0 B12R1.43 C=C(C)C(C)Nc1ccccc1 Amb28368457 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.43 C=C(C)C(N)Cc1ccccc1 Amb28056790 [0,0,0,0,0,0|2,0,0]=2 2 B12R1.43 C=C(C)C(N)Cc1cccnc1 Amb27985470 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.43 C=C(C)[C@@H](N)Cc1ccccc1 Amb28250037 [0,0,0,0,0,0|2,0,0]=2 4 B12R1.43 C=C(Cc1ccccc1)C(=O)Cl Amb27416413 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.43 C=C(Cc1ccccc1)C(=O)O Amb8393733 [0,0,0,0,0,0|1,0,1]=2 6 B12R1.43 C=C(Cc1ccccc1)[N+](=O)[O-] Amb33295355 [0,0,0,0,0,0|2,0,2]=4 7 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [0,0,0,0,0,0|2,0,1]=3 8 B12R1.43 C=C(Cc1ccncc1)C(=O)O Amb27389258 [0,0,0,0,0,0|2,0,1]=3 9 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,0,0,0,0,0|2,0,1]=3 10 B12R1.43 CC(=O)C(=O)Cc1ccccn1 Amb26923275 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.43 CC(=O)C(=O)Cc1cccnc1 Amb24556780 [0,0,0,0,0,0|3,0,1]=4 12 B12R1.43 CC(=O)C(=O)Cc1ccncc1 Amb24555440 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [0,0,0,0,0,0|2,0,0]=2 15 B12R1.43 CC(=O)C(Br)Cc1cncnc1 Amb28137449 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [0,0,0,0,0,0|2,0,0]=2 17 B12R1.43 CC(=O)C(C)Cc1ccccn1 Amb27231621 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.43 CC(=O)C(C)Cc1cccnc1 Amb27960854 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.43 CC(=O)C(C)Cc1cnccn1 Amb35723160 [0,0,0,0,0,0|4,0,0]=4 20 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.43 CC(=O)C(C)Oc1cccnc1 Amb2407640 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [0,0,0,0,0,0|2,0,0]=2 25 B12R1.43 CC(=O)C(Cl)Cc1ccncc1 Amb17507769 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [0,0,0,0,0,0|1,0,0]=1 29 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [0,0,0,0,0,0|1,0,0]=1 30 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.43 CC(=O)N(C)Cc1ccccc1 Amb3886652 [0,0,0,0,0,0|3,0,0]=3 32 B12R1.43 CC(=O)N(C)Cc1ccccn1 Amb27262191 [0,0,0,0,0,0|4,0,0]=4 33 B12R1.43 CC(=O)N(C)Cc1cccnc1 Amb33544307 [0,0,0,0,0,0|4,0,0]=4 34 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.43 CC(=O)[C@@H](C)Cc1cccnc1 Amb27177781 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [0,0,0,0,0,0|1,0,0]=1 37 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [0,0,0,0,0,0|1,0,0]=1 38 B12R1.43 CC(=O)\C(Br)=C\c1ccccc1 Amb17596166 [0,0,0,0,0,0|2,0,2]=4 39 B12R1.43 CC(=O)\C(C)=C\c1ccccc1 Amb17594004 [0,0,0,0,0,0|2,0,2]=4 40 B12R1.43 CC(=O)\C(C)=N\c1ccccc1 Amb24537849 [0,0,0,0,0,0|3,0,1]=4 41 B12R1.43 CC(C)C(N)Cc1ccccc1 Amb17138565 [0,0,0,0,0,0|2,0,1]=3 42 B12R1.43 CC(C)C(N)Cc1ccncc1 Amb18299313 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.43 CC(C)C(O)Cc1ccccc1 Amb17138584 [0,0,0,0,0,0|3,0,1]=4 44 B12R1.43 CC(C)[C@@H](N)Cc1ccccc1 Amb27858881 [0,0,0,0,0,0|2,0,1]=3 45 B12R1.43 CC(C)[C@@H](O)Cc1ccccc1 Amb28244375 [0,0,0,0,0,0|3,0,1]=4 46 B12R1.43 CC(C)[C@H](N)Cc1ccccc1 Amb28127185 [0,0,0,0,0,0|2,0,1]=3 47 B12R1.43 CC(Cc1ccccc1)C(=O)Cl Amb5744098 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,0,0,0,0,0|1,0,0]=1 49 B12R1.43 CC(Cc1ccccc1)C(N)=O Amb2701804 [0,0,0,0,0,0|2,0,0]=2 50 B12R1.43 CC(Cc1ccccc1)[N+](=O)[O-] Amb17689219 [0,0,0,0,0,0|2,0,1]=3 51 B12R1.43 CC(Cc1ccccn1)C(=O)Cl Amb5744095 [0,0,0,0,0,0|3,0,0]=3 52 B12R1.43 CC(Cc1ccccn1)C(=O)O Amb5744008 [0,0,0,0,0,0|2,0,0]=2 53 B12R1.43 CC(Cc1cccnc1)C(=O)Cl Amb5744096 [0,0,0,0,0,0|3,0,0]=3 54 B12R1.43 CC(Cc1cccnc1)C(=O)O Amb5744009 [0,0,0,0,0,0|2,0,0]=2 55 B12R1.43 CC(Cc1cccnc1)C(N)=O Amb28072992 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb33743550 [0,0,0,0,0,0|2,0,0]=2 57 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb5744010 [0,0,0,0,0,0|2,0,0]=2 58 B12R1.43 CC(Cc1ccncn1)C(=O)O Amb7101497 [0,0,0,0,0,0|3,0,0]=3 59 B12R1.43 CC(Cc1cncnc1)C(=O)O Amb24375035 [0,0,0,0,0,0|3,0,0]=3 60 B12R1.43 CC(Cc1cncnn1)C(=O)O Amb27445911 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.43 CC(Cc1ncccn1)C(=O)O Amb7101496 [0,0,0,0,0,0|3,0,0]=3 62 B12R1.43 CC(Cl)C(Cl)Cc1ccccc1 Amb27947452 [0,0,0,0,0,0|3,0,1]=4 63 B12R1.43 CC(F)C(N)Cc1ccccc1 Amb27489717 [0,0,0,0,0,0|2,0,1]=3 64 B12R1.43 CC(N)C(N)Cc1ccccc1 Amb28325649 [0,0,0,0,0,0|2,0,1]=3 65 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb30584971 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [0,0,0,0,0,0|2,0,0]=2 68 B12R1.43 CC(Nc1ccccc1)C(N)=S Amb27955863 [0,0,0,0,0,0|3,1,0]=4 69 B12R1.43 CC(Nc1cccnc1)C(=O)O Amb18270393 [0,0,0,0,0,0|3,0,0]=3 70 B12R1.43 CC(Nc1cccnc1)C(N)=O Amb27831365 [0,0,0,0,0,0|4,0,0]=4 71 B12R1.43 CC(Nc1cccnn1)C(=O)O Amb18991526 [0,0,0,0,0,0|4,0,0]=4 72 B12R1.43 CC(Nc1ccnnc1)C(=O)O Amb25261344 [0,0,0,0,0,0|4,0,0]=4 73 B12R1.43 CC(Nc1ccnnc1)C(=O)O Amb32752692 [0,0,0,0,0,0|4,0,0]=4 74 B12R1.43 CC(Nc1ncccn1)C(=O)O Amb2372391 [0,0,0,0,0,0|4,0,0]=4 75 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,0,0,0,0,0|2,0,2]=4 76 B12R1.43 CC(O)C(C)Cc1ccccc1 Amb17232485 [0,0,0,0,0,0|2,0,1]=3 77 B12R1.43 CC(O)C(C)Cc1ccccn1 Amb24341829 [0,0,0,0,0,0|3,0,1]=4 78 B12R1.43 CC(O)C(C)Cc1cccnc1 Amb27630237 [0,0,0,0,0,0|3,0,1]=4 79 B12R1.43 CC(O)C(C)Cc1ccncc1 Amb25710238 [0,0,0,0,0,0|3,0,1]=4 80 B12R1.43 CC(O)C(C)Oc1ccccc1 Amb18801039 [0,0,0,0,0,0|3,0,1]=4 81 B12R1.43 CC(O)C(C)Sc1ccccc1 Amb27165940 [0,0,0,0,0,0|3,0,1]=4 82 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,0,0,0,0,0|1,0,1]=2 83 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb32661717 [0,0,0,0,0,0|1,0,1]=2 84 B12R1.43 CC(O)C(O)Cc1ccccn1 Amb28281194 [0,0,0,0,0,0|3,0,1]=4 85 B12R1.43 CC(O)[C@@H](C)Cc1cccnc1 Amb28455142 [0,0,0,0,0,0|3,0,1]=4 86 B12R1.43 CC(O)[C@H](C)Cc1ccccc1 Amb27761643 [0,0,0,0,0,0|2,0,1]=3 87 B12R1.43 CC(Oc1ccccc1)C(=O)Cl Amb3939464 [0,0,0,0,0,0|3,0,0]=3 88 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [0,0,0,0,0,0|2,0,0]=2 89 B12R1.43 CC(Oc1ccccc1)C(N)=O Amb3886659 [0,0,0,0,0,0|3,0,0]=3 90 B12R1.43 CC(Oc1ccccc1)C(N)=S Amb17233851 [0,0,0,0,0,0|3,1,0]=4 91 B12R1.43 CC(Oc1ccccc1)[C@@H](C)O Amb27238389 [0,0,0,0,0,0|3,0,1]=4 92 B12R1.43 CC(Oc1ccccc1)[C@H](C)O Amb27876377 [0,0,0,0,0,0|3,0,1]=4 93 B12R1.43 CC(Oc1ccccn1)C(=O)O Amb26054640 [0,0,0,0,0,0|3,0,0]=3 94 B12R1.43 CC(Oc1cccnc1)C(=O)O Amb9783585 [0,0,0,0,0,0|3,0,0]=3 95 B12R1.43 CC(Sc1ccccc1)C(=O)Cl Amb17143250 [0,0,0,0,0,0|3,0,0]=3 96 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [0,0,0,0,0,0|2,0,0]=2 97 B12R1.43 CC(Sc1ccccc1)C(N)=O Amb10665761 [0,0,0,0,0,0|3,0,0]=3 98 B12R1.43 CC(Sc1ccccn1)C(=O)O Amb9710966 [0,0,0,0,0,0|3,0,0]=3 99 B12R1.43 CC(Sc1ccccn1)C(N)=O Amb13953849 [0,0,0,0,0,0|4,0,0]=4 100 B12R1.43 CC(Sc1ccncc1)C(=O)O Amb6265772 [0,0,0,0,0,0|3,0,0]=3 101 B12R1.43 CC(Sc1ccncc1)C(N)=O Amb27652645 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.43 CC(Sc1ncccn1)C(=O)O Amb9720856 [0,0,0,0,0,0|4,0,0]=4 103 B12R1.43 CN(Cc1ccccc1)C(=N)N Amb4476991 [0,0,0,0,0,0|4,0,0]=4 104 B12R1.43 CN(Cc1ccccc1)C(=N)N Amb8503406 [0,0,0,0,0,0|4,0,0]=4 105 B12R1.43 CN(Cc1ccccc1)C(=O)Cl Amb17563090 [0,0,0,0,0,0|3,0,0]=3 106 B12R1.43 CN(Cc1ccccc1)C(N)=O Amb6250028 [0,0,0,0,0,0|3,0,0]=3 107 B12R1.43 CN(Cc1ccccc1)C(N)=S Amb6251792 [0,0,0,0,0,0|3,1,0]=4 108 B12R1.43 CN(Cc1ccccn1)C(=O)Cl Amb27639695 [0,0,0,0,0,0|4,0,0]=4 109 B12R1.43 CN(Cc1ccncc1)C(=O)Cl Amb24357639 [0,0,0,0,0,0|4,0,0]=4 110 B12R1.43 CN(O)C(=O)Cc1ccccc1 Amb27622562 [0,0,0,0,0,0|3,0,1]=4 111 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,0,0,0,0,0|1,0,0]=1 112 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,0,0,0,0,0|4,0,0]=4 113 B12R1.43 C[C@@H](Cc1ccccn1)C(=O)O Amb10843999 [0,0,0,0,0,0|2,0,0]=2 114 B12R1.43 C[C@@H](Cc1cccnc1)C(=O)O Amb10844005 [0,0,0,0,0,0|2,0,0]=2 115 B12R1.43 C[C@@H](Cc1ccncc1)C(=O)O Amb10844007 [0,0,0,0,0,0|2,0,0]=2 116 B12R1.43 C[C@@H](N)C(O)Cc1ccccc1 Amb35618099 [0,0,0,0,0,0|3,0,1]=4 117 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [0,0,0,0,0,0|2,0,0]=2 118 B12R1.43 C[C@@H](Nc1ncccn1)C(=O)O Amb24707746 [0,0,0,0,0,0|4,0,0]=4 119 B12R1.43 C[C@@H](O)[C@H](O)Cc1ccccc1 Amb28401092 [0,0,0,0,0,0|2,0,1]=3 120 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [0,0,0,0,0,0|2,0,0]=2 121 B12R1.43 C[C@@H](Oc1cccnc1)C(=O)O Amb28288991 [0,0,0,0,0,0|3,0,0]=3 122 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [0,0,0,0,0,0|2,0,0]=2 123 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,0,0,0,0,0|1,0,0]=1 124 B12R1.43 C[C@H](Cc1ccccc1)C(N)=O Amb28319376 [0,0,0,0,0,0|2,0,0]=2 125 B12R1.43 C[C@H](Cc1ccccn1)C(=O)O Amb10843998 [0,0,0,0,0,0|2,0,0]=2 126 B12R1.43 C[C@H](Cc1cccnc1)C(=O)O Amb10844004 [0,0,0,0,0,0|2,0,0]=2 127 B12R1.43 C[C@H](Cc1ccncc1)C(=O)O Amb10844006 [0,0,0,0,0,0|2,0,0]=2 128 B12R1.43 C[C@H](N)C(O)Cc1ccccc1 Amb35738417 [0,0,0,0,0,0|3,0,1]=4 129 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [0,0,0,0,0,0|2,0,0]=2 130 B12R1.43 C[C@H](Nc1ccccc1)[C@@H](C)O Amb27225799 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.43 C[C@H](Nc1ccnnc1)C(=O)O Amb26542122 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.43 C[C@H](Nc1ccnnc1)C(=O)O Amb32668107 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.43 C[C@H](O)[C@@H](C)Cc1ccccc1 Amb27207474 [0,0,0,0,0,0|2,0,1]=3 134 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [0,0,0,0,0,0|2,0,0]=2 135 B12R1.43 C[C@H](Oc1ccccc1)C(N)=O Amb27431501 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.43 C[C@H](Oc1cccnc1)C(=O)O Amb28197526 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.43 C\C(=C/c1ccccc1)C(=O)Cl Amb24061289 [0,0,0,0,0,0|2,0,2]=4 138 B12R1.43 C\C(=C/c1ccccc1)C(=O)O Amb8513246 [0,0,0,0,0,0|1,0,2]=3 139 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb30584914 [0,0,0,0,0,0|2,0,2]=4 140 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb33995393 [0,0,0,0,0,0|2,0,2]=4 141 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb30584915 [0,0,0,0,0,0|2,0,2]=4 142 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb5743927 [0,0,0,0,0,0|2,0,2]=4 143 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb30584913 [0,0,0,0,0,0|2,0,2]=4 144 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb5743928 [0,0,0,0,0,0|2,0,2]=4 145 B12R1.43 C\C(=C\c1ccccc1)C(=O)O Amb24603461 [0,0,0,0,0,0|1,0,2]=3 146 B12R1.43 C\C(=C\c1cccnc1)C(=O)O Amb27837141 [0,0,0,0,0,0|2,0,2]=4 147 B12R1.43 C\C(=C\c1ccncc1)C(=O)O Amb27882270 [0,0,0,0,0,0|2,0,2]=4 148 B12R1.43 N=C(N)C(=O)Cc1ccccc1 Amb27257229 [0,0,0,0,0,0|3,0,1]=4 149 B12R1.43 N=C(N)C(N)Cc1ccccc1 Amb27813157 [0,0,0,0,0,0|2,0,0]=2 150 B12R1.43 N=C(N)C(O)Cc1ccccc1 Amb28137730 [0,0,0,0,0,0|3,0,0]=3 151 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [0,0,0,0,0,0|1,0,2]=3 152 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [0,0,0,0,0,0|2,0,1]=3 153 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,0,0,0,0,0|3,0,1]=4 154 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [0,0,0,0,0,0|3,0,1]=4 155 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [0,0,0,0,0,0|3,0,1]=4 156 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,0,0,0,0,0|2,0,0]=2 157 B12R1.43 NC(=O)C(Cl)Cc1ccccc1 Amb17204334 [0,0,0,0,0,0|2,0,0]=2 158 B12R1.43 NC(=O)C(Cl)Cc1cccnc1 Amb27978950 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.43 NC(=O)C(F)Sc1ccccc1 Amb27865643 [0,0,0,0,0,0|3,0,0]=3 160 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,0,0,0,0,0|1,0,0]=1 161 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb9727200 [0,0,0,0,0,0|1,0,0]=1 162 B12R1.43 NC(=O)C(N)Cc1ccccn1 Amb25873185 [0,0,0,0,0,0|2,0,0]=2 163 B12R1.43 NC(=O)C(N)Cc1cccnc1 Amb26475758 [0,0,0,0,0,0|2,0,0]=2 164 B12R1.43 NC(=O)C(N)Cc1cccnn1 Amb33065669 [0,0,0,0,0,0|3,0,0]=3 165 B12R1.43 NC(=O)C(N)Cc1ccncc1 Amb27153397 [0,0,0,0,0,0|2,0,0]=2 166 B12R1.43 NC(=O)C(N)Cc1ccncn1 Amb33065607 [0,0,0,0,0,0|3,0,0]=3 167 B12R1.43 NC(=O)C(N)Cc1ccnnc1 Amb33230890 [0,0,0,0,0,0|3,0,0]=3 168 B12R1.43 NC(=O)C(N)Cc1cnccn1 Amb33065713 [0,0,0,0,0,0|3,0,0]=3 169 B12R1.43 NC(=O)C(N)Cc1ncccn1 Amb26949419 [0,0,0,0,0,0|3,0,0]=3 170 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,0,0,0,0,0|2,0,0]=2 171 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,0,0,0,0,0|2,0,0]=2 172 B12R1.43 NC(=O)C(S)Cc1ccccc1 Amb27663190 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.43 NC(=O)N(O)Cc1ccccc1 Amb27966850 [0,0,0,0,0,0|3,0,0]=3 174 B12R1.43 NC(=O)N(O)Cc1ccccn1 Amb27657600 [0,0,0,0,0,0|4,0,0]=4 175 B12R1.43 NC(=O)[C@@H](Br)Cc1ccccc1 Amb27240179 [0,0,0,0,0,0|2,0,0]=2 176 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb6295777 [0,0,0,0,0,0|1,0,0]=1 177 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb9825510 [0,0,0,0,0,0|1,0,0]=1 178 B12R1.43 NC(=O)[C@@H](N)Cc1ccccn1 Amb30527600 [0,0,0,0,0,0|2,0,0]=2 179 B12R1.43 NC(=O)[C@@H](O)Cc1ccccc1 Amb26371653 [0,0,0,0,0,0|2,0,0]=2 180 B12R1.43 NC(=O)[C@H](Cl)Cc1ccccc1 Amb28385619 [0,0,0,0,0,0|2,0,0]=2 181 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb16183950 [0,0,0,0,0,0|1,0,0]=1 182 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb33800758 [0,0,0,0,0,0|1,0,0]=1 183 B12R1.43 NC(=O)[C@H](N)Cc1ccncc1 Amb27840691 [0,0,0,0,0,0|2,0,0]=2 184 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,0,0,0,0,0|2,0,0]=2 185 B12R1.43 NC(=O)\C(Cl)=C\c1ccccc1 Amb3724521 [0,0,0,0,0,0|2,0,2]=4 186 B12R1.43 NC(=S)C(O)Cc1ccccc1 Amb27398697 [0,0,0,0,0,0|2,1,0]=3 187 B12R1.43 NC(CC1=CCCCC1)C(=O)O Amb22233021 [0,0,0,0,0,0|0,0,4]=4 188 B12R1.43 NC(CC1=COCCC1)C(=O)O Amb33416022 [0,0,0,0,0,0|1,0,3]=4 189 B12R1.43 NC(CC1CC=CCC1)C(=O)O Amb26371532 [0,0,0,0,0,0|0,0,4]=4 190 B12R1.43 NC(CN1CC=CCC1)C(=O)O Amb27389896 [0,0,0,0,0,0|1,0,3]=4 191 B12R1.43 NC(Cc1ccccc1)B(O)O Amb27659344 [0,0,0,0,0,0|1,0,1]=2 192 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,0,0,0,0,0|0,0,0]=0 193 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,0,0,0,0,0|0,0,0]=0 194 B12R1.43 NC(Cc1ccccc1)C(F)F Amb8391888 [0,0,0,0,0,0|2,0,1]=3 195 B12R1.43 NC(Cc1ccccc1)[PH](=O)O Amb27254109 [0,0,0,0,0,0|1,0,0]=1 196 B12R1.43 NC(Cc1ccccn1)C(=O)O Amb22234042 [0,0,0,0,0,0|1,0,0]=1 197 B12R1.43 NC(Cc1ccccn1)C(=O)O Amb3788186 [0,0,0,0,0,0|1,0,0]=1 198 B12R1.43 NC(Cc1ccccn1)C(F)F Amb28069901 [0,0,0,0,0,0|3,0,1]=4 199 B12R1.43 NC(Cc1cccnc1)C(=O)O Amb22301544 [0,0,0,0,0,0|1,0,0]=1 200 B12R1.43 NC(Cc1cccnc1)C(=O)O Amb3788187 [0,0,0,0,0,0|1,0,0]=1 201 B12R1.43 NC(Cc1cccnc1)C(F)F Amb27155590 [0,0,0,0,0,0|3,0,1]=4 202 B12R1.43 NC(Cc1cccnn1)C(=O)O Amb18827268 [0,0,0,0,0,0|2,0,0]=2 203 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb22728340 [0,0,0,0,0,0|1,0,0]=1 204 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb32661063 [0,0,0,0,0,0|1,0,0]=1 205 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb3788185 [0,0,0,0,0,0|1,0,0]=1 206 B12R1.43 NC(Cc1ccncc1)C(F)F Amb25733681 [0,0,0,0,0,0|3,0,1]=4 207 B12R1.43 NC(Cc1ccncn1)C(=O)O Amb19000856 [0,0,0,0,0,0|2,0,0]=2 208 B12R1.43 NC(Cc1ccncn1)C(=O)O Amb30584876 [0,0,0,0,0,0|2,0,0]=2 209 B12R1.43 NC(Cc1ccnnc1)C(=O)O Amb26517405 [0,0,0,0,0,0|2,0,0]=2 210 B12R1.43 NC(Cc1ccnnc1)C(=O)O Amb32682327 [0,0,0,0,0,0|2,0,0]=2 211 B12R1.43 NC(Cc1cnccn1)C(=O)O Amb19000859 [0,0,0,0,0,0|2,0,0]=2 212 B12R1.43 NC(Cc1cncnc1)C(=O)O Amb18302429 [0,0,0,0,0,0|2,0,0]=2 213 B12R1.43 NC(Cc1cncnc1)C(=O)O Amb35789114 [0,0,0,0,0,0|2,0,0]=2 214 B12R1.43 NC(Cc1cnncn1)C(=O)O Amb18826715 [0,0,0,0,0,0|3,0,0]=3 215 B12R1.43 NC(Cc1ncccn1)C(=O)O Amb18995251 [0,0,0,0,0,0|2,0,0]=2 216 B12R1.43 NC(Cc1ncccn1)C(=O)O Amb28555732 [0,0,0,0,0,0|2,0,0]=2 217 B12R1.43 N[C@@H](CC1=CCC=CC1)C(=O)O Amb24080592 [0,0,0,0,0,0|0,0,2]=2 218 B12R1.43 N[C@@H](CC1=CCCCC1)C(=O)O Amb26874843 [0,0,0,0,0,0|0,0,4]=4 219 B12R1.43 N[C@@H](CC1CC=CCC1)C(=O)O Amb30011954 [0,0,0,0,0,0|0,0,4]=4 220 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,0,0,0,0,0|1,0,1]=2 221 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)Cl Amb27955901 [0,0,0,0,0,0|1,0,0]=1 222 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,0,0,0,0,0|0,0,0]=0 223 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,0,0,0,0,0|0,0,0]=0 224 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)S Amb27407796 [0,0,0,0,0,0|0,1,0]=1 225 B12R1.43 N[C@@H](Cc1ccccc1)C(F)F Amb27958847 [0,0,0,0,0,0|2,0,1]=3 226 B12R1.43 N[C@@H](Cc1ccccn1)C(=O)O Amb8629055 [0,0,0,0,0,0|1,0,0]=1 227 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb16231985 [0,0,0,0,0,0|1,0,0]=1 228 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb22008701 [0,0,0,0,0,0|1,0,0]=1 229 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb8395968 [0,0,0,0,0,0|1,0,0]=1 230 B12R1.43 N[C@@H](Cc1cccnn1)C(=O)O Amb33066308 [0,0,0,0,0,0|2,0,0]=2 231 B12R1.43 N[C@@H](Cc1ccncc1)C(=O)O Amb22745959 [0,0,0,0,0,0|1,0,0]=1 232 B12R1.43 N[C@@H](Cc1ccncc1)C(=O)O Amb2699212 [0,0,0,0,0,0|1,0,0]=1 233 B12R1.43 N[C@@H](Cc1ccncn1)C(=O)O Amb26025848 [0,0,0,0,0,0|2,0,0]=2 234 B12R1.43 N[C@@H](Cc1cnccn1)C(=O)O Amb22801697 [0,0,0,0,0,0|2,0,0]=2 235 B12R1.43 N[C@@H](Cc1cncnc1)C(=O)O Amb19149168 [0,0,0,0,0,0|2,0,0]=2 236 B12R1.43 N[C@@H](Cc1ncccn1)C(=O)O Amb24524889 [0,0,0,0,0,0|2,0,0]=2 237 B12R1.43 N[C@H](CC1CC=CCC1)C(=O)O Amb30011934 [0,0,0,0,0,0|0,0,4]=4 238 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,0,0,0,0,0|0,0,0]=0 239 B12R1.43 N[C@H](Cc1ccccn1)C(=O)O Amb8390365 [0,0,0,0,0,0|1,0,0]=1 240 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb19930749 [0,0,0,0,0,0|1,0,0]=1 241 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb22008700 [0,0,0,0,0,0|1,0,0]=1 242 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb6295898 [0,0,0,0,0,0|1,0,0]=1 243 B12R1.43 N[C@H](Cc1cccnn1)C(=O)O Amb33127536 [0,0,0,0,0,0|2,0,0]=2 244 B12R1.43 N[C@H](Cc1ccncc1)C(=O)O Amb19944301 [0,0,0,0,0,0|1,0,0]=1 245 B12R1.43 N[C@H](Cc1ccncc1)C(=O)O Amb6336423 [0,0,0,0,0,0|1,0,0]=1 246 B12R1.43 N[C@H](Cc1ccncn1)C(=O)O Amb26876190 [0,0,0,0,0,0|2,0,0]=2 247 B12R1.43 N[C@H](Cc1cnccn1)C(=O)O Amb24671229 [0,0,0,0,0,0|2,0,0]=2 248 B12R1.43 N[C@H](Cc1ncccn1)C(=O)O Amb27593543 [0,0,0,0,0,0|2,0,0]=2 249 B12R1.43 N\C(=C/c1ccccc1)C(=O)O Amb24081025 [0,0,0,0,0,0|0,0,2]=2 250 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [0,0,0,0,0,0|2,0,2]=4 251 B12R1.43 N\C(=C\c1ccccc1)C(=O)O Amb27148014 [0,0,0,0,0,0|0,0,2]=2 252 B12R1.43 N\C(=C\c1ccccn1)C(=O)O Amb27770994 [0,0,0,0,0,0|1,0,2]=3 253 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [0,0,0,0,0,0|2,0,2]=4 254 B12R1.43 O=C(Br)C(Br)Cc1ccccc1 Amb27840480 [0,0,0,0,0,0|2,0,0]=2 255 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,0,0,0,0,0|2,0,0]=2 256 B12R1.43 O=C(Cl)C(F)Cc1ccccc1 Amb27615534 [0,0,0,0,0,0|2,0,0]=2 257 B12R1.43 O=C(Cl)C(O)Cc1ccccc1 Amb27632817 [0,0,0,0,0,0|2,0,0]=2 258 B12R1.43 O=C(Cl)\C(F)=C/c1ccccc1 Amb27416385 [0,0,0,0,0,0|2,0,2]=4 259 B12R1.43 O=C(O)C(=O)C[n+]1ccccc1 Amb28287668 [0,0,0,0,0,0|2,0,1]=3 260 B12R1.43 O=C(O)C(=O)Cc1ccccc1 Amb2718694 [0,0,0,0,0,0|1,0,1]=2 261 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb17477815 [0,0,0,0,0,0|2,0,1]=3 262 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb32952891 [0,0,0,0,0,0|2,0,1]=3 263 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [0,0,0,0,0,0|2,0,1]=3 264 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [0,0,0,0,0,0|2,0,1]=3 265 B12R1.43 O=C(O)C(=O)Cc1ccncn1 Amb27870498 [0,0,0,0,0,0|3,0,1]=4 266 B12R1.43 O=C(O)C(=O)Cc1cnccn1 Amb33360026 [0,0,0,0,0,0|3,0,1]=4 267 B12R1.43 O=C(O)C(=O)Cc1cncnc1 Amb26564641 [0,0,0,0,0,0|3,0,1]=4 268 B12R1.43 O=C(O)C(=O)Cc1ncccn1 Amb33270697 [0,0,0,0,0,0|3,0,1]=4 269 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [0,0,0,0,0,0|2,0,1]=3 270 B12R1.43 O=C(O)C(=O)Nc1ccccn1 Amb9303802 [0,0,0,0,0,0|3,0,1]=4 271 B12R1.43 O=C(O)C(=O)Nc1cccnc1 Amb9303807 [0,0,0,0,0,0|3,0,1]=4 272 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [0,0,0,0,0,0|3,0,1]=4 273 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [0,0,0,0,0,0|2,0,1]=3 274 B12R1.43 O=C(O)C(=S)Oc1ccccc1 Amb27484078 [0,0,0,0,0,0|2,0,1]=3 275 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,0,0,0,0,0|1,0,0]=1 276 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,0,0,0,0,0|1,0,0]=1 277 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [0,0,0,0,0,0|2,0,0]=2 278 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,0,0,0,0,0|1,0,0]=1 279 B12R1.43 O=C(O)C(F)Cc1ccncc1 Amb27946336 [0,0,0,0,0,0|2,0,0]=2 280 B12R1.43 O=C(O)C(F)Cc1cnccn1 Amb35600951 [0,0,0,0,0,0|3,0,0]=3 281 B12R1.43 O=C(O)C(F)Cc1cncnc1 Amb27785706 [0,0,0,0,0,0|3,0,0]=3 282 B12R1.43 O=C(O)C(F)Sc1ccccn1 Amb28125192 [0,0,0,0,0,0|3,0,0]=3 283 B12R1.43 O=C(O)C(F)Sc1ccncn1 Amb28370340 [0,0,0,0,0,0|4,0,0]=4 284 B12R1.43 O=C(O)C(F)Sc1ncccn1 Amb2407790 [0,0,0,0,0,0|4,0,0]=4 285 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,0,0,0,0,0|1,0,0]=1 286 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb17138619 [0,0,0,0,0,0|2,0,0]=2 287 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb35750904 [0,0,0,0,0,0|2,0,0]=2 288 B12R1.43 O=C(O)C(O)Cc1cccnc1 Amb2699798 [0,0,0,0,0,0|2,0,0]=2 289 B12R1.43 O=C(O)C(O)Cc1ccncc1 Amb17138620 [0,0,0,0,0,0|2,0,0]=2 290 B12R1.43 O=C(O)C(O)Cc1ccncn1 Amb33353381 [0,0,0,0,0,0|3,0,0]=3 291 B12R1.43 O=C(O)C(O)Cc1cnccn1 Amb33353471 [0,0,0,0,0,0|3,0,0]=3 292 B12R1.43 O=C(O)C(O)Cc1cncnc1 Amb25722221 [0,0,0,0,0,0|3,0,0]=3 293 B12R1.43 O=C(O)C(O)Cc1ncccn1 Amb26934951 [0,0,0,0,0,0|3,0,0]=3 294 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [0,0,0,0,0,0|2,0,0]=2 295 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,0,0,0,0,0|1,0,0]=1 296 B12R1.43 O=C(O)C(S)Cc1cnccn1 Amb35602917 [0,0,0,0,0,0|3,0,0]=3 297 B12R1.43 O=C(O)C(S)Cc1cncnc1 Amb27847788 [0,0,0,0,0,0|3,0,0]=3 298 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,0,0,0,0,0|1,0,0]=1 299 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,0,0,0,0,0|1,0,0]=1 300 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,0,0,0,0,0|1,0,0]=1 301 B12R1.43 O=C(O)[C@@H](O)Cc1cccnc1 Amb27878615 [0,0,0,0,0,0|2,0,0]=2 302 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,0,0,0,0,0|1,0,0]=1 303 B12R1.43 O=C(O)[C@H](O)Cc1ccccn1 Amb27165660 [0,0,0,0,0,0|2,0,0]=2 304 B12R1.43 O=C(O)\C(Br)=C\c1ccccc1 Amb2794045 [0,0,0,0,0,0|1,0,2]=3 305 B12R1.43 O=C(O)\C(Cl)=C/c1ccccc1 Amb18648695 [0,0,0,0,0,0|1,0,2]=3 306 B12R1.43 O=C(O)\C(Cl)=C\c1ccccc1 Amb19651416 [0,0,0,0,0,0|1,0,2]=3 307 B12R1.43 O=C(O)\C(Cl)=C\c1cccnc1 Amb26448364 [0,0,0,0,0,0|2,0,2]=4 308 B12R1.43 O=C(O)\C(F)=C\c1ccccc1 Amb24093652 [0,0,0,0,0,0|1,0,2]=3 309 B12R1.43 O=C(O)\C(F)=C\c1ccccn1 Amb27977069 [0,0,0,0,0,0|2,0,2]=4 310 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb17614474 [0,0,0,0,0,0|2,0,2]=4 311 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb31339126 [0,0,0,0,0,0|2,0,2]=4 312 B12R1.43 O=C(O)\C(S)=C/c1ccccc1 