|0,1,1]=4 2035 B13R2.328 O=C1CC(=O)N2C=CC=CC2=N1 Amb17662604 [1,0,0,1,0,0|2,0,0]=4 2036 B13R2.328 O=C1CC(=O)Nc2cc[n]cc12 Amb25194953 [1,0,0,1,0,0|2,0,0]=4 2037 B13R2.328 O=C1CC(=O)Nc2ccccc12 Amb22263121 [1,0,0,1,0,0|1,0,0]=3 2038 B13R2.328 O=C1CC(=O)Oc2ccccc12 Amb19748567 [1,0,0,1,0,0|0,0,0]=2 2039 B13R2.328 O=C1CC(=O)Sc2ccccc12 Amb24633520 [1,0,0,1,0,0|0,1,0]=3 2040 B13R2.328 O=C1CC(=O)c2ccc[n]c2N1 Amb25698340 [1,0,0,1,0,0|2,0,0]=4 2041 B13R2.328 O=C1CS(=O)c2ccccc2N1 Amb25733529 [1,0,0,1,0,0|2,0,0]=4 2042 B13R2.328 O=C1NC(=O)Oc2c[n]ccc12 Amb24367257 [1,0,0,1,0,0|2,0,0]=4 2043 B13R2.328 O=C1NC(=O)Oc2ccccc12 Amb20243206 [1,0,0,1,0,0|1,0,0]=3 2044 B13R2.328 O=C1NC(=O)Sc2ccccc12 Amb22036855 [1,0,0,1,0,0|1,1,0]=4 2045 B13R2.328 O=C1NC(=O)c2c(C1)cccc2 Amb1221580 [1,0,0,1,0,0|2,0,0]=4 2046 B13R2.328 O=C1Nc2ccccc2C(=O)N1 Amb18005794 [1,0,0,1,0,0|2,0,0]=4 2047 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [1,0,0,1,0,0|2,0,0]=4 2048 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [1,0,0,1,0,0|2,0,0]=4 2049 B13R2.328 O=c1[nH]c(=O)oc2ccc[n]c12 Amb24065646 [1,0,0,1,0,0|2,0,0]=4 2050 B13R2.328 O=c1[nH]c2ccccc2c(=O)[nH]1 Amb1157217 [1,0,0,1,0,0|2,0,0]=4 2051 B13R2.328 O=c1[s]c(=O)[nH]c2ccccc12 Amb24065644 [1,0,0,1,0,0|2,0,0]=4 2052 B13R2.328 O=c1cc(N)c2c(o1)cccc2 Amb2388638 [1,0,0,1,0,0|1,0,1]=4 2053 B13R2.328 O=c1cc(O)c2c([nH]1)cccc2 Amb1146861 [1,0,0,1,0,0|1,0,1]=4 2054 B13R2.328 O=c1cc(O)c2c(o1)cccc2 Amb1151858 [1,0,0,1,0,0|0,0,1]=3 2055 B13R2.328 O=c1nc(O)c2c(s1)cccc2 Amb2502845 [1,0,0,1,0,0|1,1,0]=4 2056 B13R2.328 OC1=CC(=O)Nc2ccccc21 Amb18002636 [1,0,0,1,0,0|1,0,1]=4 2057 B13R2.328 OC1=CC(=O)Oc2ccccc21 Amb18372000 [1,0,0,1,0,0|0,0,1]=3 2058 B13R2.328 OC1=CC(=O)Sc2ccccc21 Amb19517275 [1,0,0,1,0,0|0,1,1]=4 2059 B13R2.328 OC1=CC(=S)Oc2ccccc21 Amb24572900 [1,0,0,1,0,0|0,1,1]=4 2060 B13R2.328 OC1=NC(=O)Sc2ccccc21 Amb20651211 [1,0,0,1,0,0|1,1,0]=4 2061 B13R2.328 OC1CC(=O)Cc2ccccc21 Amb24707065 [1,0,0,1,0,0|1,0,1]=4 2062 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [1,0,0,1,0,0|1,0,1]=4 2063 B13R2.328 Oc1cc(=O)oc2ccccc21 Amb24078542 [1,0,0,1,0,0|0,0,1]=3 2064 B13R2.581 C=Cc1cccc2CC(=O)Nc12 Amb25756675 [1,0,0,1,0,0|2,0,0]=4 2065 B13R2.581 CC1Cc2cccc(C=O)c2O1 Amb18829765 [1,0,0,1,0,0|1,0,1]=4 2066 B13R2.581 CCc1cccc2CC(=O)Oc12 Amb24092053 [1,0,0,1,0,0|1,0,1]=4 2067 B13R2.581 COc1cccc2CC(=O)Oc12 Amb24092144 [1,0,0,1,0,0|2,0,0]=4 2068 B13R2.581 Cc1[nH]c2cccc(C=O)c2[n]1 Amb18830283 [1,0,0,1,0,0|2,0,0]=4 2069 B13R2.581 Cc1[n]c2c(C=O)cccc2[s]1 Amb23401748 [1,0,0,1,0,0|1,1,0]=4 2070 B13R2.581 Cc1[n]c2c(C=O)cccc2o1 Amb22276059 [1,0,0,1,0,0|1,0,1]=4 2071 B13R2.581 Cc1[n]c2cccc(C=O)c2[s]1 Amb18195961 [1,0,0,1,0,0|1,1,0]=4 2072 B13R2.581 Cc1[n]c2cccc(C=O)c2o1 Amb22276065 [1,0,0,1,0,0|1,0,0]=3 2073 B13R2.581 Cc1cc2c(C=O)cccc2[nH]1 Amb18830376 [1,0,0,1,0,0|2,0,0]=4 2074 B13R2.581 Cc1cc2c(C=O)cccc2o1 Amb18645277 [1,0,0,1,0,0|1,0,1]=4 2075 B13R2.581 Cc1cc2cccc(C=O)c2[nH]1 Amb18830373 [1,0,0,1,0,0|2,0,0]=4 2076 B13R2.581 Cc1cc2cccc(CO)c2o1 Amb24527431 [1,0,0,1,0,0|1,0,1]=4 2077 B13R2.581 Nc1[n]c2cccc(C=O)c2o1 Amb24362845 [1,0,0,1,0,0|2,0,0]=4 2078 B13R2.581 O=C1Cc2c(cccc2N1)C=O Amb18830141 [1,0,0,1,0,0|2,0,0]=4 2079 B13R2.581 O=C1Cc2cccc(C=O)c2N1 Amb18830117 [1,0,0,1,0,0|1,0,0]=3 2080 B13R2.581 O=C1Nc2cccc(C=O)c2N1 Amb18829869 [1,0,0,1,0,0|2,0,0]=4 2081 B13R2.581 O=C1Nc2cccc(C=O)c2O1 Amb18829547 [1,0,0,1,0,0|1,0,0]=3 2082 B13R2.581 O=C1Nc2cccc(C=O)c2S1 Amb18824742 [1,0,0,1,0,0|1,1,0]=4 2083 B13R2.581 O=C1Oc2cccc(C=O)c2S1 Amb18824562 [1,0,0,1,0,0|1,1,0]=4 2084 B13R2.581 O=Cc1cccc2[n]c(Cl)oc21 Amb24679341 [1,0,0,1,0,0|2,0,0]=4 2085 B13R2.581 O=Cc1cccc2[n]c(S)oc21 Amb24610867 [1,0,0,1,0,0|1,1,0]=4 2086 B13R2.581 OCc1cccc2CC(=O)Cc21 Amb24396256 [1,0,0,1,0,0|1,0,1]=4 2087 B13R2.581 OCc1cccc2SC(=O)Oc21 Amb25156855 [1,0,0,1,0,0|1,0,1]=4 2088 B13R2.621 O=Cc1ccccc1C=C2CC2 Amb24101244 [1,0,0,1,0,0|2,0,0]=4 2089 B13R2.2931 C=CC1OC(=O)c2ccccc21 Amb24115296 [1,0,0,1,0,0|1,0,1]=4 2090 B13R2.2931 CCC1OC(=O)c2ccccc21 Amb24115402 [1,0,0,1,0,0|1,0,1]=4 2091 B13R2.2931 CNC1OC(=O)c2ccccc21 Amb18266318 [1,0,0,1,0,0|2,0,0]=4 2092 B13R2.2931 C\C=C/1\CC(=O)c2ccccc21 Amb24570409 [1,0,0,1,0,0|2,0,0]=4 2093 B13R2.2931 C\C=C\1/OC(=O)c2ccccc21 Amb19895689 [1,0,0,1,0,0|1,0,0]=3 2094 B13R2.2931 N\C=C/1\OC(=O)c2ccccc21 Amb25201645 [1,0,0,1,0,0|2,0,0]=4 2095 B13R2.2931 O=C1NC(C=O)c2ccccc12 Amb25073339 [1,0,0,1,0,0|2,0,0]=4 2096 B13R2.2931 O=C1OC(=CBr)c2ccccc21 Amb22482473 [1,0,0,1,0,0|2,0,0]=4 2097 B13R2.2931 O\C=C/1\OC(=O)c2ccccc21 Amb24060110 [1,0,0,1,0,0|1,0,1]=4 2098 B13R2.5252 O=C1CC=COc2ccccc21 Amb25143498 [1,0,0,1,0,0|1,0,1]=4 2099 B13R2.5252 O=C1NCC=Cc2ccccc21 Amb24386486 [1,0,0,1,0,0|2,0,0]=4 2100 B13R2.5252 O=C1NCC=Nc2ccccc21 Amb23592207 [1,0,0,1,0,0|2,0,0]=4 2101 B13R2.5252 O=C1NCCOc2c1cccc2 Amb2445337 [1,0,0,1,0,0|1,0,1]=4 2102 B13R2.5252 O=C1NN=COc2c1cccc2 Amb2416930 [1,0,0,1,0,0|2,0,0]=4 2103 B13R2.5252 O=C1OCCCc2ccccc21 Amb24415736 [1,0,0,1,0,0|1,0,1]=4 2104 B13R2.5569 CC(=O)c1cccc2c1OCC2 Amb10603301 [1,0,0,1,0,0|1,0,1]=4 