Amb2550972 [0,0,0,0,0,0|1,0,2]=3 313 B12R1.43 O=C(O)\C(S)=C\c1ccccc1 Amb1250109 [0,0,0,0,0,0|1,0,2]=3 314 B12R1.43 O=C(O)\C(S)=C\c1ccccn1 Amb1761004 [0,0,0,0,0,0|2,0,2]=4 315 B12R1.43 O=C(O)\C(S)=C\c1ccncc1 Amb1761003 [0,0,0,0,0,0|2,0,2]=4 316 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb19884048 [0,0,0,0,0,0|1,0,2]=3 317 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb6365780 [0,0,0,0,0,0|1,0,2]=3 318 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb8393076 [0,0,0,0,0,0|1,0,2]=3 319 B12R1.43 O=C([O-])C(O)Cc1ccccc1 Amb33513053 [0,0,0,0,0,0|1,0,1]=2 320 B12R1.43 O=[N+]([O-])C(Br)Cc1ccccc1 Amb27755505 [0,0,0,0,0,0|2,0,1]=3 321 B12R1.43 O=[N+]([O-])C(F)Cc1ccccc1 Amb25996677 [0,0,0,0,0,0|2,0,1]=3 322 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,0,0,0,0,0|3,0,1]=4 323 B12R1.43 O[C@H](Cc1ccccc1)[C@H](F)Cl Amb27392395 [0,0,0,0,0,0|3,0,1]=4 324 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [1,0,0,0,0,0|2,0,1]=4 325 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [1,0,0,0,0,0|2,0,1]=4 326 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [1,0,0,0,0,0|1,0,1]=3 327 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [1,0,0,0,0,0|1,0,1]=3 328 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [1,0,0,0,0,0|2,0,0]=3 330 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [1,0,0,0,0,0|2,0,0]=3 331 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [1,0,0,0,0,0|2,0,0]=3 333 B11R1.40 C=CC(N)Cc1cccnc1 Amb27196336 [1,0,0,0,0,0|2,0,0]=3 334 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,0,0,0,0,0|2,0,0]=3 335 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [1,0,0,0,0,0|3,0,0]=4 337 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [1,0,0,0,0,0|1,0,0]=2 338 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [1,0,0,0,0,0|1,0,0]=2 341 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [1,0,0,0,0,0|2,0,0]=3 342 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [1,0,0,0,0,0|2,0,0]=3 343 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [1,0,0,0,0,0|2,0,0]=3 344 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [1,0,0,0,0,0|2,0,0]=3 345 B11R1.40 CC(C=O)Sc1ccccn1 Amb35652165 [1,0,0,0,0,0|3,0,0]=4 346 B11R1.40 CC(C=O)Sc1ccncc1 Amb35652166 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,0,0,0,0,0|2,0,1]=4 348 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [1,0,0,0,0,0|2,0,1]=4 349 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [1,0,0,0,0,0|2,0,1]=4 351 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [1,0,0,0,0,0|1,0,1]=3 352 B11R1.40 CC(CO)Cc1ccccn1 Amb33745069 [1,0,0,0,0,0|2,0,1]=4 353 B11R1.40 CC(CO)Cc1cccnc1 Amb28350489 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.40 CC(CO)Cc1ccncc1 Amb25374015 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [1,0,0,0,0,0|1,0,1]=3 363 B11R1.40 CCC(N)Cc1ccccn1 Amb7772139 [1,0,0,0,0,0|2,0,1]=4 364 B11R1.40 CCC(N)Cc1cccnc1 Amb9428899 [1,0,0,0,0,0|2,0,1]=4 365 B11R1.40 CCC(N)Cc1ccncc1 Amb9428894 [1,0,0,0,0,0|2,0,1]=4 366 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [1,0,0,0,0,0|2,0,1]=4 367 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [1,0,0,0,0,0|2,0,1]=4 368 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [1,0,0,0,0,0|2,0,1]=4 369 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,0,0,0,0,0|1,0,1]=3 370 B11R1.40 CC[C@@H](N)Cc1ccccn1 Amb27471046 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.40 CC[C@@H](N)Cc1ccncc1 Amb27945734 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,0,0,0,0,0|1,0,1]=3 375 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [1,0,0,0,0,0|2,0,0]=3 377 B11R1.40 CN(C=O)Cc1ccncc1 Amb27262023 [1,0,0,0,0,0|3,0,0]=4 378 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [1,0,0,0,0,0|3,0,0]=4 381 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [1,0,0,0,0,0|2,0,0]=3 384 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [1,0,0,0,0,0|1,0,1]=3 388 B11R1.40 C[C@@H](CO)Cc1ccccn1 Amb33735563 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.40 C[C@@H](CO)Cc1cccnc1 Amb33741020 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.40 C[C@@H](CO)Cc1ccncc1 Amb33735386 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,0,0,0,0,0|1,0,1]=3 393 B11R1.40 C[C@H](CO)Cc1ccccn1 Amb33730468 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.40 C[C@H](CO)Cc1cccnc1 Amb33737852 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.40 C[C@H](CO)Cc1ccncc1 Amb33730461 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.40 C[SiH](CO)Cc1ccccc1 Amb27981860 [1,0,0,0,0,0|1,1,1]=4 398 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [1,0,0,0,0,0|1,0,2]=4 399 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [1,0,0,0,0,0|2,0,1]=4 400 B11R1.40 Cl\C=C(\Cl)Cc1ccccc1 Amb27657562 [1,0,0,0,0,0|2,0,1]=4 401 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,0,0,0,0,0|2,0,1]=4 402 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [1,0,0,0,0,0|2,0,1]=4 403 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [1,0,0,0,0,0|1,0,1]=3 405 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [1,0,0,0,0,0|1,0,1]=3 406 B11R1.40 N#CC(N)Cc1ccccn1 Amb23557153 [1,0,0,0,0,0|2,0,1]=4 407 B11R1.40 N#CC(N)Cc1ccncc1 Amb23557155 [1,0,0,0,0,0|2,0,1]=4 408 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [1,0,0,0,0,0|1,0,1]=3 409 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [1,0,0,0,0,0|1,0,1]=3 410 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,0,0,0,0,0|1,0,2]=4 411 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [1,0,0,0,0,0|1,0,1]=3 412 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [1,0,0,0,0,0|1,0,1]=3 413 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [1,0,0,0,0,0|0,0,1]=2 414 B11R1.40 NC(CO)Cc1ccccn1 Amb17062682 [1,0,0,0,0,0|1,0,1]=3 415 B11R1.40 NC(CO)Cc1ccccn1 Amb32729336 [1,0,0,0,0,0|1,0,1]=3 416 B11R1.40 NC(CO)Cc1ccccn1 Amb32729407 [1,0,0,0,0,0|1,0,1]=3 417 B11R1.40 NC(CO)Cc1cccnc1 Amb17062683 [1,0,0,0,0,0|1,0,1]=3 418 B11R1.40 NC(CO)Cc1cccnc1 Amb28872296 [1,0,0,0,0,0|1,0,1]=3 419 B11R1.40 NC(CO)Cc1cccnc1 Amb32729349 [1,0,0,0,0,0|1,0,1]=3 420 B11R1.40 NC(CO)Cc1ccncc1 Amb17062684 [1,0,0,0,0,0|1,0,1]=3 421 B11R1.40 NC(CO)Cc1ccncc1 Amb28872297 [1,0,0,0,0,0|1,0,1]=3 422 B11R1.40 NC(CO)Cc1ccncc1 Amb32729350 [1,0,0,0,0,0|1,0,1]=3 423 B11R1.40 NC(CO)Cc1ccncn1 Amb24099661 [1,0,0,0,0,0|2,0,1]=4 424 B11R1.40 NC(CO)Cc1ccnnc1 Amb33230897 [1,0,0,0,0,0|2,0,1]=4 425 B11R1.40 NC(CO)Cc1cnccn1 Amb25972735 [1,0,0,0,0,0|2,0,1]=4 426 B11R1.40 NC(CO)Cc1cncnc1 Amb25963732 [1,0,0,0,0,0|2,0,1]=4 427 B11R1.40 NC(CO)Cc1ncccn1 Amb26016013 [1,0,0,0,0,0|2,0,1]=4 428 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [1,0,0,0,0,0|0,1,1]=3 429 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [1,0,0,0,0,0|1,0,1]=3 430 B11R1.40 NCC(N)Cc1ccccn1 Amb27176304 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [1,0,0,0,0,0|2,0,1]=4 432 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [1,0,0,0,0,0|1,0,1]=3 434 B11R1.40 NC[C@@H](N)Cc1ccccn1 Amb27390029 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,0,0,0,0,0|2,0,1]=4 436 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [1,0,0,0,0,0|2,0,1]=4 437 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [1,0,0,0,0,0|1,0,1]=3 438 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,0,0,0,0,0|2,0,1]=4 439 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [1,0,0,0,0,0|1,0,1]=3 440 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [1,0,0,0,0,0|1,0,1]=3 441 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [1,0,0,0,0,0|0,0,1]=2 442 B11R1.40 N[C@@H](CO)Cc1cccnc1 Amb27590328 [1,0,0,0,0,0|1,0,1]=3 443 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [1,0,0,0,0,0|0,0,0]=1 444 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [1,0,0,0,0,0|1,0,1]=3 445 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [1,0,0,0,0,0|0,0,1]=2 446 B11R1.40 N[C@H](CO)Cc1ccccn1 Amb28365427 [1,0,0,0,0,0|1,0,1]=3 447 B11R1.40 N[C@H](CO)Cc1ccncc1 Amb28368142 [1,0,0,0,0,0|1,0,1]=3 448 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb18799378 [1,0,0,0,0,0|2,0,1]=4 449 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb33743404 [1,0,0,0,0,0|2,0,1]=4 450 B11R1.40 N\C(Cc1ccccc1)=N/O Amb1159399 [1,0,0,0,0,0|1,0,1]=3 451 B11R1.40 N\C(Cc1ccccc1)=N\O Amb1106303 [1,0,0,0,0,0|1,0,1]=3 452 B11R1.40 N\C(Cc1ccccn1)=N/O Amb13994155 [1,0,0,0,0,0|2,0,1]=4 453 B11R1.40 N\C(Cc1ccccn1)=N\O Amb2696195 [1,0,0,0,0,0|2,0,1]=4 454 B11R1.40 N\C(Cc1cccnc1)=N/O Amb8385611 [1,0,0,0,0,0|2,0,1]=4 455 B11R1.40 N\C(Cc1cccnc1)=N\O Amb2696196 [1,0,0,0,0,0|2,0,1]=4 456 B11R1.40 N\C(Cc1ccncc1)=N/O Amb6244226 [1,0,0,0,0,0|2,0,1]=4 457 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [1,0,0,0,0,0|1,0,1]=3 458 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [1,0,0,0,0,0|2,0,1]=4 459 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [1,0,0,0,0,0|1,0,0]=2 460 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [1,0,0,0,0,0|2,0,0]=3 461 B11R1.40 O=CC(Cl)Cc1cncnc1 Amb27239364 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [1,0,0,0,0,0|1,0,0]=2 463 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [1,0,0,0,0,0|2,0,0]=3 464 B11R1.40 O=CN(O)Cc1ccccc1 Amb27873557 [1,0,0,0,0,0|2,0,0]=3 465 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [1,0,0,0,0,0|1,0,0]=2 466 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [1,0,0,0,0,0|1,0,0]=2 467 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [1,0,0,0,0,0|1,0,0]=2 468 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [1,0,0,0,0,0|1,0,2]=4 469 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [1,0,0,0,0,0|1,0,2]=4 470 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [1,0,0,0,0,0|1,0,2]=4 471 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [1,0,0,0,0,0|1,0,2]=4 472 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [1,0,0,0,0,0|1,0,2]=4 473 B11R1.40 O=NN(O)Cc1ccccc1 Amb28131432 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [1,0,0,0,0,0|2,0,1]=4 475 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [1,0,0,0,0,0|2,0,1]=4 476 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,0,0,0,0,0|2,0,1]=4 477 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [1,0,0,0,0,0|1,0,1]=3 478 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,0,0,0,0,0|1,0,1]=3 479 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [1,0,0,0,0,0|1,0,1]=3 480 B11R1.40 OCC(O)Cc1ccccn1 Amb26381861 [1,0,0,0,0,0|2,0,1]=4 481 B11R1.40 OCC(O)Oc1ccccc1 Amb28344634 [1,0,0,0,0,0|2,0,1]=4 482 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [1,0,0,0,0,0|1,0,1]=3 483 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [1,0,0,0,0,0|1,0,1]=3 484 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [1,0,0,0,0,0|1,0,1]=3 485 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [1,0,0,0,0,0|1,0,1]=3 486 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [1,0,0,0,0,0|2,0,1]=4 487 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,0,0,0,0,0|2,0,1]=4 488 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,0,0,0,0,0|2,0,1]=4 489 B11R1.40 O\N=C(/Cl)Cc1ccccc1 Amb33625234 [1,0,0,0,0,0|2,0,1]=4 490 B11R1.40 O\N=C(/O)Cc1ccccc1 Amb19986986 [1,0,0,0,0,0|2,0,1]=4 491 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [1,0,0,0,0,0|0,0,2]=3 493 B11R1.91 C=C(Br)CNc1ccccc1 Amb4303983 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.91 C=C(C)CCc1ccccc1 Amb28199357 [1,0,0,0,0,0|2,0,0]=3 495 B11R1.91 C=C(C)CNc1ccccc1 Amb4017508 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.91 C=C(C)COc1ccccc1 Amb10601706 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.91 C=C(C)CSc1ccccc1 Amb4013110 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.91 C=C(C)NCc1ccccc1 Amb27174576 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.91 C=C(C)OCc1ccccc1 Amb22731238 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.91 C=C(Cl)CSc1ccccc1 Amb4013517 [1,0,0,0,0,0|3,0,0]=4 502 B11R1.91 C=C(O)OCc1ccccc1 Amb26478129 [1,0,0,0,0,0|2,0,0]=3 503 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [1,0,0,0,0,0|1,0,2]=4 506 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,0,0,0,0,0|1,0,0]=2 507 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,0,0|2,0,0]=3 508 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,0|2,0,0]=3 509 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,0|2,0,0]=3 510 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,0,0,0,0,0|2,0,0]=3 511 B11R1.91 CC(=O)CCc1ccncn1 Amb27399166 [1,0,0,0,0,0|3,0,0]=4 512 B11R1.91 CC(=O)CCc1cnccn1 Amb25307907 [1,0,0,0,0,0|3,0,0]=4 513 B11R1.91 CC(=O)CCc1cncnc1 Amb28285350 [1,0,0,0,0,0|3,0,0]=4 514 B11R1.91 CC(=O)CCc1ncccn1 Amb24726140 [1,0,0,0,0,0|3,0,0]=4 515 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,0,0|2,0,0]=3 516 B11R1.91 CC(=O)CNc1ccccn1 Amb26542003 [1,0,0,0,0,0|3,0,0]=4 517 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,0,0,0,0,0|2,0,0]=3 518 B11R1.91 CC(=O)COc1ccccn1 Amb26557634 [1,0,0,0,0,0|3,0,0]=4 519 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,0,0,0,0,0|2,0,0]=3 520 B11R1.91 CC(=O)CSc1ccccn1 Amb9215975 [1,0,0,0,0,0|3,0,0]=4 521 B11R1.91 CC(=O)CSc1cccnc1 Amb28351579 [1,0,0,0,0,0|3,0,0]=4 522 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,0,0|2,0,0]=3 523 B11R1.91 CC(=O)NCc1ccccn1 Amb3358089 [1,0,0,0,0,0|3,0,0]=4 524 B11R1.91 CC(=O)NCc1ccccn1 Amb6892496 [1,0,0,0,0,0|3,0,0]=4 525 B11R1.91 CC(=O)NCc1ccncc1 Amb2694533 [1,0,0,0,0,0|3,0,0]=4 526 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [1,0,0,0,0,0|3,0,0]=4 527 B11R1.91 CC(=O)OC[n+]1ccccc1 Amb27259021 [1,0,0,0,0,0|3,0,0]=4 528 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,0,0,0,0,0|2,0,0]=3 529 B11R1.91 CC(=O)OCc1ccccn1 Amb9780355 [1,0,0,0,0,0|3,0,0]=4 530 B11R1.91 CC(=O)OCc1cccnc1 Amb8388631 [1,0,0,0,0,0|3,0,0]=4 531 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [1,0,0,0,0,0|3,0,0]=4 532 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,0,0,0,0,0|2,0,0]=3 533 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,0,0|1,0,2]=4 534 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,0,0,0,0,0|1,0,2]=4 535 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,0,0|3,0,0]=4 536 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,0,0|2,1,0]=4 537 B11R1.91 CC(Br)CCc1ccccc1 Amb8835399 [1,0,0,0,0,0|2,0,1]=4 538 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,0,0,0,0,0|2,0,1]=4 539 B11R1.91 CC(C)=NCc1ccccc1 Amb10568469 [1,0,0,0,0,0|3,0,0]=4 540 B11R1.91 CC(C)CCc1ccccc1 Amb4477358 [1,0,0,0,0,0|2,0,1]=4 541 B11R1.91 CC(Cl)CCc1ccccc1 Amb9205035 [1,0,0,0,0,0|2,0,1]=4 542 B11R1.91 CC(N)CCc1ccccc1 Amb5740105 [1,0,0,0,0,0|2,0,1]=4 543 B11R1.91 CC(N)CCc1ccccc1 Amb6383144 [1,0,0,0,0,0|2,0,1]=4 544 B11R1.91 CC(O)CCc1ccccc1 Amb4009672 [1,0,0,0,0,0|1,0,1]=3 545 B11R1.91 CC(O)CCc1ccccn1 Amb17507263 [1,0,0,0,0,0|2,0,1]=4 546 B11R1.91 CC(O)CCc1cccnc1 Amb17507264 [1,0,0,0,0,0|2,0,1]=4 547 B11R1.91 CC(O)CCc1ccncc1 Amb17507265 [1,0,0,0,0,0|2,0,1]=4 548 B11R1.91 CC(O)CNc1ccccc1 Amb6537763 [1,0,0,0,0,0|2,0,1]=4 549 B11R1.91 CC(O)COc1ccccc1 Amb6298844 [1,0,0,0,0,0|2,0,1]=4 550 B11R1.91 CC(O)CPc1ccccc1 Amb27756306 [1,0,0,0,0,0|2,0,1]=4 551 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,0,0,0,0,0|2,0,1]=4 552 B11R1.91 CC(S)CCc1ccccc1 Amb7784713 [1,0,0,0,0,0|1,1,1]=4 553 B11R1.91 CN(C)CCc1ccccc1 Amb3428717 [1,0,0,0,0,0|3,0,0]=4 554 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,0,0,0,0,0|3,0,0]=4 555 B11R1.91 CN(O)CCc1ccccc1 Amb32953149 [1,0,0,0,0,0|2,0,0]=3 556 B11R1.91 CN(O)CCc1ccncc1 Amb25684228 [1,0,0,0,0,0|3,0,0]=4 557 B11R1.91 C[C@@H](N)CCc1ccccc1 Amb8516709 [1,0,0,0,0,0|2,0,1]=4 558 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,0,0|1,0,1]=3 559 B11R1.91 C[C@@H](O)CCc1ccccn1 Amb33360774 [1,0,0,0,0,0|2,0,1]=4 560 B11R1.91 C[C@@H](O)CCc1cccnc1 Amb33360059 [1,0,0,0,0,0|2,0,1]=4 561 B11R1.91 C[C@@H](O)CCc1ccncc1 Amb33380653 [1,0,0,0,0,0|2,0,1]=4 562 B11R1.91 C[C@@H](O)CNc1ccccc1 Amb27400122 [1,0,0,0,0,0|2,0,1]=4 563 B11R1.91 C[C@@H](O)COc1ccccc1 Amb27776994 [1,0,0,0,0,0|2,0,1]=4 564 B11R1.91 C[C@H](Br)CCc1ccccc1 Amb27592949 [1,0,0,0,0,0|2,0,1]=4 565 B11R1.91 C[C@H](N)CCc1ccccc1 Amb8516076 [1,0,0,0,0,0|2,0,1]=4 566 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,0,0|1,0,1]=3 567 B11R1.91 C[C@H](O)CCc1ccccn1 Amb33360775 [1,0,0,0,0,0|2,0,1]=4 568 B11R1.91 C[C@H](O)CCc1cccnc1 Amb33360413 [1,0,0,0,0,0|2,0,1]=4 569 B11R1.91 C[C@H](O)CCc1ccncc1 Amb33380654 [1,0,0,0,0,0|2,0,1]=4 570 B11R1.91 C[PH](=O)OCc1ccccc1 Amb8391293 [1,0,0,0,0,0|3,0,0]=4 571 B11R1.91 N=C(/N)SCc1ccccc1 Amb20655654 [1,0,0,0,0,0|3,0,0]=4 572 B11R1.91 N=C(N)CCc1ccccc1 Amb6264312 [1,0,0,0,0,0|2,0,0]=3 573 B11R1.91 N=C(N)CCc1ccccc1 Amb8630659 [1,0,0,0,0,0|2,0,0]=3 574 B11R1.91 N=C(N)CCc1cccnc1 Amb2700054 [1,0,0,0,0,0|3,0,0]=4 575 B11R1.91 N=C(N)COc1ccccc1 Amb2725000 [1,0,0,0,0,0|3,0,0]=4 576 B11R1.91 N=C(N)COc1ccccc1 Amb33551040 [1,0,0,0,0,0|3,0,0]=4 577 B11R1.91 N=C(N)CSc1ccccc1 Amb2726049 [1,0,0,0,0,0|3,0,0]=4 578 B11R1.91 N=C(N)NCc1ccccc1 Amb22370878 [1,0,0,0,0,0|3,0,0]=4 579 B11R1.91 N=C(N)NCc1ccccc1 Amb602728 [1,0,0,0,0,0|3,0,0]=4 580 B11R1.91 N=C(N)NCc1ccccc1 Amb7990388 [1,0,0,0,0,0|3,0,0]=4 581 B11R1.91 N=C(N)OCc1ccccc1 Amb6773970 [1,0,0,0,0,0|3,0,0]=4 582 B11R1.91 N=C(N)SCc1ccccc1 Amb20676044 [1,0,0,0,0,0|3,0,0]=4 583 B11R1.91 N=C(N)SCc1ccccc1 Amb2609643 [1,0,0,0,0,0|3,0,0]=4 584 B11R1.91 N=C(N)SCc1ccccc1 Amb6296081 [1,0,0,0,0,0|3,0,0]=4 585 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [1,0,0,0,0,0|3,0,0]=4 586 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [1,0,0,0,0,0|1,0,2]=4 587 B11R1.91 NC(=O)CC[n+]1ccccc1 Amb4010710 [1,0,0,0,0,0|2,0,0]=3 588 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,0,0,0,0,0|1,0,0]=2 589 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,0,0|2,0,0]=3 590 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,0,0|2,0,0]=3 591 B11R1.91 NC(=O)CCc1ccncn1 Amb27231725 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [1,0,0,0,0,0|2,0,0]=3 593 B11R1.91 NC(=O)CNc1ccccn1 Amb6658788 [1,0,0,0,0,0|3,0,0]=4 594 B11R1.91 NC(=O)CNc1cccnc1 Amb27482670 [1,0,0,0,0,0|3,0,0]=4 595 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [1,0,0,0,0,0|2,0,0]=3 596 B11R1.91 NC(=O)COc1ccccn1 Amb27878790 [1,0,0,0,0,0|3,0,0]=4 597 B11R1.91 NC(=O)COc1cccnc1 Amb6739850 [1,0,0,0,0,0|3,0,0]=4 598 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [1,0,0,0,0,0|2,0,0]=3 599 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [1,0,0,0,0,0|3,0,0]=4 600 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,0,0|2,0,0]=3 601 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [1,0,0,0,0,0|3,0,0]=4 602 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [1,0,0,0,0,0|3,0,0]=4 603 B11R1.91 NC(=O)NCc1ccncc1 Amb6658828 [1,0,0,0,0,0|3,0,0]=4 604 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [1,0,0,0,0,0|3,0,0]=4 605 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [1,0,0,0,0,0|3,0,0]=4 606 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [1,0,0,0,0,0|2,0,0]=3 607 B11R1.91 NC(=O)OCc1cccnc1 Amb26464124 [1,0,0,0,0,0|3,0,0]=4 608 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [1,0,0,0,0,0|2,0,0]=3 609 B11R1.91 NC(=O)SCc1ccccn1 Amb28145815 [1,0,0,0,0,0|3,0,0]=4 610 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [1,0,0,0,0,0|1,0,2]=4 611 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [1,0,0,0,0,0|1,0,2]=4 612 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [1,0,0,0,0,0|1,0,2]=4 613 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [1,0,0,0,0,0|2,0,1]=4 614 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,0,0|1,1,0]=3 615 B11R1.91 NC(=S)CCc1ccccn1 Amb6752547 [1,0,0,0,0,0|2,1,0]=4 616 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [1,0,0,0,0,0|2,1,0]=4 617 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [1,0,0,0,0,0|2,1,0]=4 618 B11R1.91 NC(=S)CSc1ccccc1 Amb6572429 [1,0,0,0,0,0|2,1,0]=4 619 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [1,0,0,0,0,0|2,1,0]=4 620 B11R1.91 NC(=S)NCc1ccccc1 Amb32644733 [1,0,0,0,0,0|2,1,0]=4 621 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [1,0,0,0,0,0|3,0,0]=4 622 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [1,0,0,0,0,0|3,0,0]=4 623 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,0,0,0,0,0|1,0,0]=2 624 B11R1.91 O=C(Cl)CCc1ccccn1 Amb2696649 [1,0,0,0,0,0|2,0,0]=3 625 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [1,0,0,0,0,0|2,0,0]=3 626 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [1,0,0,0,0,0|2,0,0]=3 627 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [1,0,0,0,0,0|2,0,0]=3 628 B11R1.91 O=C(Cl)CSc1ccccn1 Amb19650937 [1,0,0,0,0,0|3,0,0]=4 629 B11R1.91 O=C(Cl)CSc1ccncc1 Amb22396542 [1,0,0,0,0,0|3,0,0]=4 630 B11R1.91 O=C(Cl)CSc1ccncc1 Amb8629347 [1,0,0,0,0,0|3,0,0]=4 631 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [1,0,0,0,0,0|2,0,0]=3 632 B11R1.91 O=C(Cl)OCc1ccccn1 Amb33297000 [1,0,0,0,0,0|3,0,0]=4 633 B11R1.91 O=C(Cl)OCc1cccnc1 Amb25852784 [1,0,0,0,0,0|3,0,0]=4 634 B11R1.91 O=C(Cl)OCc1cccnc1 Amb33465543 [1,0,0,0,0,0|3,0,0]=4 635 B11R1.91 O=C(Cl)OCc1ccncc1 Amb24559531 [1,0,0,0,0,0|3,0,0]=4 636 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [1,0,0,0,0,0|1,0,2]=4 637 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [1,0,0,0,0,0|2,0,0]=3 638 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [1,0,0,0,0,0|0,0,2]=3 639 B11R1.91 O=C(O)C#Cc1ccccn1 Amb16233314 [1,0,0,0,0,0|1,0,2]=4 640 B11R1.91 O=C(O)C#Cc1cccnc1 Amb20673066 [1,0,0,0,0,0|1,0,2]=4 641 B11R1.91 O=C(O)C#Cc1ccncc1 Amb20673077 [1,0,0,0,0,0|1,0,2]=4 642 B11R1.91 O=C(O)CC[n+]1ccccc1 Amb31127608 [1,0,0,0,0,0|1,0,0]=2 643 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,0,0,0,0,0|0,0,0]=1 644 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [1,0,0,0,0,0|1,0,0]=2 645 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [1,0,0,0,0,0|1,0,0]=2 646 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [1,0,0,0,0,0|1,0,0]=2 647 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,0|1,0,0]=2 648 B11R1.91 O=C(O)CCc1cccnn1 Amb23592184 [1,0,0,0,0,0|2,0,0]=3 649 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,0|1,0,0]=2 650 B11R1.91 O=C(O)CCc1ccncn1 Amb33545203 [1,0,0,0,0,0|2,0,0]=3 651 B11R1.91 O=C(O)CCc1ccnnc1 Amb22499259 [1,0,0,0,0,0|2,0,0]=3 652 B11R1.91 O=C(O)CCc1cnccn1 Amb5846608 [1,0,0,0,0,0|2,0,0]=3 653 B11R1.91 O=C(O)CCc1cncnc1 Amb18201449 [1,0,0,0,0,0|2,0,0]=3 654 B11R1.91 O=C(O)CCc1cncnn1 Amb27956128 [1,0,0,0,0,0|3,0,0]=4 655 B11R1.91 O=C(O)CCc1cnncn1 Amb18201165 [1,0,0,0,0,0|3,0,0]=4 656 B11R1.91 O=C(O)CCc1ncccn1 Amb3997808 [1,0,0,0,0,0|2,0,0]=3 657 B11R1.91 O=C(O)CCc1nccnn1 Amb18201164 [1,0,0,0,0,0|3,0,0]=4 658 B11R1.91 O=C(O)CCc1ncncn1 Amb18862491 [1,0,0,0,0,0|3,0,0]=4 659 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [1,0,0,0,0,0|1,0,0]=2 660 B11R1.91 O=C(O)CNc1ccccn1 Amb33549202 [1,0,0,0,0,0|2,0,0]=3 661 B11R1.91 O=C(O)CNc1ccccn1 Amb4025757 [1,0,0,0,0,0|2,0,0]=3 662 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [1,0,0,0,0,0|2,0,0]=3 663 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [1,0,0,0,0,0|2,0,0]=3 664 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [1,0,0,0,0,0|2,0,0]=3 665 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [1,0,0,0,0,0|2,0,0]=3 666 B11R1.91 O=C(O)CNc1ccncn1 Amb18973871 [1,0,0,0,0,0|3,0,0]=4 667 B11R1.91 O=C(O)CNc1cnccn1 Amb6256346 [1,0,0,0,0,0|3,0,0]=4 668 B11R1.91 O=C(O)CNc1cncnc1 Amb18933571 [1,0,0,0,0,0|3,0,0]=4 669 B11R1.91 O=C(O)CNc1ncccn1 Amb2372087 [1,0,0,0,0,0|3,0,0]=4 670 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [1,0,0,0,0,0|1,0,0]=2 671 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [1,0,0,0,0,0|1,0,0]=2 672 B11R1.91 O=C(O)COc1ccccn1 Amb2610077 [1,0,0,0,0,0|2,0,0]=3 673 B11R1.91 O=C(O)COc1ccccn1 Amb34912615 [1,0,0,0,0,0|2,0,0]=3 674 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [1,0,0,0,0,0|2,0,0]=3 675 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [1,0,0,0,0,0|2,0,0]=3 676 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [1,0,0,0,0,0|2,0,0]=3 677 B11R1.91 O=C(O)COc1cccnn1 Amb2819556 [1,0,0,0,0,0|3,0,0]=4 678 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [1,0,0,0,0,0|2,0,0]=3 679 B11R1.91 O=C(O)COc1ccncn1 Amb26495531 [1,0,0,0,0,0|3,0,0]=4 680 B11R1.91 O=C(O)COc1cnccn1 Amb26976070 [1,0,0,0,0,0|3,0,0]=4 681 B11R1.91 O=C(O)COc1cncnc1 Amb8009333 [1,0,0,0,0,0|3,0,0]=4 682 B11R1.91 O=C(O)COc1ncccn1 Amb8010398 [1,0,0,0,0,0|3,0,0]=4 683 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [1,0,0,0,0,0|1,0,0]=2 684 B11R1.91 O=C(O)CSc1ccccn1 Amb1130490 [1,0,0,0,0,0|2,0,0]=3 685 B11R1.91 O=C(O)CSc1cccnn1 Amb9174289 [1,0,0,0,0,0|3,0,0]=4 686 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [1,0,0,0,0,0|2,0,0]=3 687 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [1,0,0,0,0,0|2,0,0]=3 688 B11R1.91 O=C(O)CSc1ccncn1 Amb8089703 [1,0,0,0,0,0|3,0,0]=4 689 B11R1.91 O=C(O)CSc1ccnnc1 Amb24670204 [1,0,0,0,0,0|3,0,0]=4 690 B11R1.91 O=C(O)CSc1cnccn1 Amb6278353 [1,0,0,0,0,0|3,0,0]=4 691 B11R1.91 O=C(O)CSc1ncccn1 Amb1625763 [1,0,0,0,0,0|3,0,0]=4 692 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [1,0,0,0,0,0|0,0,2]=3 693 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [1,0,0,0,0,0|1,0,2]=4 694 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [1,0,0,0,0,0|1,0,2]=4 695 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [1,0,0,0,0,0|1,0,2]=4 696 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [1,0,0,0,0,0|0,0,2]=3 697 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [1,0,0,0,0,0|0,0,2]=3 698 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [1,0,0,0,0,0|1,0,2]=4 699 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [1,0,0,0,0,0|1,0,2]=4 700 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [1,0,0,0,0,0|1,0,2]=4 701 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [1,0,0,0,0,0|1,0,2]=4 702 B11R1.91 O=C([O-])CCc1ccccn1 Amb32882485 [1,0,0,0,0,0|1,0,1]=3 703 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [1,0,0,0,0,0|1,0,1]=3 704 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [1,0,0,0,0,0|1,0,1]=3 705 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [1,0,0,0,0,0|1,0,1]=3 706 B11R1.91 O=C([O-])COc1ccccn1 Amb30584712 [1,0,0,0,0,0|2,0,1]=4 707 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [1,0,0,0,0,0|0,0,3]=4 708 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [1,0,0,0,0,0|0,0,3]=4 709 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [1,0,0,0,0,0|2,0,1]=4 710 B11R1.91 O=S(O)CCc1ccccc1 Amb27860522 [1,0,0,0,0,0|1,0,0]=2 711 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [1,0,0,0,0,0|1,0,2]=4 712 B11R1.91 O=S([O-])CCc1ccccc1 Amb26600239 [1,0,0,0,0,0|1,0,1]=3 713 B11R1.91 O=S([O-])CCc1ccccn1 Amb26550273 [1,0,0,0,0,0|2,0,1]=4 714 B11R1.91 O=S([O-])CCc1ccncc1 Amb25914729 [1,0,0,0,0,0|2,0,1]=4 715 B11R1.91 O=S([O-])NCc1ccccc1 Amb22641608 [1,0,0,0,0,0|2,0,1]=4 716 B11R1.91 O=[N+]([O-])CCc1ccccc1 Amb16192705 [1,0,0,0,0,0|1,0,1]=3 717 B11R1.91 O=[N+]([O-])CCc1ccccn1 Amb17399924 [1,0,0,0,0,0|2,0,1]=4 718 B11R1.91 O=[N+]([O-])CCc1cccnc1 Amb17399925 [1,0,0,0,0,0|2,0,1]=4 719 B11R1.91 O=[N+]([O-])CCc1ccncc1 Amb17399926 [1,0,0,0,0,0|2,0,1]=4 720 B11R1.91 O=[N+]([O-])NCc1ccccc1 Amb26560440 [1,0,0,0,0,0|2,0,1]=4 721 B11R1.91 O=[PH](O)CCc1ccccc1 Amb27210683 [1,0,0,0,0,0|1,0,0]=2 722 B11R1.91 OB(O)CCc1ccccc1 Amb2456045 [1,0,0,0,0,0|1,0,1]=3 723 B11R1.91 OB(O)CCc1cccnc1 Amb25259201 [1,0,0,0,0,0|2,0,1]=4 724 B11R1.91 OB(O)CCc1ccncc1 Amb28456641 [1,0,0,0,0,0|2,0,1]=4 725 B11R1.91 OB(O)CSc1ccccc1 Amb27450702 [1,0,0,0,0,0|2,0,1]=4 726 B11R1.91 OC(Cl)CNc1ccccc1 Amb28291556 [1,0,0,0,0,0|2,0,1]=4 727 B11R1.91 S=C(Cl)NCc1ccccc1 Amb28436734 [1,0,0,0,0,0|2,1,0]=4 728 B11R1.91 S=C(S)NCc1ccccc1 Amb26372903 [1,0,0,0,0,0|1,2,0]=4 729 B11R1.91 S=C([S-])NCc1ccccc1 Amb33249792 [1,0,0,0,0,0|1,2,0]=4 730 B13R1.133 C=C(C)C(N)Cc1ccc(F)cc1 Amb27465138 [0,1,0,0,0,0|2,0,0]=3 731 B13R1.133 C=C(C)C(O)Cc1ccc(Cl)cc1 Amb27494321 [0,1,0,0,0,0|3,0,0]=4 732 B13R1.133 C=C(C)C(O)Cc1ccc(F)cc1 Amb27869341 [0,1,0,0,0,0|3,0,0]=4 733 B13R1.133 C=C(C)C(O)Cc1ccc(N)cc1 Amb30024057 [0,1,0,0,0,0|3,0,0]=4 734 B13R1.133 C=C(CN1C=CC(=O)C=C1)C(=O)O Amb27655484 [0,1,0,0,0,0|2,0,1]=4 735 B13R1.133 C=C(Cc1ccc(Br)cc1)C(=O)O Amb27648751 [0,1,0,0,0,0|1,0,1]=3 736 B13R1.133 C=C(Cc1ccc(F)cc1)C(=O)O Amb27232941 [0,1,0,0,0,0|1,0,1]=3 737 B13R1.133 CC(=O)C(=O)Cc1ccc(Br)cc1 Amb23603629 [0,1,0,0,0,0|2,0,1]=4 738 B13R1.133 CC(=O)C(=O)Cc1ccc(C)cc1 Amb23603620 [0,1,0,0,0,0|2,0,1]=4 739 B13R1.133 CC(=O)C(=O)Cc1ccc(Cl)cc1 Amb23603627 [0,1,0,0,0,0|2,0,1]=4 740 B13R1.133 CC(=O)C(=O)Cc1ccc(F)cc1 Amb23603622 [0,1,0,0,0,0|2,0,1]=4 741 B13R1.133 CC(=O)C(Br)Cc1ccc(C)cc1 Amb25190028 [0,1,0,0,0,0|2,0,0]=3 742 B13R1.133 CC(=O)C(Br)Cc1ccc(Cl)cc1 Amb17507836 [0,1,0,0,0,0|2,0,0]=3 743 B13R1.133 CC(=O)C(Br)Cc1ccc(F)cc1 Amb17507837 [0,1,0,0,0,0|2,0,0]=3 744 B13R1.133 CC(=O)C(C)Cc1ccc(Br)cc1 Amb17255483 [0,1,0,0,0,0|2,0,0]=3 745 B13R1.133 CC(=O)C(C)Cc1ccc(C)cc1 Amb17233205 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.133 CC(=O)C(C)Cc1ccc(C)nc1 Amb35730912 [0,1,0,0,0,0|3,0,0]=4 747 B13R1.133 CC(=O)C(C)Cc1ccc(Cl)cc1 Amb17236509 [0,1,0,0,0,0|2,0,0]=3 748 B13R1.133 CC(=O)C(C)Cc1ccc(F)cc1 Amb17233679 [0,1,0,0,0,0|2,0,0]=3 749 B13R1.133 CC(=O)C(C)Nc1ccc(Cl)cc1 Amb27411971 [0,1,0,0,0,0|3,0,0]=4 750 B13R1.133 CC(=O)C(C)Oc1ccc(C)cc1 Amb2412522 [0,1,0,0,0,0|3,0,0]=4 751 B13R1.133 CC(=O)C(C)Oc1ccc(Cl)cc1 Amb2436605 [0,1,0,0,0,0|3,0,0]=4 752 B13R1.133 CC(=O)C(C)Oc1ccc(F)cc1 Amb2437262 [0,1,0,0,0,0|3,0,0]=4 753 B13R1.133 CC(=O)C(C)Oc1ccc(N)cc1 Amb17110086 [0,1,0,0,0,0|3,0,0]=4 754 B13R1.133 CC(=O)C(C)Sc1ccc(Br)cc1 Amb9269198 [0,1,0,0,0,0|3,0,0]=4 755 B13R1.133 CC(=O)C(C)Sc1ccc(C)cc1 Amb9216218 [0,1,0,0,0,0|3,0,0]=4 756 B13R1.133 CC(=O)C(C)Sc1ccc(Cl)cc1 Amb9269646 [0,1,0,0,0,0|3,0,0]=4 757 B13R1.133 CC(=O)C(C)Sc1ccc(F)cc1 Amb9268276 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.133 CC(=O)C(Cl)Cc1ccc(Br)cc1 Amb17204823 [0,1,0,0,0,0|2,0,0]=3 759 B13R1.133 CC(=O)C(Cl)Cc1ccc(C)cc1 Amb17204370 [0,1,0,0,0,0|2,0,0]=3 760 B13R1.133 CC(=O)C(Cl)Cc1ccc(Cl)cc1 Amb4020123 [0,1,0,0,0,0|2,0,0]=3 761 B13R1.133 CC(=O)C(Cl)Cc1ccc(F)cc1 Amb17204390 [0,1,0,0,0,0|2,0,0]=3 762 B13R1.133 CC(=O)C(N)Cc1ccc(O)cc1 Amb28138030 [0,1,0,0,0,0|1,0,0]=2 763 B13R1.133 CC(=O)C(O)Cc1ccc(O)cc1 Amb27409634 [0,1,0,0,0,0|2,0,0]=3 764 B13R1.133 CC(=O)N(C)Cc1ccc(N)cc1 Amb2693405 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.133 CC(=O)N(C)Cc1ccc(O)cc1 Amb2692177 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.133 CC(=O)[C@@H](C)Cc1ccc(Cl)cc1 Amb27232652 [0,1,0,0,0,0|2,0,0]=3 767 B13R1.133 CC(=O)[C@H](C)Cc1ccc(C)cc1 Amb28386629 [0,1,0,0,0,0|2,0,0]=3 768 B13R1.133 CC(C)C(N)Cc1ccc(Br)cc1 Amb27195529 [0,1,0,0,0,0|2,0,1]=4 769 B13R1.133 CC(C)C(N)Cc1ccc(Cl)cc1 Amb18034026 [0,1,0,0,0,0|2,0,1]=4 770 B13R1.133 CC(C)C(N)Cc1ccc(F)cc1 Amb17139012 [0,1,0,0,0,0|2,0,1]=4 771 B13R1.133 CC(Cc1ccc(Br)cc1)C(=O)Cl Amb27585400 [0,1,0,0,0,0|2,0,0]=3 772 B13R1.133 CC(Cc1ccc(Br)cc1)C(=O)O Amb16185778 [0,1,0,0,0,0|1,0,0]=2 773 B13R1.133 CC(Cc1ccc(Br)cc1)C(N)=O Amb24271353 [0,1,0,0,0,0|2,0,0]=3 774 B13R1.133 CC(Cc1ccc(Br)cn1)C(=O)O Amb26482996 [0,1,0,0,0,0|2,0,0]=3 775 B13R1.133 CC(Cc1ccc(Br)nc1)C(=O)O Amb33387670 [0,1,0,0,0,0|2,0,0]=3 776 B13R1.133 CC(Cc1ccc(Cl)cc1)C(=O)O Amb2785266 [0,1,0,0,0,0|1,0,0]=2 777 B13R1.133 CC(Cc1ccc(Cl)cn1)C(=O)O Amb33409828 [0,1,0,0,0,0|2,0,0]=3 778 B13R1.133 CC(Cc1ccc(Cl)nc1)C(=O)O Amb25685273 [0,1,0,0,0,0|2,0,0]=3 779 B13R1.133 CC(Cc1ccc(F)cc1)C(=O)Cl Amb5744103 [0,1,0,0,0,0|2,0,0]=3 780 B13R1.133 CC(Cc1ccc(F)cc1)C(=O)O Amb33534946 [0,1,0,0,0,0|1,0,0]=2 781 B13R1.133 CC(Cc1ccc(F)cn1)C(=O)O Amb28129511 [0,1,0,0,0,0|2,0,0]=3 782 B13R1.133 CC(Cc1ccc(F)nc1)C(=O)O Amb33426574 [0,1,0,0,0,0|2,0,0]=3 783 B13R1.133 CC(Cc1ccc(N)cc1)C(=O)O Amb26304191 [0,1,0,0,0,0|1,0,0]=2 784 B13R1.133 CC(Cc1ccc(N)cc1)[N+](=O)[O-] Amb16186749 [0,1,0,0,0,0|2,0,1]=4 785 B13R1.133 CC(Cc1ccc(O)cc1)C(=O)O Amb25798442 [0,1,0,0,0,0|1,0,0]=2 786 B13R1.133 CC(Cc1ccc(O)cc1)[N+](=O)[O-] Amb27593440 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.133 CC(Cc1cnc(Cl)cn1)C(=O)O Amb27625914 [0,1,0,0,0,0|3,0,0]=4 788 B13R1.133 CC(Cc1ncc(Br)cn1)C(=O)O Amb33485046 [0,1,0,0,0,0|3,0,0]=4 789 B13R1.133 CC(Nc1ccc(Br)cc1)C(=O)O Amb840565 [0,1,0,0,0,0|2,0,0]=3 790 B13R1.133 CC(Nc1ccc(Br)cc1)C(N)=O Amb7067404 [0,1,0,0,0,0|3,0,0]=4 791 B13R1.133 CC(Nc1ccc(Br)nc1)C(=O)O Amb27976297 [0,1,0,0,0,0|3,0,0]=4 792 B13R1.133 CC(Nc1ccc(Cl)cc1)C(=O)O Amb840562 [0,1,0,0,0,0|2,0,0]=3 793 B13R1.133 CC(Nc1ccc(Cl)nc1)C(=O)O Amb27754726 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.133 CC(Nc1ccc(F)cc1)C(=O)O Amb9702106 [0,1,0,0,0,0|2,0,0]=3 795 B13R1.133 CC(Nc1ccc(F)cn1)C(=O)O Amb27963262 [0,1,0,0,0,0|3,0,0]=4 796 B13R1.133 CC(Nc1ccc(N)cc1)C(=O)O Amb25850201 [0,1,0,0,0,0|2,0,0]=3 797 B13R1.133 CC(Nc1ccc(N)cc1)C(N)=O Amb9407516 [0,1,0,0,0,0|3,0,0]=4 798 B13R1.133 CC(Nc1ccc(O)cc1)C(=O)O Amb27771791 [0,1,0,0,0,0|2,0,0]=3 799 B13R1.133 CC(O)C(C)Cc1ccc(Br)cc1 Amb17256432 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.133 CC(O)C(C)Cc1ccc(Cl)cc1 Amb17236861 [0,1,0,0,0,0|2,0,1]=4 801 B13R1.133 CC(O)C(C)Cc1ccc(F)cc1 Amb17233914 [0,1,0,0,0,0|2,0,1]=4 802 B13R1.133 CC(O)C(C)Cc1ccc(I)cc1 Amb25741546 [0,1,0,0,0,0|2,0,1]=4 803 B13R1.133 CC(O)C(C)Cc1ccc(O)cc1 Amb25832821 [0,1,0,0,0,0|2,0,1]=4 804 B13R1.133 CC(O)C(N)Cc1ccc(Br)cc1 Amb18155745 [0,1,0,0,0,0|1,0,1]=3 805 B13R1.133 CC(O)C(O)Cc1ccc(Br)cc1 Amb28457861 [0,1,0,0,0,0|2,0,1]=4 806 B13R1.133 CC(O)C(O)Cc1ccc(O)cc1 Amb28202220 [0,1,0,0,0,0|2,0,1]=4 807 B13R1.133 CC(Oc1ccc(Br)cc1)C(=O)Cl Amb16230063 [0,1,0,0,0,0|3,0,0]=4 808 B13R1.133 CC(Oc1ccc(Br)cc1)C(=O)O Amb1215354 [0,1,0,0,0,0|2,0,0]=3 809 B13R1.133 CC(Oc1ccc(Br)cc1)C(N)=O Amb6430257 [0,1,0,0,0,0|3,0,0]=4 810 B13R1.133 CC(Oc1ccc(Cl)cc1)C(=O)Cl Amb17143747 [0,1,0,0,0,0|3,0,0]=4 811 B13R1.133 CC(Oc1ccc(Cl)cc1)C(=O)O Amb6336455 [0,1,0,0,0,0|2,0,0]=3 812 B13R1.133 CC(Oc1ccc(Cl)cn1)C(=O)O Amb18130810 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.133 CC(Oc1ccc(Cl)nc1)C(=O)O Amb28411194 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.133 CC(Oc1ccc(F)cc1)C(=O)Cl Amb16230027 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.133 CC(Oc1ccc(F)cc1)C(=O)O Amb9702439 [0,1,0,0,0,0|2,0,0]=3 816 B13R1.133 CC(Oc1ccc(I)cc1)C(=O)O Amb8831575 [0,1,0,0,0,0|2,0,0]=3 817 B13R1.133 CC(Oc1ccc(N)cc1)C(=O)O Amb839766 [0,1,0,0,0,0|2,0,0]=3 818 B13R1.133 CC(Oc1ccc(O)cc1)C(=O)O Amb2720531 [0,1,0,0,0,0|2,0,0]=3 819 B13R1.133 CC(Oc1ccc(O)cc1)C(N)=O Amb8837184 [0,1,0,0,0,0|3,0,0]=4 820 B13R1.133 CC(Oc1ccc(S)cc1)C(=O)O Amb27863432 [0,1,0,0,0,0|2,0,0]=3 821 B13R1.133 CC(Sc1ccc(Br)cc1)C(=O)O Amb1115989 [0,1,0,0,0,0|2,0,0]=3 822 B13R1.133 CC(Sc1ccc(Cl)cc1)C(=O)Cl Amb17144558 [0,1,0,0,0,0|3,0,0]=4 823 B13R1.133 CC(Sc1ccc(Cl)cc1)C(=O)O Amb9745731 [0,1,0,0,0,0|2,0,0]=3 824 B13R1.133 CC(Sc1ccc(Cl)cc1)C(N)=O Amb3608224 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.133 CC(Sc1ccc(F)cc1)C(=O)O Amb1115911 [0,1,0,0,0,0|2,0,0]=3 826 B13R1.133 CC(Sc1ccc(F)cn1)C(=O)O Amb18975388 [0,1,0,0,0,0|3,0,0]=4 827 B13R1.133 CC(Sc1ccc(N)cc1)C(=O)O Amb18975670 [0,1,0,0,0,0|2,0,0]=3 828 B13R1.133 CC(Sc1ccc(N)cc1)C(=O)O Amb32652412 [0,1,0,0,0,0|2,0,0]=3 829 B13R1.133 CC(Sc1ccc(N)nc1)C(=O)O Amb17305689 [0,1,0,0,0,0|3,0,0]=4 830 B13R1.133 CC(Sc1ccc(O)cc1)C(=O)O Amb19000448 [0,1,0,0,0,0|2,0,0]=3 831 B13R1.133 CN(Cc1ccc(Cl)cc1)C(=O)Cl Amb27618266 [0,1,0,0,0,0|3,0,0]=4 832 B13R1.133 CN(Cc1ccc(Cl)cc1)C(N)=O Amb18332178 [0,1,0,0,0,0|3,0,0]=4 833 B13R1.133 C[C@@H](Cc1ccc(Br)cc1)C(=O)O Amb10844183 [0,1,0,0,0,0|1,0,0]=2 834 B13R1.133 C[C@@H](Cc1ccc(F)cc1)C(=O)O Amb10844187 [0,1,0,0,0,0|1,0,0]=2 835 B13R1.133 C[C@@H](Cc1ccc(F)nc1)C(=O)O Amb33743267 [0,1,0,0,0,0|2,0,0]=3 836 B13R1.133 C[C@@H](Cc1ccc(O)cn1)C(=O)O Amb27826330 [0,1,0,0,0,0|2,0,0]=3 837 B13R1.133 C[C@@H](Nc1ccc(Cl)cc1)C(=O)O Amb24626586 [0,1,0,0,0,0|2,0,0]=3 838 B13R1.133 C[C@@H](Oc1ccc(Br)cc1)C(N)=O Amb27411967 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.133 C[C@@H](Oc1ccc(Cl)cc1)C(=O)O Amb27947480 [0,1,0,0,0,0|2,0,0]=3 840 B13R1.133 C[C@@H](Oc1ccc(O)cc1)C(=O)Cl Amb27772103 [0,1,0,0,0,0|3,0,0]=4 841 B13R1.133 C[C@@H](Oc1ccc(O)cc1)C(=O)O Amb4038211 [0,1,0,0,0,0|2,0,0]=3 842 B13R1.133 C[C@@H](Sc1ccc(Cl)cc1)C(=O)O Amb27798366 [0,1,0,0,0,0|2,0,0]=3 843 B13R1.133 C[C@H](Cc1ccc(F)cc1)C(=O)O Amb10844186 [0,1,0,0,0,0|1,0,0]=2 844 B13R1.133 C[C@H](Cc1ccc(F)nc1)C(=O)O Amb33728205 [0,1,0,0,0,0|2,0,0]=3 845 B13R1.133 C[C@H](Cc1ccc(N)cc1)C(=O)O Amb10844177 [0,1,0,0,0,0|1,0,0]=2 846 B13R1.133 C[C@H](Nc1ccc(Cl)cc1)C(=O)O Amb26032182 [0,1,0,0,0,0|2,0,0]=3 847 B13R1.133 C[C@H](Nc1ccc(F)cc1)C(=O)O Amb24375534 [0,1,0,0,0,0|2,0,0]=3 848 B13R1.133 C[C@H](O)[C@H](O)Cc1ccc(O)cc1 Amb27859392 [0,1,0,0,0,0|2,0,1]=4 849 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(=O)O Amb24471254 [0,1,0,0,0,0|2,0,0]=3 850 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(N)=O Amb28187771 [0,1,0,0,0,0|3,0,0]=4 851 B13R1.133 C[C@H](Oc1ccc(Cl)cc1)C(=O)O Amb26618695 [0,1,0,0,0,0|2,0,0]=3 852 B13R1.133 C[C@H](Oc1ccc(F)nc1)C(=O)O Amb27405646 [0,1,0,0,0,0|3,0,0]=4 853 B13R1.133 C[C@H](Oc1ccc(I)cc1)C(=O)O Amb24623054 [0,1,0,0,0,0|2,0,0]=3 854 B13R1.133 C[C@H](Oc1ccc(O)cc1)C(=O)Cl Amb27256346 [0,1,0,0,0,0|3,0,0]=4 855 B13R1.133 C[C@H](Oc1ccc(O)cc1)C(=O)O Amb28313704 [0,1,0,0,0,0|2,0,0]=3 856 B13R1.133 C[C@H](Sc1ccc(Cl)cc1)C(=O)O Amb27751301 [0,1,0,0,0,0|2,0,0]=3 857 B13R1.133 C\C(=C/c1ccc(Br)cc1)C(=O)O Amb25696415 [0,1,0,0,0,0|1,0,2]=4 858 B13R1.133 C\C(=C/c1ccc(C)cc1)C(=O)O Amb4007782 [0,1,0,0,0,0|1,0,2]=4 859 B13R1.133 C\C(=C/c1ccc(Cl)cc1)C(=O)O Amb33800051 [0,1,0,0,0,0|1,0,2]=4 860 B13R1.133 C\C(=C/c1ccc(F)cc1)C(=O)O Amb32835535 [0,1,0,0,0,0|1,0,2]=4 861 B13R1.133 C\C(=C/c1ccc(I)cc1)C(=O)O Amb17844105 [0,1,0,0,0,0|1,0,2]=4 862 B13R1.133 C\C(=C/c1ccc(O)cc1)C(=O)O Amb18128066 [0,1,0,0,0,0|1,0,2]=4 863 B13R1.133 C\C(=C/c1ccc(S)cc1)C(=O)O Amb27607664 [0,1,0,0,0,0|1,0,2]=4 864 B13R1.133 C\C(=C\c1ccc(Br)cc1)C(=O)O Amb28042216 [0,1,0,0,0,0|1,0,2]=4 865 B13R1.133 C\C(=C\c1ccc(Cl)cc1)C(=O)O Amb4010035 [0,1,0,0,0,0|1,0,2]=4 866 B13R1.133 C\C(=C\c1ccc(I)cc1)C(=O)O Amb28186320 [0,1,0,0,0,0|1,0,2]=4 867 B13R1.133 C\C(=C\c1ccc(O)cc1)C(=O)O Amb28186661 [0,1,0,0,0,0|1,0,2]=4 868 B13R1.133 Cc1ccc(CC(=O)C(=O)O)cc1 Amb1140634 [0,1,0,0,0,0|1,0,1]=3 869 B13R1.133 Cc1ccc(CC(=O)C(=O)O)cn1 Amb33344531 [0,1,0,0,0,0|2,0,1]=4 870 B13R1.133 Cc1ccc(CC(=O)C(=O)O)nc1 Amb25710761 [0,1,0,0,0,0|2,0,1]=4 871 B13R1.133 Cc1ccc(CC(Br)C(=O)O)cc1 Amb23320603 [0,1,0,0,0,0|1,0,0]=2 872 B13R1.133 Cc1ccc(CC(C)C(=O)Cl)cc1 Amb5744101 [0,1,0,0,0,0|2,0,0]=3 873 B13R1.133 Cc1ccc(CC(C)C(=O)O)cc1 Amb4009798 [0,1,0,0,0,0|1,0,0]=2 874 B13R1.133 Cc1ccc(CC(C)C(=O)O)cn1 Amb27608956 [0,1,0,0,0,0|2,0,0]=3 875 B13R1.133 Cc1ccc(CC(C)C(=O)O)nc1 Amb25335020 [0,1,0,0,0,0|2,0,0]=3 876 B13R1.133 Cc1ccc(CC(C)C(C)O)cc1 Amb17233453 [0,1,0,0,0,0|2,0,1]=4 877 B13R1.133 Cc1ccc(CC(C)[N+](=O)[O-])cc1 Amb25104684 [0,1,0,0,0,0|2,0,1]=4 878 B13R1.133 Cc1ccc(CC(Cl)C(=O)O)cc1 Amb17204376 [0,1,0,0,0,0|1,0,0]=2 879 B13R1.133 Cc1ccc(CC(Cl)C(N)=O)cc1 Amb17204373 [0,1,0,0,0,0|2,0,0]=3 880 B13R1.133 Cc1ccc(CC(F)C(=O)O)cc1 Amb28187602 [0,1,0,0,0,0|1,0,0]=2 881 B13R1.133 Cc1ccc(CC(N)C(=O)O)cc1 Amb33463040 [0,1,0,0,0,0|0,0,0]=1 882 B13R1.133 Cc1ccc(CC(N)C(=O)O)cc1 Amb3788276 [0,1,0,0,0,0|0,0,0]=1 883 B13R1.133 Cc1ccc(CC(N)C(=O)O)cn1 Amb18193897 [0,1,0,0,0,0|1,0,0]=2 884 B13R1.133 Cc1ccc(CC(N)C(=O)O)nc1 Amb3788312 [0,1,0,0,0,0|1,0,0]=2 885 B13R1.133 Cc1ccc(CC(N)C(=O)O)nn1 Amb18193226 [0,1,0,0,0,0|2,0,0]=3 886 B13R1.133 Cc1ccc(CC(N)C(C)C)cc1 Amb17138833 [0,1,0,0,0,0|2,0,1]=4 887 B13R1.133 Cc1ccc(CC(N)C(F)F)cc1 Amb25067174 [0,1,0,0,0,0|2,0,1]=4 888 B13R1.133 Cc1ccc(CC(N)C(N)=O)cc1 Amb4324459 [0,1,0,0,0,0|1,0,0]=2 889 B13R1.133 Cc1ccc(CC(N)C(N)=O)cn1 Amb33066044 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.133 Cc1ccc(CC(N)C(N)=O)nn1 Amb33308706 [0,1,0,0,0,0|3,0,0]=4 891 B13R1.133 Cc1ccc(CC(N)[PH](=O)O)cc1 Amb27658989 [0,1,0,0,0,0|1,0,0]=2 892 B13R1.133 Cc1ccc(CC(O)C(=O)O)cc1 Amb17138950 [0,1,0,0,0,0|1,0,0]=2 893 B13R1.133 Cc1ccc(CC(O)C(=O)O)cn1 Amb32878624 [0,1,0,0,0,0|2,0,0]=3 894 B13R1.133 Cc1ccc(CC(O)C(=O)O)nc1 Amb33353376 [0,1,0,0,0,0|2,0,0]=3 895 B13R1.133 Cc1ccc(CC(O)C(C)O)cc1 Amb27478391 [0,1,0,0,0,0|2,0,1]=4 896 B13R1.133 Cc1ccc(CC(S)C(=O)O)cc1 Amb2806516 [0,1,0,0,0,0|1,0,0]=2 897 B13R1.133 Cc1ccc(CN(C)C(N)=O)cc1 Amb6749995 [0,1,0,0,0,0|3,0,0]=4 898 B13R1.133 Cc1ccc(CN(N)C(N)=O)cc1 Amb28138031 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.133 Cc1ccc(C[C@@H](C)C(=O)O)cc1 Amb10844190 [0,1,0,0,0,0|1,0,0]=2 900 B13R1.133 Cc1ccc(C[C@@H](Cl)C(=O)O)cc1 Amb27865410 [0,1,0,0,0,0|1,0,0]=2 901 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)cc1 Amb8397010 [0,1,0,0,0,0|0,0,0]=1 902 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)cn1 Amb25836372 [0,1,0,0,0,0|1,0,0]=2 903 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)nn1 Amb33066040 [0,1,0,0,0,0|2,0,0]=3 904 B13R1.133 Cc1ccc(C[C@H](C)C(=O)O)cc1 Amb10844191 [0,1,0,0,0,0|1,0,0]=2 905 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb8397007 [0,1,0,0,0,0|0,0,0]=1 906 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb27609589 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb33872485 [0,1,0,0,0,0|1,0,0]=2 908 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)nn1 Amb33066217 [0,1,0,0,0,0|2,0,0]=3 909 B13R1.133 Cc1ccc(NC(=O)C(=O)O)cc1 Amb838974 [0,1,0,0,0,0|2,0,1]=4 910 B13R1.133 Cc1ccc(NC(C)C(=O)O)cc1 Amb840549 [0,1,0,0,0,0|2,0,0]=3 911 B13R1.133 Cc1ccc(NC(C)C(=O)O)cn1 Amb27609076 [0,1,0,0,0,0|3,0,0]=4 912 B13R1.133 Cc1ccc(N[C@@H](C)C(=O)O)cc1 Amb27453592 [0,1,0,0,0,0|2,0,0]=3 913 B13R1.133 Cc1ccc(OC(C)C(=O)Cl)cc1 Amb16230059 [0,1,0,0,0,0|3,0,0]=4 914 B13R1.133 Cc1ccc(OC(C)C(=O)O)cc1 Amb9702459 [0,1,0,0,0,0|2,0,0]=3 915 B13R1.133 Cc1ccc(OC(C)C(=O)O)cn1 Amb18986235 [0,1,0,0,0,0|3,0,0]=4 916 B13R1.133 Cc1ccc(OC(F)C(=O)O)cn1 Amb27247369 [0,1,0,0,0,0|3,0,0]=4 917 B13R1.133 Cc1ccc(O[C@@H](C)C(=O)O)cn1 Amb27656531 [0,1,0,0,0,0|3,0,0]=4 918 B13R1.133 Cc1ccc(SC(=O)C(=O)O)cc1 Amb28366039 [0,1,0,0,0,0|2,0,1]=4 919 B13R1.133 Cc1ccc(SC(C)C(=O)O)cc1 Amb9745733 [0,1,0,0,0,0|2,0,0]=3 920 B13R1.133 Cc1ccc(\C=C(/F)C(=O)O)cc1 Amb18128596 [0,1,0,0,0,0|1,0,2]=4 921 B13R1.133 Cc1ccc(\C=C(\Br)C(=O)O)cc1 Amb28042378 [0,1,0,0,0,0|1,0,2]=4 922 B13R1.133 Cc1ccc(\C=C(\S)C(=O)O)cc1 Amb25950062 [0,1,0,0,0,0|1,0,2]=4 923 B13R1.133 Cc1cnc(CC(C)C(=O)O)cn1 Amb33375593 [0,1,0,0,0,0|3,0,0]=4 924 B13R1.133 Cc1cnc(CC(N)C(=O)O)cn1 Amb18193225 [0,1,0,0,0,0|2,0,0]=3 925 B13R1.133 Cc1cnc(CC(N)C(=O)O)nc1 Amb33065812 [0,1,0,0,0,0|2,0,0]=3 926 B13R1.133 Cc1cnc(CC(N)C(N)=O)cn1 Amb33066175 [0,1,0,0,0,0|3,0,0]=4 927 B13R1.133 Cc1cnc(CC(N)C(N)=O)nc1 Amb33036770 [0,1,0,0,0,0|3,0,0]=4 928 B13R1.133 Cc1cnc(CC(O)C(=O)O)cn1 Amb33375084 [0,1,0,0,0,0|3,0,0]=4 929 B13R1.133 Cc1cnc(C[C@@H](N)C(=O)O)cn1 Amb33309208 [0,1,0,0,0,0|2,0,0]=3 930 B13R1.133 Cc1cnc(C[C@@H](N)C(=O)O)nc1 Amb33308982 [0,1,0,0,0,0|2,0,0]=3 931 B13R1.133 Cc1cnc(C[C@H](N)C(=O)O)cn1 Amb33066209 [0,1,0,0,0,0|2,0,0]=3 932 B13R1.133 Cc1cnc(C[C@H](N)C(=O)O)nc1 Amb33036958 [0,1,0,0,0,0|2,0,0]=3 933 B13R1.133 Cc1ncc(CC(O)C(=O)O)cn1 Amb33353507 [0,1,0,0,0,0|3,0,0]=4 934 B13R1.133 NC(=O)C(Br)Cc1ccc(Cl)cc1 Amb27433260 [0,1,0,0,0,0|2,0,0]=3 935 B13R1.133 NC(=O)C(Br)Cc1ccc(F)cc1 Amb25774251 [0,1,0,0,0,0|2,0,0]=3 936 B13R1.133 NC(=O)C(Cl)Cc1ccc(Br)cc1 Amb17204830 [0,1,0,0,0,0|2,0,0]=3 937 B13R1.133 NC(=O)C(Cl)Cc1ccc(Cl)cc1 Amb17204475 [0,1,0,0,0,0|2,0,0]=3 938 B13R1.133 NC(=O)C(Cl)Cc1ccc(F)cc1 Amb17204395 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.133 NC(=O)C(Cl)Cc1ccc(I)cc1 Amb27243285 [0,1,0,0,0,0|2,0,0]=3 940 B13R1.133 NC(=O)C(N)Cc1ccc(Br)cc1 Amb4324455 [0,1,0,0,0,0|1,0,0]=2 941 B13R1.133 NC(=O)C(N)Cc1ccc(Br)cn1 Amb25972903 [0,1,0,0,0,0|2,0,0]=3 942 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)cc1 Amb18130578 [0,1,0,0,0,0|1,0,0]=2 943 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)cc1 Amb33550751 [0,1,0,0,0,0|1,0,0]=2 944 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)cn1 Amb33036819 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)nc1 Amb33066191 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)nn1 Amb33309245 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.133 NC(=O)C(N)Cc1ccc(F)cc1 Amb18129023 [0,1,0,0,0,0|1,0,0]=2 948 B13R1.133 NC(=O)C(N)Cc1ccc(I)cc1 Amb26867404 [0,1,0,0,0,0|1,0,0]=2 949 B13R1.133 NC(=O)C(N)Cc1ccc(O)cc1 Amb18972786 [0,1,0,0,0,0|1,0,0]=2 950 B13R1.133 NC(=O)C(N)Cc1ccc(O)cc1 Amb33527610 [0,1,0,0,0,0|1,0,0]=2 951 B13R1.133 NC(=O)C(N)Cc1cnc(Cl)cn1 Amb32789394 [0,1,0,0,0,0|3,0,0]=4 952 B13R1.133 NC(=O)C(O)Cc1ccc(N)cc1 Amb27968354 [0,1,0,0,0,0|2,0,0]=3 953 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(Br)cc1 Amb27756310 [0,1,0,0,0,0|1,0,0]=2 954 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb28121098 [0,1,0,0,0,0|1,0,0]=2 955 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb22745198 [0,1,0,0,0,0|1,0,0]=2 956 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb8385765 [0,1,0,0,0,0|1,0,0]=2 957 B13R1.133 NC(=O)[C@H](N)Cc1ccc(O)cc1 Amb16183978 [0,1,0,0,0,0|1,0,0]=2 958 B13R1.133 NC(=O)[C@H](N)Cc1ccc(O)cc1 Amb22432215 [0,1,0,0,0,0|1,0,0]=2 959 B13R1.133 NC(CC1=CNC(=O)C=C1)C(=O)O Amb24649985 [0,1,0,0,0,0|1,0,0]=2 960 B13R1.133 NC(CC1C=C=C(O)C=C1)C(=O)O Amb27872317 [0,1,0,0,0,0|0,0,2]=3 961 B13R1.133 NC(Cc1cc[n+]([O-])cc1)C(=O)O Amb17594678 [0,1,0,0,0,0|1,0,0]=2 962 B13R1.133 NC(Cc1ccc(Br)cc1)C(=O)O Amb22490717 [0,1,0,0,0,0|0,0,0]=1 963 B13R1.133 NC(Cc1ccc(Br)cc1)C(=O)O Amb2713315 [0,1,0,0,0,0|0,0,0]=1 964 B13R1.133 NC(Cc1ccc(Br)cc1)C(F)F Amb27867234 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.133 NC(Cc1ccc(Br)cn1)C(=O)O Amb26594126 [0,1,0,0,0,0|1,0,0]=2 966 B13R1.133 NC(Cc1ccc(Br)nc1)C(=O)O Amb26594363 [0,1,0,0,0,0|1,0,0]=2 967 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)Cl Amb27867320 [0,1,0,0,0,0|1,0,0]=2 968 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb30867690 [0,1,0,0,0,0|0,0,0]=1 969 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb8469810 [0,1,0,0,0,0|0,0,0]=1 970 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb9724294 [0,1,0,0,0,0|0,0,0]=1 971 B13R1.133 NC(Cc1ccc(Cl)cc1)[PH](=O)O Amb27867360 [0,1,0,0,0,0|1,0,0]=2 972 B13R1.133 NC(Cc1ccc(Cl)cn1)C(=O)O Amb27268269 [0,1,0,0,0,0|1,0,0]=2 973 B13R1.133 NC(Cc1ccc(Cl)cn1)C(=O)O Amb35747081 [0,1,0,0,0,0|1,0,0]=2 974 B13R1.133 NC(Cc1ccc(Cl)nc1)C(=O)O Amb25282233 [0,1,0,0,0,0|1,0,0]=2 975 B13R1.133 NC(Cc1ccc(Cl)nn1)C(=O)O Amb33308646 [0,1,0,0,0,0|2,0,0]=3 976 B13R1.133 NC(Cc1ccc(F)cc1)C(=O)O Amb20246818 [0,1,0,0,0,0|0,0,0]=1 977 B13R1.133 NC(Cc1ccc(F)cc1)C(=O)O Amb6342375 [0,1,0,0,0,0|0,0,0]=1 978 B13R1.133 NC(Cc1ccc(F)cc1)C(F)F Amb26535908 [0,1,0,0,0,0|2,0,1]=4 979 B13R1.133 NC(Cc1ccc(F)cn1)C(=O)O Amb25843769 [0,1,0,0,0,0|1,0,0]=2 980 B13R1.133 NC(Cc1ccc(F)nc1)C(=O)O Amb24351607 [0,1,0,0,0,0|1,0,0]=2 981 B13R1.133 NC(Cc1ccc(I)cc1)C(=O)O Amb3796904 [0,1,0,0,0,0|0,0,0]=1 982 B13R1.133 NC(Cc1ccc(I)cn1)C(=O)O Amb28397971 [0,1,0,0,0,0|1,0,0]=2 983 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)O Amb22730237 [0,1,0,0,0,0|0,0,0]=1 984 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)O Amb9703113 [0,1,0,0,0,0|0,0,0]=1 985 B13R1.133 NC(Cc1ccc(O)cc1)C(F)F Amb28251450 [0,1,0,0,0,0|2,0,1]=4 986 B13R1.133 NC(Cc1ccc(O)cn1)C(=O)O Amb28137820 [0,1,0,0,0,0|1,0,0]=2 987 B13R1.133 NC(Cc1ccc(O)nc1)C(=O)O Amb35746579 [0,1,0,0,0,0|1,0,0]=2 988 B13R1.133 NC(Cc1ccc(S)cc1)C(=O)O Amb27870593 [0,1,0,0,0,0|0,0,0]=1 989 B13R1.133 NC(Cc1ccc(S)cc1)C(=O)O Amb33482800 [0,1,0,0,0,0|0,0,0]=1 990 B13R1.133 NC(Cc1cnc(Cl)cn1)C(=O)O Amb33308607 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.133 NC(Cc1ncc(Br)cn1)C(=O)O Amb33334354 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.133 N[C@@H](CC1=CCC(=O)CC1)C(=O)O Amb27451296 [0,1,0,0,0,0|0,0,3]=4 993 B13R1.133 N[C@@H](CC1=CNC(=O)C=C1)C(=O)O Amb25109157 [0,1,0,0,0,0|1,0,0]=2 994 B13R1.133 N[C@@H](Cc1ccc(Br)cc1)C(=O)O Amb6295861 [0,1,0,0,0,0|0,0,0]=1 995 B13R1.133 N[C@@H](Cc1ccc(Br)cn1)C(=O)O Amb25364955 [0,1,0,0,0,0|1,0,0]=2 996 B13R1.133 N[C@@H](Cc1ccc(Br)cn1)C(=O)O Amb30869509 [0,1,0,0,0,0|1,0,0]=2 997 B13R1.133 N[C@@H](Cc1ccc(Cl)cc1)C(=O)O Amb2719692 [0,1,0,0,0,0|0,0,0]=1 998 B13R1.133 N[C@@H](Cc1ccc(Cl)cn1)C(=O)O Amb27585540 [0,1,0,0,0,0|1,0,0]=2 999 B13R1.133 N[C@@H](Cc1ccc(Cl)nc1)C(=O)O Amb26472566 [0,1,0,0,0,0|1,0,0]=2 1000 B13R1.133 N[C@@H](Cc1ccc(Cl)nn1)C(=O)O Amb32862465 [0,1,0,0,0,0|2,0,0]=3 1001 B13R1.133 N[C@@H](Cc1ccc(F)cc1)C(=O)O Amb2688314 [0,1,0,0,0,0|0,0,0]=1 1002 B13R1.133 N[C@@H](Cc1ccc(F)cc1)C(=O)O Amb6295863 [0,1,0,0,0,0|0,0,0]=1 1003 B13R1.133 N[C@@H](Cc1ccc(F)nc1)C(=O)O Amb25858507 [0,1,0,0,0,0|1,0,0]=2 1004 B13R1.133 N[C@@H](Cc1ccc(I)cc1)C(=O)O Amb3941497 [0,1,0,0,0,0|0,0,0]=1 1005 B13R1.133 N[C@@H](Cc1ccc(I)nc1)C(=O)O Amb28282605 [0,1,0,0,0,0|1,0,0]=2 1006 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(=O)O Amb22351112 [0,1,0,0,0,0|0,0,0]=1 1007 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(=O)O Amb533651 [0,1,0,0,0,0|0,0,0]=1 1008 B13R1.133 N[C@@H](Cc1ccc(O)cn1)C(=O)O Amb27810763 [0,1,0,0,0,0|1,0,0]=2 1009 B13R1.133 N[C@@H](Cc1ccc([O-])cc1)C(=O)[O-] Amb10072562 [0,1,0,0,0,0|0,0,1]=2 1010 B13R1.133 N[C@@H](Cc1cnc(Cl)cn1)C(=O)O Amb33069943 [0,1,0,0,0,0|2,0,0]=3 1011 B13R1.133 N[C@H](CC1=CNC(=O)C=C1)C(=O)O Amb27229771 [0,1,0,0,0,0|1,0,0]=2 1012 B13R1.133 N[C@H](CN1C=CC(=O)C=C1)C(=O)O Amb27950000 [0,1,0,0,0,0|1,0,0]=2 1013 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(=O)O Amb20241889 [0,1,0,0,0,0|0,0,0]=1 1014 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(=O)O Amb3938905 [0,1,0,0,0,0|0,0,0]=1 1015 B13R1.133 N[C@H](Cc1ccc(Br)cn1)C(=O)O Amb25278417 [0,1,0,0,0,0|1,0,0]=2 1016 B13R1.133 N[C@H](Cc1ccc(Br)nc1)C(=O)O Amb27402625 [0,1,0,0,0,0|1,0,0]=2 1017 B13R1.133 N[C@H](Cc1ccc(Cl)cc1)C(=O)O Amb6295862 [0,1,0,0,0,0|0,0,0]=1 1018 B13R1.133 N[C@H](Cc1ccc(Cl)cc1)C(=O)O Amb8390370 [0,1,0,0,0,0|0,0,0]=1 1019 B13R1.133 N[C@H](Cc1ccc(Cl)cn1)C(=O)O Amb26034050 [0,1,0,0,0,0|1,0,0]=2 1020 B13R1.133 N[C@H](Cc1ccc(Cl)nc1)C(=O)O Amb26484990 [0,1,0,0,0,0|1,0,0]=2 1021 B13R1.133 N[C@H](Cc1ccc(Cl)nn1)C(=O)O Amb33127510 [0,1,0,0,0,0|2,0,0]=3 1022 B13R1.133 N[C@H](Cc1ccc(F)cc1)C(=O)O Amb2720054 [0,1,0,0,0,0|0,0,0]=1 1023 B13R1.133 N[C@H](Cc1ccc(F)cc1)C(=O)O Amb4034642 [0,1,0,0,0,0|0,0,0]=1 1024 B13R1.133 N[C@H](Cc1ccc(F)cn1)C(=O)O Amb28346894 [0,1,0,0,0,0|1,0,0]=2 1025 B13R1.133 N[C@H](Cc1ccc(F)nc1)C(=O)O Amb24680870 [0,1,0,0,0,0|1,0,0]=2 1026 B13R1.133 N[C@H](Cc1ccc(I)cc1)C(=O)O Amb6298337 [0,1,0,0,0,0|0,0,0]=1 1027 B13R1.133 N[C@H](Cc1ccc(O)cc1)C(=O)O Amb2718757 [0,1,0,0,0,0|0,0,0]=1 1028 B13R1.133 N[C@H](Cc1ccc(O)cn1)C(=O)O Amb27250648 [0,1,0,0,0,0|1,0,0]=2 1029 B13R1.133 N[C@H](Cc1cnc(Cl)cn1)C(=O)O Amb33065853 [0,1,0,0,0,0|2,0,0]=3 1030 B13R1.133 N\C(=C\c1ccc(Br)cc1)C(=O)O Amb29883100 [0,1,0,0,0,0|0,0,2]=3 1031 B13R1.133 N\C(=C\c1ccc(Br)cn1)C(=O)O Amb35644575 [0,1,0,0,0,0|1,0,2]=4 1032 B13R1.133 N\C(=C\c1ccc(Cl)cc1)C(=O)O Amb27399082 [0,1,0,0,0,0|0,0,2]=3 1033 B13R1.133 Nc1ccc(CC(=O)C(=O)O)cc1 Amb24433983 [0,1,0,0,0,0|1,0,1]=3 1034 B13R1.133 Nc1ccc(CC(N)C(=O)O)cc1 Amb24079001 [0,1,0,0,0,0|0,0,0]=1 1035 B13R1.133 Nc1ccc(CC(N)C(=O)O)cc1 Amb6357138 [0,1,0,0,0,0|0,0,0]=1 1036 B13R1.133 Nc1ccc(CC(O)C(=O)O)cc1 Amb24635658 [0,1,0,0,0,0|1,0,0]=2 1037 B13R1.133 Nc1ccc(CC(O)C(=O)O)cn1 Amb27946962 [0,1,0,0,0,0|2,0,0]=3 1038 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)cc1 Amb19130487 [0,1,0,0,0,0|0,0,0]=1 1039 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)cc1 Amb8397002 [0,1,0,0,0,0|0,0,0]=1 1040 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)nc1 Amb27447182 [0,1,0,0,0,0|1,0,0]=2 1041 B13R1.133 Nc1ccc(C[C@H](N)C(=O)O)cc1 Amb6295864 [0,1,0,0,0,0|0,0,0]=1 1042 B13R1.133 Nc1ccc(C[C@H](N)C(=O)O)cc1 Amb6365459 [0,1,0,0,0,0|0,0,0]=1 1043 B13R1.133 Nc1ccc(C[C@H](O)C(=O)O)cc1 Amb27403844 [0,1,0,0,0,0|1,0,0]=2 1044 B13R1.133 Nc1ccc(NC(=O)C(=O)O)cc1 Amb1348301 [0,1,0,0,0,0|2,0,1]=4 1045 B13R1.133 Nc1ccc(NC(=S)C(=O)O)cc1 Amb27858852 [0,1,0,0,0,0|2,0,1]=4 1046 B13R1.133 Nc1ccc(\C=C(\F)C(=O)O)cc1 Amb27659003 [0,1,0,0,0,0|1,0,2]=4 1047 B13R1.133 Nc1ncc(CC(N)C(=O)O)cn1 Amb26519679 [0,1,0,0,0,0|2,0,0]=3 1048 B13R1.133 O=C(Cl)C(Cl)Cc1ccc(Cl)cc1 Amb17204629 [0,1,0,0,0,0|2,0,0]=3 1049 B13R1.133 O=C(Cl)[C@@H](Cl)Cc1ccc(Cl)cc1 Amb27617643 [0,1,0,0,0,0|2,0,0]=3 1050 B13R1.133 O=C(O)C(=O)Cc1ccc(Br)cc1 Amb1140012 [0,1,0,0,0,0|1,0,1]=3 1051 B13R1.133 O=C(O)C(=O)Cc1ccc(Br)cn1 Amb25091452 [0,1,0,0,0,0|2,0,1]=4 1052 B13R1.133 O=C(O)C(=O)Cc1ccc(Br)nc1 Amb33387727 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.133 O=C(O)C(=O)Cc1ccc(Cl)cc1 Amb1141688 [0,1,0,0,0,0|1,0,1]=3 1054 B13R1.133 O=C(O)C(=O)Cc1ccc(Cl)cn1 Amb33390549 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.133 O=C(O)C(=O)Cc1ccc(Cl)nc1 Amb33261566 [0,1,0,0,0,0|2,0,1]=4 1056 B13R1.133 O=C(O)C(=O)Cc1ccc(F)cc1 Amb1130482 [0,1,0,0,0,0|1,0,1]=3 1057 B13R1.133 O=C(O)C(=O)Cc1ccc(F)cn1 Amb33317396 [0,1,0,0,0,0|2,0,1]=4 1058 B13R1.133 O=C(O)C(=O)Cc1ccc(F)nc1 Amb33426564 [0,1,0,0,0,0|2,0,1]=4 1059 B13R1.133 O=C(O)C(=O)Cc1ccc(I)cc1 Amb26533898 [0,1,0,0,0,0|1,0,1]=3 1060 B13R1.133 O=C(O)C(=O)Cc1ccc(O)cc1 Amb1124591 [0,1,0,0,0,0|1,0,1]=3 1061 B13R1.133 O=C(O)C(=O)Nc1ccc(Br)cc1 Amb838965 [0,1,0,0,0,0|2,0,1]=4 1062 B13R1.133 O=C(O)C(=O)Nc1ccc(Cl)cc1 Amb2371148 [0,1,0,0,0,0|2,0,1]=4 1063 B13R1.133 O=C(O)C(=O)Nc1ccc(F)cc1 Amb9303980 [0,1,0,0,0,0|2,0,1]=4 1064 B13R1.133 O=C(O)C(=O)Nc1ccc(I)cc1 Amb9303921 [0,1,0,0,0,0|2,0,1]=4 1065 B13R1.133 O=C(O)C(Br)Cc1ccc(Cl)cc1 Amb23320619 [0,1,0,0,0,0|1,0,0]=2 1066 B13R1.133 O=C(O)C(Br)Cc1ccc(F)cc1 Amb2480736 [0,1,0,0,0,0|1,0,0]=2 1067 B13R1.133 O=C(O)C(Cl)Cc1ccc(Br)cc1 Amb4165088 [0,1,0,0,0,0|1,0,0]=2 1068 B13R1.133 O=C(O)C(Cl)Cc1ccc(Cl)cc1 Amb17204492 [0,1,0,0,0,0|1,0,0]=2 1069 B13R1.133 O=C(O)C(Cl)Cc1ccc(F)cc1 Amb17204398 [0,1,0,0,0,0|1,0,0]=2 1070 B13R1.133 O=C(O)C(F)Cc1ccc(Br)cc1 Amb27221424 [0,1,0,0,0,0|1,0,0]=2 1071 B13R1.133 O=C(O)C(F)Cc1ccc(F)cc1 Amb27608914 [0,1,0,0,0,0|1,0,0]=2 1072 B13R1.133 O=C(O)C(F)Cc1ccc(I)cc1 Amb27627165 [0,1,0,0,0,0|1,0,0]=2 1073 B13R1.133 O=C(O)C(F)Oc1ccc(F)cc1 Amb27787626 [0,1,0,0,0,0|2,0,0]=3 1074 B13R1.133 O=C(O)C(F)Oc1ccc(I)cc1 Amb28058790 [0,1,0,0,0,0|2,0,0]=3 1075 B13R1.133 O=C(O)C(F)Sc1ccc(Br)cc1 Amb27883688 [0,1,0,0,0,0|2,0,0]=3 1076 B13R1.133 O=C(O)C(F)Sc1ccc(Cl)cc1 Amb27771739 [0,1,0,0,0,0|2,0,0]=3 1077 B13R1.133 O=C(O)C(O)Cc1ccc(Br)cc1 Amb17159703 [0,1,0,0,0,0|1,0,0]=2 1078 B13R1.133 O=C(O)C(O)Cc1ccc(Br)cn1 Amb24410790 [0,1,0,0,0,0|2,0,0]=3 1079 B13R1.133 O=C(O)C(O)Cc1ccc(Br)nc1 Amb33387745 [0,1,0,0,0,0|2,0,0]=3 1080 B13R1.133 O=C(O)C(O)Cc1ccc(Cl)cc1 Amb17139824 [0,1,0,0,0,0|1,0,0]=2 1081 B13R1.133 O=C(O)C(O)Cc1ccc(Cl)cn1 Amb33390561 [0,1,0,0,0,0|2,0,0]=3 1082 B13R1.133 O=C(O)C(O)Cc1ccc(Cl)nc1 Amb33261189 [0,1,0,0,0,0|2,0,0]=3 1083 B13R1.133 O=C(O)C(O)Cc1ccc(F)cc1 Amb17139080 [0,1,0,0,0,0|1,0,0]=2 1084 B13R1.133 O=C(O)C(O)Cc1ccc(F)cn1 Amb25963177 [0,1,0,0,0,0|2,0,0]=3 1085 B13R1.133 O=C(O)C(O)Cc1ccc(F)nc1 Amb33426547 [0,1,0,0,0,0|2,0,0]=3 1086 B13R1.133 O=C(O)C(O)Cc1ccc(I)cc1 Amb25079589 [0,1,0,0,0,0|1,0,0]=2 1087 B13R1.133 O=C(O)C(O)Cc1ccc(O)cc1 Amb9813717 [0,1,0,0,0,0|1,0,0]=2 1088 B13R1.133 O=C(O)C(O)Cc1ncc(Br)cn1 Amb33334711 [0,1,0,0,0,0|3,0,0]=4 1089 B13R1.133 O=C(O)C(S)Cc1ccc(Br)cn1 Amb27427237 [0,1,0,0,0,0|2,0,0]=3 1090 B13R1.133 O=C(O)C(S)Cc1ccc(F)cc1 Amb33250291 [0,1,0,0,0,0|1,0,0]=2 1091 B13R1.133 O=C(O)[C@@H](F)Cc1ccc(O)cc1 Amb27478048 [0,1,0,0,0,0|1,0,0]=2 1092 B13R1.133 O=C(O)[C@@H](O)Cc1ccc(Br)cc1 Amb25943047 [0,1,0,0,0,0|1,0,0]=2 1093 B13R1.133 O=C(O)[C@@H](O)Cc1ccc(Cl)cc1 Amb25816136 [0,1,0,0,0,0|1,0,0]=2 1094 B13R1.133 O=C(O)[C@@H](O)Cc1ccc(F)cc1 Amb27401894 [0,1,0,0,0,0|1,0,0]=2 1095 B13R1.133 O=C(O)[C@@H](O)Cc1ccc(O)cc1 Amb8390585 [0,1,0,0,0,0|1,0,0]=2 1096 B13R1.133 O=C(O)[C@H](O)Cc1ccc(Cl)cc1 Amb25731054 [0,1,0,0,0,0|1,0,0]=2 1097 B13R1.133 O=C(O)[C@H](O)Cc1ccc(O)cc1 Amb22388639 [0,1,0,0,0,0|1,0,0]=2 1098 B13R1.133 O=C(O)\C(F)=C\c1ccc(Br)cc1 Amb27415963 [0,1,0,0,0,0|1,0,2]=4 1099 B13R1.133 O=C(O)\C(F)=C\c1ccc(Cl)cc1 Amb25209028 [0,1,0,0,0,0|1,0,2]=4 1100 B13R1.133 O=C(O)\C(F)=C\c1ccc(F)cc1 Amb25858140 [0,1,0,0,0,0|1,0,2]=4 1101 B13R1.133 O=C(O)\C(O)=C\c1ccc(F)cc1 Amb22549399 [0,1,0,0,0,0|1,0,2]=4 1102 B13R1.133 O=C(O)\C(S)=C/c1ccc(Cl)cc1 Amb2550970 [0,1,0,0,0,0|1,0,2]=4 1103 B13R1.133 O=C(O)\C(S)=C\c1ccc(Br)cc1 Amb1250113 [0,1,0,0,0,0|1,0,2]=4 1104 B13R1.133 O=C(O)\C(S)=C\c1ccc(F)cc1 Amb1250112 [0,1,0,0,0,0|1,0,2]=4 1105 B13R1.133 O=C(O)\C(S)=C\c1ccc(I)cc1 Amb24400252 [0,1,0,0,0,0|1,0,2]=4 1106 B13R1.135 C#CC(=O)C(N)Cc1ccccc1 Amb28313542 [0,1,0,0,0,0|1,0,0]=2 1107 B13R1.135 C#CC(=O)[C@@H](N)Cc1ccccc1 Amb30024205 [0,1,0,0,0,0|1,0,0]=2 1108 B13R1.135 C#CC(=O)[C@H](N)Cc1ccccc1 Amb35588700 [0,1,0,0,0,0|1,0,0]=2 1109 B13R1.135 C#CC(O)[C@@H](N)Cc1ccccc1 Amb30024276 [0,1,0,0,0,0|1,0,1]=3 1110 B13R1.135 C#CC(O)[C@H](N)Cc1ccccc1 Amb30023991 [0,1,0,0,0,0|1,0,1]=3 1111 B13R1.135 C#C[C@@H](O)[C@@H](N)Cc1ccccc1 Amb28397990 [0,1,0,0,0,0|1,0,1]=3 1112 B13R1.135 C#C[C@@H](O)[C@H](C)Cc1ccccc1 Amb28065981 [0,1,0,0,0,0|2,0,1]=4 1113 B13R1.135 C=C(Cc1ccccc1)C(=O)OC Amb8390348 [0,1,0,0,0,0|1,0,1]=3 1114 B13R1.135 C=C=C(C)C(O)Cc1ccccc1 Amb28381777 [0,1,0,0,0,0|3,0,0]=4 1115 B13R1.135 CC(Oc1ccccc1)C(=O)CCl Amb17139731 [0,1,0,0,0,0|3,0,0]=4 1116 B13R1.135 CC(Oc1ccccc1)C(=O)NN Amb6361387 [0,1,0,0,0,0|3,0,0]=4 1117 B13R1.135 CC(Oc1ccccc1)C(=O)NO Amb28064721 [0,1,0,0,0,0|2,0,0]=3 1118 B13R1.135 CC(Oc1ccccc1)\C(N)=N\O Amb18184695 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.135 CC(Oc1cccnc1)C(=O)NO Amb28190110 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.135 CC(Sc1ccccc1)C(=O)NO Amb27790142 [0,1,0,0,0,0|2,0,0]=3 1121 B13R1.135 CC(Sc1ccccc1)\C(N)=N\O Amb18325027 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.135 CC(Sc1ccccn1)C(=O)NO Amb28349732 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.135 CCC(=O)C(C)Cc1ccccc1 Amb17233202 [0,1,0,0,0,0|2,0,0]=3 1124 B13R1.135 CCC(=O)C(C)Sc1ccccc1 Amb32683032 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.135 CCC(=O)N(C)Cc1ccccc1 Amb3886753 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.135 CN(Cc1ccccc1)C(=O)CBr Amb17332398 [0,1,0,0,0,0|3,0,0]=4 1127 B13R1.135 CN(Cc1ccccc1)C(=O)CCl Amb1204773 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.135 CN(Cc1ccccc1)C(=O)CN Amb33545703 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.135 CN(Cc1ccccc1)C(=O)CO Amb5798080 [0,1,0,0,0,0|2,0,0]=3 1130 B13R1.135 CN(Cc1ccccc1)\C(N)=N\O Amb18186378 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,0|2,0,1]=4 1132 B13R1.135 CNC(=O)C(Br)Cc1ccccc1 Amb27610156 [0,1,0,0,0,0|2,0,0]=3 1133 B13R1.135 CNC(=O)C(C)Oc1ccccc1 Amb3886772 [0,1,0,0,0,0|3,0,0]=4 1134 B13R1.135 CNC(=O)C(C)Sc1ccccc1 Amb8328078 [0,1,0,0,0,0|3,0,0]=4 1135 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,0|1,0,0]=2 1136 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb6279885 [0,1,0,0,0,0|1,0,0]=2 1137 B13R1.135 CNC(=O)C(N)Cc1ccccn1 Amb27179833 [0,1,0,0,0,0|2,0,0]=3 1138 B13R1.135 CNC(=O)C(N)Cc1cccnc1 Amb27220814 [0,1,0,0,0,0|2,0,0]=3 1139 B13R1.135 CNC(=O)C(N)Cc1ccncc1 Amb27252186 [0,1,0,0,0,0|2,0,0]=3 1140 B13R1.135 CNC(=O)C(N)Cc1ccnnc1 Amb33230892 [0,1,0,0,0,0|3,0,0]=4 1141 B13R1.135 CNC(=O)C(O)Cc1ccccc1 Amb27789590 [0,1,0,0,0,0|2,0,0]=3 1142 B13R1.135 CNC(=O)C(S)Cc1ccccc1 Amb27207974 [0,1,0,0,0,0|2,0,0]=3 1143 B13R1.135 CNC(=O)N(C)Cc1ccccc1 Amb27168216 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.135 CNC(=O)N(O)Cc1ccccc1 Amb28255708 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb10878601 [0,1,0,0,0,0|1,0,0]=2 1146 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb15740701 [0,1,0,0,0,0|1,0,0]=2 1147 B13R1.135 CNC(=O)[C@@H](N)Cc1ccncc1 Amb28075255 [0,1,0,0,0,0|2,0,0]=3 1148 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb10608885 [0,1,0,0,0,0|1,0,0]=2 1149 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb33801562 [0,1,0,0,0,0|1,0,0]=2 1150 B13R1.135 CNC(=O)[C@H](N)Cc1cccnc1 Amb27804012 [0,1,0,0,0,0|2,0,0]=3 1151 B13R1.135 CNC(=O)[C@H](N)Cc1ccncc1 Amb28055852 [0,1,0,0,0,0|2,0,0]=3 1152 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,0|1,0,1]=3 1153 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,0,0|2,0,1]=4 1154 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,0,0|2,0,1]=4 1155 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,0,0|2,0,1]=4 1156 B13R1.135 COC(=O)C(Br)Cc1ccccc1 Amb9758191 [0,1,0,0,0,0|1,0,0]=2 1157 B13R1.135 COC(=O)C(C)Cc1ccccc1 Amb32412695 [0,1,0,0,0,0|1,0,0]=2 1158 B13R1.135 COC(=O)C(C)Nc1ccccc1 Amb4137936 [0,1,0,0,0,0|2,0,0]=3 1159 B13R1.135 COC(=O)C(C)Nc1cccnc1 Amb18270387 [0,1,0,0,0,0|3,0,0]=4 1160 B13R1.135 COC(=O)C(C)Oc1ccccc1 Amb2780660 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.135 COC(=O)C(Cl)Cc1ccccc1 Amb17204377 [0,1,0,0,0,0|1,0,0]=2 1162 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb1779248 [0,1,0,0,0,0|0,0,0]=1 1163 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,0|0,0,0]=1 1164 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb6335185 [0,1,0,0,0,0|0,0,0]=1 1165 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb30867720 [0,1,0,0,0,0|1,0,0]=2 1166 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb32645721 [0,1,0,0,0,0|1,0,0]=2 1167 B13R1.135 COC(=O)C(N)Cc1cccnc1 Amb33042860 [0,1,0,0,0,0|1,0,0]=2 1168 B13R1.135 COC(=O)C(N)Cc1cccnn1 Amb32937012 [0,1,0,0,0,0|2,0,0]=3 1169 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb28555952 [0,1,0,0,0,0|1,0,0]=2 1170 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb33506229 [0,1,0,0,0,0|1,0,0]=2 1171 B13R1.135 COC(=O)C(N)Cc1ccncn1 Amb32661109 [0,1,0,0,0,0|2,0,0]=3 1172 B13R1.135 COC(=O)C(N)Cc1ccnnc1 Amb33230885 [0,1,0,0,0,0|2,0,0]=3 1173 B13R1.135 COC(=O)C(N)Cc1cnccn1 Amb33127563 [0,1,0,0,0,0|2,0,0]=3 1174 B13R1.135 COC(=O)C(N)Cc1cncnc1 Amb32413242 [0,1,0,0,0,0|2,0,0]=3 1175 B13R1.135 COC(=O)C(N)Cc1ncccn1 Amb32645693 [0,1,0,0,0,0|2,0,0]=3 1176 B13R1.135 COC(=O)C(O)Cc1ccccc1 Amb17138951 [0,1,0,0,0,0|1,0,0]=2 1177 B13R1.135 COC(=O)C(O)Cc1ccccn1 Amb17138998 [0,1,0,0,0,0|2,0,0]=3 1178 B13R1.135 COC(=O)C(O)Cc1cccnc1 Amb17138999 [0,1,0,0,0,0|2,0,0]=3 1179 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb17139000 [0,1,0,0,0,0|2,0,0]=3 1180 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb32663204 [0,1,0,0,0,0|2,0,0]=3 1181 B13R1.135 COC(=O)C(O)Cc1ccncn1 Amb33268573 [0,1,0,0,0,0|3,0,0]=4 1182 B13R1.135 COC(=O)C(O)Cc1cnccn1 Amb33429670 [0,1,0,0,0,0|3,0,0]=4 1183 B13R1.135 COC(=O)C(O)Cc1cncnc1 Amb32876396 [0,1,0,0,0,0|3,0,0]=4 1184 B13R1.135 COC(=O)C(O)Cc1ncccn1 Amb33270049 [0,1,0,0,0,0|3,0,0]=4 1185 B13R1.135 COC(=O)[C@@H](C)Nc1cccnc1 Amb27430339 [0,1,0,0,0,0|3,0,0]=4 1186 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb533665 [0,1,0,0,0,0|0,0,0]=1 1187 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb6364970 [0,1,0,0,0,0|0,0,0]=1 1188 B13R1.135 COC(=O)[C@@H](N)Cc1cccnc1 Amb22756662 [0,1,0,0,0,0|1,0,0]=2 1189 B13R1.135 COC(=O)[C@@H](N)Cc1ncccn1 Amb30527040 [0,1,0,0,0,0|2,0,0]=3 1190 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 Amb5722454 [0,1,0,0,0,0|1,0,0]=2 1191 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb3939007 [0,1,0,0,0,0|0,0,0]=1 1192 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb8396272 [0,1,0,0,0,0|0,0,0]=1 1193 B13R1.135 COC(=O)[C@H](N)Cc1ccccn1 Amb30527042 [0,1,0,0,0,0|1,0,0]=2 1194 B13R1.135 COC(=O)[C@H](N)Cc1cccnc1 Amb15691971 [0,1,0,0,0,0|1,0,0]=2 1195 B13R1.135 COC(=O)[C@H](O)Cc1ccccc1 Amb8390894 [0,1,0,0,0,0|1,0,0]=2 1196 B13R1.135 COC(=O)\C(Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,0,0|1,0,2]=4 1197 B13R1.135 C[C@@H](Cc1ccccc1)[C@@H](O)C#N Amb28123699 [0,1,0,0,0,0|2,0,1]=4 1198 B13R1.135 C[C@@H](Cc1ccccc1)[C@H](O)C#N Amb28188310 [0,1,0,0,0,0|2,0,1]=4 1199 B13R1.135 C\C(CO)=C(\C)Cc1ccccc1 Amb27651727 [0,1,0,0,0,0|2,0,1]=4 1200 B13R1.135 N#C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb28401086 [0,1,0,0,0,0|2,0,1]=4 1201 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,0,0|0,0,0]=1 1202 B13R1.135 NC(Cc1ccccc1)C(O)CF Amb10842057 [0,1,0,0,0,0|1,0,1]=3 1203 B13R1.135 NCC(=O)N(O)Cc1ccccc1 Amb27812961 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.135 NNC(=O)C(N)Cc1ccccc1 Amb16231875 [0,1,0,0,0,0|1,0,0]=2 1205 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb3717717 [0,1,0,0,0,0|1,0,0]=2 1206 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)CCl Amb31291751 [0,1,0,0,0,0|1,0,0]=2 1207 B13R1.135 N[C@H](Cc1ccccc1)C(=O)NO Amb27587806 [0,1,0,0,0,0|0,0,0]=1 1208 B13R1.135 N\C(=N\O)C(O)Cc1ccccc1 Amb27623340 [0,1,0,0,0,0|2,0,0]=3 1209 B13R1.135 O=C(CO)N(O)Cc1ccccc1 Amb27835032 [0,1,0,0,0,0|2,0,0]=3 1210 B13R1.135 O=C(NO)C(=O)Nc1ccccc1 Amb27439064 [0,1,0,0,0,0|2,0,1]=4 1211 B13R1.135 O=C(NO)C(F)Cc1ccccc1 Amb28182984 [0,1,0,0,0,0|1,0,0]=2 1212 B13R1.148 C=C(C)C(N)Cc1cccc(Cl)c1 Amb27410837 [0,1,0,0,0,0|2,0,0]=3 1213 B13R1.148 C=C(C)C(O)Cc1cccc(Cl)c1 Amb28048435 [0,1,0,0,0,0|3,0,0]=4 1214 B13R1.148 C=C(C)C(O)Cc1cccc(N)c1 Amb29875258 [0,1,0,0,0,0|3,0,0]=4 1215 B13R1.148 C=C(Cc1cccc(O)c1)C(=O)O Amb28291558 [0,1,0,0,0,0|1,0,1]=3 1216 B13R1.148 CC(=O)C(=O)Cc1cccc(Br)c1 Amb23603630 [0,1,0,0,0,0|2,0,1]=4 1217 B13R1.148 CC(=O)C(=O)Cc1cccc(C)c1 Amb23603621 [0,1,0,0,0,0|2,0,1]=4 1218 B13R1.148 CC(=O)C(=O)Cc1cccc(Cl)c1 Amb23603628 [0,1,0,0,0,0|2,0,1]=4 1219 B13R1.148 CC(=O)C(=O)Cc1cccc(F)c1 Amb23603623 [0,1,0,0,0,0|2,0,1]=4 1220 B13R1.148 CC(=O)C(Br)Cc1cccc(C)c1 Amb17507803 [0,1,0,0,0,0|2,0,0]=3 1221 B13R1.148 CC(=O)C(Br)Cc1cccc(Cl)c1 Amb18589745 [0,1,0,0,0,0|2,0,0]=3 1222 B13R1.148 CC(=O)C(Br)Cc1cccc(F)c1 Amb26497024 [0,1,0,0,0,0|2,0,0]=3 1223 B13R1.148 CC(=O)C(Br)Cc1cncc(Br)c1 Amb27668644 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.148 CC(=O)C(Br)Cc1cncc(Cl)c1 Amb35671334 [0,1,0,0,0,0|3,0,0]=4 1225 B13R1.148 CC(=O)C(C)Cc1cccc(Br)c1 Amb17255482 [0,1,0,0,0,0|2,0,0]=3 1226 B13R1.148 CC(=O)C(C)Cc1cccc(C)c1 Amb17233204 [0,1,0,0,0,0|2,0,0]=3 1227 B13R1.148 CC(=O)C(C)Cc1cccc(Cl)c1 Amb17236508 [0,1,0,0,0,0|2,0,0]=3 1228 B13R1.148 CC(=O)C(C)Cc1cncc(F)c1 Amb28078157 [0,1,0,0,0,0|3,0,0]=4 1229 B13R1.148 CC(=O)C(C)Oc1cccc(C)c1 Amb2412509 [0,1,0,0,0,0|3,0,0]=4 1230 B13R1.148 CC(=O)C(C)Oc1cccc(Cl)c1 Amb2415403 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.148 CC(=O)C(C)Oc1cccc(F)c1 Amb2412534 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.148 CC(=O)C(C)Oc1cccc(N)c1 Amb17110087 [0,1,0,0,0,0|3,0,0]=4 1233 B13R1.148 CC(=O)C(C)Sc1cccc(Br)c1 Amb27157551 [0,1,0,0,0,0|3,0,0]=4 1234 B13R1.148 CC(=O)C(C)Sc1cccc(C)c1 Amb18317877 [0,1,0,0,0,0|3,0,0]=4 1235 B13R1.148 CC(=O)C(C)Sc1cccc(Cl)c1 Amb24434266 [0,1,0,0,0,0|3,0,0]=4 1236 B13R1.148 CC(=O)C(C)Sc1cccc(F)c1 Amb25801589 [0,1,0,0,0,0|3,0,0]=4 1237 B13R1.148 CC(=O)C(Cl)Cc1cccc(Br)c1 Amb17204825 [0,1,0,0,0,0|2,0,0]=3 1238 B13R1.148 CC(=O)C(Cl)Cc1cccc(C)c1 Amb17204369 [0,1,0,0,0,0|2,0,0]=3 1239 B13R1.148 CC(=O)C(Cl)Cc1cccc(Cl)c1 Amb4020124 [0,1,0,0,0,0|2,0,0]=3 1240 B13R1.148 CC(=O)C(Cl)Cc1cccc(F)c1 Amb17204391 [0,1,0,0,0,0|2,0,0]=3 1241 B13R1.148 CC(=O)C(N)Cc1cccc(Br)c1 Amb18156180 [0,1,0,0,0,0|1,0,0]=2 1242 B13R1.148 CC(=O)C(N)Cc1cccc(C)c1 Amb18195910 [0,1,0,0,0,0|1,0,0]=2 1243 B13R1.148 CC(=O)N(C)Cc1cccc(Br)c1 Amb28435612 