2105 B13R2.5569 CC(=O)c1cccc2c1occ2 Amb16185462 [1,0,0,1,0,0|1,0,1]=4 2106 B13R2.5569 NC(=O)c1cccc2CCOc21 Amb24101548 [1,0,0,1,0,0|1,0,1]=4 2107 B13R2.5569 O=C(Cl)c1cccc2ccoc21 Amb24743632 [1,0,0,1,0,0|1,0,1]=4 2108 B13R2.5569 OC(=O)c1[n]ccc2[n]coc21 Amb24098537 [1,0,0,1,0,0|2,0,0]=4 2109 B13R2.5569 OC(=O)c1[n]ccc2ccoc21 Amb24081795 [1,0,0,1,0,0|1,0,1]=4 2110 B13R2.5569 OC(=O)c1c[n]cc2ccoc21 Amb18829557 [1,0,0,1,0,0|1,0,1]=4 2111 B13R2.5569 OC(=O)c1cccc2CC=Cc12 Amb18645284 [1,0,0,1,0,0|1,0,0]=3 2112 B13R2.5569 OC(=O)c1cccc2CCNc21 Amb18645821 [1,0,0,1,0,0|1,0,1]=4 2113 B13R2.5569 OC(=O)c1cccc2CCSc21 Amb25694266 [1,0,0,1,0,0|0,1,1]=4 2114 B13R2.5569 OC(=O)c1cccc2CNCc21 Amb18829483 [1,0,0,1,0,0|2,0,0]=4 2115 B13R2.5569 OC(=O)c1cccc2COCc21 Amb22901076 [1,0,0,1,0,0|2,0,0]=4 2116 B13R2.5569 OC(=O)c1cccc2[nH]c[n]c12 Amb22284084 [1,0,0,1,0,0|2,0,0]=4 2117 B13R2.5569 OC(=O)c1cccc2[n]c[s]c12 Amb19957786 [1,0,0,1,0,0|1,1,0]=4 2118 B13R2.5569 OC(=O)c1cccc2[s]c[n]c12 Amb22728897 [1,0,0,1,0,0|1,1,0]=4 2119 B13R2.5569 OC(=O)c1cccc2c1CCC2 Amb10610329 [1,0,0,1,0,0|1,0,1]=4 2120 B13R2.5569 OC(=O)c1cccc2c1cco2 Amb10603966 [1,0,0,1,0,0|1,0,1]=4 2121 B13R2.5569 OC(=O)c1cccc2c1nc[nH]2 Amb1099263 [1,0,0,1,0,0|2,0,0]=4 2122 B13R2.5569 OC(=O)c1cccc2c1nco2 Amb17130929 [1,0,0,1,0,0|1,0,1]=4 2123 B13R2.5569 OC(=O)c1cccc2c1occ2 Amb10603968 [1,0,0,1,0,0|0,0,1]=3 2124 B13R2.5569 OC(=O)c1cccc2c1ocn2 Amb17130908 [1,0,0,1,0,0|1,0,0]=3 2125 B13R2.5569 OC(=O)c1cccc2c1scc2 Amb1995222 [1,0,0,1,0,0|0,1,1]=4 2126 B13R2.371 C=C1CNC(=O)c2ccccc21 Amb25835782 [0,0,0,1,1,0|2,0,0]=4 2127 B13R2.371 C=C1COC(=O)c2ccccc21 Amb22549604 [0,0,0,1,1,0|1,0,0]=3 2128 B13R2.371 CC1=NNC(=O)c2ccccc21 Amb19132657 [0,0,0,1,1,0|2,0,0]=4 2129 B13R2.371 CC1=NOC(=O)c2ccccc21 Amb21927595 [0,0,0,1,1,0|1,0,0]=3 2130 B13R2.371 Cc1[n]cc(O)c2ccccc21 Amb24079648 [0,0,0,1,1,0|2,0,0]=4 2131 B13R2.371 Cc1c[n]c(O)c2ccccc21 Amb18645157 [0,0,0,1,1,0|2,0,0]=4 2132 B13R2.371 O=C1CCC(=O)c2ccccc12 Amb24054332 [0,0,0,1,1,0|1,0,0]=3 2133 B13R2.371 O=C1CCS(=O)c2ccccc12 Amb18178842 [0,0,0,1,1,0|2,0,0]=4 2134 B13R2.371 O=C1N=NC(=O)c2c1cccc2 Amb10809027 [0,0,0,1,1,0|2,0,0]=4 2135 B13R2.371 O=C1NCC(=O)c2ccc[n]c12 Amb18829831 [0,0,0,1,1,0|2,0,0]=4 2136 B13R2.371 O=C1NCC(=O)c2ccccc12 Amb22372293 [0,0,0,1,1,0|1,0,0]=3 2137 B13R2.371 O=C1NCS(=O)c2ccccc12 Amb25667389 [0,0,0,1,1,0|2,0,0]=4 2138 B13R2.371 O=C1NNC(=O)c2ccccc12 Amb18800603 [0,0,0,1,1,0|2,0,0]=4 2139 B13R2.371 O=C1OCC(=O)c2ccccc12 Amb24078409 [0,0,0,1,1,0|0,0,0]=2 2140 B13R2.371 O=c1[nH][nH]c(=O)c2c1cccc2 Amb1641093 [0,0,0,1,1,0|2,0,0]=4 2141 B13R2.371 OC1=CNC(=O)c2ccccc21 Amb19987031 [0,0,0,1,1,0|2,0,0]=4 2142 B13R2.371 OC1=NNC(=O)c2ccccc21 Amb18548432 [0,0,0,1,1,0|2,0,0]=4 2143 B13R2.371 OC1CCC(=O)c2ccccc21 Amb22170418 [0,0,0,1,1,0|1,0,1]=4 2144 B13R2.371 O[C@@H]1CCC(=O)c2ccccc21 Amb25718269 [0,0,0,1,1,0|1,0,1]=4 2145 B13R2.371 O[C@H]1CCC(=O)c2ccccc21 Amb24690507 [0,0,0,1,1,0|1,0,1]=4 2146 B13R2.371 Oc1ccc(c2c1cccc2)C Amb17200159 [0,0,0,1,1,0|2,0,0]=4 2147 B13R2.371 Oc1nnc(c2c1cccc2)C Amb2371419 [0,0,0,1,1,0|2,0,0]=4 2148 B13R2.12159 CC1(C)OC(=O)c2ccccc12 Amb17778630 [0,0,0,1,1,0|1,0,1]=4 2149 B13R2.12159 CC1(O)OC(=O)c2ccccc12 Amb24060114 [0,0,0,1,1,0|0,0,2]=4 2150 B13R2.12973 OC(=O)c1cccc2CC(=O)c12 Amb17778829 [0,0,0,1,1,0|0,0,0]=2 2151 B15R2.356 O=C1CCC(=O)Nc2ccccc2N1 Amb19987116 [0,0,0,1,0,1|2,0,0]=4 2152 B15R2.356 O=C1Cc2ccccc2NC(=O)CN1 Amb24336643 [0,0,0,1,0,1|2,0,0]=4 2153 B15R2.356 S=C1NCC(=O)Oc2c(N1)cccc2 Amb1064697 [0,0,0,1,0,1|1,1,0]=4 2154 B15R2.988 CC(=O)C1=CC(=O)Nc2ccccc21 Amb25785159 [0,0,0,1,0,1|2,0,0]=4 2155 B15R2.988 CC(=O)C1=CC(=O)Oc2ccccc21 Amb24574177 [0,0,0,1,0,1|1,0,1]=4 2156 B15R2.988 Cc1cc2ccccc2c([n]1)C(O)=O Amb19100580 [0,0,0,1,0,1|2,0,0]=4 2157 B15R2.988 Cc1cc2ccccc2c(c1)C(O)=O Amb18649277 [0,0,0,1,0,1|2,0,0]=4 2158 B15R2.988 NC(=O)C1CC(=O)Nc2ccccc21 Amb25059205 [0,0,0,1,0,1|2,0,0]=4 2159 B15R2.988 O=C1Nc2ccccc2C(C1)C(=O)O Amb1111499 [0,0,0,1,0,1|1,0,0]=3 2160 B15R2.988 O=C1Nc2ccccc2N(C1)C(=O)C Amb1670560 [0,0,0,1,0,1|2,0,0]=4 2161 B15R2.988 OC(=O)C1=CC(=O)Nc2ccccc21 Amb18013046 [0,0,0,1,0,1|1,0,1]=4 2162 B15R2.988 OC(=O)C1=CC(=O)Nc2ccccc21 Amb22586945 [0,0,0,1,0,1|1,0,1]=4 2163 B15R2.988 OC(=O)C1=NC(=O)Nc2ccccc21 Amb18548460 [0,0,0,1,0,1|2,0,0]=4 2164 B15R2.988 OC(=O)C1=NC(=O)Nc2ccccc21 Amb22587698 [0,0,0,1,0,1|2,0,0]=4 2165 B15R2.988 OC(=O)C1CC(=O)N=C2C=CC=CN12 Amb17844934 [0,0,0,1,0,1|2,0,0]=4 2166 B15R2.988 OC(=O)C1CC(=O)Oc2ccccc21 Amb23590642 [0,0,0,1,0,1|0,0,0]=2 2167 B15R2.988 OC(=O)C1CC(=O)Sc2ccccc21 Amb24665852 [0,0,0,1,0,1|0,1,0]=3 2168 B15R2.988 OC(=O)C1NC(=O)Nc2ccccc21 Amb22499964 [0,0,0,1,0,1|2,0,0]=4 2169 B15R2.988 OC(=O)C1NC(=O)Oc2ccccc21 Amb25255547 [0,0,0,1,0,1|1,0,0]=3 2170 B15R2.988 OC=1CC(c2ccccc2C1)C(O)=O Amb25109248 [0,0,0,1,0,1|1,0,1]=4 2171 B15R2.1106 CC(=O)Nc1cccc2CC(=O)Nc21 Amb25119361 [0,0,0,1,0,1|2,0,0]=4 2172 B15R2.1106 CC(=O)Nc1cccc2NC(=O)Cc21 Amb24499238 [0,0,0,1,0,1|2,0,0]=4 2173 B15R2.1106 CC(=O)Oc1cccc2CC(=O)Nc12 Amb25268684 [0,0,0,1,0,1|1,0,0]=3 2174 B15R2.1106 