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.148 CC(=O)N(C)Cc1cccc(C)c1 Amb27260794 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.148 CC(=O)N(C)Cc1cccc(N)c1 Amb6893122 [0,1,0,0,0,0|3,0,0]=4 1246 B13R1.148 CC(=O)[C@@H](C)Cc1cccc(Cl)c1 Amb28188801 [0,1,0,0,0,0|2,0,0]=3 1247 B13R1.148 CC(C)C(N)Cc1cccc(Br)c1 Amb27482427 [0,1,0,0,0,0|2,0,1]=4 1248 B13R1.148 CC(C)C(N)Cc1cccc(Cl)c1 Amb17139688 [0,1,0,0,0,0|2,0,1]=4 1249 B13R1.148 CC(C)C(N)Cc1cccc(F)c1 Amb17139011 [0,1,0,0,0,0|2,0,1]=4 1250 B13R1.148 CC(Cc1cc(F)ccn1)C(=O)O Amb33415296 [0,1,0,0,0,0|2,0,0]=3 1251 B13R1.148 CC(Cc1cccc(Br)c1)C(=O)O Amb25923971 [0,1,0,0,0,0|1,0,0]=2 1252 B13R1.148 CC(Cc1cccc(Br)n1)C(=O)O Amb33432795 [0,1,0,0,0,0|2,0,0]=3 1253 B13R1.148 CC(Cc1cccc(Cl)c1)C(=O)O Amb2785265 [0,1,0,0,0,0|1,0,0]=2 1254 B13R1.148 CC(Cc1cccc(Cl)c1)[N+](=O)[O-] Amb25160711 [0,1,0,0,0,0|2,0,1]=4 1255 B13R1.148 CC(Cc1cccc(Cl)n1)C(=O)O Amb33223040 [0,1,0,0,0,0|2,0,0]=3 1256 B13R1.148 CC(Cc1cccc(F)c1)C(=O)O Amb13951302 [0,1,0,0,0,0|1,0,0]=2 1257 B13R1.148 CC(Cc1cccc(F)c1)[N+](=O)[O-] Amb6297633 [0,1,0,0,0,0|2,0,1]=4 1258 B13R1.148 CC(Cc1cccc(N)c1)C(=O)O Amb24693893 [0,1,0,0,0,0|1,0,0]=2 1259 B13R1.148 CC(Cc1cccc(O)c1)C(=O)O Amb10844220 [0,1,0,0,0,0|1,0,0]=2 1260 B13R1.148 CC(Cc1cccc(O)c1)[N+](=O)[O-] Amb27253189 [0,1,0,0,0,0|2,0,1]=4 1261 B13R1.148 CC(Cc1ccnc(Cl)c1)C(=O)O Amb28396938 [0,1,0,0,0,0|2,0,0]=3 1262 B13R1.148 CC(Cc1cncc(Br)c1)C(=O)O Amb25821532 [0,1,0,0,0,0|2,0,0]=3 1263 B13R1.148 CC(Cc1cncc(F)c1)C(=O)O Amb25782318 [0,1,0,0,0,0|2,0,0]=3 1264 B13R1.148 CC(Nc1cccc(Br)c1)C(=O)O Amb840564 [0,1,0,0,0,0|2,0,0]=3 1265 B13R1.148 CC(Nc1cccc(Cl)c1)C(=O)O Amb840561 [0,1,0,0,0,0|2,0,0]=3 1266 B13R1.148 CC(Nc1cccc(F)c1)C(=O)O Amb840558 [0,1,0,0,0,0|2,0,0]=3 1267 B13R1.148 CC(Nc1cccc(N)c1)C(=O)O Amb27608588 [0,1,0,0,0,0|2,0,0]=3 1268 B13R1.148 CC(Nc1cncc(Cl)c1)C(=O)O Amb29864726 [0,1,0,0,0,0|3,0,0]=4 1269 B13R1.148 CC(Nc1cncc(F)c1)C(=O)O Amb27444488 [0,1,0,0,0,0|3,0,0]=4 1270 B13R1.148 CC(O)C(C)Cc1cccc(Br)c1 Amb17256429 [0,1,0,0,0,0|2,0,1]=4 1271 B13R1.148 CC(O)C(C)Cc1cccc(Cl)c1 Amb17236859 [0,1,0,0,0,0|2,0,1]=4 1272 B13R1.148 CC(O)C(C)Cc1cccc(F)c1 Amb18809755 [0,1,0,0,0,0|2,0,1]=4 1273 B13R1.148 CC(O)C(C)Cc1cccc(O)c1 Amb24415928 [0,1,0,0,0,0|2,0,1]=4 1274 B13R1.148 CC(Oc1cccc(Br)c1)C(=O)Cl Amb16230148 [0,1,0,0,0,0|3,0,0]=4 1275 B13R1.148 CC(Oc1cccc(Br)c1)C(=O)O Amb2556137 [0,1,0,0,0,0|2,0,0]=3 1276 B13R1.148 CC(Oc1cccc(Br)c1)C(N)=O Amb2085822 [0,1,0,0,0,0|3,0,0]=4 1277 B13R1.148 CC(Oc1cccc(Cl)c1)C(=O)Cl Amb20224027 [0,1,0,0,0,0|3,0,0]=4 1278 B13R1.148 CC(Oc1cccc(Cl)c1)C(=O)O Amb9745694 [0,1,0,0,0,0|2,0,0]=3 1279 B13R1.148 CC(Oc1cccc(F)c1)C(=O)O Amb1116562 [0,1,0,0,0,0|2,0,0]=3 1280 B13R1.148 CC(Oc1cccc(F)c1)C(N)=O Amb8997636 [0,1,0,0,0,0|3,0,0]=4 1281 B13R1.148 CC(Oc1cccc(I)c1)C(=O)O Amb8838601 [0,1,0,0,0,0|2,0,0]=3 1282 B13R1.148 CC(Oc1cccc(N)c1)C(=O)O Amb28465284 [0,1,0,0,0,0|2,0,0]=3 1283 B13R1.148 CC(Oc1cccc(N)c1)C(=O)O Amb839768 [0,1,0,0,0,0|2,0,0]=3 1284 B13R1.148 CC(Oc1cccc(O)c1)C(=O)O Amb18192781 [0,1,0,0,0,0|2,0,0]=3 1285 B13R1.148 CC(Oc1cccc(O)c1)C(N)=O Amb9210987 [0,1,0,0,0,0|3,0,0]=4 1286 B13R1.148 CC(Sc1cccc(Cl)c1)C(=O)Cl Amb17144557 [0,1,0,0,0,0|3,0,0]=4 1287 B13R1.148 CC(Sc1cccc(Cl)c1)C(=O)O Amb5774993 [0,1,0,0,0,0|2,0,0]=3 1288 B13R1.148 CC(Sc1cccc(Cl)c1)C(N)=O Amb17143658 [0,1,0,0,0,0|3,0,0]=4 1289 B13R1.148 CC(Sc1cccc(Cl)n1)C(=O)O Amb28398710 [0,1,0,0,0,0|3,0,0]=4 1290 B13R1.148 CC(Sc1cccc(O)c1)C(N)=O Amb28196233 [0,1,0,0,0,0|3,0,0]=4 1291 B13R1.148 CC(Sc1cncc(Br)c1)C(=O)O Amb28398775 [0,1,0,0,0,0|3,0,0]=4 1292 B13R1.148 CN(Cc1cccc(F)c1)C(=O)Cl Amb25785989 [0,1,0,0,0,0|3,0,0]=4 1293 B13R1.148 C[C@@H](Cc1cncc(F)c1)C(=O)O Amb33728367 [0,1,0,0,0,0|2,0,0]=3 1294 B13R1.148 C[C@@H](Nc1cccc(Cl)n1)C(=O)O Amb27591323 [0,1,0,0,0,0|3,0,0]=4 1295 B13R1.148 C[C@@H](Oc1cccc(Br)c1)C(N)=O Amb27814216 [0,1,0,0,0,0|3,0,0]=4 1296 B13R1.148 C[C@@H](Oc1cccc(I)c1)C(=O)O Amb27601305 [0,1,0,0,0,0|2,0,0]=3 1297 B13R1.148 C[C@@H](Oc1cncc(Cl)c1)C(=O)O Amb27610332 [0,1,0,0,0,0|3,0,0]=4 1298 B13R1.148 C[C@@H](Oc1cncc(F)c1)C(=O)O Amb28243455 [0,1,0,0,0,0|3,0,0]=4 1299 B13R1.148 C[C@H](Cc1cccc(Cl)c1)C(=O)O Amb10844155 [0,1,0,0,0,0|1,0,0]=2 1300 B13R1.148 C[C@H](Cc1cccc(N)c1)C(=O)O Amb27179116 [0,1,0,0,0,0|1,0,0]=2 1301 B13R1.148 C[C@H](Cc1cccc(O)c1)C(=O)O Amb27179117 [0,1,0,0,0,0|1,0,0]=2 1302 B13R1.148 C[C@H](Cc1cncc(F)c1)C(=O)O Amb33728690 [0,1,0,0,0,0|2,0,0]=3 1303 B13R1.148 C[C@H](Nc1cccc(F)c1)C(=O)O Amb24495647 [0,1,0,0,0,0|2,0,0]=3 1304 B13R1.148 C[C@H](Nc1cccc(F)n1)C(=O)O Amb27762212 [0,1,0,0,0,0|3,0,0]=4 1305 B13R1.148 C[C@H](Nc1ccnc(Cl)c1)C(=O)O Amb27426592 [0,1,0,0,0,0|3,0,0]=4 1306 B13R1.148 C[C@H](Oc1cccc(Br)c1)C(=O)O Amb27410285 [0,1,0,0,0,0|2,0,0]=3 1307 B13R1.148 C[C@H](Oc1cccc(F)c1)C(=O)O Amb27760496 [0,1,0,0,0,0|2,0,0]=3 1308 B13R1.148 C\C(=C/c1cccc(Br)c1)C(=O)O Amb22339395 [0,1,0,0,0,0|1,0,2]=4 1309 B13R1.148 C\C(=C/c1cccc(C)c1)C(=O)O Amb4009520 [0,1,0,0,0,0|1,0,2]=4 1310 B13R1.148 C\C(=C/c1cccc(Cl)c1)C(=O)O Amb4007781 [0,1,0,0,0,0|1,0,2]=4 1311 B13R1.148 C\C(=C/c1cccc(F)c1)C(=O)O Amb24745620 [0,1,0,0,0,0|1,0,2]=4 1312 B13R1.148 C\C(=C/c1cccc(I)c1)C(=O)O Amb27393743 [0,1,0,0,0,0|1,0,2]=4 1313 B13R1.148 Cc1cc(CC(=O)C(=O)O)ccn1 Amb33268223 [0,1,0,0,0,0|2,0,1]=4 1314 B13R1.148 Cc1cc(CC(C)C(=O)O)ccn1 Amb33268546 [0,1,0,0,0,0|2,0,0]=3 1315 B13R1.148 Cc1cc(CC(N)C(=O)O)ccn1 Amb18824521 [0,1,0,0,0,0|1,0,0]=2 1316 B13R1.148 Cc1cc(CC(N)C(=O)O)ncn1 Amb18824236 [0,1,0,0,0,0|2,0,0]=3 1317 B13R1.148 Cc1cc(CC(N)C(N)=O)ccn1 Amb33036886 [0,1,0,0,0,0|2,0,0]=3 1318 B13R1.148 Cc1cc(CC(N)C(N)=O)ncn1 Amb33065842 [0,1,0,0,0,0|3,0,0]=4 1319 B13R1.148 Cc1cc(CC(O)C(=O)O)ccn1 Amb33268216 [0,1,0,0,0,0|2,0,0]=3 1320 B13R1.148 Cc1cc(C[C@@H](N)C(=O)O)ccn1 Amb24409497 [0,1,0,0,0,0|1,0,0]=2 1321 B13R1.148 Cc1cc(C[C@@H](N)C(=O)O)ncn1 Amb33036600 [0,1,0,0,0,0|2,0,0]=3 1322 B13R1.148 Cc1cc(C[C@H](N)C(=O)O)ccn1 Amb28316516 [0,1,0,0,0,0|1,0,0]=2 1323 B13R1.148 Cc1cc(C[C@H](N)C(=O)O)ncn1 Amb32987312 [0,1,0,0,0,0|2,0,0]=3 1324 B13R1.148 Cc1cc(N[C@@H](C)C(=O)O)ccn1 Amb27769488 [0,1,0,0,0,0|3,0,0]=4 1325 B13R1.148 Cc1cccc(CC(=O)C(=O)O)c1 Amb1131949 [0,1,0,0,0,0|1,0,1]=3 1326 B13R1.148 Cc1cccc(CC(=O)C(=O)O)n1 Amb33201939 [0,1,0,0,0,0|2,0,1]=4 1327 B13R1.148 Cc1cccc(CC(Br)C(=O)O)c1 Amb23320585 [0,1,0,0,0,0|1,0,0]=2 1328 B13R1.148 Cc1cccc(CC(C)C(=O)Cl)c1 Amb5744100 [0,1,0,0,0,0|2,0,0]=3 1329 B13R1.148 Cc1cccc(CC(C)C(=O)O)c1 Amb5744012 [0,1,0,0,0,0|1,0,0]=2 1330 B13R1.148 Cc1cccc(CC(C)C(=O)O)n1 Amb25761364 [0,1,0,0,0,0|2,0,0]=3 1331 B13R1.148 Cc1cccc(CC(C)C(C)O)c1 Amb17233451 [0,1,0,0,0,0|2,0,1]=4 1332 B13R1.148 Cc1cccc(CC(C)[N+](=O)[O-])c1 Amb27164308 [0,1,0,0,0,0|2,0,1]=4 1333 B13R1.148 Cc1cccc(CC(Cl)C(=O)O)c1 Amb17204375 [0,1,0,0,0,0|1,0,0]=2 1334 B13R1.148 Cc1cccc(CC(Cl)C(N)=O)c1 Amb17204372 [0,1,0,0,0,0|2,0,0]=3 1335 B13R1.148 Cc1cccc(CC(F)C(=O)O)c1 Amb27832954 [0,1,0,0,0,0|1,0,0]=2 1336 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb33551326 [0,1,0,0,0,0|0,0,0]=1 1337 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb3788275 [0,1,0,0,0,0|0,0,0]=1 1338 B13R1.148 Cc1cccc(CC(N)C(=O)O)n1 Amb3788309 [0,1,0,0,0,0|1,0,0]=2 1339 B13R1.148 Cc1cccc(CC(N)C(C)C)c1 Amb17138832 [0,1,0,0,0,0|2,0,1]=4 1340 B13R1.148 Cc1cccc(CC(N)C(F)F)c1 Amb25077003 [0,1,0,0,0,0|2,0,1]=4 1341 B13R1.148 Cc1cccc(CC(N)C(N)=O)c1 Amb25122272 [0,1,0,0,0,0|1,0,0]=2 1342 B13R1.148 Cc1cccc(CC(N)C(N)=O)n1 Amb25808216 [0,1,0,0,0,0|2,0,0]=3 1343 B13R1.148 Cc1cccc(CC(O)C(=O)O)c1 Amb17138949 [0,1,0,0,0,0|1,0,0]=2 1344 B13R1.148 Cc1cccc(CC(O)C(=O)O)n1 Amb24740737 [0,1,0,0,0,0|2,0,0]=3 1345 B13R1.148 Cc1cccc(CC(O)C(C)O)c1 Amb28242270 [0,1,0,0,0,0|2,0,1]=4 1346 B13R1.148 Cc1cccc(CN(C)C(=O)Cl)c1 Amb27618265 [0,1,0,0,0,0|3,0,0]=4 1347 B13R1.148 Cc1cccc(C[C@@H](C)C(=O)O)c1 Amb10844168 [0,1,0,0,0,0|1,0,0]=2 1348 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)c1 Amb8397009 [0,1,0,0,0,0|0,0,0]=1 1349 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)n1 Amb25117997 [0,1,0,0,0,0|1,0,0]=2 1350 B13R1.148 Cc1cccc(C[C@H](C)C(=O)O)c1 Amb10844169 [0,1,0,0,0,0|1,0,0]=2 1351 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)c1 Amb8397006 [0,1,0,0,0,0|0,0,0]=1 1352 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)n1 Amb27190836 [0,1,0,0,0,0|1,0,0]=2 1353 B13R1.148 Cc1cccc(C[C@H](N)C(N)=O)c1 Amb28383434 [0,1,0,0,0,0|1,0,0]=2 1354 B13R1.148 Cc1cccc(NC(=O)C(=O)O)c1 Amb838988 [0,1,0,0,0,0|2,0,1]=4 1355 B13R1.148 Cc1cccc(NC(=S)C(=O)O)c1 Amb27985884 [0,1,0,0,0,0|2,0,1]=4 1356 B13R1.148 Cc1cccc(NC(C)C(=O)O)c1 Amb840548 [0,1,0,0,0,0|2,0,0]=3 1357 B13R1.148 Cc1cccc(NC(C)C(=O)O)n1 Amb27454972 [0,1,0,0,0,0|3,0,0]=4 1358 B13R1.148 Cc1cccc(N[C@@H](C)C(=O)O)c1 Amb16231733 [0,1,0,0,0,0|2,0,0]=3 1359 B13R1.148 Cc1cccc(OC(C)C(=O)Cl)c1 Amb16230058 [0,1,0,0,0,0|3,0,0]=4 1360 B13R1.148 Cc1cccc(OC(C)C(=O)O)c1 Amb9702048 [0,1,0,0,0,0|2,0,0]=3 1361 B13R1.148 Cc1cccc(OC(C)C(N)=O)c1 Amb5288107 [0,1,0,0,0,0|3,0,0]=4 1362 B13R1.148 Cc1cccc(O[C@@H](C)C(=O)O)c1 Amb24310391 [0,1,0,0,0,0|2,0,0]=3 1363 B13R1.148 Cc1cccc(SC(C)C(=O)Cl)c1 Amb17143634 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.148 Cc1cccc(SC(C)C(=O)O)c1 Amb5769096 [0,1,0,0,0,0|2,0,0]=3 1365 B13R1.148 Cc1cccc(SC(C)C(N)=O)c1 Amb17143161 [0,1,0,0,0,0|3,0,0]=4 1366 B13R1.148 Cc1cccc(SC(F)C(=O)O)c1 Amb27883690 [0,1,0,0,0,0|2,0,0]=3 1367 B13R1.148 Cc1cccc(\C=C(/F)C(=O)O)c1 Amb32677835 [0,1,0,0,0,0|1,0,2]=4 1368 B13R1.148 Cc1ccnc(CC(=O)C(=O)O)c1 Amb33318411 [0,1,0,0,0,0|2,0,1]=4 1369 B13R1.148 Cc1ccnc(CC(C)C(=O)O)c1 Amb33318420 [0,1,0,0,0,0|2,0,0]=3 1370 B13R1.148 Cc1ccnc(CC(N)C(=O)O)c1 Amb18193874 [0,1,0,0,0,0|1,0,0]=2 1371 B13R1.148 Cc1ccnc(CC(N)C(=O)O)n1 Amb33065529 [0,1,0,0,0,0|2,0,0]=3 1372 B13R1.148 Cc1ccnc(CC(N)C(N)=O)n1 Amb33036952 [0,1,0,0,0,0|3,0,0]=4 1373 B13R1.148 Cc1ccnc(CC(O)C(=O)O)c1 Amb33318127 [0,1,0,0,0,0|2,0,0]=3 1374 B13R1.148 Cc1ccnc(C[C@@H](N)C(=O)O)c1 Amb28456557 [0,1,0,0,0,0|1,0,0]=2 1375 B13R1.148 Cc1ccnc(C[C@@H](N)C(=O)O)n1 Amb33036811 [0,1,0,0,0,0|2,0,0]=3 1376 B13R1.148 Cc1ccnc(C[C@H](N)C(=O)O)n1 Amb33065805 [0,1,0,0,0,0|2,0,0]=3 1377 B13R1.148 Cc1cncc(CC(=O)C(=O)O)c1 Amb33318377 [0,1,0,0,0,0|2,0,1]=4 1378 B13R1.148 Cc1cncc(CC(C)C(=O)O)c1 Amb25898497 [0,1,0,0,0,0|2,0,0]=3 1379 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb18193896 [0,1,0,0,0,0|1,0,0]=2 1380 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb33620537 [0,1,0,0,0,0|1,0,0]=2 1381 B13R1.148 Cc1cncc(CC(N)C(N)=O)c1 Amb27160949 [0,1,0,0,0,0|2,0,0]=3 1382 B13R1.148 Cc1cncc(CC(O)C(=O)O)c1 Amb33318319 [0,1,0,0,0,0|2,0,0]=3 1383 B13R1.148 Cc1cncc(C[C@@H](C)C(=O)O)c1 Amb33738122 [0,1,0,0,0,0|2,0,0]=3 1384 B13R1.148 Cc1cncc(C[C@@H](N)C(=O)O)c1 Amb26318555 [0,1,0,0,0,0|1,0,0]=2 1385 B13R1.148 Cc1cncc(C[C@H](C)C(=O)O)c1 Amb33744909 [0,1,0,0,0,0|2,0,0]=3 1386 B13R1.148 Cc1cncc(C[C@H](N)C(=O)O)c1 Amb25864934 [0,1,0,0,0,0|1,0,0]=2 1387 B13R1.148 Cc1cncc(NC(C)C(=O)O)c1 Amb27617938 [0,1,0,0,0,0|3,0,0]=4 1388 B13R1.148 Cc1nccc(CC(N)C(N)=O)n1 Amb33309226 [0,1,0,0,0,0|3,0,0]=4 1389 B13R1.148 Cc1nccc(CC(O)C(=O)O)n1 Amb33353344 [0,1,0,0,0,0|3,0,0]=4 1390 B13R1.148 Cc1nccc(C[C@@H](N)C(=O)O)n1 Amb33309118 [0,1,0,0,0,0|2,0,0]=3 1391 B13R1.148 Cc1nccc(C[C@H](N)C(=O)O)n1 Amb33036772 [0,1,0,0,0,0|2,0,0]=3 1392 B13R1.148 NC(=O)C(Br)Cc1cncc(Br)c1 Amb27452781 [0,1,0,0,0,0|3,0,0]=4 1393 B13R1.148 NC(=O)C(Br)Cc1cncc(Cl)c1 Amb35671335 [0,1,0,0,0,0|3,0,0]=4 1394 B13R1.148 NC(=O)C(Cl)Cc1cccc(Br)c1 Amb17204832 [0,1,0,0,0,0|2,0,0]=3 1395 B13R1.148 NC(=O)C(Cl)Cc1cccc(Cl)c1 Amb17204474 [0,1,0,0,0,0|2,0,0]=3 1396 B13R1.148 NC(=O)C(Cl)Cc1cccc(F)c1 Amb17204396 [0,1,0,0,0,0|2,0,0]=3 1397 B13R1.148 NC(=O)C(Cl)Cc1cncc(Cl)c1 Amb35684099 [0,1,0,0,0,0|3,0,0]=4 1398 B13R1.148 NC(=O)C(N)Cc1cccc(Br)c1 Amb18136032 [0,1,0,0,0,0|1,0,0]=2 1399 B13R1.148 NC(=O)C(N)Cc1cccc(Cl)c1 Amb4324457 [0,1,0,0,0,0|1,0,0]=2 1400 B13R1.148 NC(=O)C(N)Cc1cccc(F)c1 Amb27150180 [0,1,0,0,0,0|1,0,0]=2 1401 B13R1.148 NC(=O)C(N)Cc1cccc(O)c1 Amb24660581 [0,1,0,0,0,0|1,0,0]=2 1402 B13R1.148 NC(=O)C(N)Cc1ccnc(Cl)c1 Amb33036744 [0,1,0,0,0,0|2,0,0]=3 1403 B13R1.148 NC(=O)C(N)Cc1ccnc(Cl)n1 Amb33308731 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.148 NC(=O)C(N)Cc1cncc(Br)c1 Amb25040763 [0,1,0,0,0,0|2,0,0]=3 1405 B13R1.148 NC(=O)C(N)Cc1cncc(Cl)c1 Amb33308613 [0,1,0,0,0,0|2,0,0]=3 1406 B13R1.148 NC(=O)C(N)Cc1cncc(F)c1 Amb27650841 [0,1,0,0,0,0|2,0,0]=3 1407 B13R1.148 NC(=O)N(N)Cc1cccc(O)c1 Amb28239700 [0,1,0,0,0,0|2,0,0]=3 1408 B13R1.148 NC(=S)N(N)Cc1cccc(Cl)c1 Amb27248359 [0,1,0,0,0,0|2,1,0]=4 1409 B13R1.148 NC(CC1=CC(=O)NC=C1)C(=O)O Amb25127065 [0,1,0,0,0,0|1,0,0]=2 1410 B13R1.148 NC(CC1=CC(=O)NC=N1)C(=O)O Amb25095191 [0,1,0,0,0,0|2,0,0]=3 1411 B13R1.148 NC(CC1=NC=CC(=O)N1)C(=O)O Amb25270760 [0,1,0,0,0,0|2,0,0]=3 1412 B13R1.148 NC(Cc1cc(Cl)ccn1)C(=O)O Amb25764479 [0,1,0,0,0,0|1,0,0]=2 1413 B13R1.148 NC(Cc1cc(F)ccn1)C(=O)O Amb33415313 [0,1,0,0,0,0|1,0,0]=2 1414 B13R1.148 NC(Cc1cc(O)ncn1)C(=O)O Amb35747953 [0,1,0,0,0,0|2,0,0]=3 1415 B13R1.148 NC(Cc1cccc(Br)c1)C(=O)O Amb33551434 [0,1,0,0,0,0|0,0,0]=1 1416 B13R1.148 NC(Cc1cccc(Br)c1)C(=O)O Amb3790941 [0,1,0,0,0,0|0,0,0]=1 1417 B13R1.148 NC(Cc1cccc(Br)c1)C(F)F Amb24520759 [0,1,0,0,0,0|2,0,1]=4 1418 B13R1.148 NC(Cc1cccc(Br)n1)C(=O)O Amb28061133 [0,1,0,0,0,0|1,0,0]=2 1419 B13R1.148 NC(Cc1cccc(Cl)c1)C(=O)O Amb20622650 [0,1,0,0,0,0|0,0,0]=1 1420 B13R1.148 NC(Cc1cccc(Cl)c1)C(=O)O Amb3788687 [0,1,0,0,0,0|0,0,0]=1 1421 B13R1.148 NC(Cc1cccc(Cl)c1)C(F)F Amb27952184 [0,1,0,0,0,0|2,0,1]=4 1422 B13R1.148 NC(Cc1cccc(Cl)n1)C(=O)O Amb24342291 [0,1,0,0,0,0|1,0,0]=2 1423 B13R1.148 NC(Cc1cccc(F)c1)C(=O)O Amb2688313 [0,1,0,0,0,0|0,0,0]=1 1424 B13R1.148 NC(Cc1cccc(F)c1)C(=O)O Amb28468151 [0,1,0,0,0,0|0,0,0]=1 1425 B13R1.148 NC(Cc1cccc(F)c1)C(F)F Amb24413521 [0,1,0,0,0,0|2,0,1]=4 1426 B13R1.148 NC(Cc1cccc(I)c1)C(=O)O Amb3796903 [0,1,0,0,0,0|0,0,0]=1 1427 B13R1.148 NC(Cc1cccc(O)c1)C(=O)O Amb9727593 [0,1,0,0,0,0|0,0,0]=1 1428 B13R1.148 NC(Cc1cccc(O)c1)C(F)F Amb25247330 [0,1,0,0,0,0|2,0,1]=4 1429 B13R1.148 NC(Cc1cccc(S)c1)C(=O)O Amb28119335 [0,1,0,0,0,0|0,0,0]=1 1430 B13R1.148 NC(Cc1cccc(S)c1)C(=O)O Amb33330728 [0,1,0,0,0,0|0,0,0]=1 1431 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb25068866 [0,1,0,0,0,0|1,0,0]=2 1432 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb33734846 [0,1,0,0,0,0|1,0,0]=2 1433 B13R1.148 NC(Cc1ccnc(Cl)c1)C(=O)O Amb25301408 [0,1,0,0,0,0|1,0,0]=2 1434 B13R1.148 NC(Cc1ccnc(Cl)n1)C(=O)O Amb33036794 [0,1,0,0,0,0|2,0,0]=3 1435 B13R1.148 NC(Cc1ccnc(O)c1)C(=O)O Amb33743902 [0,1,0,0,0,0|1,0,0]=2 1436 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33733905 [0,1,0,0,0,0|1,0,0]=2 1437 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33742683 [0,1,0,0,0,0|1,0,0]=2 1438 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb26850411 [0,1,0,0,0,0|1,0,0]=2 1439 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb33527128 [0,1,0,0,0,0|1,0,0]=2 1440 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb26424973 [0,1,0,0,0,0|1,0,0]=2 1441 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb33299384 [0,1,0,0,0,0|1,0,0]=2 1442 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb26347287 [0,1,0,0,0,0|1,0,0]=2 1443 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb33620579 [0,1,0,0,0,0|1,0,0]=2 1444 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb24377085 [0,1,0,0,0,0|1,0,0]=2 1445 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb33620577 [0,1,0,0,0,0|1,0,0]=2 1446 B13R1.148 NC(Cc1cncc(S)c1)C(=O)O Amb35789190 [0,1,0,0,0,0|1,0,0]=2 1447 B13R1.148 NC(Cc1nccc(O)n1)C(=O)O Amb33484100 [0,1,0,0,0,0|2,0,0]=3 1448 B13R1.148 N[C@@H](Cc1cccc(Br)c1)C(=O)O Amb32409701 [0,1,0,0,0,0|0,0,0]=1 1449 B13R1.148 N[C@@H](Cc1cccc(Br)c1)C(=O)O Amb8396992 [0,1,0,0,0,0|0,0,0]=1 1450 B13R1.148 N[C@@H](Cc1cccc(Cl)c1)C(=O)O Amb8390369 [0,1,0,0,0,0|0,0,0]=1 1451 B13R1.148 N[C@@H](Cc1cccc(Cl)c1)C(=O)O Amb8396996 [0,1,0,0,0,0|0,0,0]=1 1452 B13R1.148 N[C@@H](Cc1cccc(Cl)n1)C(=O)O Amb27463062 [0,1,0,0,0,0|1,0,0]=2 1453 B13R1.148 N[C@@H](Cc1cccc(F)c1)C(=O)O Amb6295851 [0,1,0,0,0,0|0,0,0]=1 1454 B13R1.148 N[C@@H](Cc1cccc(F)n1)C(=O)O Amb28057714 [0,1,0,0,0,0|1,0,0]=2 1455 B13R1.148 N[C@@H](Cc1cccc(I)c1)C(=O)O Amb22229331 [0,1,0,0,0,0|0,0,0]=1 1456 B13R1.148 N[C@@H](Cc1cccc(O)c1)C(=O)O Amb6295781 [0,1,0,0,0,0|0,0,0]=1 1457 B13R1.148 N[C@@H](Cc1cccc(S)c1)C(=O)O Amb27404833 [0,1,0,0,0,0|0,0,0]=1 1458 B13R1.148 N[C@@H](Cc1ccnc(Cl)c1)C(=O)O Amb26988815 [0,1,0,0,0,0|1,0,0]=2 1459 B13R1.148 N[C@@H](Cc1ccnc(Cl)n1)C(=O)O Amb33308876 [0,1,0,0,0,0|2,0,0]=3 1460 B13R1.148 N[C@@H](Cc1ccnc(F)c1)C(=O)O Amb28076584 [0,1,0,0,0,0|1,0,0]=2 1461 B13R1.148 N[C@@H](Cc1ccnc(O)c1)C(=O)O Amb27270877 [0,1,0,0,0,0|1,0,0]=2 1462 B13R1.148 N[C@@H](Cc1cncc(Br)c1)C(=O)O Amb24418099 [0,1,0,0,0,0|1,0,0]=2 1463 B13R1.148 N[C@@H](Cc1cncc(Cl)c1)C(=O)O Amb26855853 [0,1,0,0,0,0|1,0,0]=2 1464 B13R1.148 N[C@@H](Cc1cncc(F)c1)C(=O)O Amb27609591 [0,1,0,0,0,0|1,0,0]=2 1465 B13R1.148 N[C@H](Cc1cccc(Br)c1)C(=O)O Amb8396991 [0,1,0,0,0,0|0,0,0]=1 1466 B13R1.148 N[C@H](Cc1cccc(Br)n1)C(=O)O Amb27180873 [0,1,0,0,0,0|1,0,0]=2 1467 B13R1.148 N[C@H](Cc1cccc(Cl)c1)C(=O)O Amb6295852 [0,1,0,0,0,0|0,0,0]=1 1468 B13R1.148 N[C@H](Cc1cccc(F)c1)C(=O)O Amb8389455 [0,1,0,0,0,0|0,0,0]=1 1469 B13R1.148 N[C@H](Cc1cccc(F)n1)C(=O)O Amb27175331 [0,1,0,0,0,0|1,0,0]=2 1470 B13R1.148 N[C@H](Cc1cccc(I)c1)C(=O)O Amb22229329 [0,1,0,0,0,0|0,0,0]=1 1471 B13R1.148 N[C@H](Cc1cccc(O)c1)C(=O)O Amb8396995 [0,1,0,0,0,0|0,0,0]=1 1472 B13R1.148 N[C@H](Cc1ccnc(Cl)c1)C(=O)O Amb27592823 [0,1,0,0,0,0|1,0,0]=2 1473 B13R1.148 N[C@H](Cc1ccnc(Cl)n1)C(=O)O Amb33066258 [0,1,0,0,0,0|2,0,0]=3 1474 B13R1.148 N[C@H](Cc1ccnc(F)c1)C(=O)O Amb27596543 [0,1,0,0,0,0|1,0,0]=2 1475 B13R1.148 N[C@H](Cc1ccnc(O)c1)C(=O)O Amb28317768 [0,1,0,0,0,0|1,0,0]=2 1476 B13R1.148 N[C@H](Cc1cncc(Br)c1)C(=O)O Amb26005016 [0,1,0,0,0,0|1,0,0]=2 1477 B13R1.148 N[C@H](Cc1cncc(Cl)c1)C(=O)O Amb26867986 [0,1,0,0,0,0|1,0,0]=2 1478 B13R1.148 N[C@H](Cc1cncc(F)c1)C(=O)O Amb25679683 [0,1,0,0,0,0|1,0,0]=2 1479 B13R1.148 N[C@H](Cc1cncc(O)c1)C(=O)O Amb28317767 [0,1,0,0,0,0|1,0,0]=2 1480 B13R1.148 N\C(=C\c1cccc(Br)c1)C(=O)O Amb29883096 [0,1,0,0,0,0|0,0,2]=3 1481 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb28316362 [0,1,0,0,0,0|1,0,0]=2 1482 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb33299370 [0,1,0,0,0,0|1,0,0]=2 1483 B13R1.148 Nc1cc(C[C@@H](N)C(=O)O)ccn1 Amb28365832 [0,1,0,0,0,0|1,0,0]=2 1484 B13R1.148 Nc1cccc(CC(N)C(=O)O)c1 Amb21864824 [0,1,0,0,0,0|0,0,0]=1 1485 B13R1.148 Nc1cccc(CC(N)C(=O)O)n1 Amb33804191 [0,1,0,0,0,0|1,0,0]=2 1486 B13R1.148 Nc1cccc(CC(O)C(=O)O)c1 Amb27415733 [0,1,0,0,0,0|1,0,0]=2 1487 B13R1.148 Nc1cccc(C[C@H](N)C(=O)O)c1 Amb33801893 [0,1,0,0,0,0|0,0,0]=1 1488 B13R1.148 Nc1cccc(C[C@H](N)C(=O)O)c1 Amb33872488 [0,1,0,0,0,0|0,0,0]=1 1489 B13R1.148 Nc1ccnc(CC(N)C(=O)O)c1 Amb28197756 [0,1,0,0,0,0|1,0,0]=2 1490 B13R1.148 Nc1ccnc(CC(N)C(=O)O)c1 Amb33620803 [0,1,0,0,0,0|1,0,0]=2 1491 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb28200132 [0,1,0,0,0,0|1,0,0]=2 1492 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb33741539 [0,1,0,0,0,0|1,0,0]=2 1493 B13R1.148 Nc1cncc(C[C@H](N)C(=O)O)c1 Amb28456538 [0,1,0,0,0,0|1,0,0]=2 1494 B13R1.148 Nc1nccc(C[C@H](N)C(=O)O)n1 Amb25966577 [0,1,0,0,0,0|2,0,0]=3 1495 B13R1.148 O=C(O)C(=O)C[n+]1cccc(O)c1 Amb27169388 [0,1,0,0,0,0|2,0,1]=4 1496 B13R1.148 O=C(O)C(=O)Cc1cc(F)ccn1 Amb33415003 [0,1,0,0,0,0|2,0,1]=4 1497 B13R1.148 O=C(O)C(=O)Cc1cccc(Br)c1 Amb1137720 [0,1,0,0,0,0|1,0,1]=3 1498 B13R1.148 O=C(O)C(=O)Cc1cccc(Br)n1 Amb33432757 [0,1,0,0,0,0|2,0,1]=4 1499 B13R1.148 O=C(O)C(=O)Cc1cccc(Cl)c1 Amb1135307 [0,1,0,0,0,0|1,0,1]=3 1500 B13R1.148 O=C(O)C(=O)Cc1cccc(Cl)n1 Amb33223299 [0,1,0,0,0,0|2,0,1]=4 1501 B13R1.148 O=C(O)C(=O)Cc1cccc(F)c1 Amb1126816 [0,1,0,0,0,0|1,0,1]=3 1502 B13R1.148 O=C(O)C(=O)Cc1cccc(I)c1 Amb27768916 [0,1,0,0,0,0|1,0,1]=3 1503 B13R1.148 O=C(O)C(=O)Cc1cccc(O)c1 Amb1141341 [0,1,0,0,0,0|1,0,1]=3 1504 B13R1.148 O=C(O)C(=O)Cc1cncc(Br)c1 Amb25979407 [0,1,0,0,0,0|2,0,1]=4 1505 B13R1.148 O=C(O)C(=O)Cc1cncc(F)c1 Amb33196974 [0,1,0,0,0,0|2,0,1]=4 1506 B13R1.148 O=C(O)C(=O)Nc1cccc(Br)c1 Amb838964 [0,1,0,0,0,0|2,0,1]=4 1507 B13R1.148 O=C(O)C(=O)Nc1cccc(Cl)c1 Amb838963 [0,1,0,0,0,0|2,0,1]=4 1508 B13R1.148 O=C(O)C(=O)Nc1cccc(F)c1 Amb9303976 [0,1,0,0,0,0|2,0,1]=4 1509 B13R1.148 O=C(O)C(=S)Cc1cccc(Cl)c1 Amb27798340 [0,1,0,0,0,0|1,0,1]=3 1510 B13R1.148 O=C(O)C(Br)Cc1cccc(Cl)c1 Amb23320616 [0,1,0,0,0,0|1,0,0]=2 1511 B13R1.148 O=C(O)C(Br)Cc1cccc(F)c1 Amb25871653 [0,1,0,0,0,0|1,0,0]=2 1512 B13R1.148 O=C(O)C(Cl)Cc1cccc(Br)c1 Amb17204844 [0,1,0,0,0,0|1,0,0]=2 1513 B13R1.148 O=C(O)C(Cl)Cc1cccc(Cl)c1 Amb17204491 [0,1,0,0,0,0|1,0,0]=2 1514 B13R1.148 O=C(O)C(Cl)Cc1cccc(F)c1 Amb17204399 [0,1,0,0,0,0|1,0,0]=2 1515 B13R1.148 O=C(O)C(Cl)Cc1cccc(O)c1 Amb27946723 [0,1,0,0,0,0|1,0,0]=2 1516 B13R1.148 O=C(O)C(F)Cc1cccc(I)c1 Amb27221429 [0,1,0,0,0,0|1,0,0]=2 1517 B13R1.148 O=C(O)C(F)Oc1cccc(F)c1 Amb27759576 [0,1,0,0,0,0|2,0,0]=3 1518 B13R1.148 O=C(O)C(O)Cc1cc(F)ccn1 Amb33414600 [0,1,0,0,0,0|2,0,0]=3 1519 B13R1.148 O=C(O)C(O)Cc1cccc(Br)c1 Amb17159702 [0,1,0,0,0,0|1,0,0]=2 1520 B13R1.148 O=C(O)C(O)Cc1cccc(Br)n1 Amb33432775 [0,1,0,0,0,0|2,0,0]=3 1521 B13R1.148 O=C(O)C(O)Cc1cccc(Cl)c1 Amb33549427 [0,1,0,0,0,0|1,0,0]=2 1522 B13R1.148 O=C(O)C(O)Cc1cccc(Cl)n1 Amb33223340 [0,1,0,0,0,0|2,0,0]=3 1523 B13R1.148 O=C(O)C(O)Cc1cccc(F)c1 Amb26651975 [0,1,0,0,0,0|1,0,0]=2 1524 B13R1.148 O=C(O)C(O)Cc1cccc(I)c1 Amb33353476 [0,1,0,0,0,0|1,0,0]=2 1525 B13R1.148 O=C(O)C(O)Cc1cccc(O)c1 Amb32669558 [0,1,0,0,0,0|1,0,0]=2 1526 B13R1.148 O=C(O)C(O)Cc1cncc(Br)c1 Amb24535360 [0,1,0,0,0,0|2,0,0]=3 1527 B13R1.148 O=C(O)C(O)Cc1cncc(Cl)c1 Amb33353481 [0,1,0,0,0,0|2,0,0]=3 1528 B13R1.148 O=C(O)C(O)Cc1cncc(F)c1 Amb33196678 [0,1,0,0,0,0|2,0,0]=3 1529 B13R1.148 O=C(O)[C@@H](O)Cc1cccc(F)c1 Amb24725523 [0,1,0,0,0,0|1,0,0]=2 1530 B13R1.148 O=C(O)[C@H](O)Cc1cccc(Br)c1 Amb26964962 [0,1,0,0,0,0|1,0,0]=2 1531 B13R1.148 O=C(O)\C(Br)=C\c1cccc(Cl)c1 Amb2794050 [0,1,0,0,0,0|1,0,2]=4 1532 B13R1.148 O=C(O)\C(Cl)=C/c1cccc(Cl)c1 Amb27427070 [0,1,0,0,0,0|1,0,2]=4 1533 B13R1.148 O=C(O)\C(F)=C\c1cccc(Br)c1 Amb24520960 [0,1,0,0,0,0|1,0,2]=4 1534 B13R1.148 O=C(O)\C(F)=C\c1cccc(Cl)c1 Amb25085473 [0,1,0,0,0,0|1,0,2]=4 1535 B13R1.148 O=C(O)\C(F)=C\c1cccc(F)c1 Amb27162615 [0,1,0,0,0,0|1,0,2]=4 1536 B13R1.148 O=C(O)\C(F)=C\c1cccc(O)c1 Amb26474923 [0,1,0,0,0,0|1,0,2]=4 1537 B13R1.148 O=C(O)\C(S)=C\c1cccc(Cl)c1 Amb4036384 [0,1,0,0,0,0|1,0,2]=4 1538 B13R1.152 