CC(=O)Oc1cccc2NC(=O)Cc12 Amb25114007 [0,0,0,1,0,1|1,0,0]=3 2175 B15R2.1106 CC(=O)Oc1cccc2c1nc([nH]2)C Amb10560577 [0,0,0,1,0,1|2,0,0]=4 2176 B15R2.1106 CC1Cc2cccc(CC(O)=O)c2O1 Amb18817573 [0,0,0,1,0,1|1,0,1]=4 2177 B15R2.1106 Cc1[n]c2c(CC(O)=O)cccc2[s]1 Amb18779215 [0,0,0,1,0,1|1,1,0]=4 2178 B15R2.1106 Cc1[n]c2c(CC(O)=O)cccc2o1 Amb18818951 [0,0,0,1,0,1|1,0,1]=4 2179 B15R2.1106 Cc1[n]c2c(cccc2o1)OC(C)=O Amb25376454 [0,0,0,1,0,1|1,0,0]=3 2180 B15R2.1106 Cc1[n]c2cc[n]c(CC(O)=O)c2o1 Amb18817846 [0,0,0,1,0,1|2,0,0]=4 2181 B15R2.1106 Cc1[n]c2cccc(CC(O)=O)c2[s]1 Amb25780677 [0,0,0,1,0,1|1,1,0]=4 2182 B15R2.1106 Cc1cc2c(CC(O)=O)cccc2[nH]1 Amb18820465 [0,0,0,1,0,1|2,0,0]=4 2183 B15R2.1106 Cc1cc2c(CC(O)=O)cccc2o1 Amb18819733 [0,0,0,1,0,1|1,0,1]=4 2184 B15R2.1106 Cc1cc2c(cccc2o1)OC(C)=O Amb25144500 [0,0,0,1,0,1|1,0,0]=3 2185 B15R2.1106 OC(=O)Cc1cccc2CC(=O)Nc21 Amb18650726 [0,0,0,1,0,1|1,0,0]=3 2186 B15R2.1106 OC(=O)Cc1cccc2NC(=O)Nc21 Amb18817850 [0,0,0,1,0,1|2,0,0]=4 2187 B15R2.1106 OC(=O)Cc1cccc2c1[nH]c(c2)C Amb17194063 [0,0,0,1,0,1|2,0,0]=4 2188 B15R2.16133 CC1(C)Oc2ccccc2C1C(O)=O Amb25771172 [0,0,0,1,0,1|1,0,1]=4 2189 B15R2.60844 Cc1cc2cccc(cc2c1)C(O)=O Amb24693970 [0,0,0,1,0,1|2,0,0]=4 2190 B15R2.384 CC(=O)c1cccc2NC(=O)OCc12 Amb24594112 [0,0,0,1,0,1|2,0,0]=4 2191 B15R2.384 Cc1cc2cccc(C(O)=O)c2[n]c1 Amb25315045 [0,0,0,1,0,1|2,0,0]=4 2192 B15R2.384 Cc1cc2cccc(C(O)=O)c2cc1 Amb22002081 [0,0,0,1,0,1|2,0,0]=4 2193 B15R2.384 Cc1ccc2c(cccc2C(O)=O)[n]1 Amb21927512 [0,0,0,1,0,1|2,0,0]=4 2194 B15R2.384 NC(=O)c1cccc2CC(=O)COc21 Amb24526680 [0,0,0,1,0,1|1,0,0]=3 2195 B15R2.384 O=C1COc2c(N1)cccc2C(=O)C Amb17570515 [0,0,0,1,0,1|2,0,0]=4 2196 B15R2.384 OC(=O)c1cccc2CC(=O)OCc21 Amb24498067 [0,0,0,1,0,1|0,0,0]=2 2197 B15R2.384 OC(=O)c1cccc2NC(=O)CCc12 Amb18650723 [0,0,0,1,0,1|2,0,0]=4 2198 B15R2.384 OC(=O)c1cccc2NC(=O)COc12 Amb18816814 [0,0,0,1,0,1|1,0,0]=3 2199 B15R2.384 OC(=O)c1cccc2NC(=O)CSc12 Amb25381263 [0,0,0,1,0,1|1,1,0]=4 2200 B15R2.384 OC(=O)c1cccc2OC(=O)C=Cc12 Amb24741963 [0,0,0,1,0,1|2,0,0]=4 2201 B15R2.384 [O-][N+](=O)c1cccc2CC(=O)COc21 Amb24594713 [0,0,0,1,0,1|1,0,1]=4 2202 B15R2.7343 O=C1CNc2ccccc2C(=O)CC1 Amb24637821 [0,0,0,1,0,1|2,0,0]=4 2203 B15R2.14951 CC(=O)C1NC(=O)c2ccccc2O1 Amb24336556 [0,0,0,1,0,1|1,0,0]=3 2204 B15R2.14951 CC(=O)C=1NC(=O)c2ccccc2N1 Amb22488765 [0,0,0,1,0,1|2,0,0]=4 2205 B15R2.14951 CC(=O)N1CC(=O)c2ccccc2C1 Amb18820473 [0,0,0,1,0,1|2,0,0]=4 2206 B15R2.14951 CC(C)=C1CC(=O)c2ccccc2O1 Amb24518821 [0,0,0,1,0,1|2,0,0]=4 2207 B15R2.14951 NC(=O)C1=CC(=O)c2ccccc2O1 Amb19186059 [0,0,0,1,0,1|2,0,0]=4 2208 B15R2.14951 NC(=O)C1=Nc2ccccc2C(=O)O1 Amb24415431 [0,0,0,1,0,1|2,0,0]=4 2209 B15R2.14951 NC(=O)C1Cc2ccccc2C(=O)O1 Amb24443026 [0,0,0,1,0,1|2,0,0]=4 2210 B15R2.14951 O=C1C=C(Oc2ccccc12)C(=O)Cl Amb21937110 [0,0,0,1,0,1|2,0,0]=4 2211 B15R2.14951 O=C1OC(=Nc2ccccc12)C(=O)Cl Amb24079293 [0,0,0,1,0,1|2,0,0]=4 2212 B15R2.14951 OC(=O)C1=CC(=O)c2ccccc2O1 Amb19078126 [0,0,0,1,0,1|2,0,0]=4 2213 B15R2.14951 OC(=O)C1=Cc2ccccc2C(=O)O1 Amb18528332 [0,0,0,1,0,1|2,0,0]=4 2214 B15R2.14951 OC(=O)C1OC(=O)c2c(C1)cccc2 Amb2482799 [0,0,0,1,0,1|2,0,0]=4 2215 B15R2.14951 OC(=O)c1cc(=O)c2c(o1)cccc2 Amb1151866 [0,0,0,1,0,1|2,0,0]=4 2216 B15R2.14951 [O-]C(=O)C1=CC(=O)c2ccccc2O1 Amb22489449 [0,0,0,1,0,1|2,0,0]=4 2217 B15R2.53147 CC(=O)CC1NC(=O)c2ccccc21 Amb25041166 [0,0,0,1,0,1|2,0,0]=4 2218 B15R2.53147 CC(=O)NC1CC(=O)c2ccccc21 Amb24072232 [0,0,0,1,0,1|2,0,0]=4 2219 B15R2.53147 CC(=O)NC1OC(=O)c2ccccc21 Amb22442905 [0,0,0,1,0,1|1,0,0]=3 2220 B15R2.53147 CC(=O)OC1C=C(C)c2ccccc12 Amb17778913 [0,0,0,1,0,1|2,0,0]=4 2221 B15R2.53147 CC(=O)OC1OC(=O)c2ccccc12 Amb17850786 [0,0,0,1,0,1|0,0,0]=2 2222 B15R2.53147 CC(=O)OC1OC(O)c2ccccc21 Amb25837909 [0,0,0,1,0,1|0,0,2]=4 2223 B15R2.53147 CC(=O)OI1OC(=O)c2ccccc12 Amb25733584 [0,0,0,1,0,1|0,0,0]=2 2224 B15R2.53147 CC(=O)\C=C/1\NC(=O)c2ccccc12 Amb24548268 [0,0,0,1,0,1|2,0,0]=4 2225 B15R2.53147 NC(=O)NC1OC(=O)c2c1cccc2 Amb2420495 [0,0,0,1,0,1|2,0,0]=4 2226 B15R2.53147 NC(=O)\C=C/1\OC(=O)c2ccccc12 Amb24563501 [0,0,0,1,0,1|2,0,0]=4 2227 B15R2.53147 NC(=O)\C=C\1/OC(=O)c2ccccc12 Amb19750821 [0,0,0,1,0,1|2,0,0]=4 2228 B15R2.53147 OC(=O)C=C1OC(=O)c2c1cccc2 Amb15740491 [0,0,0,1,0,1|2,0,0]=4 2229 B15R2.53147 OC(=O)CC1OC(=O)c2c1cccc2 Amb1153244 [0,0,0,1,0,1|2,0,0]=4 2230 B15R2.53147 OC(=O)\C=C\1/OC(=O)c2c1cccc2 Amb1150341 [0,0,0,1,0,1|2,0,0]=4 2231 B15R2.53147 OC(=O)\C=C\1/OC(=O)c2ccccc12 Amb22733359 [0,0,0,1,0,1|2,0,0]=4 2232 B15R2.7328 O=C1CCC(=O)Nc2cc(Cl)ccc12 Amb24399850 [0,1,0,1,0,0|2,0,0]=4 2233 B15R2.7328 O=C1NCC(=O)Nc2cc(Cl)ccc12 Amb19888449 [0,1,0,1,0,0|2,0,0]=4 2234 B15R2.7328 O=C1NCC(=O)Nc2cc(F)ccc12 Amb24336778 [0,1,0,1,0,0|2,0,0]=4 2235 B15R2.7569 Nc1cc(OC2CC2)c(cc1)C(O)=O Amb25167702 [0,1,0,1,0,0|1,0,1]=4 2236 B15R2.7569 OC(=O)c1ccc(Br)cc1OC2CC2 Amb25764553 [0,1,0,1,0,0|1,0,1]=4 2237 B15R2.7569 OC(=O)c1ccc(F)cc1OC2CC2 Amb25336462 [0,1,0,1,0,0|1,0,1]=4 2238 B15R2.7569 OC(=O)c1ccc(I)cc1OC2CC2 Amb24585054 [0,1,0,1,0,0|1,0,1]=4 2239 B15R2.14565 CC(=O)c1ccc(O)c2CC(=O)Nc12 Amb24681118 [0,1,0,1,0,0|2,0,0]=4 2240 B15R2.14565 CC1Cc2c(Cl)ccc(C(O)=O)c2O1 Amb25678505 [0,1,0,1,0,0|1,0,1]=4 2241 B15R2.14565 CC1Cc2c(N)ccc(C(O)=O)c2O1 Amb24091204 [0,1,0,1,0,0|1,0,1]=4 2242 B15R2.14565 Cc1[nH]c2c(F)ccc(C(O)=O)c2[n]1 Amb24664478 [0,1,0,1,0,0|2,0,0]=4 2243 B15R2.14565 Cc1cc2c(F)ccc(C(O)=O)c2[s]1 Amb24667162 [0,1,0,1,0,0|1,1,0]=4 2244 B15R2.14565 Cc1cc2c(I)ccc(C(O)=O)c2[s]1 Amb24655269 [0,1,0,1,0,0|1,1,0]=4 2245 B15R2.14565 Cc1cc2c(N)ccc(C(O)=O)c2[nH]1 Amb18191015 [0,1,0,1,0,0|2,0,0]=4 2246 B15R2.14565 Cc1cc2c([nH]1)c(Br)ccc2C(O)=O Amb25747891 [0,1,0,1,0,0|2,0,0]=4 2247 B15R2.14565 Cc1cc2c([s]1)c(Br)ccc2C(O)=O Amb25250126 [0,1,0,1,0,0|1,1,0]=4 2248 B15R2.14565 Cc1cc2c([s]1)c(Cl)ccc2C(O)=O Amb24728623 [0,1,0,1,0,0|1,1,0]=4 2249 B15R2.14565 Cc1cc2c([s]1)c(S)ccc2C(O)=O Amb25339802 [0,1,0,1,0,0|1,1,0]=4 2250 B15R2.14565 Cc1cc2c([s]1)c(ccc2O)C(O)=O Amb25245488 [0,1,0,1,0,0|1,1,0]=4 2251 B15R2.14565 Cc1ccc(C(O)=O)c2cc(C)[nH]c12 Amb25720299 [0,1,0,1,0,0|2,0,0]=4 2252 B15R2.14565 OC(=O)c1ccc(Cl)c2NC(=O)Nc12 Amb25329550 [0,1,0,1,0,0|2,0,0]=4 2253 B15R2.14565 OC(=O)c1ccc(Cl)c2NC(=O)Oc12 Amb22479533 [0,1,0,1,0,0|1,0,0]=3 2254 B15R2.14565 OC(=O)c1ccc(F)c2NC(=O)Oc12 Amb25122105 [0,1,0,1,0,0|1,0,0]=3 2255 B15R2.14743 CC(=O)N1CC(=O)c2ccc(F)cc12 Amb23590113 [0,1,0,1,0,0|2,0,0]=4 2256 B15R2.14743 CC(=O)[n]1[nH]c(=O)c2ccc(N)cc12 Amb24082841 [0,1,0,1,0,0|2,0,0]=4 2257 B15R2.14743 Cc1cc2C(OC(=O)c2cc1)C(O)=O Amb18817910 [0,1,0,1,0,0|2,0,0]=4 2258 B15R2.14743 OC(=O)C1OC(=O)c2ccc(Cl)cc21 Amb18174950 [0,1,0,1,0,0|2,0,0]=4 2259 B15R2.14743 OC(=O)C1OC(=O)c2ccc(F)cc21 Amb18189103 [0,1,0,1,0,0|2,0,0]=4 2260 B15R2.14743 OC(=O)C1OC(=O)c2ccc(O)cc21 Amb18815610 [0,1,0,1,0,0|2,0,0]=4 2261 B15R2.63911 CC1(C)Oc2cc(Cl)ccc2C(=O)O1 Amb25201764 [0,1,0,1,0,0|1,0,1]=4 2262 B15R2.63911 CC1(C)Oc2cc(O)ccc2C(=O)O1 Amb24662284 [0,1,0,1,0,0|1,0,1]=4 2263 B15R2.63911 C[Si]1(C)Oc2cc(N)ccc2C(=O)O1 Amb25668474 [0,1,0,1,0,0|1,1,0]=4 2264 B15R2.63911 Cc1ccc2c(c1)OC(C)(C)OC2=O Amb24452283 [0,1,0,1,0,0|1,0,1]=4 2265 B15R2.1107 CN1c2c(cccc2C(O)=O)NC1=O Amb22001969 [0,1,0,1,0,0|2,0,0]=4 2266 B15R2.1107 Cc1[s]c2cccc(C(O)=O)c2c1Cl Amb24713920 [0,1,0,1,0,0|1,1,0]=4 2267 B15R2.1107 Cc1[s]c2cccc(C(O)=O)c2c1S Amb24584874 [0,1,0,1,0,0|1,1,0]=4 2268 B15R2.1107 NN1c2c(cccc2C(O)=O)NC1=O Amb24605308 [0,1,0,1,0,0|2,0,0]=4 2269 B15R2.1107 OC(=O)c1cccc2NC(=O)C(=O)c12 Amb22750805 [0,1,0,1,0,0|2,0,0]=4 2270 B15R2.1149 OC(=O)c1ccccc1N2CCC2=O Amb25181670 [0,1,0,1,0,0|1,0,0]=3 2271 B15R2.14628 CC(=O)C1=CNC(=O)c2ccccc12 Amb22495362 [0,1,0,1,0,0|2,0,0]=4 2272 B15R2.14628 CC(=O)C1CCC(=O)c2ccccc21 Amb24731766 [0,1,0,1,0,0|2,0,0]=4 2273 B15R2.14628 CC(=O)N1C=CC(=O)c2ccccc12 Amb25253347 [0,1,0,1,0,0|2,0,0]=4 2274 B15R2.14628 CC(=O)N1CCC(=O)c2c1cccc2 Amb16971728 [0,1,0,1,0,0|2,0,0]=4 2275 B15R2.14628 CC(=O)N1N=CC(=O)c2ccccc12 Amb22461967 [0,1,0,1,0,0|2,0,0]=4 2276 B15R2.14628 CC(=O)c1ccc(c2c1cccc2)O Amb17594809 [0,1,0,1,0,0|2,0,0]=4 2277 B15R2.14628 OC(=O)C1=COC(=O)c2ccccc12 Amb18650314 [0,1,0,1,0,0|2,0,0]=4 2278 B15R2.14628 OC(=O)C1=NOC(=O)c2ccccc12 Amb20000914 [0,1,0,1,0,0|2,0,0]=4 2279 B15R2.14628 OC(=O)C1COC(=O)c2ccccc21 Amb18651012 [0,1,0,1,0,0|2,0,0]=4 2280 B15R2.147885 CC1(OC(=O)c2ccccc12)C(O)=O Amb25070099 [0,1,0,1,0,0|2,0,0]=4 2281 B15R2.147885 C[C@@]1(OC(=O)c2ccccc12)C(O)=O Amb24347907 [0,1,0,1,0,0|2,0,0]=4 2282 B15R2.550 CC1=NOCC(=O)Nc2ccccc21 Amb25124769 [0,1,0,1,0,0|2,0,0]=4 2283 B15R2.550 O=C1CCCC(=O)Nc2ccccc12 Amb25743041 [0,1,0,1,0,0|2,0,0]=4 2284 B15R2.4815 O\N=C/1\CCC(=O)Nc2ccccc12 Amb25038420 [0,1,0,1,0,0|2,0,0]=4 2285 B15R2.8448 O=C1Nc2ccccc2C(=O)N(C1)C Amb1979905 [0,1,0,1,0,0|2,0,0]=4 2286 B15R2.8448 OC1=CC(=O)Nc2ccccc2C1=O Amb25366186 [0,1,0,1,0,0|1,0,1]=4 2287 B15R2.19309 COC(=O)c1cccc2CC(C)Oc12 Amb23558898 [0,1,0,1,0,0|1,0,1]=4 2288 B15R2.19309 COC(=O)c1cccc2NC(=O)Nc21 Amb22492464 [0,1,0,1,0,0|2,0,0]=4 2289 B15R2.19309 COC(=O)c1cccc2OC(=O)Nc12 Amb24654818 [0,1,0,1,0,0|2,0,0]=4 2290 B15R2.19309 COC(=O)c1cccc2SC(=O)Nc21 Amb24079044 [0,1,0,1,0,0|2,0,0]=4 2291 B15R2.19309 COC(=O)c1cccc2[n]c(Cl)oc21 Amb24498455 [0,1,0,1,0,0|2,0,0]=4 2292 B15R2.19309 COC(=O)c1cccc2[n]c(O)oc21 Amb24536826 [0,1,0,1,0,0|1,0,1]=4 2293 B15R2.19309 COC(=O)c1cccc2c1oc(n2)C Amb16230879 [0,1,0,1,0,0|1,0,0]=3 2294 B15R2.19309 Cc1[nH]c2cccc(C(=O)OC)c2[n]1 Amb22494104 [0,1,0,1,0,0|2,0,0]=4 2295 B15R2.19309 Cc1[n]c2c(cccc2C(=O)OC)[s]1 Amb25223169 [0,1,0,1,0,0|1,1,0]=4 2296 B15R2.19309 Cc1[n]c2c(cccc2C(=O)OC)o1 Amb22749855 [0,1,0,1,0,0|1,0,1]=4 2297 B15R2.19309 Cc1[n]c2cccc(C(=O)CN)c2o1 Amb24640621 [0,1,0,1,0,0|2,0,0]=4 2298 B15R2.19309 Cc1[n]c2cccc(C(=O)OC)c2[s]1 Amb24096008 [0,1,0,1,0,0|1,1,0]=4 2299 B15R2.19309 Cc1cc2c(cccc2C(=O)OC)[nH]1 Amb24183498 [0,1,0,1,0,0|2,0,0]=4 2300 B15R2.19309 Cc1cc2c(cccc2C(=O)OC)o1 Amb25695106 [0,1,0,1,0,0|1,0,1]=4 2301 B15R2.24965 CC(=O)N1C(N)C(=O)c2ccccc12 Amb24347925 [0,1,0,1,0,0|2,0,0]=4 2302 B15R2.24965 CC(=O)N1c2ccccc2C(O)C1=O Amb25201994 [0,1,0,1,0,0|1,0,1]=4 2303 B15R2.24965 CC(=O)N1c2ccccc2[C@@H](O)C1=O Amb25844573 [0,1,0,1,0,0|1,0,1]=4 2304 B15R2.24965 O=C1c2ccccc2N(C1=O)C(=O)C Amb1631473 [0,1,0,1,0,0|1,0,1]=4 2305 B15R2.39201 CC(=O)N1C\C(=N/O)\c2ccccc12 Amb19984841 [0,1,0,1,0,0|2,0,0]=4 2306 B15R2.39201 CC(=O)[n]1cc(CO)c2ccccc12 Amb23513695 [0,1,0,1,0,0|2,0,0]=4 2307 B15R2.39201 O=Cc1cn(c2c1cccc2)C(=O)C Amb1981177 [0,1,0,1,0,0|2,0,0]=4 2308 B15R2.49945 CC(=O)Nc1cccc2c1C(=O)CC2 Amb16232626 [0,1,0,1,0,0|2,0,0]=4 2309 B15R2.49945 Cc1[n][nH]c2cccc(OC(C)=O)c12 Amb24067090 [0,1,0,1,0,0|2,0,0]=4 2310 B15R2.49945 Cc1coc2cccc(NC(C)=O)c12 Amb25685841 [0,1,0,1,0,0|2,0,0]=4 2311 B15R2.2047 CC(=O)c1cccc2[n]c(CO)oc12 Amb24656430 [0,1,0,1,0,0|2,0,0]=4 2312 B15R2.2047 CC(=O)c1cccc2[n]c(oc21)OC Amb24759227 [0,1,0,1,0,0|2,0,0]=4 2313 B15R2.2047 CCc1[nH]c2cccc(C(O)=O)c2[n]1 Amb18966911 [0,1,0,1,0,0|2,0,0]=4 2314 B15R2.2047 CCc1[n]c2cccc(C(N)=O)c2o1 Amb25224022 [0,1,0,1,0,0|2,0,0]=4 2315 B15R2.2047 CCc1nc2c(o1)c(ccc2)C(=O)O Amb17130909 [0,1,0,1,0,0|1,0,0]=3 2316 B15R2.2047 CCc1oc2c(n1)c(ccc2)C(=O)O Amb17130931 [0,1,0,1,0,0|1,0,1]=4 2317 B15R2.2047 CNc1[n]c2cccc(C(O)=O)c2[s]1 Amb24101340 [0,1,0,1,0,0|1,1,0]=4 2318 B15R2.2047 CNc1nc2c(o1)c(ccc2)C(=O)C Amb17570469 [0,1,0,1,0,0|2,0,0]=4 2319 B15R2.2047 COc1[n]c2cccc(c2o1)C(N)=O Amb24727419 [0,1,0,1,0,0|2,0,0]=4 2320 B15R2.2047 COc1[n]c2cccc(c2o1)C(O)=O Amb25373456 [0,1,0,1,0,0|1,0,0]=3 2321 B15R2.2047 CSc1[nH]c2cccc(C(O)=O)c2[n]1 Amb24637993 [0,1,0,1,0,0|2,0,0]=4 2322 B15R2.2047 CSc1[n]c2c(cccc2C(O)=O)o1 Amb24444893 [0,1,0,1,0,0|1,0,1]=4 2323 B15R2.2047 CSc1[n]c2cccc(C(O)=O)c2o1 Amb24439586 [0,1,0,1,0,0|1,0,0]=3 2324 B15R2.2047 ClCc1nc2c(o1)c(ccc2)C(=O)C Amb10975725 [0,1,0,1,0,0|2,0,0]=4 2325 B15R2.2047 NC(=O)c1cccc2[n]c(C=O)oc12 Amb24566769 [0,1,0,1,0,0|2,0,0]=4 2326 B15R2.2047 NC(=O)c1cccc2[n]c(CO)oc12 Amb24727630 [0,1,0,1,0,0|2,0,0]=4 2327 B15R2.2047 NCc1[n]c2c(cccc2C(O)=O)o1 Amb18817810 [0,1,0,1,0,0|1,0,1]=4 2328 B15R2.2047 NCc1[n]c2cccc(C(O)=O)c2o1 Amb18817811 [0,1,0,1,0,0|1,0,0]=3 2329 B15R2.2047 NCc1nc2c(o1)c(ccc2)C(=O)C Amb17570468 [0,1,0,1,0,0|2,0,0]=4 2330 B15R2.2047 O=C(Cl)c1cccc2[n]c(CBr)oc12 Amb25253206 [0,1,0,1,0,0|2,0,0]=4 2331 B15R2.2047 OC(=O)c1cccc2[nH]c(C=O)[n]c12 Amb18819799 [0,1,0,1,0,0|2,0,0]=4 2332 B15R2.2047 OC(=O)c1cccc2[nH]c(CO)[n]c21 Amb18966912 [0,1,0,1,0,0|2,0,0]=4 2333 B15R2.2047 OC(=O)c1cccc2[nH]c(cc12)C=O Amb18820634 [0,1,0,1,0,0|2,0,0]=4 2334 B15R2.2047 OC(=O)c1cccc2[n]c(CCl)[nH]c12 Amb25201678 [0,1,0,1,0,0|2,0,0]=4 2335 B15R2.2047 OC(=O)c1cccc2[n]c(CCl)oc12 Amb25042673 [0,1,0,1,0,0|1,0,0]=3 2336 B15R2.2047 OC(=O)c1cccc2oc(CO)[n]c21 Amb25165486 [0,1,0,1,0,0|1,0,1]=4 2337 B15R2.2047 OCc1[n]c2cccc(C(=O)Cl)c2o1 Amb25223831 [0,1,0,1,0,0|2,0,0]=4 2338 B15R2.2292 ClCC1=NNC(=O)c2c(O1)cccc2 Amb10070595 [0,1,0,1,0,0|2,0,0]=4 2339 B15R2.2292 OCC1COC(=O)c2ccccc2O1 Amb25381272 [0,1,0,1,0,0|0,0,2]=4 2340 B15R2.7268 CC(=O)c1cccc2COC(=O)Nc12 Amb25249486 [0,1,0,1,0,0|2,0,0]=4 2341 B15R2.7268 CC1CCc2cccc(C(O)=O)c2O1 Amb25331077 [0,1,0,1,0,0|1,0,1]=4 2342 B15R2.7268 Cc1[n]c2c(cccc2c[n]1)C(O)=O Amb24708200 [0,1,0,1,0,0|2,0,0]=4 2343 B15R2.7268 Cc1c[n]c2cccc(C(O)=O)c2c1 Amb24102420 [0,1,0,1,0,0|2,0,0]=4 2344 B15R2.7268 Cc1cc2c(cccc2c[n]1)C(O)=O Amb19103851 [0,1,0,1,0,0|2,0,0]=4 2345 B15R2.7268 Cc1cc2c(cccc2cc1)C(O)=O Amb18649286 [0,1,0,1,0,0|2,0,0]=4 2346 B15R2.7268 Cc1ccc2cccc(C(O)=O)c2[n]1 Amb18649540 [0,1,0,1,0,0|2,0,0]=4 2347 B15R2.7268 NC(=O)c1cccc2CCC(=O)Cc12 Amb25299234 [0,1,0,1,0,0|2,0,0]=4 2348 B15R2.7268 NC(=O)c1cccc2CCC(=O)Nc12 Amb23400227 [0,1,0,1,0,0|2,0,0]=4 2349 B15R2.7268 OC(=O)c1cc[n]c2NCC(=O)Nc12 Amb23557207 [0,1,0,1,0,0|2,0,0]=4 2350 B15R2.7268 OC(=O)c1cccc2CCC(=O)Nc12 Amb23399617 [0,1,0,1,0,0|1,0,0]=3 2351 B15R2.7268 OC(=O)c1cccc2COC(=O)Cc12 Amb25274053 [0,1,0,1,0,0|1,0,0]=3 2352 B15R2.7268 OC(=O)c1cccc2N=CC(=O)Nc12 Amb25365397 [0,1,0,1,0,0|1,0,1]=4 2353 B15R2.7268 OC(=O)c1cccc2NCC(=O)Nc12 Amb25250594 [0,1,0,1,0,0|1,0,0]=3 2354 B15R2.7268 OC(=O)c1cccc2NCC(=O)Oc12 Amb25685388 [0,1,0,1,0,0|0,0,0]=2 2355 B15R2.7268 OC(=O)c1cccc2OCC(=O)Nc12 Amb18061749 [0,1,0,1,0,0|1,0,0]=3 2356 B15R2.7268 OC(=O)c1cccc2SCC(=O)Nc12 Amb25170233 [0,1,0,1,0,0|1,0,0]=3 2357 B15R2.13167 NC1CC(=O)c2ccccc2NC1=O Amb24400307 [0,1,0,1,0,0|2,0,0]=4 2358 B15R2.13167 O=C1NC(=O)c2c(OC1C)cccc2 Amb1765147 [0,1,0,1,0,0|1,0,1]=4 2359 B15R2.16320 OC(=O)c1ccccc1OC2CCC2 Amb18987377 [0,1,0,1,0,0|1,0,1]=4 2360 B15R2.16320 OC(=O)c1ccccc1OC2CNC2 Amb25109062 [0,1,0,1,0,0|1,0,1]=4 2361 B15R2.23388 CNC(=O)C1CC(=O)c2c1cccc2 Amb17470705 [0,1,0,1,0,0|2,0,0]=4 2362 B15R2.23388 CNC(=O)N1OC(=O)c2ccccc12 Amb25857472 [0,1,0,1,0,0|1,0,0]=3 2363 B15R2.23388 COC(=O)C1CC(=O)c2ccccc12 Amb17755304 [0,1,0,1,0,0|2,0,0]=4 2364 B15R2.23388 C\C(\CC)=C\1/OC(=O)c2ccccc21 Amb25254906 [0,1,0,1,0,0|2,0,0]=4 2365 B15R2.45730 CC(=O)c1cccc2c1OC(=O)N2C Amb18547347 [0,1,0,1,0,0|1,0,0]=3 2366 B15R2.45730 CC1C(C)Oc2c1cccc2C(=O)O Amb1221737 [0,1,0,1,0,0|1,0,1]=4 2367 B15R2.45730 CN1c2cccc(C(O)=O)c2CC1=O Amb25676514 [0,1,0,1,0,0|1,0,0]=3 2368 B15R2.45730 C[C@@H]1[C@H](C)Oc2c1cccc2C(O)=O Amb24677767 [0,1,0,1,0,0|1,0,1]=4 2369 B15R2.45730 