C=C(C(=C)c1ccccc1)C(=O)O Amb27760436 [0,1,0,0,0,0|1,0,2]=4 1539 B13R1.152 C=C(C(=O)O)C(C)c1ccccc1 Amb24634053 [0,1,0,0,0,0|1,0,1]=3 1540 B13R1.152 C=C(C(=O)O)C(O)c1ccccc1 Amb27477832 [0,1,0,0,0,0|1,0,1]=3 1541 B13R1.152 C=C(C(C)=O)C(N)c1ccccc1 Amb27647520 [0,1,0,0,0,0|2,0,1]=4 1542 B13R1.152 C=C(C(C)=O)C(O)c1ccccc1 Amb6537578 [0,1,0,0,0,0|2,0,1]=4 1543 B13R1.152 C=C(C(C)=O)[C@@H](N)c1ccccc1 Amb28429564 [0,1,0,0,0,0|2,0,1]=4 1544 B13R1.152 C=C(C(N)=O)C(N)c1ccccc1 Amb27882833 [0,1,0,0,0,0|2,0,1]=4 1545 B13R1.152 C=C(C(N)=O)[C@@H](N)c1ccccc1 Amb28365000 [0,1,0,0,0,0|2,0,1]=4 1546 B13R1.152 C=C(C(N)=O)[C@H](O)c1ccccc1 Amb28397965 [0,1,0,0,0,0|2,0,1]=4 1547 B13R1.152 C=C(C)C(O)C(N)c1ccccc1 Amb29875677 [0,1,0,0,0,0|3,0,0]=4 1548 B13R1.152 C=C(C)[C@@H](C)[C@H](O)c1ccccc1 Amb27486556 [0,1,0,0,0,0|3,0,0]=4 1549 B13R1.152 C=C(C)[C@H](C)[C@@H](O)c1ccccc1 Amb28061921 [0,1,0,0,0,0|3,0,0]=4 1550 B13R1.152 C=C(C)[C@H](C)[C@H](O)c1ccccc1 Amb27394813 [0,1,0,0,0,0|3,0,0]=4 1551 B13R1.152 C=C(C)[C@H](O)[C@@H](C)c1ccccc1 Amb27761634 [0,1,0,0,0,0|3,0,0]=4 1552 B13R1.152 C=C(c1ccccc1)C(C)C(=O)O Amb18127713 [0,1,0,0,0,0|1,0,1]=3 1553 B13R1.152 CC(=O)C(Br)C(=O)c1ccccc1 Amb28317159 [0,1,0,0,0,0|2,0,1]=4 1554 B13R1.152 CC(=O)C(Br)C(Br)c1ccccc1 Amb2610167 [0,1,0,0,0,0|2,0,0]=3 1555 B13R1.152 CC(=O)C(Br)C(C)c1cccnc1 Amb27475734 [0,1,0,0,0,0|3,0,0]=4 1556 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 Amb8394273 [0,1,0,0,0,0|2,0,1]=4 1557 B13R1.152 CC(=O)C(C)C(O)c1ccncc1 Amb27164650 [0,1,0,0,0,0|3,0,0]=4 1558 B13R1.152 CC(=O)C(Cl)C(Cl)c1ccccc1 Amb27623863 [0,1,0,0,0,0|2,0,0]=3 1559 B13R1.152 CC(=O)C(F)C(O)c1ccccc1 Amb28294136 [0,1,0,0,0,0|2,0,0]=3 1560 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](O)c1ccccc1 Amb28076748 [0,1,0,0,0,0|2,0,0]=3 1561 B13R1.152 CC(=O)[C@@H](Cl)[C@H](O)c1ccccc1 Amb28252413 [0,1,0,0,0,0|2,0,0]=3 1562 B13R1.152 CC(=O)[C@H](Cl)[C@H](Cl)c1ccccc1 Amb27390157 [0,1,0,0,0,0|2,0,0]=3 1563 B13R1.152 CC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb28121183 [0,1,0,0,0,0|2,0,0]=3 1564 B13R1.152 CC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb27660884 [0,1,0,0,0,0|2,0,0]=3 1565 B13R1.152 CC(C(=O)C(=O)O)c1ccccc1 Amb18648106 [0,1,0,0,0,0|1,0,1]=3 1566 B13R1.152 CC(C(=O)C(N)=O)c1ccccc1 Amb27984702 [0,1,0,0,0,0|2,0,1]=4 1567 B13R1.152 CC(C(=O)O)C(C)c1ccccc1 Amb6360544 [0,1,0,0,0,0|1,0,0]=2 1568 B13R1.152 CC(C(=O)O)C(C)c1ccccn1 Amb18824717 [0,1,0,0,0,0|2,0,0]=3 1569 B13R1.152 CC(C(=O)O)C(C)c1cccnc1 Amb27857029 [0,1,0,0,0,0|2,0,0]=3 1570 B13R1.152 CC(C(=O)O)C(C)c1ccncc1 Amb27415960 [0,1,0,0,0,0|2,0,0]=3 1571 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb17470593 [0,1,0,0,0,0|1,0,0]=2 1572 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb19375481 [0,1,0,0,0,0|1,0,0]=2 1573 B13R1.152 CC(C(=O)O)C(O)c1ccccc1 Amb3430442 [0,1,0,0,0,0|1,0,0]=2 1574 B13R1.152 CC(C(=O)O)N(C)c1ccccc1 Amb5762145 [0,1,0,0,0,0|2,0,0]=3 1575 B13R1.152 CC(C(=O)O)N(C)c1ccccn1 Amb27604988 [0,1,0,0,0,0|3,0,0]=4 1576 B13R1.152 CC(C(=O)O)N(C)c1ccncc1 Amb18993802 [0,1,0,0,0,0|3,0,0]=4 1577 B13R1.152 CC(C(=O)O)S(=O)c1ccccc1 Amb18292847 [0,1,0,0,0,0|2,0,0]=3 1578 B13R1.152 CC(C(=S)C(=O)O)c1ccccc1 Amb27409058 [0,1,0,0,0,0|1,0,1]=3 1579 B13R1.152 CC(C(N)=O)C(=O)c1ccccc1 Amb17594504 [0,1,0,0,0,0|2,0,1]=4 1580 B13R1.152 CC(C(N)=O)C(N)c1ccccc1 Amb27585479 [0,1,0,0,0,0|2,0,0]=3 1581 B13R1.152 CC(C(O)c1ccccc1)N(C)O Amb28189465 [0,1,0,0,0,0|3,0,0]=4 1582 B13R1.152 CC(C(O)c1ccccc1)[N+](=O)[O-] Amb6360730 [0,1,0,0,0,0|2,0,1]=4 1583 B13R1.152 CC(C)C(N)C(O)c1ccccc1 Amb17138913 [0,1,0,0,0,0|2,0,1]=4 1584 B13R1.152 CC(C)[C@@H](N)C(O)c1ccccc1 Amb35623667 [0,1,0,0,0,0|2,0,1]=4 1585 B13R1.152 CC(C)[C@H](N)C(O)c1ccccc1 Amb27201305 [0,1,0,0,0,0|2,0,1]=4 1586 B13R1.152 CC(C)[C@H](N)[C@H](O)c1ccccc1 Amb27180072 [0,1,0,0,0,0|2,0,1]=4 1587 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,1,0,0,0,0|2,0,1]=4 1588 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb32662531 [0,1,0,0,0,0|2,0,1]=4 1589 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb10072242 [0,1,0,0,0,0|0,0,0]=1 1590 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb2696733 [0,1,0,0,0,0|0,0,0]=1 1591 B13R1.152 CC(c1ccccc1)C(N)C(F)F Amb28318298 [0,1,0,0,0,0|2,0,1]=4 1592 B13R1.152 CC(c1ccccc1)C(N)C(N)=O Amb18975500 [0,1,0,0,0,0|1,0,0]=2 1593 B13R1.152 CC(c1ccccc1)C(N)C(N)=O Amb33552324 [0,1,0,0,0,0|1,0,0]=2 1594 B13R1.152 CC(c1ccccc1)C(O)C(=O)O Amb33537959 [0,1,0,0,0,0|1,0,0]=2 1595 B13R1.152 CC(c1ccccc1)N(C)C(N)=O Amb28293855 [0,1,0,0,0,0|3,0,0]=4 1596 B13R1.152 CC(c1ccccc1)[C@@H](C)C(=O)O Amb33744674 [0,1,0,0,0,0|1,0,0]=2 1597 B13R1.152 CC(c1ccccc1)[C@H](C)C(=O)O Amb33744350 [0,1,0,0,0,0|1,0,0]=2 1598 B13R1.152 CC(c1ccccc1)[C@H](N)C(=O)O Amb2694835 [0,1,0,0,0,0|0,0,0]=1 1599 B13R1.152 CC(c1ccccn1)C(N)C(=O)O Amb29892397 [0,1,0,0,0,0|1,0,0]=2 1600 B13R1.152 CC(c1cccnc1)C(N)C(=O)O Amb29892396 [0,1,0,0,0,0|1,0,0]=2 1601 B13R1.152 CC(c1cccnc1)[C@@H](C)C(=O)O Amb33749386 [0,1,0,0,0,0|2,0,0]=3 1602 B13R1.152 CC(c1cccnc1)[C@H](C)C(=O)O Amb33749516 [0,1,0,0,0,0|2,0,0]=3 1603 B13R1.152 CC(c1ccncc1)C(N)C(=O)O Amb29892398 [0,1,0,0,0,0|1,0,0]=2 1604 B13R1.152 CC(c1ccncn1)C(N)C(=O)O Amb30039898 [0,1,0,0,0,0|2,0,0]=3 1605 B13R1.152 CC(c1cnccn1)C(F)C(=O)O Amb27608863 [0,1,0,0,0,0|3,0,0]=4 1606 B13R1.152 CC(c1cnccn1)C(N)C(=O)O Amb29892399 [0,1,0,0,0,0|2,0,0]=3 1607 B13R1.152 CN(C(=O)C(=O)O)c1ccccc1 Amb9303801 [0,1,0,0,0,0|2,0,1]=4 1608 B13R1.152 C[C@@H](C(=O)O)[C@@H](C)c1ccccc1 Amb27407054 [0,1,0,0,0,0|1,0,0]=2 1609 B13R1.152 C[C@@H](C(=O)O)[C@H](O)c1ccccc1 Amb28239779 [0,1,0,0,0,0|1,0,0]=2 1610 B13R1.152 C[C@@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb27665209 [0,1,0,0,0,0|2,0,1]=4 1611 B13R1.152 C[C@@H]([C@@H](C)O)[C@@H](O)c1ccccc1 Amb27406983 [0,1,0,0,0,0|2,0,1]=4 1612 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)O Amb27972558 [0,1,0,0,0,0|3,0,0]=4 1613 B13R1.152 C[C@@H](c1ccccc1)C(N)C(=O)O Amb27645474 [0,1,0,0,0,0|0,0,0]=1 1614 B13R1.152 C[C@@H](c1ccccc1)[C@H](N)C(=O)O Amb4021752 [0,1,0,0,0,0|0,0,0]=1 1615 B13R1.152 C[C@H](C(=O)O)C(O)c1ccccc1 Amb27408977 [0,1,0,0,0,0|1,0,0]=2 1616 B13R1.152 C[C@H](C(=O)O)N(C)c1ccccc1 Amb27234440 [0,1,0,0,0,0|2,0,0]=3 1617 B13R1.152 C[C@H](C(=O)O)S(=O)c1ccccc1 Amb27848039 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.152 C[C@H](C(=O)O)[C@@H](N)c1ccccc1 Amb27392248 [0,1,0,0,0,0|1,0,0]=2 1619 B13R1.152 C[C@H](C(=O)O)[C@H](C)c1ccccc1 Amb28244756 [0,1,0,0,0,0|1,0,0]=2 1620 B13R1.152 C[C@H](O)[C@@H](C)[C@H](O)c1ccccc1 Amb27197964 [0,1,0,0,0,0|2,0,1]=4 1621 B13R1.152 C[C@H](O)[C@H](C)[C@@H](N)c1ccccc1 Amb27179082 [0,1,0,0,0,0|2,0,1]=4 1622 B13R1.152 C[C@H]([C@@H](C)O)[C@@H](N)c1ccccc1 Amb27777185 [0,1,0,0,0,0|2,0,1]=4 1623 B13R1.152 C[C@H](c1ccccc1)[C@@H](N)C(=O)O Amb22801136 [0,1,0,0,0,0|0,0,0]=1 1624 B13R1.152 C[C@H](c1ccccc1)[C@H](N)C(=O)O Amb28243568 [0,1,0,0,0,0|0,0,0]=1 1625 B13R1.152 C\C(=C(\F)C(=O)O)c1ccccc1 Amb18128594 [0,1,0,0,0,0|1,0,2]=4 1626 B13R1.152 C\C(C(=O)O)=C(\C)c1ccccc1 Amb18127724 [0,1,0,0,0,0|1,0,2]=4 1627 B13R1.152 NC(=O)C(=O)C(Cl)c1ccccc1 Amb27878632 [0,1,0,0,0,0|2,0,1]=4 1628 B13R1.152 NC(=O)C(Cl)S(=O)c1ccccc1 Amb27230549 [0,1,0,0,0,0|3,0,0]=4 1629 B13R1.152 NC(=O)C(F)C(O)c1ccccc1 Amb27876419 [0,1,0,0,0,0|2,0,0]=3 1630 B13R1.152 NC(=O)C(N)C(S)c1ccccc1 Amb28123114 [0,1,0,0,0,0|1,0,0]=2 1631 B13R1.152 NC(=O)[C@H](N)[C@@H](S)c1ccccc1 Amb27483657 [0,1,0,0,0,0|1,0,0]=2 1632 B13R1.152 NC(=O)[C@H](N)[C@H](O)c1ccccc1 Amb27477518 [0,1,0,0,0,0|1,0,0]=2 1633 B13R1.152 NC(C(=O)O)C(Cl)c1ccccc1 Amb9809972 [0,1,0,0,0,0|0,0,0]=1 1634 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb2228459 [0,1,0,0,0,0|0,0,0]=1 1635 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb533731 [0,1,0,0,0,0|0,0,0]=1 1636 B13R1.152 NC(C(=O)O)C(O)c1cccnc1 Amb32992289 [0,1,0,0,0,0|1,0,0]=2 1637 B13R1.152 NC(C(=O)O)C(O)c1cccnc1 Amb4036110 [0,1,0,0,0,0|1,0,0]=2 1638 B13R1.152 NC(C(=O)O)C(O)c1ccncc1 Amb18192714 [0,1,0,0,0,0|1,0,0]=2 1639 B13R1.152 NC(C(=O)O)C(O)c1ccncc1 Amb32721630 [0,1,0,0,0,0|1,0,0]=2 1640 B13R1.152 NC(C(=O)O)C(O)c1ccncn1 Amb25359555 [0,1,0,0,0,0|2,0,0]=3 1641 B13R1.152 NC(C(=O)O)C(O)c1cnccn1 Amb33359997 [0,1,0,0,0,0|2,0,0]=3 1642 B13R1.152 NC(C(=O)O)C(O)c1cncnc1 Amb25362434 [0,1,0,0,0,0|2,0,0]=3 1643 B13R1.152 NC(C(=O)O)C(O)c1ncccn1 Amb33270414 [0,1,0,0,0,0|2,0,0]=3 1644 B13R1.152 NC(C(F)F)C(O)c1ccccc1 Amb27415651 [0,1,0,0,0,0|2,0,1]=4 1645 B13R1.152 NC(c1ccccc1)C(F)C(=O)O Amb28248481 [0,1,0,0,0,0|1,0,0]=2 1646 B13R1.152 NC(c1ccccc1)C(O)C(=O)O Amb2697384 [0,1,0,0,0,0|1,0,0]=2 1647 B13R1.152 NC(c1cccnc1)C(O)C(=O)O Amb2697385 [0,1,0,0,0,0|2,0,0]=3 1648 B13R1.152 N[C@@H](C(=O)O)[C@@H](F)c1ccccc1 Amb27400343 [0,1,0,0,0,0|0,0,0]=1 1649 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)c1ccccc1 Amb26968525 [0,1,0,0,0,0|0,0,0]=1 1650 B13R1.152 N[C@@H](C(=O)O)[C@H](F)c1ccccc1 Amb27179073 [0,1,0,0,0,0|0,0,0]=1 1651 B13R1.152 N[C@@H](c1ccccc1)C(F)C(=O)O Amb27827423 [0,1,0,0,0,0|1,0,0]=2 1652 B13R1.152 N[C@@H](c1ccccc1)C(O)C(=O)O Amb28422254 [0,1,0,0,0,0|1,0,0]=2 1653 B13R1.152 N[C@@H](c1ccccc1)[C@@H](O)C(=O)O Amb10601661 [0,1,0,0,0,0|1,0,0]=2 1654 B13R1.152 N[C@@H](c1ccccc1)[C@@H](O)C(=O)O Amb16231605 [0,1,0,0,0,0|1,0,0]=2 1655 B13R1.152 N[C@@H](c1ccccc1)[C@H](O)C(=O)O Amb27874033 [0,1,0,0,0,0|1,0,0]=2 1656 B13R1.152 N[C@H](C(=O)O)C(O)c1ccccc1 Amb27180158 [0,1,0,0,0,0|0,0,0]=1 1657 B13R1.152 N[C@H](C(=O)O)[C@@H](F)c1ccccc1 Amb27983777 [0,1,0,0,0,0|0,0,0]=1 1658 B13R1.152 N[C@H](C(=O)O)[C@H](F)c1ccccc1 Amb27974203 [0,1,0,0,0,0|0,0,0]=1 1659 B13R1.152 N[C@H](C(=O)O)[C@H](O)c1ccccc1 Amb8516907 [0,1,0,0,0,0|0,0,0]=1 1660 B13R1.152 N[C@H](c1ccccc1)[C@@H](O)C(=O)O Amb17779638 [0,1,0,0,0,0|1,0,0]=2 1661 B13R1.152 N[C@H](c1ccccc1)[C@H](O)C(=O)O Amb17619345 [0,1,0,0,0,0|1,0,0]=2 1662 B13R1.152 N[C@H](c1ccccc1)[C@H](O)C(=O)O Amb22745018 [0,1,0,0,0,0|1,0,0]=2 1663 B13R1.152 N[C@H](c1cccnc1)[C@@H](O)C(=O)O Amb28282699 [0,1,0,0,0,0|2,0,0]=3 1664 B13R1.152 O=C(O)C(=O)C(=O)c1ccccc1 Amb31096952 [0,1,0,0,0,0|1,0,2]=4 1665 B13R1.152 O=C(O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,1,0,0,0,0|1,0,1]=3 1666 B13R1.152 O=C(O)C(=O)C(F)c1ccccc1 Amb27179146 [0,1,0,0,0,0|1,0,1]=3 1667 B13R1.152 O=C(O)C(=O)C(O)c1ccccc1 Amb27400378 [0,1,0,0,0,0|1,0,1]=3 1668 B13R1.152 O=C(O)C(Br)C(Br)c1ccccc1 Amb6335786 [0,1,0,0,0,0|1,0,0]=2 1669 B13R1.152 O=C(O)C(Cl)C(Cl)c1ccccc1 Amb18132697 [0,1,0,0,0,0|1,0,0]=2 1670 B13R1.152 O=C(O)C(O)C(Br)c1ccccc1 Amb17596766 [0,1,0,0,0,0|1,0,0]=2 1671 B13R1.152 O=C(O)C(O)C(O)c1ccccc1 Amb2799349 [0,1,0,0,0,0|1,0,0]=2 1672 B13R1.152 O=C(O)[C@@H](O)[C@@H](O)c1ccccc1 Amb559389 [0,1,0,0,0,0|1,0,0]=2 1673 B13R1.152 O=C(O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb27438527 [0,1,0,0,0,0|1,0,0]=2 1674 B13R1.152 O=C(O)\C(Br)=C(/Br)c1ccccc1 Amb28240921 [0,1,0,0,0,0|1,0,2]=4 1675 B13R1.152 O=C(O)\C(Br)=C(\Br)c1ccccc1 Amb4013024 [0,1,0,0,0,0|1,0,2]=4 1676 B13R1.152 O=C(O)\C(Cl)=C(\F)c1ccccc1 Amb26913366 [0,1,0,0,0,0|1,0,2]=4 1677 B13R1.202 C=C(C)C(N)Cc1ccccc1F Amb27195513 [0,1,0,0,0,0|2,0,0]=3 1678 B13R1.202 C=C(C)C(O)Cc1ccccc1Br Amb27974945 [0,1,0,0,0,0|3,0,0]=4 1679 B13R1.202 C=C(C)C(O)Cc1ccccc1Cl Amb27617551 [0,1,0,0,0,0|3,0,0]=4 1680 B13R1.202 C=C(Cc1ccccc1C)C(=O)O Amb27401861 [0,1,0,0,0,0|1,0,1]=3 1681 B13R1.202 CC(=O)C(=O)Cc1ccccc1Br Amb27241132 [0,1,0,0,0,0|2,0,1]=4 1682 B13R1.202 CC(=O)C(=O)Cc1ccccc1C Amb25158383 [0,1,0,0,0,0|2,0,1]=4 1683 B13R1.202 CC(=O)C(=O)Cc1ccccc1Cl Amb26452970 [0,1,0,0,0,0|2,0,1]=4 1684 B13R1.202 CC(=O)C(=O)Cc1ccccc1F Amb23603624 [0,1,0,0,0,0|2,0,1]=4 1685 B13R1.202 CC(=O)C(Br)Cc1ccccc1Br Amb18601676 [0,1,0,0,0,0|2,0,0]=3 1686 B13R1.202 CC(=O)C(Br)Cc1ccccc1C Amb25154824 [0,1,0,0,0,0|2,0,0]=3 1687 B13R1.202 CC(=O)C(Br)Cc1ccccc1Cl Amb18589744 [0,1,0,0,0,0|2,0,0]=3 1688 B13R1.202 CC(=O)C(Br)Cc1ccccc1F Amb33530399 [0,1,0,0,0,0|2,0,0]=3 1689 B13R1.202 CC(=O)C(Br)Cc1ccccc1I Amb28381308 [0,1,0,0,0,0|2,0,0]=3 1690 B13R1.202 CC(=O)C(Br)Cc1ccccc1O Amb17507801 [0,1,0,0,0,0|2,0,0]=3 1691 B13R1.202 CC(=O)C(C)Cc1ccccc1C Amb17233203 [0,1,0,0,0,0|2,0,0]=3 1692 B13R1.202 CC(=O)C(C)Cc1ccccc1Cl Amb17236507 [0,1,0,0,0,0|2,0,0]=3 1693 B13R1.202 CC(=O)C(C)Cc1ccccc1F Amb17233678 [0,1,0,0,0,0|2,0,0]=3 1694 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl Amb2412507 [0,1,0,0,0,0|3,0,0]=4 1695 B13R1.202 CC(=O)C(C)Oc1ccccc1F Amb2412550 [0,1,0,0,0,0|3,0,0]=4 1696 B13R1.202 CC(=O)C(C)Oc1ccccc1N Amb17110088 [0,1,0,0,0,0|3,0,0]=4 1697 B13R1.202 CC(=O)C(C)Oc1ccccc1O Amb2418519 [0,1,0,0,0,0|3,0,0]=4 1698 B13R1.202 CC(=O)C(C)Sc1ccccc1Br Amb9230774 [0,1,0,0,0,0|3,0,0]=4 1699 B13R1.202 CC(=O)C(C)Sc1ccccc1C Amb19051953 [0,1,0,0,0,0|3,0,0]=4 1700 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl Amb9268764 [0,1,0,0,0,0|3,0,0]=4 1701 B13R1.202 CC(=O)C(C)Sc1ccccc1F Amb9268570 [0,1,0,0,0,0|3,0,0]=4 1702 B13R1.202 CC(=O)C(Cl)Cc1ccccc1Br Amb17204824 [0,1,0,0,0,0|2,0,0]=3 1703 B13R1.202 CC(=O)C(Cl)Cc1ccccc1C Amb17204368 [0,1,0,0,0,0|2,0,0]=3 1704 B13R1.202 CC(=O)C(Cl)Cc1ccccc1Cl Amb4020125 [0,1,0,0,0,0|2,0,0]=3 1705 B13R1.202 CC(=O)C(Cl)Cc1ccccc1F Amb17204389 [0,1,0,0,0,0|2,0,0]=3 1706 B13R1.202 CC(=O)C(F)Cc1ccccc1Cl Amb28280408 [0,1,0,0,0,0|2,0,0]=3 1707 B13R1.202 CC(=O)C(N)Cc1ccccc1Br Amb18726733 [0,1,0,0,0,0|1,0,0]=2 1708 B13R1.202 CC(=O)C(N)Cc1ccccc1F Amb25079181 [0,1,0,0,0,0|1,0,0]=2 1709 B13R1.202 CC(=O)N(C)Cc1ccccc1N Amb6892986 [0,1,0,0,0,0|3,0,0]=4 1710 B13R1.202 CC(C)C(N)Cc1ccccc1Cl Amb17139687 [0,1,0,0,0,0|2,0,1]=4 1711 B13R1.202 CC(C)C(N)Cc1ccccc1F Amb17139010 [0,1,0,0,0,0|2,0,1]=4 1712 B13R1.202 CC(CN1C=NC=CC1=O)C(=O)O Amb27949381 [0,1,0,0,0,0|3,0,0]=4 1713 B13R1.202 CC(Cc1ccccc1Br)C(=O)O Amb17605816 [0,1,0,0,0,0|1,0,0]=2 1714 B13R1.202 CC(Cc1ccccc1Cl)C(=O)Cl Amb5744108 [0,1,0,0,0,0|2,0,0]=3 1715 B13R1.202 CC(Cc1ccccc1Cl)C(=O)O Amb2785264 [0,1,0,0,0,0|1,0,0]=2 1716 B13R1.202 CC(Cc1ccccc1F)C(=O)O Amb5744013 [0,1,0,0,0,0|1,0,0]=2 1717 B13R1.202 CC(Cc1ccccc1F)[N+](=O)[O-] Amb25924184 [0,1,0,0,0,0|2,0,1]=4 1718 B13R1.202 CC(Cc1ccccc1O)C(=O)O Amb10844200 [0,1,0,0,0,0|1,0,0]=2 1719 B13R1.202 CC(Cc1cccnc1Br)C(=O)O Amb33387424 [0,1,0,0,0,0|2,0,0]=3 1720 B13R1.202 CC(Cc1cccnc1Cl)C(=O)O Amb33256915 [0,1,0,0,0,0|2,0,0]=3 1721 B13R1.202 CC(Cc1cccnc1F)C(=O)O Amb33378336 [0,1,0,0,0,0|2,0,0]=3 1722 B13R1.202 CC(Cc1cccnc1N)C(=O)O Amb27954879 [0,1,0,0,0,0|2,0,0]=3 1723 B13R1.202 CC(Cc1ccncc1Br)C(=O)O Amb33242590 [0,1,0,0,0,0|2,0,0]=3 1724 B13R1.202 CC(Cc1ccncc1Cl)C(=O)O Amb26848472 [0,1,0,0,0,0|2,0,0]=3 1725 B13R1.202 CC(Cc1ccncc1F)C(=O)O Amb25039005 [0,1,0,0,0,0|2,0,0]=3 1726 B13R1.202 CC(Cc1cnccc1N)C(=O)O Amb28342767 [0,1,0,0,0,0|2,0,0]=3 1727 B13R1.202 CC(Cc1ncccc1Br)C(=O)O Amb24428877 [0,1,0,0,0,0|2,0,0]=3 1728 B13R1.202 CC(Cc1ncccc1F)C(=O)O Amb26560681 [0,1,0,0,0,0|2,0,0]=3 1729 B13R1.202 CC(F)C(N)Cc1ccccc1O Amb27965578 [0,1,0,0,0,0|2,0,1]=4 1730 B13R1.202 CC(Nc1cccc[n+]1[O-])C(=O)O Amb27428701 [0,1,0,0,0,0|3,0,0]=4 1731 B13R1.202 CC(Nc1ccccc1Br)C(=O)O Amb840563 [0,1,0,0,0,0|2,0,0]=3 1732 B13R1.202 CC(Nc1ccccc1Cl)C(=O)O Amb840560 [0,1,0,0,0,0|2,0,0]=3 1733 B13R1.202 CC(Nc1ccccc1F)C(=O)O Amb840557 [0,1,0,0,0,0|2,0,0]=3 1734 B13R1.202 CC(Nc1ccccc1I)C(=O)O Amb27657485 [0,1,0,0,0,0|2,0,0]=3 1735 B13R1.202 CC(Nc1cccnc1F)C(=O)O Amb35725109 [0,1,0,0,0,0|3,0,0]=4 1736 B13R1.202 CC(Nc1ccncc1F)C(=O)O Amb30036426 [0,1,0,0,0,0|3,0,0]=4 1737 B13R1.202 CC(Nc1cnccc1Cl)C(=O)O Amb28342529 [0,1,0,0,0,0|3,0,0]=4 1738 B13R1.202 CC(Nc1ncccc1O)C(=O)O Amb27592160 [0,1,0,0,0,0|3,0,0]=4 1739 B13R1.202 CC(O)C(C)Cc1ccccc1Br Amb24430235 [0,1,0,0,0,0|2,0,1]=4 1740 B13R1.202 CC(O)C(C)Cc1ccccc1Cl Amb17236857 [0,1,0,0,0,0|2,0,1]=4 1741 B13R1.202 CC(O)C(C)Cc1ccccc1F Amb17233912 [0,1,0,0,0,0|2,0,1]=4 1742 B13R1.202 CC(O)C(N)Cc1ccccc1Br Amb18155747 [0,1,0,0,0,0|1,0,1]=3 1743 B13R1.202 CC(Oc1ccccc1Br)C(=O)Cl Amb16230147 [0,1,0,0,0,0|3,0,0]=4 1744 B13R1.202 CC(Oc1ccccc1Br)C(=O)O Amb9704262 [0,1,0,0,0,0|2,0,0]=3 1745 B13R1.202 CC(Oc1ccccc1Br)C(N)=O Amb7752959 [0,1,0,0,0,0|3,0,0]=4 1746 B13R1.202 CC(Oc1ccccc1Cl)C(=O)Cl Amb16230065 [0,1,0,0,0,0|3,0,0]=4 1747 B13R1.202 CC(Oc1ccccc1Cl)C(=O)O Amb9704614 [0,1,0,0,0,0|2,0,0]=3 1748 B13R1.202 CC(Oc1ccccc1Cl)C(N)=O Amb8342103 [0,1,0,0,0,0|3,0,0]=4 1749 B13R1.202 CC(Oc1ccccc1F)C(=O)O Amb9702562 [0,1,0,0,0,0|2,0,0]=3 1750 B13R1.202 CC(Oc1ccccc1I)C(=O)O Amb9339551 [0,1,0,0,0,0|2,0,0]=3 1751 B13R1.202 CC(Oc1ccccc1N)C(=O)O Amb17110011 [0,1,0,0,0,0|2,0,0]=3 1752 B13R1.202 CC(Oc1cccnc1N)C(=O)O Amb18293670 [0,1,0,0,0,0|3,0,0]=4 1753 B13R1.202 CC(Sc1cccc[n+]1[O-])C(=O)O Amb28185774 [0,1,0,0,0,0|3,0,0]=4 1754 B13R1.202 CC(Sc1ccccc1Cl)C(=O)O Amb1126189 [0,1,0,0,0,0|2,0,0]=3 1755 B13R1.202 CC(Sc1ccccc1F)C(N)=O Amb10665503 [0,1,0,0,0,0|3,0,0]=4 1756 B13R1.202 CC(Sc1ccccc1O)C(=O)O Amb18984793 [0,1,0,0,0,0|2,0,0]=3 1757 B13R1.202 CC(Sc1ccccc1O)C(N)=O Amb18318228 [0,1,0,0,0,0|3,0,0]=4 1758 B13R1.202 CC(Sc1ccncc1F)C(=O)O Amb35737116 [0,1,0,0,0,0|3,0,0]=4 1759 B13R1.202 CC(Sc1ccncc1N)C(=O)O Amb18975669 [0,1,0,0,0,0|3,0,0]=4 1760 B13R1.202 CN(Cc1ccccc1N)C(N)=O Amb9318044 [0,1,0,0,0,0|3,0,0]=4 1761 B13R1.202 C[C@@H](Cc1ccccc1Cl)C(=O)O Amb10844213 [0,1,0,0,0,0|1,0,0]=2 1762 B13R1.202 C[C@@H](Cc1ccccc1F)C(=O)O Amb10844134 [0,1,0,0,0,0|1,0,0]=2 1763 B13R1.202 C[C@H](Cc1ccccc1Cl)C(=O)O Amb10844130 [0,1,0,0,0,0|1,0,0]=2 1764 B13R1.202 C[C@H](Cc1ccccc1F)C(=O)O Amb10844133 [0,1,0,0,0,0|1,0,0]=2 1765 B13R1.202 C[C@H](Nc1ccccc1Cl)C(=O)O Amb28121138 [0,1,0,0,0,0|2,0,0]=3 1766 B13R1.202 C\C(=C/c1ccccc1Br)C(=O)O Amb27181049 [0,1,0,0,0,0|1,0,2]=4 1767 B13R1.202 C\C(=C/c1ccccc1C)C(=O)O Amb4013359 [0,1,0,0,0,0|1,0,2]=4 1768 B13R1.202 C\C(=C/c1ccccc1Cl)C(=O)O Amb4005937 [0,1,0,0,0,0|1,0,2]=4 1769 B13R1.202 C\C(=C/c1ccccc1F)C(=O)O Amb5743929 [0,1,0,0,0,0|1,0,2]=4 1770 B13R1.202 C\C(=C/c1ccccc1O)C(=O)O Amb27881651 [0,1,0,0,0,0|1,0,2]=4 1771 B13R1.202 C\C(=C\c1ccccc1Br)C(=O)O Amb28128655 [0,1,0,0,0,0|1,0,2]=4 1772 B13R1.202 C\C(=C\c1ccccc1F)C(=O)O Amb27403871 [0,1,0,0,0,0|1,0,2]=4 1773 B13R1.202 C\C(=C\c1ccccc1N)C(=O)O Amb28436850 [0,1,0,0,0,0|1,0,2]=4 1774 B13R1.202 C\C(=N/c1ccccc1C)C(=O)O Amb27415502 [0,1,0,0,0,0|2,0,1]=4 1775 B13R1.202 Cc1ccccc1CC(=O)C(=O)O Amb1125804 [0,1,0,0,0,0|1,0,1]=3 1776 B13R1.202 Cc1ccccc1CC(Br)C(=O)O Amb23320597 [0,1,0,0,0,0|1,0,0]=2 1777 B13R1.202 Cc1ccccc1CC(C)C(=O)Cl Amb5744099 [0,1,0,0,0,0|2,0,0]=3 1778 B13R1.202 Cc1ccccc1CC(C)C(=O)O Amb5744011 [0,1,0,0,0,0|1,0,0]=2 1779 B13R1.202 Cc1ccccc1CC(C)C(C)O Amb17233449 [0,1,0,0,0,0|2,0,1]=4 1780 B13R1.202 Cc1ccccc1CC(C)[N+](=O)[O-] Amb28346871 [0,1,0,0,0,0|2,0,1]=4 1781 B13R1.202 Cc1ccccc1CC(Cl)C(=O)O Amb17204374 [0,1,0,0,0,0|1,0,0]=2 1782 B13R1.202 Cc1ccccc1CC(Cl)C(N)=O Amb17204371 [0,1,0,0,0,0|2,0,0]=3 1783 B13R1.202 Cc1ccccc1CC(N)C(=O)O Amb3788277 [0,1,0,0,0,0|0,0,0]=1 1784 B13R1.202 Cc1ccccc1CC(N)C(=O)O Amb5718718 [0,1,0,0,0,0|0,0,0]=1 1785 B13R1.202 Cc1ccccc1CC(N)C(C)C Amb17138831 [0,1,0,0,0,0|2,0,1]=4 1786 B13R1.202 Cc1ccccc1CC(N)C(F)F Amb25369105 [0,1,0,0,0,0|2,0,1]=4 1787 B13R1.202 Cc1ccccc1CC(N)C(N)=O Amb27667581 [0,1,0,0,0,0|1,0,0]=2 1788 B13R1.202 Cc1ccccc1CC(O)C(=O)O Amb17138948 [0,1,0,0,0,0|1,0,0]=2 1789 B13R1.202 Cc1ccccc1CC(S)C(=O)O Amb18968267 [0,1,0,0,0,0|1,0,0]=2 1790 B13R1.202 Cc1ccccc1CN(C)C(=O)Cl Amb27154131 [0,1,0,0,0,0|3,0,0]=4 1791 B13R1.202 Cc1ccccc1CN(C)C(N)=O Amb18186203 [0,1,0,0,0,0|3,0,0]=4 1792 B13R1.202 Cc1ccccc1C[C@@H](C)C(=O)O Amb10844135 [0,1,0,0,0,0|1,0,0]=2 1793 B13R1.202 Cc1ccccc1C[C@@H](N)C(=O)O Amb8397008 [0,1,0,0,0,0|0,0,0]=1 1794 B13R1.202 Cc1ccccc1C[C@H](C)C(=O)O Amb10844136 [0,1,0,0,0,0|1,0,0]=2 1795 B13R1.202 Cc1ccccc1C[C@H](N)C(=O)O Amb8397005 [0,1,0,0,0,0|0,0,0]=1 1796 B13R1.202 Cc1ccccc1NC(=O)C(=O)O Amb838973 [0,1,0,0,0,0|2,0,1]=4 1797 B13R1.202 Cc1ccccc1NC(C)C(=O)O Amb840547 [0,1,0,0,0,0|2,0,0]=3 1798 B13R1.202 Cc1ccccc1N[C@@H](C)C(=O)O Amb16231747 [0,1,0,0,0,0|2,0,0]=3 1799 B13R1.202 Cc1ccccc1OC(C)C(=O)Cl Amb16230057 [0,1,0,0,0,0|3,0,0]=4 1800 B13R1.202 Cc1ccccc1OC(C)C(=O)O Amb9704479 [0,1,0,0,0,0|2,0,0]=3 1801 B13R1.202 Cc1ccccc1OC(C)C(N)=O Amb5288275 [0,1,0,0,0,0|3,0,0]=4 1802 B13R1.202 Cc1ccccc1\C=C(/F)C(=O)O Amb32677834 [0,1,0,0,0,0|1,0,2]=4 1803 B13R1.202 Cc1ccccc1\C=C(/S)C(=O)O Amb24115487 [0,1,0,0,0,0|1,0,2]=4 1804 B13R1.202 Cc1ccccc1\C=C(\N)C(=O)O Amb28078042 [0,1,0,0,0,0|0,0,2]=3 1805 B13R1.202 Cc1ccccc1\C=C(\S)C(=O)O Amb27650601 [0,1,0,0,0,0|1,0,2]=4 1806 B13R1.202 Cc1cccnc1CC(=O)C(=O)O Amb33429020 [0,1,0,0,0,0|2,0,1]=4 1807 B13R1.202 Cc1cccnc1CC(C)C(=O)O Amb27465120 [0,1,0,0,0,0|2,0,0]=3 1808 B13R1.202 Cc1cccnc1CC(N)C(=O)O Amb3788310 [0,1,0,0,0,0|1,0,0]=2 1809 B13R1.202 Cc1cccnc1CC(N)C(N)=O Amb26356835 [0,1,0,0,0,0|2,0,0]=3 1810 B13R1.202 Cc1cccnc1CC(O)C(=O)O Amb28342261 [0,1,0,0,0,0|2,0,0]=3 1811 B13R1.202 Cc1cccnc1C[C@H](N)C(=O)O Amb24727924 [0,1,0,0,0,0|1,0,0]=2 1812 B13R1.202 Cc1cccnc1SC(F)C(=O)O Amb29879817 [0,1,0,0,0,0|3,0,0]=4 1813 B13R1.202 Cc1ccncc1CC(=O)C(=O)O Amb33377101 [0,1,0,0,0,0|2,0,1]=4 1814 B13R1.202 Cc1ccncc1CC(C)C(=O)O Amb25696863 [0,1,0,0,0,0|2,0,0]=3 1815 B13R1.202 Cc1ccncc1CC(N)C(=O)O Amb27640249 [0,1,0,0,0,0|1,0,0]=2 1816 B13R1.202 Cc1ccncc1CC(O)C(=O)O Amb33377044 [0,1,0,0,0,0|2,0,0]=3 1817 B13R1.202 Cc1ccncc1\C=C(\N)C(=O)O Amb27664554 [0,1,0,0,0,0|1,0,2]=4 1818 B13R1.202 Cc1cnccc1CC(=O)C(=O)O Amb33414514 [0,1,0,0,0,0|2,0,1]=4 1819 B13R1.202 Cc1cnccc1CC(C)C(=O)O Amb27226786 [0,1,0,0,0,0|2,0,0]=3 1820 B13R1.202 Cc1cnccc1CC(N)C(=O)O Amb3788313 [0,1,0,0,0,0|1,0,0]=2 1821 B13R1.202 Cc1cnccc1CC(N)C(N)=O Amb33036921 [0,1,0,0,0,0|2,0,0]=3 1822 B13R1.202 Cc1cnccc1CC(O)C(=O)O Amb33414502 [0,1,0,0,0,0|2,0,0]=3 1823 B13R1.202 Cc1cnccc1C[C@@H](N)C(=O)O Amb25063835 [0,1,0,0,0,0|1,0,0]=2 1824 B13R1.202 Cc1cnccc1C[C@H](N)C(=O)O Amb24390165 [0,1,0,0,0,0|1,0,0]=2 1825 B13R1.202 Cc1ncccc1CC(=O)C(=O)O Amb32880135 [0,1,0,0,0,0|2,0,1]=4 1826 B13R1.202 Cc1ncccc1CC(C)C(=O)O Amb25773491 [0,1,0,0,0,0|2,0,0]=3 1827 B13R1.202 Cc1ncccc1CC(Cl)C(N)=O Amb27415321 [0,1,0,0,0,0|3,0,0]=4 1828 B13R1.202 Cc1ncccc1CC(N)C(=O)O Amb26063815 [0,1,0,0,0,0|1,0,0]=2 1829 B13R1.202 Cc1ncccc1CC(N)C(N)=O Amb27251622 [0,1,0,0,0,0|2,0,0]=3 1830 B13R1.202 Cc1ncccc1CC(O)C(=O)O Amb32879600 [0,1,0,0,0,0|2,0,0]=3 1831 B13R1.202 Cc1ncccc1C[C@@H](N)C(=O)O Amb27187505 [0,1,0,0,0,0|1,0,0]=2 1832 B13R1.202 Cc1ncccc1C[C@H](N)C(=O)O Amb27609597 [0,1,0,0,0,0|1,0,0]=2 1833 B13R1.202 Cc1ncccc1OC(C)C(=O)O Amb27875064 [0,1,0,0,0,0|3,0,0]=4 1834 B13R1.202 Cc1ncccc1OC(F)C(=O)O Amb27637432 [0,1,0,0,0,0|3,0,0]=4 1835 B13R1.202 Cc1ncccc1O[C@@H](C)C(=O)O Amb27952243 [0,1,0,0,0,0|3,0,0]=4 1836 B13R1.202 Cc1ncccc1O[C@H](C)C(=O)O