C[C@H]1[C@H](C)Oc2c1cccc2C(O)=O Amb25179521 [0,1,0,1,0,0|1,0,1]=4 2370 B15R2.45730 C[n]1c(Cl)[n]c2c(cccc12)C(O)=O Amb24414161 [0,1,0,1,0,0|2,0,0]=4 2371 B15R2.45730 Cc1[n]c2c(cccc2[n]1C)C(O)=O Amb24088900 [0,1,0,1,0,0|2,0,0]=4 2372 B15R2.45730 Cc1[s]c2c(cccc2c1I)C(O)=O Amb25379005 [0,1,0,1,0,0|1,1,0]=4 2373 B15R2.45730 Cc1c2cccc(C(O)=O)c2[s]c1C Amb25253821 [0,1,0,1,0,0|1,1,0]=4 2374 B15R2.45730 Cc1c2cccc(C(O)=O)c2oc1C Amb25256149 [0,1,0,1,0,0|1,0,0]=3 2375 B15R2.45730 NC1c2cccc(C(O)=O)c2NC1=O Amb25665402 [0,1,0,1,0,0|1,0,0]=3 2376 B15R2.45730 OC(=O)c1cccc2C(O)C(=O)Nc21 Amb24761414 [0,1,0,1,0,0|1,0,0]=3 2377 B15R2.45730 OC(=O)c1cccc2c1[nH]c(c2C)C Amb1134710 [0,1,0,1,0,0|2,0,0]=4 2378 B15R2.81184 COC(=O)Cc1cccc2CC(=O)c21 Amb24652923 [0,1,0,1,0,0|2,0,0]=4 2379 B15R2.7355 Cc1cccc2c1NC(=O)CNC2=O Amb24548873 [0,1,0,1,0,0|2,0,0]=4 2380 B15R2.7355 O=C1NCC(=O)Nc2c(Br)cccc12 Amb24655456 [0,1,0,1,0,0|2,0,0]=4 2381 B15R2.7355 O=C1NCC(=O)Nc2c(Cl)cccc12 Amb23401378 [0,1,0,1,0,0|2,0,0]=4 2382 B15R2.13615 CC1(C)OC(=O)c2cccc(O)c2O1 Amb24424975 [0,1,0,1,0,0|1,0,1]=4 2383 B15R2.13630 CC(=O)N1CC(=O)c2cccc(Cl)c12 Amb25038271 [0,1,0,1,0,0|2,0,0]=4 2384 B15R2.13630 Cc1cccc2c1C(OC2=O)C(O)=O Amb18817909 [0,1,0,1,0,0|2,0,0]=4 2385 B15R2.13630 OC(=O)C1OC(=O)c2cccc(F)c21 Amb18189104 [0,1,0,1,0,0|2,0,0]=4 2386 B15R2.13630 OC(=O)C1OC(=O)c2cccc(O)c21 Amb18815611 [0,1,0,1,0,0|2,0,0]=4 2387 B15R2.15373 Nc1cccc(C(O)=O)c1OC2CC2 Amb24467516 [0,1,0,1,0,0|1,0,1]=4 2388 B15R2.15373 OC(=O)c1cccc(Cl)c1OC2CC2 Amb24680082 [0,1,0,1,0,0|1,0,1]=4 2389 B15R2.69023 CC1(C)Oc2cccc(C(O)=O)c2O1 Amb24608931 [0,1,0,1,0,0|0,0,2]=4 2390 B15R2.7251 CC(=O)c1c(O)ccc2SC(=O)Oc21 Amb24706818 [0,1,0,1,0,0|2,0,0]=4 2391 B15R2.7251 Cc1[nH]c2ccc(F)c(C(O)=O)c2[n]1 Amb25247352 [0,1,0,1,0,0|2,0,0]=4 2392 B15R2.7251 Cc1[n]c2ccc(F)c(C(O)=O)c2o1 Amb22475282 [0,1,0,1,0,0|1,0,0]=3 2393 B15R2.7251 Cc1cc2c(C(O)=O)c(Cl)ccc2[s]1 Amb24728592 [0,1,0,1,0,0|1,1,0]=4 2394 B15R2.7251 Cc1cc2c(C(O)=O)c(O)ccc2[s]1 Amb25259344 [0,1,0,1,0,0|1,1,0]=4 2395 B15R2.7251 Cc1cc2c(C(O)=O)c(O)ccc2o1 Amb25359359 [0,1,0,1,0,0|1,0,1]=4 2396 B15R2.7251 Cc1cc2c(C(O)=O)c(S)ccc2[s]1 Amb24560401 [0,1,0,1,0,0|1,1,0]=4 2397 B15R2.7251 Cc1cc2ccc(C)c(C(O)=O)c2[nH]1 Amb25084483 [0,1,0,1,0,0|2,0,0]=4 2398 B15R2.7251 Cc1cc2ccc(C)c(C(O)=O)c2[s]1 Amb25218347 [0,1,0,1,0,0|1,1,0]=4 2399 B15R2.7251 Cc1cc2ccc(F)c(C(N)=O)c2o1 Amb22482280 [0,1,0,1,0,0|2,0,0]=4 2400 B15R2.7251 Cc1cc2ccc(F)c(C(O)=O)c2[s]1 Amb25293186 [0,1,0,1,0,0|1,1,0]=4 2401 B15R2.7251 Cc1ccc2NC(=O)Nc2c1C(O)=O Amb24717162 [0,1,0,1,0,0|2,0,0]=4 2402 B15R2.7251 Cc1ccc2OC(=O)Nc2c1C(O)=O Amb25210541 [0,1,0,1,0,0|2,0,0]=4 2403 B15R2.7251 Cc1ccc2[s]c(C)cc2c1C(O)=O Amb24759387 [0,1,0,1,0,0|1,1,0]=4 2404 B15R2.7251 OC(=O)c1c(Br)ccc2NC(=O)Nc21 Amb25315365 [0,1,0,1,0,0|2,0,0]=4 2405 B15R2.7251 OC(=O)c1c(Cl)ccc2NC(=O)Nc21 Amb25329726 [0,1,0,1,0,0|2,0,0]=4 2406 B15R2.7251 OC(=O)c1c(F)ccc2NC(=O)Nc21 Amb25197942 [0,1,0,1,0,0|2,0,0]=4 2407 B15R2.7251 OC(=O)c1c(F)ccc2NC(=O)Oc21 Amb22464704 [0,1,0,1,0,0|1,0,0]=3 2408 B15R2.13631 CC(=O)N1CC(=O)c2c(Br)cccc12 Amb25122000 [0,1,0,1,0,0|2,0,0]=4 2409 B15R2.13631 CC(=O)N1CC(=O)c2c(F)cccc12 Amb24601039 [0,1,0,1,0,0|2,0,0]=4 2410 B15R2.13631 Cc1cccc2C(OC(=O)c21)C(O)=O Amb18817911 [0,1,0,1,0,0|2,0,0]=4 2411 B15R2.13631 OC(=O)C1OC(=O)c2c(F)cccc21 Amb18189105 [0,1,0,1,0,0|2,0,0]=4 2412 B15R2.13631 OC(=O)C1OC(=O)c2c1cccc2O Amb18815612 [0,1,0,1,0,0|2,0,0]=4 2413 B15R2.48037 OC(=O)c1c(F)cccc1OC2CC2 Amb24753229 [0,1,0,1,0,0|1,0,1]=4 2414 B15R2.383 CC(=O)N1CC(=O)c2cc(Cl)ccc12 Amb25784728 [0,1,0,1,0,0|2,0,0]=4 2415 B15R2.383 CC(=O)N1CC(=O)c2cc(F)ccc12 Amb23590112 [0,1,0,1,0,0|2,0,0]=4 2416 B15R2.383 CC(=O)N1CC(=O)c2cc(N)ccc12 Amb18819598 [0,1,0,1,0,0|2,0,0]=4 2417 B15R2.383 CC(=O)N1NC(=O)c2cc(C)ccc12 Amb24078897 [0,1,0,1,0,0|2,0,0]=4 2418 B15R2.383 Cc1ccc2C(OC(=O)c2c1)C(O)=O Amb18817912 [0,1,0,1,0,0|2,0,0]=4 2419 B15R2.383 OC(=O)C1OC(=O)c2cc(Cl)ccc21 Amb18174970 [0,1,0,1,0,0|2,0,0]=4 2420 B15R2.383 OC(=O)C1OC(=O)c2cc(F)ccc21 Amb18813427 [0,1,0,1,0,0|2,0,0]=4 2421 B15R2.383 OC(=O)C1OC(=O)c2cc(O)ccc21 Amb18815609 [0,1,0,1,0,0|2,0,0]=4 2422 B15R2.7332 Cc1ccc2NC(=O)CNC(=O)c2c1 Amb24066330 [0,1,0,1,0,0|2,0,0]=4 2423 B15R2.7332 O=C1CCC(=O)Nc2ccc(Br)cc12 Amb23537349 [0,1,0,1,0,0|2,0,0]=4 2424 B15R2.7332 O=C1CNC(=O)c2c(N1)ccc(c2)F Amb10074507 [0,1,0,1,0,0|2,0,0]=4 2425 B15R2.7332 O=C1OCC(=O)Nc2ccc(F)cc12 Amb25166206 [0,1,0,1,0,0|1,0,0]=3 2426 B15R2.7332 OC1=CCC(=O)Nc2ccc(F)cc21 Amb25825100 [0,1,0,1,0,0|2,0,0]=4 2427 B15R2.62112 Brc1cc2nc(oc2c(c1)C(=O)C)C Amb17573660 [0,1,0,1,0,0|2,0,0]=4 2428 B15R2.62112 CC(=O)c1cc(Br)cc2NC(=O)Oc12 Amb18547462 [0,1,0,1,0,0|2,0,0]=4 2429 B15R2.62112 CC(=O)c1cc(N)cc2NC(=O)Oc12 Amb18547357 [0,1,0,1,0,0|2,0,0]=4 2430 B15R2.62112 CC1Cc2cc(Br)cc(C(O)=O)c2O1 Amb18692662 [0,1,0,1,0,0|1,0,1]=4 2431 B15R2.62112 CC1Cc2cc(Cl)cc(C(O)=O)c2O1 Amb18174726 [0,1,0,1,0,0|1,0,1]=4 2432 B15R2.62112 CC1Cc2cc(F)cc(C(O)=O)c2O1 Amb18813385 [0,1,0,1,0,0|1,0,1]=4 2433 B15R2.62112 CC1Cc2cc(N)cc(C(O)=O)c2O1 Amb23558911 [0,1,0,1,0,0|1,0,1]=4 2434 B15R2.62112 Cc1[nH]c2c(cc(F)cc2C(O)=O)[n]1 Amb24663536 [0,1,0,1,0,0|2,0,0]=4 2435 B15R2.62112 Cc1[nH]c2cc(Cl)cc(C(O)=O)c2[n]1 Amb25687583 [0,1,0,1,0,0|2,0,0]=4 2436 B15R2.62112 Cc1[nH]c2cc(O)cc(c2[n]1)C(O)=O Amb25288116 [0,1,0,1,0,0|2,0,0]=4 2437 B15R2.62112 Cc1[n]c2c(cc(Cl)cc2C(O)=O)[s]1 Amb25351905 [0,1,0,1,0,0|1,1,0]=4 2438 B15R2.62112 Cc1[n]c2c(cc(F)cc2C(O)=O)[s]1 Amb25178750 [0,1,0,1,0,0|1,1,0]=4 2439 B15R2.62112 Cc1[n]c2cc(C)[n]c(C(O)=O)c2o1 Amb25312415 [0,1,0,1,0,0|2,0,0]=4 2440 B15R2.62112 Cc1[n]c2cc(Cl)cc(C(O)=O)c2o1 Amb24638887 [0,1,0,1,0,0|1,0,0]=3 2441 B15R2.62112 Cc1cc(C(O)=O)c2CC(=O)Oc2c1 Amb25348839 [0,1,0,1,0,0|2,0,0]=4 2442 B15R2.62112 Cc1cc(C(O)=O)c2OC(=O)Nc2c1 Amb25754297 [0,1,0,1,0,0|1,0,0]=3 2443 B15R2.62112 Cc1cc(C(O)=O)c2OC(C)Cc2c1 Amb18817578 [0,1,0,1,0,0|1,0,1]=4 2444 B15R2.62112 Cc1cc2NC(=O)C=C(C(O)=O)c2o1 Amb18816804 [0,1,0,1,0,0|2,0,0]=4 2445 B15R2.62112 Cc1cc2c(cc(Br)cc2C(O)=O)[nH]1 Amb24328404 [0,1,0,1,0,0|2,0,0]=4 2446 B15R2.62112 Cc1cc2c(cc(Cl)cc2C(O)=O)[nH]1 Amb24328403 [0,1,0,1,0,0|2,0,0]=4 2447 B15R2.62112 Cc1cc2c(cc(Cl)cc2C(O)=O)[s]1 Amb25292999 [0,1,0,1,0,0|1,1,0]=4 2448 B15R2.62112 Cc1cc2c(cc(F)cc2C(O)=O)[nH]1 Amb24328405 [0,1,0,1,0,0|2,0,0]=4 2449 B15R2.62112 Cc1cc2c(cc(F)cc2C(O)=O)[s]1 Amb24542061 [0,1,0,1,0,0|1,1,0]=4 2450 B15R2.62112 Cc1cc2c(cc(N)cc2C(O)=O)[nH]1 Amb24328402 [0,1,0,1,0,0|2,0,0]=4 2451 B15R2.62112 Cc1cc2c(cc(O)cc2C(O)=O)[s]1 Amb25203671 [0,1,0,1,0,0|1,1,0]=4 2452 B15R2.62112 Cc1cc2cc(Cl)cc(C(O)=O)c2[s]1 Amb24728593 [0,1,0,1,0,0|1,1,0]=4 2453 B15R2.62112 Cc1cc2cc(F)cc(C(O)=O)c2[s]1 Amb25224581 [0,1,0,1,0,0|1,1,0]=4 2454 B15R2.62112 Cc1cc2cc(N)cc(C(O)=O)c2[nH]1 Amb18819696 [0,1,0,1,0,0|2,0,0]=4 2455 B15R2.62112 Cc1cc2cc(N)cc(C(O)=O)c2[s]1 Amb24609480 [0,1,0,1,0,0|1,1,0]=4 2456 B15R2.62112 Cc1cc2cc(S)cc(C(O)=O)c2[s]1 Amb24670607 [0,1,0,1,0,0|1,1,0]=4 2457 B15R2.62112 Nc1[n]c2cc(Br)cc(C(O)=O)c2o1 Amb25283233 [0,1,0,1,0,0|2,0,0]=4 2458 B15R2.62112 Nc1[n]c2cc(Cl)cc(C(O)=O)c2o1 Amb23527686 [0,1,0,1,0,0|2,0,0]=4 2459 B15R2.62112 Nc1cc2nc(oc2c(c1)C(=O)C)C Amb17570467 [0,1,0,1,0,0|2,0,0]=4 2460 B15R2.62112 O=C1Nc2c(C1)cc(cc2C(=O)O)Br Amb17318521 [0,1,0,1,0,0|1,0,0]=3 2461 B15R2.62112 O=C1Nc2c(C1)cc(cc2C(=O)O)C Amb17318505 [0,1,0,1,0,0|1,0,0]=3 2462 B15R2.62112 O=C1Nc2c(C1)cc(cc2C(=O)O)Cl Amb17318517 [0,1,0,1,0,0|1,0,0]=3 2463 B15R2.62112 O=C1Nc2c(C1)cc(cc2C(=O)O)F Amb17318513 [0,1,0,1,0,0|1,0,0]=3 2464 B15R2.62112 OC(=O)C1=CC(Cl)=CC2=NC(=O)N=C21 Amb24717097 [0,1,0,1,0,0|2,0,0]=4 2465 B15R2.62112 OC(=O)c1cc(Cl)cc2NC(=O)Nc21 Amb25668225 [0,1,0,1,0,0|2,0,0]=4 2466 B15R2.62112 OC(=O)c1cc(Cl)cc2OC(=O)Nc12 Amb24668913 [0,1,0,1,0,0|2,0,0]=4 2467 B15R2.62112 OC(=O)c1cc(F)cc2NC(=O)Sc12 Amb25247314 [0,1,0,1,0,0|1,1,0]=4 2468 B15R2.62112 OC(=O)c1cc(O)cc2SC(=O)Oc21 Amb25842333 [0,1,0,1,0,0|1,0,0]=3 2469 B15R2.65880 OC(=O)c1cc(Br)ccc1OC2CC2 Amb25055706 [0,1,0,1,0,0|1,0,1]=4 2470 B15R2.65880 OC(=O)c1cc(F)ccc1OC2CC2 Amb25114214 [0,1,0,1,0,0|1,0,1]=4 2471 B11R0.30 CC(=O)O\C=C\C=C\OC(=O)C Amb15693475 [0,0,1,0,1,0|2,0,0]=4 2472 B11R1.57 CC(=O)Cc1[nH]ccc1C=O Amb25798384 [1,0,0,0,1,0|2,0,0]=4 2473 B11R1.57 CC(=O)Cc1ccoc1C=O Amb25807627 [1,0,0,0,1,0|2,0,0]=4 2474 B11R1.57 CC(=O)Cc1occc1C=O Amb18125352 [1,0,0,0,1,0|2,0,0]=4 2475 B11R1.57 CC(=O)Nc1cc[s]c1C=O Amb18126609 [1,0,0,0,1,0|2,0,0]=4 2476 B11R1.57 CC(=O)Nc1ccoc1C=O Amb25132300 [1,0,0,0,1,0|2,0,0]=4 2477 B11R1.193 CCOc1c[s]cc1C(O)=O Amb18126889 [1,0,0,0,1,0|1,0,1]=4 2478 B11R1.193 CCOc1occc1C(O)=O Amb24078776 [1,0,0,0,1,0|1,0,1]=4 2479 B11R1.193 C\C=C\[n]1cccc1C(O)=O Amb24379103 [1,0,0,0,1,0|2,0,0]=4 2480 B11R1.193 C\C=C\c1[nH]ccc1C(O)=O Amb24616423 [1,0,0,0,1,0|2,0,0]=4 2481 B11R1.178 CC(=O)C/1=CC=C\C1=C(\C)/O Amb24485987 [0,0,0,0,2,0|1,0,0]=3 2482 B11R1.178 CC(=O)[n]1cccc1C(O)=O Amb25218296 [0,0,0,0,2,0|1,0,0]=3 2483 B11R1.178 CC(=O)c1[nH][n]cc1C(O)=O Amb18200852 [0,0,0,0,2,0|2,0,0]=4 2484 B11R1.178 CC(=O)c1[n][s]cc1C(O)=O Amb24079657 [0,0,0,0,2,0|2,0,0]=4 2485 B11R1.178 CC(=O)c1[n]c[nH]c1C(O)=O Amb25800823 [0,0,0,0,2,0|2,0,0]=4 2486 B11R1.178 CC(=O)c1[n]occ1C(O)=O Amb18830932 [0,0,0,0,2,0|2,0,0]=4 2487 B11R1.178 CC(=O)c1[s]c[n]c1C(O)=O Amb18687215 [0,0,0,0,2,0|2,0,0]=4 2488 B11R1.178 CC(=O)c1[s]ccc1C(O)=O Amb18126671 [0,0,0,0,2,0|1,0,0]=3 2489 B11R1.178 CC(=O)c1c[nH]cc1C(C)=O Amb22363701 [0,0,0,0,2,0|2,0,0]=4 2490 B11R1.178 CC(=O)c1c[s]cc1C(O)=O Amb25060748 [0,0,0,0,2,0|1,0,0]=3 2491 B11R1.178 CC(=O)c1cc[nH]c1C(N)=O Amb24355955 [0,0,0,0,2,0|2,0,0]=4 2492 B11R1.178 CC(=O)c1cc[nH]c1C(O)=O Amb23440687 [0,0,0,0,2,0|1,0,0]=3 2493 B11R1.178 CC(=O)c1cc[s]c1C(N)=O Amb24387464 [0,0,0,0,2,0|2,0,0]=4 2494 B11R1.178 CC(=O)c1ccoc1C(O)=O Amb24652536 [0,0,0,0,2,0|1,0,0]=3 2495 B11R1.178 CC(=O)c1cocc1C(C)=O Amb24415262 [0,0,0,0,2,0|2,0,0]=4 2496 B11R1.178 CC(=O)c1ncsc1C(=O)O Amb17156970 [0,0,0,0,2,0|2,0,0]=4 2497 B11R1.178 CC(=O)c1o[n]cc1C(O)=O Amb18830931 [0,0,0,0,2,0|2,0,0]=4 2498 B11R1.178 CC(=O)c1occc1C(C)=O Amb24456595 [0,0,0,0,2,0|2,0,0]=4 2499 B11R1.178 CC(=O)c1occc1C(N)=O Amb24078766 [0,0,0,0,2,0|2,0,0]=4 