Amb27610333 [0,1,0,0,0,0|3,0,0]=4 1837 B13R1.202 Cc1nccnc1CC(C)C(=O)O Amb33142868 [0,1,0,0,0,0|3,0,0]=4 1838 B13R1.202 Cc1nccnc1CC(F)C(=O)O Amb35600939 [0,1,0,0,0,0|3,0,0]=4 1839 B13R1.202 Cc1nccnc1CC(N)C(=O)O Amb18193215 [0,1,0,0,0,0|2,0,0]=3 1840 B13R1.202 Cc1nccnc1CC(N)C(N)=O Amb33065738 [0,1,0,0,0,0|3,0,0]=4 1841 B13R1.202 Cc1nccnc1CC(O)C(=O)O Amb33353469 [0,1,0,0,0,0|3,0,0]=4 1842 B13R1.202 Cc1nccnc1CC(S)C(=O)O Amb35602915 [0,1,0,0,0,0|3,0,0]=4 1843 B13R1.202 Cc1nccnc1C[C@@H](N)C(=O)O Amb33065870 [0,1,0,0,0,0|2,0,0]=3 1844 B13R1.202 Cc1nccnc1C[C@H](N)C(=O)O Amb33065930 [0,1,0,0,0,0|2,0,0]=3 1845 B13R1.202 Cc1ncncc1CC(C)C(=O)O Amb33472513 [0,1,0,0,0,0|3,0,0]=4 1846 B13R1.202 Cc1ncncc1CC(N)C(=O)O Amb18193227 [0,1,0,0,0,0|2,0,0]=3 1847 B13R1.202 Cc1ncncc1CC(O)C(=O)O Amb33472480 [0,1,0,0,0,0|3,0,0]=4 1848 B13R1.202 N=C(Nc1ccccc1Cl)C(=O)O Amb27876025 [0,1,0,0,0,0|1,0,2]=4 1849 B13R1.202 N=C1C=CC=CN1CC(O)C(=O)O Amb27444608 [0,1,0,0,0,0|2,0,0]=3 1850 B13R1.202 NC(=O)C(Cl)Cc1ccccc1Br Amb17204831 [0,1,0,0,0,0|2,0,0]=3 1851 B13R1.202 NC(=O)C(Cl)Cc1ccccc1Cl Amb17204473 [0,1,0,0,0,0|2,0,0]=3 1852 B13R1.202 NC(=O)C(Cl)Cc1ccccc1F Amb17204394 [0,1,0,0,0,0|2,0,0]=3 1853 B13R1.202 NC(=O)C(N)Cc1ccccc1Br Amb27436997 [0,1,0,0,0,0|1,0,0]=2 1854 B13R1.202 NC(=O)C(N)Cc1ccccc1Cl Amb25239223 [0,1,0,0,0,0|1,0,0]=2 1855 B13R1.202 NC(=O)C(N)Cc1ccccc1F Amb26070634 [0,1,0,0,0,0|1,0,0]=2 1856 B13R1.202 NC(=O)C(N)Cc1ccncc1Br Amb33309067 [0,1,0,0,0,0|2,0,0]=3 1857 B13R1.202 NC(=O)C(N)Cc1ccncc1Cl Amb25109764 [0,1,0,0,0,0|2,0,0]=3 1858 B13R1.202 NC(=O)C(N)Cc1ncccc1Br Amb26436321 [0,1,0,0,0,0|2,0,0]=3 1859 B13R1.202 NC(=O)C(N)Cc1ncccc1Cl Amb33037056 [0,1,0,0,0,0|2,0,0]=3 1860 B13R1.202 NC(=O)N(O)Cc1ccccc1Cl Amb27950906 [0,1,0,0,0,0|3,0,0]=4 1861 B13R1.202 NC(=O)[C@H](N)Cc1ccccc1F Amb28316842 [0,1,0,0,0,0|1,0,0]=2 1862 B13R1.202 NC(CC1=CN=CNC1=O)C(=O)O Amb24654941 [0,1,0,0,0,0|2,0,0]=3 1863 B13R1.202 NC(CC1=CN=CNC1=O)C(=O)O Amb35752476 [0,1,0,0,0,0|2,0,0]=3 1864 B13R1.202 NC(CN1C=NC=CC1=O)C(=O)O Amb27181213 [0,1,0,0,0,0|2,0,0]=3 1865 B13R1.202 NC(CN1N=CC=CC1=O)C(=O)O Amb27181160 [0,1,0,0,0,0|2,0,0]=3 1866 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb28963434 [0,1,0,0,0,0|0,0,0]=1 1867 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb3790942 [0,1,0,0,0,0|0,0,0]=1 1868 B13R1.202 NC(Cc1ccccc1Br)C(F)F Amb25238069 [0,1,0,0,0,0|2,0,1]=4 1869 B13R1.202 NC(Cc1ccccc1Cl)C(=O)O Amb22723318 [0,1,0,0,0,0|0,0,0]=1 1870 B13R1.202 NC(Cc1ccccc1Cl)C(=O)O Amb9720245 [0,1,0,0,0,0|0,0,0]=1 1871 B13R1.202 NC(Cc1ccccc1Cl)C(F)F Amb27207200 [0,1,0,0,0,0|2,0,1]=4 1872 B13R1.202 NC(Cc1ccccc1F)C(=O)O Amb9725850 [0,1,0,0,0,0|0,0,0]=1 1873 B13R1.202 NC(Cc1ccccc1F)C(F)F Amb27977051 [0,1,0,0,0,0|2,0,1]=4 1874 B13R1.202 NC(Cc1ccccc1I)C(=O)O Amb3796905 [0,1,0,0,0,0|0,0,0]=1 1875 B13R1.202 NC(Cc1ccccc1O)C(=O)O Amb4035732 [0,1,0,0,0,0|0,0,0]=1 1876 B13R1.202 NC(Cc1ccccc1O)C(F)F Amb25350810 [0,1,0,0,0,0|2,0,1]=4 1877 B13R1.202 NC(Cc1cccnc1Br)C(=O)O Amb28186491 [0,1,0,0,0,0|1,0,0]=2 1878 B13R1.202 NC(Cc1cccnc1Cl)C(=O)O Amb27622699 [0,1,0,0,0,0|1,0,0]=2 1879 B13R1.202 NC(Cc1cccnc1F)C(=O)O Amb26027275 [0,1,0,0,0,0|1,0,0]=2 1880 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb25965738 [0,1,0,0,0,0|1,0,0]=2 1881 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb35747686 [0,1,0,0,0,0|1,0,0]=2 1882 B13R1.202 NC(Cc1cccnc1S)C(=O)O Amb27234612 [0,1,0,0,0,0|1,0,0]=2 1883 B13R1.202 NC(Cc1ccncc1Br)C(=O)O Amb26595170 [0,1,0,0,0,0|1,0,0]=2 1884 B13R1.202 NC(Cc1ccncc1Cl)C(=O)O Amb28397123 [0,1,0,0,0,0|1,0,0]=2 1885 B13R1.202 NC(Cc1ccncc1F)C(=O)O Amb26519678 [0,1,0,0,0,0|1,0,0]=2 1886 B13R1.202 NC(Cc1ncccc1Br)C(=O)O Amb25732428 [0,1,0,0,0,0|1,0,0]=2 1887 B13R1.202 NC(Cc1ncccc1Cl)C(=O)O Amb25778279 [0,1,0,0,0,0|1,0,0]=2 1888 B13R1.202 NC(Cc1ncccc1F)C(=O)O Amb24700457 [0,1,0,0,0,0|1,0,0]=2 1889 B13R1.202 NC(Cc1ncccc1O)C(=O)O Amb27595613 [0,1,0,0,0,0|1,0,0]=2 1890 B13R1.202 N[C@@H](Cc1ccccc1Br)C(=O)O Amb6295856 [0,1,0,0,0,0|0,0,0]=1 1891 B13R1.202 N[C@@H](Cc1ccccc1Cl)C(=O)O Amb2720121 [0,1,0,0,0,0|0,0,0]=1 1892 B13R1.202 N[C@@H](Cc1ccccc1F)C(=O)O Amb6295853 [0,1,0,0,0,0|0,0,0]=1 1893 B13R1.202 N[C@@H](Cc1ccccc1I)C(=O)O Amb22228856 [0,1,0,0,0,0|0,0,0]=1 1894 B13R1.202 N[C@@H](Cc1ccccc1O)C(=O)O Amb23440357 [0,1,0,0,0,0|0,0,0]=1 1895 B13R1.202 N[C@@H](Cc1ccccc1O)C(=O)O Amb8396994 [0,1,0,0,0,0|0,0,0]=1 1896 B13R1.202 N[C@@H](Cc1cccnc1O)C(=O)O Amb27488704 [0,1,0,0,0,0|1,0,0]=2 1897 B13R1.202 N[C@@H](Cc1cccnc1S)C(=O)O Amb27461489 [0,1,0,0,0,0|1,0,0]=2 1898 B13R1.202 N[C@@H](Cc1ccncc1Br)C(=O)O Amb25995158 [0,1,0,0,0,0|1,0,0]=2 1899 B13R1.202 N[C@@H](Cc1ccncc1Cl)C(=O)O Amb24655759 [0,1,0,0,0,0|1,0,0]=2 1900 B13R1.202 N[C@@H](Cc1cnccc1Cl)C(=O)O Amb27398552 [0,1,0,0,0,0|1,0,0]=2 1901 B13R1.202 N[C@@H](Cc1ncccc1Br)C(=O)O Amb26656037 [0,1,0,0,0,0|1,0,0]=2 1902 B13R1.202 N[C@@H](Cc1ncccc1Cl)C(=O)O Amb26657363 [0,1,0,0,0,0|1,0,0]=2 1903 B13R1.202 N[C@@H](Cc1ncccc1O)C(=O)O Amb27602165 [0,1,0,0,0,0|1,0,0]=2 1904 B13R1.202 N[C@H](Cc1ccccc1Br)C(=O)O Amb8389456 [0,1,0,0,0,0|0,0,0]=1 1905 B13R1.202 N[C@H](Cc1ccccc1Cl)C(=O)O Amb8396997 [0,1,0,0,0,0|0,0,0]=1 1906 B13R1.202 N[C@H](Cc1ccccc1F)C(=O)O Amb33813069 [0,1,0,0,0,0|0,0,0]=1 1907 B13R1.202 N[C@H](Cc1ccccc1F)C(=O)O Amb8389454 [0,1,0,0,0,0|0,0,0]=1 1908 B13R1.202 N[C@H](Cc1ccccc1I)C(=O)O Amb22228855 [0,1,0,0,0,0|0,0,0]=1 1909 B13R1.202 N[C@H](Cc1ccccc1O)C(=O)O Amb8396993 [0,1,0,0,0,0|0,0,0]=1 1910 B13R1.202 N[C@H](Cc1ccccc1S)C(=O)O Amb27468501 [0,1,0,0,0,0|0,0,0]=1 1911 B13R1.202 N[C@H](Cc1cccnc1O)C(=O)O Amb27173186 [0,1,0,0,0,0|1,0,0]=2 1912 B13R1.202 N[C@H](Cc1ccncc1Br)C(=O)O Amb27390068 [0,1,0,0,0,0|1,0,0]=2 1913 B13R1.202 N[C@H](Cc1ccncc1Cl)C(=O)O Amb26935883 [0,1,0,0,0,0|1,0,0]=2 1914 B13R1.202 N[C@H](Cc1ccncc1O)C(=O)O Amb27187347 [0,1,0,0,0,0|1,0,0]=2 1915 B13R1.202 N[C@H](Cc1cnccc1Br)C(=O)O Amb28133340 [0,1,0,0,0,0|1,0,0]=2 1916 B13R1.202 N[C@H](Cc1ncccc1Br)C(=O)O Amb27397558 [0,1,0,0,0,0|1,0,0]=2 1917 B13R1.202 N[C@H](Cc1ncccc1Cl)C(=O)O Amb26881661 [0,1,0,0,0,0|1,0,0]=2 1918 B13R1.202 N\C(=C\c1ccccc1Cl)C(=O)O Amb28456914 [0,1,0,0,0,0|0,0,2]=3 1919 B13R1.202 Nc1ccccc1CC(=S)C(=O)O Amb27415505 [0,1,0,0,0,0|1,0,1]=3 1920 B13R1.202 Nc1ccccc1CC(Cl)C(=O)O Amb27232765 [0,1,0,0,0,0|1,0,0]=2 1921 B13R1.202 Nc1ccccc1CC(N)C(=O)O Amb22002697 [0,1,0,0,0,0|0,0,0]=1 1922 B13R1.202 Nc1ccccc1C[C@@H](N)C(=O)O Amb22228579 [0,1,0,0,0,0|0,0,0]=1 1923 B13R1.202 Nc1ccccc1C[C@H](N)C(=O)O Amb22228581 [0,1,0,0,0,0|0,0,0]=1 1924 B13R1.202 Nc1ccncc1CC(N)C(=O)O Amb24460737 [0,1,0,0,0,0|1,0,0]=2 1925 B13R1.202 Nc1cnccc1C[C@@H](N)C(=O)O Amb27759999 [0,1,0,0,0,0|1,0,0]=2 1926 B13R1.202 Nc1cnccc1C[C@H](N)C(=O)O Amb27817785 [0,1,0,0,0,0|1,0,0]=2 1927 B13R1.202 Nc1ncccc1CC(N)C(=O)O Amb26926489 [0,1,0,0,0,0|1,0,0]=2 1928 B13R1.202 Nc1ncccc1C[C@@H](N)C(=O)O Amb27173187 [0,1,0,0,0,0|1,0,0]=2 1929 B13R1.202 O=C(O)C(=O)Cc1ccccc1Br Amb6261503 [0,1,0,0,0,0|1,0,1]=3 1930 B13R1.202 O=C(O)C(=O)Cc1ccccc1Cl Amb1135873 [0,1,0,0,0,0|1,0,1]=3 1931 B13R1.202 O=C(O)C(=O)Cc1ccccc1F Amb6249101 [0,1,0,0,0,0|1,0,1]=3 1932 B13R1.202 O=C(O)C(=O)Cc1ccccc1O Amb26601164 [0,1,0,0,0,0|1,0,1]=3 1933 B13R1.202 O=C(O)C(=O)Cc1cccnc1Br Amb33387453 [0,1,0,0,0,0|2,0,1]=4 1934 B13R1.202 O=C(O)C(=O)Cc1cccnc1Cl Amb33256969 [0,1,0,0,0,0|2,0,1]=4 1935 B13R1.202 O=C(O)C(=O)Cc1cccnc1F Amb33378326 [0,1,0,0,0,0|2,0,1]=4 1936 B13R1.202 O=C(O)C(=O)Cc1ccncc1Br Amb33385815 [0,1,0,0,0,0|2,0,1]=4 1937 B13R1.202 O=C(O)C(=O)Cc1ccncc1Cl Amb28196929 [0,1,0,0,0,0|2,0,1]=4 1938 B13R1.202 O=C(O)C(=O)Cc1ccncc1F Amb33317723 [0,1,0,0,0,0|2,0,1]=4 1939 B13R1.202 O=C(O)C(=O)Cc1ncccc1Br Amb24547998 [0,1,0,0,0,0|2,0,1]=4 1940 B13R1.202 O=C(O)C(=O)Cc1ncccc1F Amb33419186 [0,1,0,0,0,0|2,0,1]=4 1941 B13R1.202 O=C(O)C(=O)Nc1ccccc1Br Amb9238892 [0,1,0,0,0,0|2,0,1]=4 1942 B13R1.202 O=C(O)C(=O)Nc1ccccc1Cl Amb9303981 [0,1,0,0,0,0|2,0,1]=4 1943 B13R1.202 O=C(O)C(=O)Nc1ccccc1F Amb9303984 [0,1,0,0,0,0|2,0,1]=4 1944 B13R1.202 O=C(O)C(=O)Nc1ccccc1O Amb18128783 [0,1,0,0,0,0|2,0,1]=4 1945 B13R1.202 O=C(O)C(=S)Cc1ccccc1Cl Amb26316839 [0,1,0,0,0,0|1,0,1]=3 1946 B13R1.202 O=C(O)C(=S)Cc1ccccc1O Amb28044414 [0,1,0,0,0,0|1,0,1]=3 1947 B13R1.202 O=C(O)C(Br)Cc1ccccc1Br Amb22549389 [0,1,0,0,0,0|1,0,0]=2 1948 B13R1.202 O=C(O)C(Br)Cc1ccccc1Cl Amb2228490 [0,1,0,0,0,0|1,0,0]=2 1949 B13R1.202 O=C(O)C(Br)Cc1ccccc1F Amb22049841 [0,1,0,0,0,0|1,0,0]=2 1950 B13R1.202 O=C(O)C(Br)Cc1ccccc1O Amb27241205 [0,1,0,0,0,0|1,0,0]=2 1951 B13R1.202 O=C(O)C(Cl)CN1C=CC=NC1=O Amb27399209 [0,1,0,0,0,0|3,0,0]=4 1952 B13R1.202 O=C(O)C(Cl)Cc1ccccc1Br Amb17204843 [0,1,0,0,0,0|1,0,0]=2 1953 B13R1.202 O=C(O)C(Cl)Cc1ccccc1Cl Amb17204490 [0,1,0,0,0,0|1,0,0]=2 1954 B13R1.202 O=C(O)C(Cl)Cc1ccccc1F Amb17204397 [0,1,0,0,0,0|1,0,0]=2 1955 B13R1.202 O=C(O)C(F)Cc1ccccc1Br Amb27843640 [0,1,0,0,0,0|1,0,0]=2 1956 B13R1.202 O=C(O)C(F)Oc1ccccc1Cl Amb27263606 [0,1,0,0,0,0|2,0,0]=3 1957 B13R1.202 O=C(O)C(F)Oc1ccccc1F Amb27241900 [0,1,0,0,0,0|2,0,0]=3 1958 B13R1.202 O=C(O)C(F)Sc1ccccc1O Amb27397775 [0,1,0,0,0,0|2,0,0]=3 1959 B13R1.202 O=C(O)C(F)Sc1ncccc1Br Amb27263607 [0,1,0,0,0,0|3,0,0]=4 1960 B13R1.202 O=C(O)C(F)Sc1ncccc1Cl Amb27593087 [0,1,0,0,0,0|3,0,0]=4 1961 B13R1.202 O=C(O)C(O)Cc1ccccc1Br Amb26914266 [0,1,0,0,0,0|1,0,0]=2 1962 B13R1.202 O=C(O)C(O)Cc1ccccc1Cl Amb17139822 [0,1,0,0,0,0|1,0,0]=2 1963 B13R1.202 O=C(O)C(O)Cc1ccccc1F Amb17139079 [0,1,0,0,0,0|1,0,0]=2 1964 B13R1.202 O=C(O)C(O)Cc1ccccc1O Amb24692674 [0,1,0,0,0,0|1,0,0]=2 1965 B13R1.202 O=C(O)C(O)Cc1cccnc1Br Amb33387457 [0,1,0,0,0,0|2,0,0]=3 1966 B13R1.202 O=C(O)C(O)Cc1cccnc1Cl Amb33257315 [0,1,0,0,0,0|2,0,0]=3 1967 B13R1.202 O=C(O)C(O)Cc1cccnc1F Amb25266041 [0,1,0,0,0,0|2,0,0]=3 1968 B13R1.202 O=C(O)C(O)Cc1ccncc1Br Amb33330845 [0,1,0,0,0,0|2,0,0]=3 1969 B13R1.202 O=C(O)C(O)Cc1ccncc1Br Amb33353363 [0,1,0,0,0,0|2,0,0]=3 1970 B13R1.202 O=C(O)C(O)Cc1ccncc1Cl Amb25718576 [0,1,0,0,0,0|2,0,0]=3 1971 B13R1.202 O=C(O)C(O)Cc1ccncc1F Amb33317714 [0,1,0,0,0,0|2,0,0]=3 1972 B13R1.202 O=C(O)C(O)Cc1ncccc1Br Amb24669896 [0,1,0,0,0,0|2,0,0]=3 1973 B13R1.202 O=C(O)C(O)Cc1ncccc1F Amb28317451 [0,1,0,0,0,0|2,0,0]=3 1974 B13R1.202 O=C(O)[C@H](O)Cc1ccccc1F Amb28291609 [0,1,0,0,0,0|1,0,0]=2 1975 B13R1.202 O=C(O)\C(F)=C\c1ccccc1Br Amb27415913 [0,1,0,0,0,0|1,0,2]=4 1976 B13R1.202 O=C(O)\C(F)=C\c1ccccc1Cl Amb25256125 [0,1,0,0,0,0|1,0,2]=4 1977 B13R1.202 O=C(O)\C(F)=C\c1ccccc1F Amb27812349 [0,1,0,0,0,0|1,0,2]=4 1978 B13R1.202 O=C(O)\C(S)=C/c1ccccc1Cl Amb2550971 [0,1,0,0,0,0|1,0,2]=4 1979 B13R1.353 CC(C)(C)C(N)Cc1ccccc1 Amb18968296 [0,1,0,0,0,0|2,0,1]=4 1980 B13R1.353 CC(C)(C)C(N)Cc1ccccc1 Amb19374190 [0,1,0,0,0,0|2,0,1]=4 1981 B13R1.353 CC(C)(C)[C@@H](N)Cc1ccccc1 Amb27807481 [0,1,0,0,0,0|2,0,1]=4 1982 B13R1.353 CC(C)(C)[C@H](N)Cc1ccccc1 Amb27950872 [0,1,0,0,0,0|2,0,1]=4 1983 B13R1.353 CC(C)(F)C(N)Cc1ccccc1 Amb27179540 [0,1,0,0,0,0|2,0,1]=4 1984 B13R1.353 CC(Cc1ccccc1)S(=O)(=O)Cl Amb5735532 [0,1,0,0,0,0|2,0,1]=4 1985 B13R1.353 CC(Cc1ccccc1)S(=O)(=O)F Amb33352295 [0,1,0,0,0,0|2,0,1]=4 1986 B13R1.353 CC(Cc1ccccc1)S(N)(=O)=O Amb18316776 [0,1,0,0,0,0|2,0,1]=4 1987 B13R1.353 CC(F)(F)C(N)Cc1ccccc1 Amb27948036 [0,1,0,0,0,0|2,0,1]=4 1988 B13R1.353 CP(=O)(O)C(N)Cc1ccccc1 Amb22450960 [0,1,0,0,0,0|1,0,0]=2 1989 B13R1.353 CP(=O)(O)[C@@H](N)Cc1ccccc1 Amb28048822 [0,1,0,0,0,0|1,0,0]=2 1990 B13R1.353 CP(C)(=O)C(N)Cc1ccccc1 Amb27983581 [0,1,0,0,0,0|2,0,0]=3 1991 B13R1.353 CS(=O)(=O)N(N)Cc1ccccc1 Amb24530171 [0,1,0,0,0,0|2,0,1]=4 1992 B13R1.353 CS(=O)(=O)N(N)Cc1ccccc1 Amb32661065 [0,1,0,0,0,0|2,0,1]=4 1993 B13R1.353 C[C@H](Nc1ccccc1)S(=O)(=O)O Amb27481684 [0,1,0,0,0,0|3,0,0]=4 1994 B13R1.353 C[Si](C)(C)C(N)Cc1ccccc1 Amb27597650 [0,1,0,0,0,0|2,1,0]=4 1995 B13R1.353 NC(Cc1ccccc1)C(F)(F)F Amb10839109 [0,1,0,0,0,0|2,0,1]=4 1996 B13R1.353 NC(Cc1ccccc1)P(=O)(O)O Amb4062872 [0,1,0,0,0,0|1,0,0]=2 1997 B13R1.353 NC(Cc1ccccn1)P(=O)(O)O Amb28047328 [0,1,0,0,0,0|2,0,0]=3 1998 B13R1.353 N[C@@H](Cc1ccccc1)C(F)(F)F Amb19889267 [0,1,0,0,0,0|2,0,1]=4 1999 B13R1.353 N[C@@H](Cc1ccccc1)P(=O)(O)O Amb10069962 [0,1,0,0,0,0|1,0,0]=2 2000 B13R1.353 N[C@H](Cc1ccccc1)C(F)(F)F Amb19889268 [0,1,0,0,0,0|2,0,1]=4 2001 B13R1.353 N[C@H](Cc1ccccc1)P(=O)(O)O Amb10069963 [0,1,0,0,0,0|1,0,0]=2 2002 B13R1.353 N\C(=N/c1ccccc1)S(=O)(=O)O Amb24399284 [0,1,0,0,0,0|2,0,1]=4 2003 B13R1.353 O=S(=O)([O-])C(O)Cc1ccccc1 Amb22475703 [0,1,0,0,0,0|2,0,1]=4 2004 B13R1.418 CC(=O)C(CN)Cc1ccccc1 Amb33447075 [0,1,0,0,0,0|1,0,0]=2 2005 B13R1.418 CC(=O)C(CN)Cc1ccccn1 Amb33447068 [0,1,0,0,0,0|2,0,0]=3 2006 B13R1.418 CC(=O)C(CN)Cc1cccnc1 Amb33447072 [0,1,0,0,0,0|2,0,0]=3 2007 B13R1.418 CC(=O)C(CN)Cc1ccncc1 Amb33447069 [0,1,0,0,0,0|2,0,0]=3 2008 B13R1.418 CC(=O)C(Cc1ccccc1)=[N+]=[N-] Amb17594403 [0,1,0,0,0,0|1,0,2]=4 2009 B13R1.418 CC(=O)N(CCl)Cc1ccccc1 Amb27659293 [0,1,0,0,0,0|3,0,0]=4 2010 B13R1.418 CC(=O)N(CO)Cc1ccccc1 Amb27662432 [0,1,0,0,0,0|3,0,0]=4 2011 B13R1.418 CC(=O)\C(=C/N)Cc1ccccc1 Amb17777847 [0,1,0,0,0,0|1,0,1]=3 2012 B13R1.418 CC(=O)\C(=C/O)Cc1ccccc1 Amb27260481 [0,1,0,0,0,0|2,0,1]=4 2013 B13R1.418 CC(=O)\C(=C/[O-])Cc1ccccc1 Amb21947890 [0,1,0,0,0,0|2,0,1]=4 2014 B13R1.418 CC(=O)\C(=C/[O-])Cc1ccccc1 Amb21947891 [0,1,0,0,0,0|2,0,1]=4 2015 B13R1.418 CC(=O)\C(=C\N)Sc1ccccc1 Amb26873942 [0,1,0,0,0,0|2,0,1]=4 2016 B13R1.418 CC(=O)\C(Cc1ccccc1)=N/O Amb28202239 [0,1,0,0,0,0|1,0,2]=4 2017 B13R1.418 CC(C)C(CN)Cc1ccccc1 Amb17233325 [0,1,0,0,0,0|2,0,1]=4 2018 B13R1.418 CC(C)C(CN)Cc1ccccc1 Amb28600315 [0,1,0,0,0,0|2,0,1]=4 2019 B13R1.418 CC(C)C(Cc1ccccc1)NN Amb33109800 [0,1,0,0,0,0|2,0,1]=4 2020 B13R1.418 CCC(Cc1ccccc1)C(=O)O Amb5744036 [0,1,0,0,0,0|1,0,0]=2 2021 B13R1.418 CCC(Cc1ccccc1)C(C)=O Amb17233201 [0,1,0,0,0,0|2,0,0]=3 2022 B13R1.418 CCC(Cc1ccccn1)C(=O)O Amb5744033 [0,1,0,0,0,0|2,0,0]=3 2023 B13R1.418 CCC(Cc1cccnc1)C(=O)O Amb5744034 [0,1,0,0,0,0|2,0,0]=3 2024 B13R1.418 CCC(Cc1ccncc1)C(=O)O Amb5744035 [0,1,0,0,0,0|2,0,0]=3 2025 B13R1.418 CCC(Nc1ccccc1)C(=O)O Amb9702181 [0,1,0,0,0,0|2,0,0]=3 2026 B13R1.418 CCC(Nc1ccccc1)C(C)=O Amb27244645 [0,1,0,0,0,0|3,0,0]=4 2027 B13R1.418 CCC(Nc1ccccc1)C(N)=O Amb19007446 [0,1,0,0,0,0|3,0,0]=4 2028 B13R1.418 CCC(Nc1ccncc1)C(=O)O Amb9329941 [0,1,0,0,0,0|3,0,0]=4 2029 B13R1.418 CCC(Oc1ccccc1)C(=O)Cl Amb22274837 [0,1,0,0,0,0|3,0,0]=4 2030 B13R1.418 CCC(Oc1ccccc1)C(=O)O Amb6334837 [0,1,0,0,0,0|2,0,0]=3 2031 B13R1.418 CCC(Sc1ccccc1)C(=O)O Amb5721598 [0,1,0,0,0,0|2,0,0]=3 2032 B13R1.418 CCC(Sc1ccccc1)C(C)=O Amb32682580 [0,1,0,0,0,0|3,0,0]=4 2033 B13R1.418 CCC(Sc1ccccn1)C(=O)O Amb9284764 [0,1,0,0,0,0|3,0,0]=4 2034 B13R1.418 CCN(Cc1ccccc1)C(=O)Cl Amb17563084 [0,1,0,0,0,0|3,0,0]=4 2035 B13R1.418 CCN(Cc1ccccc1)C(C)=O Amb6338885 [0,1,0,0,0,0|3,0,0]=4 2036 B13R1.418 CCN(Cc1ccccc1)C(N)=O Amb7761977 [0,1,0,0,0,0|3,0,0]=4 2037 B13R1.418 CC[C@@H](Nc1ccccc1)C(=O)O Amb33347517 [0,1,0,0,0,0|2,0,0]=3 2038 B13R1.418 CC[C@H](Nc1ccccc1)C(=O)O Amb33347515 [0,1,0,0,0,0|2,0,0]=3 2039 B13R1.418 CC[C@H](Nc1ccccc1)C(C)=O Amb28070936 [0,1,0,0,0,0|3,0,0]=4 2040 B13R1.418 CC\C(=C/c1ccccc1)C(=O)O Amb4021410 [0,1,0,0,0,0|1,0,2]=4 2041 B13R1.418 CN(C)C(CN)Cc1ccccc1 Amb433665 [0,1,0,0,0,0|3,0,0]=4 2042 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb33983942 [0,1,0,0,0,0|0,0,0]=1 2043 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb9619791 [0,1,0,0,0,0|0,0,0]=1 2044 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb10604038 [0,1,0,0,0,0|0,0,0]=1 2045 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb22744994 [0,1,0,0,0,0|0,0,0]=1 2046 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb16183857 [0,1,0,0,0,0|0,0,0]=1 2047 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb33801550 [0,1,0,0,0,0|0,0,0]=1 2048 B13R1.418 COC(Cc1ccccc1)C(=O)O Amb18128650 [0,1,0,0,0,0|1,0,0]=2 2049 B13R1.418 COC(Cc1ccccn1)C(=O)O Amb33360479 [0,1,0,0,0,0|2,0,0]=3 2050 B13R1.418 COC(Cc1cccnc1)C(=O)O Amb33360424 [0,1,0,0,0,0|2,0,0]=3 2051 B13R1.418 COC(Cc1ccncc1)C(=O)O Amb33380641 [0,1,0,0,0,0|2,0,0]=3 2052 B13R1.418 COC(Cc1ccncn1)C(=O)O Amb33225031 [0,1,0,0,0,0|3,0,0]=4 2053 B13R1.418 COC(Cc1cnccn1)C(=O)O Amb33429662 [0,1,0,0,0,0|3,0,0]=4 2054 B13R1.418 COC(Cc1cncnc1)C(=O)O Amb32876390 [0,1,0,0,0,0|3,0,0]=4 2055 B13R1.418 COC(Cc1ncccn1)C(=O)O Amb33269944 [0,1,0,0,0,0|3,0,0]=4 2056 B13R1.418 CO\C(=C/c1ccccc1)C(=O)O Amb1945718 [0,1,0,0,0,0|1,0,2]=4 2057 B13R1.418 CO\C(=C\c1ccccc1)C(=O)O Amb28242324 [0,1,0,0,0,0|1,0,2]=4 2058 B13R1.418 CS\C(=C\c1ccccc1)C(=O)O Amb18130097 [0,1,0,0,0,0|1,0,2]=4 2059 B13R1.418 N#CC(Cc1ccccc1)C(=O)O Amb2731872 [0,1,0,0,0,0|0,0,1]=2 2060 B13R1.418 N#CC(Cc1ccccn1)C(=O)O Amb17090107 [0,1,0,0,0,0|1,0,1]=3 2061 B13R1.418 N#CC(Cc1cccnc1)C(=O)O Amb17090108 [0,1,0,0,0,0|1,0,1]=3 2062 B13R1.418 N#CC(Cc1ccncc1)C(=O)O Amb17090109 [0,1,0,0,0,0|1,0,1]=3 2063 B13R1.418 N#CC(Cc1ccncc1)C(N)=O Amb28193426 [0,1,0,0,0,0|2,0,1]=4 2064 B13R1.418 N#CC(Cc1cnccn1)C(=O)O Amb35621326 [0,1,0,0,0,0|2,0,1]=4 2065 B13R1.418 N#CC(Cc1ncccn1)C(=O)O Amb35583765 [0,1,0,0,0,0|2,0,1]=4 2066 B13R1.418 N#C\C(=C/c1ccccc1)C(=O)O Amb17224284 [0,1,0,0,0,0|0,0,3]=4 2067 B13R1.418 N#C\C(=C\c1ccccc1)C(=O)O Amb4015026 [0,1,0,0,0,0|0,0,3]=4 2068 B13R1.418 NC(=O)C(CO)Nc1ccccc1 Amb27180189 [0,1,0,0,0,0|3,0,0]=4 2069 B13R1.418 NC(=O)N(Cc1ccccc1)N=O Amb24710298 [0,1,0,0,0,0|2,0,1]=4 2070 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb2697356 [0,1,0,0,0,0|0,0,0]=1 2071 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb33547962 [0,1,0,0,0,0|0,0,0]=1 2072 B13R1.418 NCC(Cc1ccccc1)C(F)F Amb32953313 [0,1,0,0,0,0|2,0,1]=4 2073 B13R1.418 NCC(Cc1ccccn1)C(=O)O Amb19343541 [0,1,0,0,0,0|1,0,0]=2 2074 B13R1.418 NCC(Cc1ccccn1)C(=O)O Amb5744248 [0,1,0,0,0,0|1,0,0]=2 2075 B13R1.418 NCC(Cc1cccnc1)C(=O)O Amb19373762 [0,1,0,0,0,0|1,0,0]=2 2076 B13R1.418 NCC(Cc1cccnc1)C(=O)O Amb33532050 [0,1,0,0,0,0|1,0,0]=2 2077 B13R1.418 NCC(Cc1ccncc1)C(=O)O Amb32664801 [0,1,0,0,0,0|1,0,0]=2 2078 B13R1.418 NCC(Cc1ccncc1)C(=O)O Amb5744250 [0,1,0,0,0,0|1,0,0]=2 2079 B13R1.418 NCC(Oc1ccccc1)C(=O)O Amb32651876 [0,1,0,0,0,0|1,0,0]=2 2080 B13R1.418 NCC(Oc1ccccc1)C(=O)O Amb32651877 [0,1,0,0,0,0|1,0,0]=2 2081 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745974 [0,1,0,0,0,0|0,0,0]=1 2082 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745975 [0,1,0,0,0,0|0,0,0]=1 2083 B13R1.418 NC[C@@H](Oc1ccccc1)C(=O)O Amb32652164 [0,1,0,0,0,0|1,0,0]=2 2084 B13R1.418 NC[C@@H](Oc1ccccc1)C(=O)O Amb32652167 [0,1,0,0,0,0|1,0,0]=2 2085 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33329263 [0,1,0,0,0,0|0,0,0]=1 2086 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33457755 [0,1,0,0,0,0|0,0,0]=1 2087 B13R1.418 NC[C@H](Oc1ccccc1)C(=O)O Amb32652288 [0,1,0,0,0,0|1,0,0]=2 2088 B13R1.418 NC[C@H](Oc1ccccc1)C(=O)O Amb32652289 [0,1,0,0,0,0|1,0,0]=2 2089 B13R1.418 NC\C(=C/c1cccnc1)C(=O)O Amb27232796 [0,1,0,0,0,0|1,0,2]=4 2090 B13R1.418 NC\C(=C\c1cccnc1)C(=O)O Amb27477995 [0,1,0,0,0,0|1,0,2]=4 2091 B13R1.418 NOC(Cc1ccccc1)C(=O)O Amb32663372 [0,1,0,0,0,0|0,0,0]=1 2092 B13R1.418 NOC(Cc1ccccc1)C(=O)O Amb33339164 [0,1,0,0,0,0|0,0,0]=1 2093 B13R1.418 N\N=C(\Cc1ccccc1)C(=O)O Amb27409024 [0,1,0,0,0,0|0,0,1]=2 2094 B13R1.418 O=C(O)C(CO)Cc1ccccc1 Amb31291631 [0,1,0,0,0,0|1,0,0]=2 2095 B13R1.418 O=C(O)C(Cc1ccccc1)NO Amb33482855 [0,1,0,0,0,0|0,0,0]=1 2096 B13R1.418 O=C(O)[C@@H](CS)Nc1ccccc1 Amb27415495 [0,1,0,0,0,0|2,0,0]=3 2097 B13R1.418 O=C(O)[C@H](CO)Nc1ccccc1 Amb28243263 [0,1,0,0,0,0|2,0,0]=3 2098 B13R1.418 O=C(O)\C(=C/O)Nc1ccccc1 Amb27440517 [0,1,0,0,0,0|2,0,1]=4 2099 B13R1.418 O=C(O)\C(=C/c1ccccc1)CO Amb20671516 [0,1,0,0,0,0|1,0,2]=4 2100 B13R1.418 O=C(O)\C(=C\Cl)Cc1ccccc1 Amb27187237 [0,1,0,0,0,0|1,0,1]=3 2101 B13R1.418 O=C(O)\C(Cc1ccccc1)=N/O Amb4035775 [0,1,0,0,0,0|0,0,2]=3 2102 B13R1.418 O=C(O)\C(Cc1ccccn1)=N/O Amb23603651 [0,1,0,0,0,0|1,0,2]=4 2103 B13R1.418 O=C(O)\C(Cc1cccnc1)=N/O Amb23603650 [0,1,0,0,0,0|1,0,2]=4 2104 B13R1.418 O=C(O)\C(Cc1ccncc1)=N/O Amb23603652 [0,1,0,0,0,0|1,0,2]=4 2105 B13R1.418 O=C=C(Cc1ccccc1)C(=O)Cl Amb27607123 [0,1,0,0,0,0|2,0,1]=4 2106 B13R1.418 [C-]#[N+]\C(=C/c1ccccc1)C(=O)O Amb27608648 [0,1,0,0,0,0|0,0,3]=4 2107 B13R1.1073 CC(=O)C(C)(Cl)Cc1ccccc1 Amb4020126 [0,1,0,0,0,0|2,0,0]=3 2108 B13R1.1073 CC(=O)C(C)(N)Cc1ccccc1 Amb28239796 [0,1,0,0,0,0|1,0,0]=2 2109 B13R1.1073 CC(=O)C(C)(N)Cc1ccccc1 Amb35746580 [0,1,0,0,0,0|1,0,0]=2 2110 B13R1.1073 CC(=O)C(C)(N)Cc1ccncc1 Amb28136931 [0,1,0,0,0,0|2,0,0]=3 2111 B13R1.1073 CC(=O)C(C)(O)Cc1ccccc1 Amb22641853 [0,1,0,0,0,0|2,0,0]=3 2112 B13R1.1073 CC(=O)C(C)(O)Nc1ccccc1 Amb27777272 [0,1,0,0,0,0|3,0,0]=4 2113 B13R1.1073 CC(Br)(Cc1ccccc1)C(=O)O Amb25957726 [0,1,0,0,0,0|1,0,0]=2 2114 B13R1.1073 CC(C)(Cc1ccccc1)C(=O)O Amb8439763 [0,1,0,0,0,0|1,0,0]=2 2115 B13R1.1073 CC(C)(Cc1ccccc1)C(N)=O Amb16939814 [0,1,0,0,0,0|2,0,0]=3 2116 B13R1.1073 CC(C)(Cc1ccccc1)C(N)=S Amb17466450 [0,1,0,0,0,0|2,1,0]=4 2117 B13R1.1073 CC(C)(Cc1ccccn1)C(=O)O Amb18065824 [0,1,0,0,0,0|2,0,0]=3 2118 B13R1.1073 CC(C)(Cc1cccnc1)C(=O)O Amb18065825 [0,1,0,0,0,0|2,0,0]=3 2119 B13R1.1073 CC(C)(Cc1ccncc1)C(=O)O Amb18065826 [0,1,0,0,0,0|2,0,0]=3 2120 B13R1.1073 CC(C)(Cc1ccncn1)C(=O)O Amb33269481 [0,1,0,0,0,0|3,0,0]=4 2121 B13R1.1073 CC(C)(Cc1cnccn1)C(=O)O Amb33360421 [0,1,0,0,0,0|3,0,0]=4 2122 B13R1.1073 CC(C)(Cc1cncnc1)C(=O)O Amb33149191 [0,1,0,0,0,0|3,0,0]=4 2123 B13R1.1073 CC(C)(Cc1ncccn1)C(=O)O Amb24489880 [0,1,0,0,0,0|3,0,0]=4 2124 B13R1.1073 CC(C)(Nc1ccccc1)C(=O)O Amb840740 [0,1,0,0,0,0|2,0,0]=3 2125 B13R1.1073 CC(C)(Nc1ccccc1)C(N)=O Amb1394882 [0,1,0,0,0,0|3,0,0]=4 2126 B13R1.1073 CC(C)(Nc1ccccc1)[PH](=O)O Amb24648751 [0,1,0,0,0,0|3,0,0]=4 2127 B13R1.1073 CC(C)(Nc1ccccn1)C(=O)O Amb18254760 [0,1,0,0,0,0|3,0,0]=4 2128 B13R1.1073 CC(C)(Nc1cccnc1)C(=O)O Amb23559812 [0,1,0,0,0,0|3,0,0]=4 2129 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)Cl Amb16230100 [0,1,0,0,0,0|3,0,0]=4 2130 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)O Amb6551023 [0,1,0,0,0,0|2,0,0]=3 2131 B13R1.1073 CC(C)(Oc1ccccc1)C(N)=O Amb17142977 [0,1,0,0,0,0|3,0,0]=4 2132 B13R1.1073 CC(C)(Oc1ccccn1)C(=O)O Amb28079334 [0,1,0,0,0,0|3,0,0]=4 2133 B13R1.1073 CC(C)(Oc1cccnc1)C(=O)O Amb26641894 [0,1,0,0,0,0|3,0,0]=4 2134 B13R1.1073 CC(C)(Oc1ccncc1)C(=O)O Amb26873415 [0,1,0,0,0,0|3,0,0]=4 2135 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)O Amb5769190 [0,1,0,0,0,0|2,0,0]=3 2136 B13R1.1073 CC(C)(Sc1ccccc1)C(N)=O Amb17143164 [0,1,0,0,0,0|3,0,0]=4 2137 B13R1.1073 CC(C)(Sc1ccncc1)C(=O)O Amb25765775 [0,1,0,0,0,0|3,0,0]=4 2138 B13R1.1073 CC(C)C(C)(N)Cc1ccccc1 Amb32655783 [0,1,0,0,0,0|2,0,1]=4 2139 B13R1.1073 CC(C)C(C)(N)Cc1ccccc1 Amb9677076 [0,1,0,0,0,0|2,0,1]=4 2140 