2500 B11R1.178 CC(=O)c1occc1C(O)=O Amb18200885 [0,0,0,0,2,0|1,0,0]=3 2501 B11R1.178 CS(=O)c1c[s]cc1C(O)=O Amb25310935 [0,0,0,0,2,0|2,0,0]=4 2502 B11R1.178 NC(=O)c1c[nH]cc1C(O)=O Amb25242314 [0,0,0,0,2,0|2,0,0]=4 2503 B11R1.178 NC(=O)c1c[s]cc1C(O)=O Amb24742062 [0,0,0,0,2,0|2,0,0]=4 2504 B11R1.178 NC(=O)c1cc[s]c1C(O)=O Amb25321990 [0,0,0,0,2,0|2,0,0]=4 2505 B11R1.178 NC(=O)c1ccoc1C(O)=O Amb24487809 [0,0,0,0,2,0|2,0,0]=4 2506 B11R1.178 NC(=O)c1cocc1C(O)=O Amb24677731 [0,0,0,0,2,0|2,0,0]=4 2507 B11R1.178 OC(=O)c1[nH]ccc1C(=O)O Amb17619732 [0,0,0,0,2,0|2,0,0]=4 2508 B11R1.178 OC(=O)c1c[nH]cc1C(=O)O Amb10610305 [0,0,0,0,2,0|2,0,0]=4 2509 B11R1.178 OC(=O)c1cscc1C(=O)O Amb2447537 [0,0,0,0,2,0|2,0,0]=4 2510 B13R0.179 OC(=O)\C=C\C=C\C=C\C=C\C(O)=O Amb24329280 [0,0,1,0,0,1|2,0,0]=4 2511 B13R1.90 C=Cc1ccccc1OCC(=O)O Amb17594532 [1,0,0,0,0,1|2,0,0]=4 2512 B13R1.90 CC(=C)C#Cc1ccccc1C=O Amb25350348 [1,0,0,0,0,1|2,0,0]=4 2513 B13R1.90 CC(=O)C#Cc1ccccc1CO Amb24584510 [1,0,0,0,0,1|1,0,1]=4 2514 B13R1.90 CC(=O)CNc1ccccc1C=O Amb18127853 [1,0,0,0,0,1|1,0,0]=3 2515 B13R1.90 CC(=O)NCc1ccccc1C=C Amb24724840 [1,0,0,0,0,1|2,0,0]=4 2516 B13R1.90 CC(=O)OCc1ccccc1C#N Amb22047886 [1,0,0,0,0,1|1,0,1]=4 2517 B13R1.90 CC(=O)\C=C\c1ccccc1C=C Amb25807551 [1,0,0,0,0,1|2,0,0]=4 2518 B13R1.90 CC(=O)\C=C\c1ccccc1C=O Amb25201620 [1,0,0,0,0,1|1,0,0]=3 2519 B13R1.90 CC(=O)\C=C\c1ccccc1CO Amb25179632 [1,0,0,0,0,1|1,0,1]=4 2520 B13R1.90 CC(C)=CCc1ccccc1C=O Amb25084739 [1,0,0,0,0,1|2,0,0]=4 2521 B13R1.90 NC(=O)CNc1ccccc1C=O Amb25060224 [1,0,0,0,0,1|2,0,0]=4 2522 B13R1.90 O=Cc1ccccc1C=CC(=O)O Amb17614570 [1,0,0,0,0,1|2,0,0]=4 2523 B13R1.90 OC(=O)CCc1ccccc1C=O Amb24090149 [1,0,0,0,0,1|2,0,0]=4 2524 B13R1.90 OC(=O)CNc1ccccc1C=O Amb18128352 [1,0,0,0,0,1|2,0,0]=4 2525 B13R1.587 CC(=N)Nc1cc(ccc1)C(O)=O Amb25288565 [0,0,0,0,1,1|2,0,0]=4 2526 B13R1.587 CC(=O)Nc1c[n]cc([n]1)C(O)=O Amb25109196 [0,0,0,0,1,1|2,0,0]=4 2527 B13R1.587 CC(=O)Nc1cc([n]cc1)C(O)=O Amb18128563 [0,0,0,0,1,1|2,0,0]=4 2528 B13R1.587 CC(=O)Nc1cc(ccc1)S(O)=O Amb24356669 [0,0,0,0,1,1|2,0,0]=4 2529 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)Br Amb20620399 [0,0,0,0,1,1|2,0,0]=4 2530 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)C Amb1214354 [0,0,0,0,1,1|2,0,0]=4 2531 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)Cl Amb17143176 [0,0,0,0,1,1|2,0,0]=4 2532 B13R1.587 CC(=O)Nc1cccc(c1)C(=O)O Amb1395993 [0,0,0,0,1,1|1,0,0]=3 2533 B13R1.587 CC(=O)Nc1cccc(n1)C(=O)O Amb1235491 [0,0,0,0,1,1|1,0,0]=3 2534 B13R1.587 CC(=O)Nc1cncc(c1)C(=O)O Amb10072094 [0,0,0,0,1,1|2,0,0]=4 2535 B13R1.587 CC(=O)Oc1cc(cc[n]1)C(C)=O Amb24721774 [0,0,0,0,1,1|2,0,0]=4 2536 B13R1.587 CC(=O)Oc1cc(ccc1)B(O)O Amb22035243 [0,0,0,0,1,1|1,0,1]=4 2537 B13R1.587 CC(=O)Oc1cc(ccc1)C(C)O Amb25330842 [0,0,0,0,1,1|1,0,1]=4 2538 B13R1.587 CC(=O)Oc1cc(ccc1)C(N)=O Amb25061217 [0,0,0,0,1,1|1,0,0]=3 2539 B13R1.587 CC(=O)Oc1cc(ccc1)C(N)=S Amb24471863 [0,0,0,0,1,1|1,1,0]=4 2540 B13R1.587 CC(=O)c1cc(CC(C)=O)ccc1 Amb25066433 [0,0,0,0,1,1|2,0,0]=4 2541 B13R1.587 CC(=O)c1cc(ccc1)OC(=O)Cl Amb24613038 [0,0,0,0,1,1|2,0,0]=4 2542 B13R1.587 CC(=O)c1cc(ccc1)OC(N)=O Amb25295310 [0,0,0,0,1,1|2,0,0]=4 2543 B13R1.587 CC(=O)c1cccc(NC(C)=O)[n]1 Amb24364619 [0,0,0,0,1,1|2,0,0]=4 2544 B13R1.587 CC(=S)Nc1cc(ccc1)C(O)=O Amb25188028 [0,0,0,0,1,1|1,1,0]=4 2545 B13R1.587 CC(C)Oc1cccc([n]1)C(O)=O Amb18987762 [0,0,0,0,1,1|1,0,1]=4 2546 B13R1.587 CS(=O)Cc1cccc([n]1)C(O)=O Amb25821541 [0,0,0,0,1,1|2,0,0]=4 2547 B13R1.587 CS(=O)Nc1cc(ccc1)C(O)=O Amb24620387 [0,0,0,0,1,1|2,0,0]=4 2548 B13R1.587 NC(=O)Cc1cc(ccc1)C(O)=O Amb25160571 [0,0,0,0,1,1|2,0,0]=4 2549 B13R1.587 NC(=O)Nc1cccc(c1)C(=O)O Amb1215273 [0,0,0,0,1,1|2,0,0]=4 2550 B13R1.587 OC(=O)c1cc(CC(O)=O)ccc1 Amb18128554 [0,0,0,0,1,1|2,0,0]=4 2551 B13R1.587 OC(=O)c1cc(ccc1)SC(=O)F Amb25075630 [0,0,0,0,1,1|1,1,0]=4 2552 B13R1.587 OC(=O)c1cccc(CC(O)=O)[n]1 Amb25676132 [0,0,0,0,1,1|2,0,0]=4 2553 B15R1.5914 CC(=O)Nc1ccccc1\C=C\C(O)=O Amb22728079 [0,0,0,0,0,2|1,0,0]=3 2554 B15R1.5914 CC(=O)Oc1ccccc1COC(C)=O Amb24092765 [0,0,0,0,0,2|1,0,0]=3 2555 B15R1.5914 CC(C)Oc1ccccc1C#CC(O)=O Amb24338236 [0,0,0,0,0,2|1,0,1]=4 2556 B15R1.5914 NC(=O)COc1ccccc1NC(=O)C Amb1207351 [0,0,0,0,0,2|2,0,0]=4 2557 B15R1.5914 NC(=O)CSc1ccccc1NC(=O)C Amb15703165 [0,0,0,0,0,2|2,0,0]=4 2558 B15R1.5914 NC(=O)Nc1ccccc1OCC(O)=O Amb24080818 [0,0,0,0,0,2|2,0,0]=4 2559 B15R1.5914 OC(=O)COc1ccccc1NC(=O)C Amb1130143 [0,0,0,0,0,2|1,0,0]=3 2560 B15R1.5914 OC(=O)Cc1ccccc1OCC(O)=O Amb24080819 [0,0,0,0,0,2|1,0,0]=3 2561 B15R1.8882 CC(=C)CSCc1ccccc1C(=O)O Amb17498608 [0,0,0,0,0,2|1,1,0]=4 2562 B15R1.8882 CC(=O)O\N=C\c1ccccc1[N+](=O)[O-] Amb2221034 [0,0,0,0,0,2|1,0,1]=4 2563 B15R1.8882 CC(CCOc1ccccc1C(=O)O)C Amb1141182 [0,0,0,0,0,2|1,0,1]=4 2564 B15R1.8882 CN(CCOc1ccccc1C(=O)O)C Amb10608979 [0,0,0,0,0,2|2,0,0]=4 2565 B15R1.8882 CN(CCOc1ccccc1C(=O)O)C Amb1114018 [0,0,0,0,0,2|2,0,0]=4 2566 B15R1.8882 NC(=O)CSCc1ccccc1C(=O)O Amb17497161 [0,0,0,0,0,2|1,1,0]=4 2567 B15R1.8882 OC(=O)CNCc1ccccc1C(O)=O Amb23568200 [0,0,0,0,0,2|2,0,0]=4