B13R1.1073 CC(Cl)(Cc1ccccc1)C(=O)O Amb26944936 [0,1,0,0,0,0|1,0,0]=2 2141 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb28555907 [0,1,0,0,0,0|0,0,0]=1 2142 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb3941655 [0,1,0,0,0,0|0,0,0]=1 2143 B13R1.1073 CC(N)(Cc1ccccc1)C(F)F Amb28401176 [0,1,0,0,0,0|2,0,1]=4 2144 B13R1.1073 CC(N)(Cc1ccccc1)C(F)F Amb32835862 [0,1,0,0,0,0|2,0,1]=4 2145 B13R1.1073 CC(N)(Cc1ccccc1)C(N)=O Amb19001791 [0,1,0,0,0,0|1,0,0]=2 2146 B13R1.1073 CC(N)(Cc1ccccn1)C(=O)O Amb17400758 [0,1,0,0,0,0|1,0,0]=2 2147 B13R1.1073 CC(N)(Cc1cccnc1)C(=O)O Amb17233667 [0,1,0,0,0,0|1,0,0]=2 2148 B13R1.1073 CC(N)(Cc1ccncc1)C(=O)O Amb17400763 [0,1,0,0,0,0|1,0,0]=2 2149 B13R1.1073 CC(O)(Cc1ccccc1)C(=O)O Amb10067052 [0,1,0,0,0,0|1,0,0]=2 2150 B13R1.1073 CC(O)(Cc1ccccn1)C(=O)O Amb33360483 [0,1,0,0,0,0|2,0,0]=3 2151 B13R1.1073 CC(O)(Cc1cccnc1)C(=O)O Amb33360048 [0,1,0,0,0,0|2,0,0]=3 2152 B13R1.1073 CC(O)(Cc1ccncc1)C(=O)O Amb33380638 [0,1,0,0,0,0|2,0,0]=3 2153 B13R1.1073 CC(O)(Cc1ccncn1)C(=O)O Amb33267969 [0,1,0,0,0,0|3,0,0]=4 2154 B13R1.1073 CC(O)(Cc1cnccn1)C(=O)O Amb33429654 [0,1,0,0,0,0|3,0,0]=4 2155 B13R1.1073 CC(O)(Cc1cncnc1)C(=O)O Amb32876383 [0,1,0,0,0,0|3,0,0]=4 2156 B13R1.1073 CC(O)(Cc1ncccn1)C(=O)O Amb33269934 [0,1,0,0,0,0|3,0,0]=4 2157 B13R1.1073 CC(O)C(C)(C)Cc1ccccc1 Amb4020331 [0,1,0,0,0,0|2,0,1]=4 2158 B13R1.1073 CN(O)C(C)(C)Cc1ccccc1 Amb26347284 [0,1,0,0,0,0|3,0,0]=4 2159 B13R1.1073 C[C@@H](O)C(C)(C)Cc1ccccc1 Amb28079206 [0,1,0,0,0,0|2,0,1]=4 2160 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb33482937 [0,1,0,0,0,0|0,0,0]=1 2161 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb8629107 [0,1,0,0,0,0|0,0,0]=1 2162 B13R1.1073 C[C@@](N)(Cc1cccnc1)C(=O)O Amb27433908 [0,1,0,0,0,0|1,0,0]=2 2163 B13R1.1073 C[C@@](O)(Cc1ccccc1)C(=O)O Amb10067053 [0,1,0,0,0,0|1,0,0]=2 2164 B13R1.1073 C[C@H](O)[C@@](C)(O)Cc1ccccc1 Amb27206010 [0,1,0,0,0,0|2,0,1]=4 2165 B13R1.1073 C[C@H](O)[C@](C)(O)Cc1ccccc1 Amb27835884 [0,1,0,0,0,0|2,0,1]=4 2166 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb2720582 [0,1,0,0,0,0|0,0,0]=1 2167 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb33482933 [0,1,0,0,0,0|0,0,0]=1 2168 B13R1.1073 C[C@](O)(Cc1ccccc1)C(=O)O Amb4166326 [0,1,0,0,0,0|1,0,0]=2 2169 B13R1.1073 C[C@](S)(Cc1ccccc1)C(=O)O Amb28137940 [0,1,0,0,0,0|1,0,0]=2 2170 B13R1.1073 O=C(O)C(Cl)(Cl)Cc1ccccc1 Amb28287726 [0,1,0,0,0,0|1,0,0]=2 2171 B13R1.1073 O=C(O)C(F)(F)Cc1ccccc1 Amb26334044 [0,1,0,0,0,0|1,0,0]=2 2172 B13R1.1073 O=C(O)C(F)(F)Cc1ccccn1 Amb27484122 [0,1,0,0,0,0|2,0,0]=3 2173 B13R1.1073 O=C(O)C(F)(F)Cc1cccnc1 Amb27878125 [0,1,0,0,0,0|2,0,0]=3 2174 B13R1.1073 O=C(O)C(F)(F)Cc1ccncc1 Amb24586446 [0,1,0,0,0,0|2,0,0]=3 2175 B13R1.1073 O=C(O)C(F)(F)Cc1ccncn1 Amb33409893 [0,1,0,0,0,0|3,0,0]=4 2176 B13R1.1073 O=C(O)C(F)(F)Cc1cnccn1 Amb33170643 [0,1,0,0,0,0|3,0,0]=4 2177 B13R1.1073 O=C(O)C(F)(F)Cc1cncnc1 Amb33170644 [0,1,0,0,0,0|3,0,0]=4 2178 B13R1.1073 O=C(O)C(F)(F)Cc1ncccn1 Amb33411462 [0,1,0,0,0,0|3,0,0]=4 2179 B13R1.1073 O=C(O)C(F)(F)Oc1ccccc1 Amb4061775 [0,1,0,0,0,0|2,0,0]=3 2180 B13R1.1073 O=C(O)C(O)(O)C[n+]1ccccc1 Amb27592882 [0,1,0,0,0,0|2,0,0]=3 2181 B13R1.1073 O=C([O-])C(F)(F)Oc1ccccc1 Amb33329475 [0,1,0,0,0,0|2,0,1]=4 2182 B13R2.27 O=C1CCC1Cc2ccccc2 Amb27177755 [0,0,0,1,0,0|2,0,0]=3 2183 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [0,0,0,1,0,0|3,0,0]=4 2184 B13R2.27 O=C1COC1Cc2ccccc2 Amb35789727 [0,0,0,1,0,0|2,0,0]=3 2185 B13R2.27 O=C1NCC1Cc2ccccc2 Amb27855620 [0,0,0,1,0,0|2,0,0]=3 2186 B13R2.27 OC1CCC1Cc2ccccc2 Amb33213493 [0,0,0,1,0,0|2,0,1]=4 2187 B13R2.27 OC1CNC1Cc2ccccc2 Amb25960214 [0,0,0,1,0,0|1,0,1]=3 2188 B13R2.27 OC1COC1Cc2ccccc2 Amb27972405 [0,0,0,1,0,0|2,0,1]=4 2189 B13R2.27 OC1CO[C@H]1Cc2ccccc2 Amb27587820 [0,0,0,1,0,0|2,0,1]=4 2190 B13R2.27 O[C@H]1CN[C@@H]1Cc2ccccc2 Amb26954864 [0,0,0,1,0,0|1,0,1]=3 2191 B13R2.197 CC1CC1(N)Cc2ccccc2 Amb28239731 [0,0,0,1,0,0|2,0,1]=4 2192 B13R2.197 C[C@@H]1C[C@@]1(N)Cc2ccccc2 Amb33804455 [0,0,0,1,0,0|2,0,1]=4 2193 B13R2.197 C[C@@H]1C[C@@]1(N)Cc2ccccc2 Amb33804487 [0,0,0,1,0,0|2,0,1]=4 2194 B13R2.359 CC1(O)c2ccccc2CC1N Amb27173166 [0,0,0,1,0,0|1,0,1]=3 2195 B13R2.359 CC1Cc2ccccc2C1(C)O Amb26622469 [0,0,0,1,0,0|2,0,1]=4 2196 B13R2.369 C=C1Nc2ccccc2OC1=O Amb25996357 [0,0,0,1,0,0|2,0,1]=4 2197 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,0,0,1,0,0|1,0,2]=4 2198 B13R2.369 CC1=Nc2ccccc2OC1=O Amb27482974 [0,0,0,1,0,0|2,0,1]=4 2199 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,0,0,1,0,0|2,0,1]=4 2200 B13R2.369 CC1Cc2ccccc2CC1=O Amb28321881 [0,0,0,1,0,0|2,0,0]=3 2201 B13R2.369 CC1Cc2ccccc2NC1=O Amb10604462 [0,0,0,1,0,0|2,0,0]=3 2202 B13R2.369 CC1Cc2ccccc2OC1O Amb27650455 [0,0,0,1,0,0|1,0,2]=4 2203 B13R2.369 CC1Cc2ccncc2NC1=O Amb27227915 [0,0,0,1,0,0|3,0,0]=4 2204 B13R2.369 CC1Cc2ncccc2NC1=O Amb28122873 [0,0,0,1,0,0|3,0,0]=4 2205 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,0,0,1,0,0|3,0,0]=4 2206 B13R2.369 CC1Nc2ccccc2OC1=O Amb17217247 [0,0,0,1,0,0|2,0,0]=3 2207 B13R2.369 CC1Oc2ccccc2CC1N Amb18645891 [0,0,0,1,0,0|1,0,1]=3 2208 B13R2.369 CC1Oc2ccccc2CC1N Amb33743347 [0,0,0,1,0,0|1,0,1]=3 2209 B13R2.369 CC1Oc2ccccc2NC1=O Amb2568450 [0,0,0,1,0,0|3,0,0]=4 2210 B13R2.369 CC1Sc2ccccc2CC1=O Amb27836849 [0,0,0,1,0,0|3,0,0]=4 2211 B13R2.369 CC1Sc2ccccc2NC1=O Amb2714505 [0,0,0,1,0,0|3,0,0]=4 2212 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,0,0,1,0,0|3,0,0]=4 2213 B13R2.369 CN1Cc2ccccc2NC1=O Amb6198737 [0,0,0,1,0,0|3,0,0]=4 2214 B13R2.369 CN1Cc2ccccc2OC1=O Amb28244326 [0,0,0,1,0,0|2,0,0]=3 2215 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,0,0,1,0,0|3,0,0]=4 2216 B13R2.369 C[C@H]1Oc2ccccc2C[C@@H]1N Amb27214189 [0,0,0,1,0,0|1,0,1]=3 2217 B13R2.369 C[C@H]1Oc2ccccc2C[C@H]1N Amb27847520 [0,0,0,1,0,0|1,0,1]=3 2218 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,0,0,1,0,0|1,0,2]=4 2219 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,0,0,1,0,0|0,0,2]=3 2220 B13R2.369 NC1Cc2ccccc2CC1O Amb28990988 [0,0,0,1,0,0|1,0,1]=3 2221 B13R2.369 NC1Cc2ccccc2NC1=O Amb10975380 [0,0,0,1,0,0|1,0,0]=2 2222 B13R2.369 NC1Cc2ccccc2NC1=O Amb2196732 [0,0,0,1,0,0|1,0,0]=2 2223 B13R2.369 NC1Cc2ccccc2NC1=O Amb6353803 [0,0,0,1,0,0|1,0,0]=2 2224 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,0,0,1,0,0|0,0,0]=1 2225 B13R2.369 NC1Cc2cccnc2NC1=O Amb23571829 [0,0,0,1,0,0|2,0,0]=3 2226 B13R2.369 NC1Cc2cccnc2NC1=O Amb30291382 [0,0,0,1,0,0|2,0,0]=3 2227 B13R2.369 NC1Cc2cnccc2NC1=O Amb20241350 [0,0,0,1,0,0|2,0,0]=3 2228 B13R2.369 NC1Cc2cnccc2NC1=O Amb30046355 [0,0,0,1,0,0|2,0,0]=3 2229 B13R2.369 NC1Cc2ncccc2NC1=O Amb20241349 [0,0,0,1,0,0|2,0,0]=3 2230 B13R2.369 NC1Oc2cccnc2NC1=O Amb27403939 [0,0,0,1,0,0|3,0,0]=4 2231 B13R2.369 NN1Cc2ccccc2NC1=O Amb28076843 [0,0,0,1,0,0|2,0,0]=3 2232 B13R2.369 N[C@@H]1Cc2ccccc2C[C@H]1O Amb27440505 [0,0,0,1,0,0|1,0,1]=3 2233 B13R2.369 N[C@H]1Cc2ccccc2C[C@H]1O Amb27966789 [0,0,0,1,0,0|1,0,1]=3 2234 B13R2.369 Nc1cc2ccccc2cc1O Amb2781576 [0,0,0,1,0,0|1,0,2]=4 2235 B13R2.369 Nc1cc2ccccc2nc1O Amb18645300 [0,0,0,1,0,0|1,0,2]=4 2236 B13R2.369 Nc1nc2ccccc2cc1O Amb27471786 [0,0,0,1,0,0|2,0,1]=4 2237 B13R2.369 O=C1Cc2ccccc2CC1Cl Amb28458358 [0,0,0,1,0,0|2,0,0]=3 2238 B13R2.369 O=C1Cc2ccccc2CN1O Amb27607094 [0,0,0,1,0,0|3,0,0]=4 2239 B13R2.369 O=C1Cc2ccccc2OC1=O Amb22755081 [0,0,0,1,0,0|1,0,1]=3 2240 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,0,0,1,0,0|2,0,1]=4 2241 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,0,0,1,0,0|2,0,0]=3 2242 B13R2.369 O=C1Nc2ccccc2CC1O Amb22899290 [0,0,0,1,0,0|2,0,0]=3 2243 B13R2.369 O=C1Nc2ccccc2OC1=O Amb19650977 [0,0,0,1,0,0|2,0,1]=4 2244 B13R2.369 O=C1Nc2ccccc2OC1Br Amb33328763 [0,0,0,1,0,0|3,0,0]=4 2245 B13R2.369 O=C1Nc2ccccc2OC1O Amb9824611 [0,0,0,1,0,0|3,0,0]=4 2246 B13R2.369 O=C1Nc2ccccc2SC1O Amb28243913 [0,0,0,1,0,0|3,0,0]=4 2247 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,0,0,1,0,0|1,0,2]=4 2248 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,0,0,1,0,0|1,0,2]=4 2249 B13R2.369 O=C1Oc2ccccc2C=C1O Amb18511465 [0,0,0,1,0,0|1,0,2]=4 2250 B13R2.369 O=C1Oc2ccccc2C=C1S Amb27173626 [0,0,0,1,0,0|1,0,2]=4 2251 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,0,0,1,0,0|2,0,1]=4 2252 B13R2.369 O=C1Oc2ccccc2N=C1O Amb22494623 [0,0,0,1,0,0|2,0,1]=4 2253 B13R2.369 O=C1Oc2ccccc2NC1=S Amb27947432 [0,0,0,1,0,0|2,0,1]=4 2254 B13R2.369 O=C1Oc2ccccc2NC1Cl Amb27444661 [0,0,0,1,0,0|2,0,0]=3 2255 B13R2.369 O=C1Oc2ccccc2NC1O Amb27767886 [0,0,0,1,0,0|2,0,0]=3 2256 B13R2.369 O=C1Sc2ccccc2NC1Cl Amb27984888 [0,0,0,1,0,0|2,1,0]=4 2257 B13R2.369 OC1Cc2ccccc2CC1Cl Amb27400376 [0,0,0,1,0,0|2,0,1]=4 2258 B13R2.369 OC1Cc2ccccc2CC1F Amb28063909 [0,0,0,1,0,0|2,0,1]=4 2259 B13R2.369 OC1Cc2ccccc2CC1O Amb26539914 [0,0,0,1,0,0|2,0,1]=4 2260 B13R2.373 C=C1C(=O)N[C@H]1c2ccccc2 Amb28243927 [0,0,0,1,0,0|2,0,1]=4 2261 B13R2.373 CC1C(=O)C=C1c2ccccc2 Amb27770129 [0,0,0,1,0,0|2,0,1]=4 2262 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [0,0,0,1,0,0|2,0,0]=3 2263 B13R2.373 CC1C(=O)CC1c2ccccn2 Amb27241620 [0,0,0,1,0,0|3,0,0]=4 2264 B13R2.373 CC1C(=O)CN1c2ccccc2 Amb27471934 [0,0,0,1,0,0|3,0,0]=4 2265 B13R2.373 CC1C(=O)NC1c2ccccc2 Amb19149073 [0,0,0,1,0,0|2,0,0]=3 2266 B13R2.373 CN1C(O)=CC1c2ccccc2 Amb27424055 [0,0,0,1,0,0|3,0,0]=4 2267 B13R2.373 C[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb28286725 [0,0,0,1,0,0|2,0,0]=3 2268 B13R2.373 C[C@H]1C(=O)N[C@H]1c2ccccc2 Amb27849042 [0,0,0,1,0,0|2,0,0]=3 2269 B13R2.373 NC1C(=O)NC1c2ccccc2 Amb18829732 [0,0,0,1,0,0|1,0,0]=2 2270 B13R2.373 N[C@@H]1C(=O)N[C@@H]1c2ccccc2 Amb27847571 [0,0,0,1,0,0|1,0,0]=2 2271 B13R2.373 N[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb27420058 [0,0,0,1,0,0|1,0,0]=2 2272 B13R2.373 O=C1CC(c2ccccc2)C1=O Amb27245972 [0,0,0,1,0,0|2,0,1]=4 2273 B13R2.373 O=C1NC(c2ccccc2)C1F Amb27653356 [0,0,0,1,0,0|2,0,0]=3 2274 B13R2.373 O=C1NC(c2ccccc2)C1O Amb25272921 [0,0,0,1,0,0|2,0,0]=3 2275 B13R2.373 O=C1NC(c2cccnc2)C1O Amb25148534 [0,0,0,1,0,0|3,0,0]=4 2276 B13R2.373 O=C1N[C@@H](c2ccccc2)[C@@H]1Cl Amb28052060 [0,0,0,1,0,0|2,0,0]=3 2277 B13R2.373 O=C1N[C@@H](c2ccccc2)[C@@H]1O Amb27195840 [0,0,0,1,0,0|2,0,0]=3 2278 B13R2.373 O=C1N[C@@H](c2ccccc2)[C@H]1Cl Amb28246843 [0,0,0,1,0,0|2,0,0]=3 2279 B13R2.373 O=C1N[C@@H](c2ccccc2)[C@H]1O Amb17615687 [0,0,0,1,0,0|2,0,0]=3 2280 B13R2.373 O=C1N[C@H](c2ccccc2)[C@@H]1Cl Amb28294080 [0,0,0,1,0,0|2,0,0]=3 2281 B13R2.373 O=C1N[C@H](c2ccccc2)[C@@H]1O Amb26629123 [0,0,0,1,0,0|2,0,0]=3 2282 B13R2.373 O=C1OC(c2ccccc2)C1Cl Amb27178098 [0,0,0,1,0,0|1,0,0]=2 2283 B13R2.423 CC(=O)C1CC1c2ccccc2 Amb534893 [0,0,0,1,0,0|2,0,0]=3 2284 B13R2.423 CC(=O)C1N=C1c2ccccc2 Amb25863961 [0,0,0,1,0,0|1,0,2]=4 2285 B13R2.423 CC(=O)C1OC1c2ccccn2 Amb27426800 [0,0,0,1,0,0|3,0,0]=4 2286 B13R2.423 CC(=O)C1OC1c2cccnc2 Amb26055012 [0,0,0,1,0,0|3,0,0]=4 2287 B13R2.423 CC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb27780823 [0,0,0,1,0,0|2,0,0]=3 2288 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,0,0|2,0,0]=3 2289 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb33457459 [0,0,0,1,0,0|3,0,0]=4 2290 B13R2.423 CC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb26481631 [0,0,0,1,0,0|2,0,0]=3 2291 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,0,0|2,0,0]=3 2292 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccn2 Amb26055245 [0,0,0,1,0,0|3,0,0]=4 2293 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cccnc2 Amb27758910 [0,0,0,1,0,0|3,0,0]=4 2294 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccncc2 Amb25375191 [0,0,0,1,0,0|3,0,0]=4 2295 B13R2.423 CC(=O)[C@H]1CC1c2ccccc2 Amb27770300 [0,0,0,1,0,0|2,0,0]=3 2296 B13R2.423 CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb28054879 [0,0,0,1,0,0|2,0,0]=3 2297 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,0,0|2,0,0]=3 2298 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,0,0|2,0,0]=3 2299 B13R2.423 CC(=O)[C@H]1O[C@H]1c2ccccc2 Amb27966798 [0,0,0,1,0,0|2,0,0]=3 2300 B13R2.423 CC(C)C1NC1c2ccccc2 Amb31293615 [0,0,0,1,0,0|2,0,1]=4 2301 B13R2.423 CC(C)[C@@H]1N[C@H]1c2ccccc2 Amb31293613 [0,0,0,1,0,0|2,0,1]=4 2302 B13R2.423 CC(O)C1CC1c2ccccc2 Amb17605479 [0,0,0,1,0,0|2,0,1]=4 2303 B13R2.423 CC(O)[C@@H]1O[C@H]1c2ccccc2 Amb27422611 [0,0,0,1,0,0|2,0,1]=4 2304 B13R2.423 CC(O)[C@H]1C[C@@H]1c2ccccc2 Amb27664262 [0,0,0,1,0,0|2,0,1]=4 2305 B13R2.423 CC(O)[C@H]1O[C@@H]1c2ccccc2 Amb28076907 [0,0,0,1,0,0|2,0,1]=4 2306 B13R2.423 C[C@@H](O)[C@@H]1O[C@H]1c2ccccc2 Amb27218973 [0,0,0,1,0,0|2,0,1]=4 2307 B13R2.423 C[C@@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb27857504 [0,0,0,1,0,0|2,0,1]=4 2308 B13R2.423 C[C@@H](O)[C@H]1O[C@H]1c2ccccc2 Amb27431417 [0,0,0,1,0,0|2,0,1]=4 2309 B13R2.423 C[C@H](O)[C@H]1O[C@H]1c2ccccc2 Amb27775377 [0,0,0,1,0,0|2,0,1]=4 2310 B13R2.423 NC(=O)C1=NC1c2ccccc2 Amb27954727 [0,0,0,1,0,0|1,0,2]=4 2311 B13R2.423 NC(=O)C1CC1c2cccnc2 Amb25701875 [0,0,0,1,0,0|3,0,0]=4 2312 B13R2.423 NC(=O)C1CC1c2ccncc2 Amb27598012 [0,0,0,1,0,0|3,0,0]=4 2313 B13R2.423 NC(=O)C1OC1c2ccccc2 Amb26844548 [0,0,0,1,0,0|2,0,0]=3 2314 B13R2.423 NC(=O)N1OC1c2ccccc2 Amb27984785 [0,0,0,1,0,0|3,0,0]=4 2315 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25965684 [0,0,0,1,0,0|2,0,0]=3 2316 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb26624595 [0,0,0,1,0,0|2,0,0]=3 2317 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cccnc2 Amb27473517 [0,0,0,1,0,0|3,0,0]=4 2318 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccncc2 Amb29837838 [0,0,0,1,0,0|3,0,0]=4 2319 B13R2.423 NC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27878627 [0,0,0,1,0,0|2,0,0]=3 2320 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,0,0|2,0,0]=3 2321 B13R2.423 NC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27984902 [0,0,0,1,0,0|2,0,0]=3 2322 B13R2.423 NC(=S)C1CC1c2ccccc2 Amb27616774 [0,0,0,1,0,0|2,1,0]=4 2323 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,0,0|2,0,0]=3 2324 B13R2.423 O=C(Cl)[C@@H]1C[C@H]1c2ccccc2 Amb3939047 [0,0,0,1,0,0|2,0,0]=3 2325 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,0,0|2,0,0]=3 2326 B13R2.423 O=C(O)C1=C(c2ccccc2)C1 Amb28121109 [0,0,0,1,0,0|1,0,2]=4 2327 B13R2.423 O=C(O)C1CC1c2ccccc2 Amb534800 [0,0,0,1,0,0|1,0,0]=2 2328 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb28991402 [0,0,0,1,0,0|2,0,0]=3 2329 B13R2.423 O=C(O)C1CC1c2ccccn2 Amb9677166 [0,0,0,1,0,0|2,0,0]=3 2330 B13R2.423 O=C(O)C1CC1c2cccnc2 Amb9677138 [0,0,0,1,0,0|2,0,0]=3 2331 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb19514911 [0,0,0,1,0,0|2,0,0]=3 2332 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb9677129 [0,0,0,1,0,0|2,0,0]=3 2333 B13R2.423 O=C(O)C1CC1c2ccncn2 Amb24662852 [0,0,0,1,0,0|3,0,0]=4 2334 B13R2.423 O=C(O)C1CC1c2cnccn2 Amb26336135 [0,0,0,1,0,0|3,0,0]=4 2335 B13R2.423 O=C(O)C1CC1c2cncnc2 Amb23571328 [0,0,0,1,0,0|3,0,0]=4 2336 B13R2.423 O=C(O)C1CC1c2ncccn2 Amb33270696 [0,0,0,1,0,0|3,0,0]=4 2337 B13R2.423 O=C(O)C1OC1c2ccccc2 Amb3775834 [0,0,0,1,0,0|1,0,0]=2 2338 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,0,0|1,0,0]=2 2339 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2cccnc2 Amb27234646 [0,0,0,1,0,0|2,0,0]=3 2340 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccc2 Amb33524226 [0,0,0,1,0,0|1,0,0]=2 2341 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb25983800 [0,0,0,1,0,0|2,0,0]=3 2342 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccn2 Amb31260868 [0,0,0,1,0,0|2,0,0]=3 2343 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cccnc2 Amb26636966 [0,0,0,1,0,0|2,0,0]=3 2344 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb25299768 [0,0,0,1,0,0|2,0,0]=3 2345 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb28594202 [0,0,0,1,0,0|2,0,0]=3 2346 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb33269039 [0,0,0,1,0,0|3,0,0]=4 2347 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb35753095 [0,0,0,1,0,0|3,0,0]=4 2348 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cnccn2 Amb33360019 [0,0,0,1,0,0|3,0,0]=4 2349 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cncnc2 Amb33472947 [0,0,0,1,0,0|3,0,0]=4 2350 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ncccn2 Amb33270686 [0,0,0,1,0,0|3,0,0]=4 2351 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,0,0|1,0,0]=2 2352 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccn2 Amb27488853 [0,0,0,1,0,0|2,0,0]=3 2353 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2cccnc2 Amb26928613 [0,0,0,1,0,0|2,0,0]=3 2354 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccncc2 Amb27974957 [0,0,0,1,0,0|2,0,0]=3 2355 B13R2.423 O=C(O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,0,0|1,0,0]=2 2356 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb4008297 [0,0,0,1,0,0|1,0,1]=3 2357 B13R2.423 O=C([O-])C1OC1c2ccccc2 Amb431197 [0,0,0,1,0,0|1,0,1]=3 2358 B13R2.423 O=S([O-])[C@@H]1C[C@H]1c2ccccc2 Amb32755429 [0,0,0,1,0,0|2,0,1]=4 2359 B13R2.423 O=[N+]([O-])C1CC1c2ccccc2 Amb27651637 [0,0,0,1,0,0|2,0,1]=4 2360 B13R2.423 O=[N+]([O-])[C@@H]1CC1c2ccccc2 Amb27635928 [0,0,0,1,0,0|2,0,1]=4 2361 B13R2.423 O=[N+]([O-])[C@H]1C[C@@H]1c2ccccc2 Amb26989678 [0,0,0,1,0,0|2,0,1]=4 2362 B13R2.423 OB(O)C1CC1c2ccccc2 Amb26632211 [0,0,0,1,0,0|2,0,1]=4 2363 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [0,0,0,1,0,0|2,0,1]=4 2364 B13R2.423 OB(O)[C@H]1C[C@@H]1c2ccccc2 Amb27420204 [0,0,0,1,0,0|2,0,1]=4 2365 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,0,0,1,0,0|2,0,1]=4 2366 B13R2.435 CC(=O)C1Cc2ccccc2C1 Amb10071756 [0,0,0,1,0,0|2,0,0]=3 2367 B13R2.435 CC(=O)C1Cc2ccccc2N1 Amb28423109 [0,0,0,1,0,0|1,0,0]=2 2368 B13R2.435 CC(=O)C1Cc2ccccc2O1 Amb23586288 [0,0,0,1,0,0|2,0,0]=3 2369 B13R2.435 CC(=O)N1Cc2ccccc2C1 Amb26627508 [0,0,0,1,0,0|3,0,0]=4 2370 B13R2.435 CC(C)C1Cc2ccccc2N1 Amb18560784 [0,0,0,1,0,0|2,0,1]=4 2371 B13R2.435 CC(F)C1Cc2ccccc2N1 Amb27791329 [0,0,0,1,0,0|2,0,1]=4 2372 B13R2.435 CC(O)C1Cc2ccccc2O1 Amb27977019 [0,0,0,1,0,0|2,0,1]=4 2373 B13R2.435 C[C@@H](O)C1Cc2ccccc2C1 Amb26901996 [0,0,0,1,0,0|2,0,1]=4 2374 B13R2.435 C[C@H](O)C1Cc2ccccc2C1 Amb24377688 [0,0,0,1,0,0|2,0,1]=4 2375 B13R2.435 C[C@H](O)C1Cc2ccccc2O1 Amb28314024 [0,0,0,1,0,0|2,0,1]=4 2376 B13R2.435 C[C@H](O)[C@@H]1Cc2ccccc2N1 Amb27642314 [0,0,0,1,0,0|1,0,1]=3 2377 B13R2.435 C[C@H](O)[C@@H]1Cc2ccccc2O1 Amb27472521 [0,0,0,1,0,0|2,0,1]=4 2378 B13R2.435 N=C(N)C1Cc2ccccc2C1 Amb27174204 [0,0,0,1,0,0|3,0,0]=4 2379 B13R2.435 N=C(N)C1Cc2ccccc2O1 Amb28366671 [0,0,0,1,0,0|3,0,0]=4 2380 B13R2.435 NC(=O)C1=Cc2ccccc2C1 Amb22227964 [0,0,0,1,0,0|2,0,1]=4 2381 B13R2.435 NC(=O)C1Cc2ccccc2C1 Amb28291341 [0,0,0,1,0,0|2,0,0]=3 2382 B13R2.435 NC(=O)C1Cc2ccccc2N1 Amb7173128 [0,0,0,1,0,0|1,0,0]=2 2383 B13R2.435 NC(=O)C1Cc2ccccc2S1 Amb8998792 [0,0,0,1,0,0|2,0,0]=3 2384 B13R2.435 NC(=O)[C@@H]1Cc2ccccc2N1 Amb9753465 [0,0,0,1,0,0|1,0,0]=2 2385 B13R2.435 NC(=S)C1Cc2ccccc2C1 Amb28340533 [0,0,0,1,0,0|2,1,0]=4 2386 B13R2.435 NC(=S)C1Cc2ccccc2N1 Amb28044916 [0,0,0,1,0,0|1,1,0]=3 2387 B13R2.435 O=C(Cl)C1Cc2ccccc2O1 Amb2723362 [0,0,0,1,0,0|2,0,0]=3 2388 B13R2.435 O=C(Cl)N1Cc2ccccc2C1 Amb24061265 [0,0,0,1,0,0|3,0,0]=4 2389 B13R2.435 O=C(O)C1=Cc2ccccc2C1 Amb10553818 [0,0,0,1,0,0|1,0,1]=3 2390 B13R2.435 O=C(O)C1=Nc2ccccc2C1 Amb24078944 [0,0,0,1,0,0|0,0,2]=3 2391 B13R2.435 O=C(O)C1Cc2ccccc2C1 Amb33537232 [0,0,0,1,0,0|1,0,0]=2 2392 B13R2.435 O=C(O)C1Cc2ccccc2N1 Amb1914079 [0,0,0,1,0,0|0,0,0]=1 2393 B13R2.435 O=C(O)C1Cc2ccccc2O1 Amb1154832 [0,0,0,1,0,0|1,0,0]=2 2394 B13R2.435 O=C(O)C1Cc2ccccc2S1 Amb9702994 [0,0,0,1,0,0|1,0,0]=2 2395 B13R2.435 O=C(O)C1Cc2cccnc2C1 Amb18829466 [0,0,0,1,0,0|2,0,0]=3 2396 B13R2.435 O=C(O)C1Cc2cccnc2C1 Amb29083219 [0,0,0,1,0,0|2,0,0]=3 2397 B13R2.435 O=C(O)C1Cc2cccnc2N1 Amb27794813 [0,0,0,1,0,0|1,0,0]=2 2398 B13R2.435 O=C(O)C1Cc2ccncc2C1 Amb24563347 [0,0,0,1,0,0|2,0,0]=3 2399 B13R2.435 O=C(O)C1Cc2ccncc2C1 Amb33552604 [0,0,0,1,0,0|2,0,0]=3 2400 B13R2.435 O=C(O)C1Cc2cncnc2C1 Amb18829042 [0,0,0,1,0,0|3,0,0]=4 2401 B13R2.435 O=C(O)C1Cc2nccnc2C1 Amb18829015 [0,0,0,1,0,0|3,0,0]=4 2402 B13R2.435 O=C(O)C1Oc2ccccc2O1 Amb535196 [0,0,0,1,0,0|2,0,0]=3 2403 B13R2.435 O=C(O)C1Oc2ccccc2S1 Amb27477990 [0,0,0,1,0,0|2,0,0]=3 2404 B13R2.435 O=C(O)C1Sc2ccccc2S1 Amb2795796 [0,0,0,1,0,0|2,0,0]=3 2405 B13R2.435 O=C(O)[C@@H]1Cc2ccccc2N1 Amb2698470 [0,0,0,1,0,0|0,0,0]=1 2406 B13R2.435 O=C(O)[C@@H]1Cc2ccccc2O1 Amb28396501 [0,0,0,1,0,0|1,0,0]=2 2407 B13R2.435 O=C(O)[C@H]1Cc2ccccc2N1 Amb2699613 [0,0,0,1,0,0|0,0,0]=1 2408 B13R2.435 O=C(O)c1cc2ccccc2[se]1 Amb2611625 [0,0,0,1,0,0|1,0,2]=4 2409 B13R2.435 O=C(O)c1cc2ccccc2o1 Amb1203290 [0,0,0,1,0,0|1,0,2]=4 2410 B13R2.435 O=C(O)c1cc2ccccc2s1 Amb6335225 [0,0,0,1,0,0|1,0,2]=4 2411 B13R2.435 O=C(O)c1nc2ccccc2o1 Amb10066905 [0,0,0,1,0,0|1,0,2]=4 2412 B13R2.435 O=C(O)c1nc2ccccc2s1 Amb17622301 [0,0,0,1,0,0|1,0,2]=4 2413 B13R2.435 O=C(O)c1nc2ccccc2s1 Amb3428729 [0,0,0,1,0,0|1,0,2]=4 2414 B13R2.435 O=C([O-])C1Cc2ccccc2C1 Amb32660995 [0,0,0,1,0,0|1,0,1]=3 2415 B13R2.435 O=C([O-])C1Cc2ccccc2N1 Amb33513028 [0,0,0,1,0,0|0,0,1]=2 2416 B13R2.435 O=S([O-])C1Cc2ccccc2C1 Amb32754095 [0,0,0,1,0,0|2,0,1]=4 2417 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb17138534 [0,0,0,1,0,0|2,0,1]=4 2418 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb33548408 [0,0,0,1,0,0|2,0,1]=4 2419 B13R2.444 NC(Cc1ccccc1)C2CO2 Amb27178072 [0,0,0,1,0,0|1,0,1]=3 2420 B13R2.444 N[C@@H](Cc1ccccc1)C2CC2 Amb27253031 [0,0,0,1,0,0|2,0,1]=4 2421 B13R2.444 N[C@@H](Cc1ccccc1)[C@@H]2CO2 Amb27453506 [0,0,0,1,0,0|1,0,1]=3 2422 B13R2.444 O[C@@H](Cc1ccccc1)[C@H]2CO2 Amb28194254 [0,0,0,1,0,0|2,0,1]=4 2423 B13R2.3080 CC1(C)C(N)C1c2ccccc2 Amb25351441 [0,0,0,1,0,0|2,0,1]=4 2424 B13R2.3080 CC1(C)[C@@H](N)[C@@H]1c2ccccc2 Amb26867085 [0,0,0,1,0,0|2,0,1]=4 2425 B13R2.3080 CC1(C)[C@H](c2ccccc2)[C@H]1N Amb27788397 [0,0,0,1,0,0|2,0,1]=4 2426 B13R2.5517 CC(=O)C1(C)Oc2ccccc21 Amb26484343 [0,0,0,1,0,0|3,0,0]=4 2427 B13R2.5517 CC1(C(=O)O)Cc2ccccc21 Amb17778872 [0,0,0,1,0,0|1,0,0]=2 2428 B13R2.5517 NC1(C(=O)O)Cc2ccccc21 Amb28120231 [0,0,0,1,0,0|0,0,0]=1 2429 B13R2.13685 O=C(O)C1Oc2ccc(cc2)O1 Amb27172678 [0,0,0,1,0,0|2,0,0]=3 2430 B11R1.35 C=C(Cc1ccco1)C(=O)O Amb27985009 [0,0,0,0,1,0|2,0,1]=4 2431 B11R1.35 CC(=O)C(C)Cc1ccco1 Amb17939894 [0,0,0,0,1,0|3,0,0]=4 2432 B11R1.35 CC(=O)C(N)Cc1cncs1 Amb18198886 [0,0,0,0,1,0|3,0,0]=4 2433 B11R1.35 CC(=O)C(N)Cn1ccnc1 Amb27173747 [0,0,0,0,1,0|3,0,0]=4 2434 B11R1.35 CC(Cc1ccco1)C(=O)O Amb33540750 [0,0,0,0,1,0|2,0,0]=3 2435 B11R1.35 CC(Cc1cccs1)C(=O)Cl Amb5744094 [0,0,0,0,1,0|3,0,0]=4 2436 B11R1.35 CC(Cc1cccs1)C(=O)O Amb5400513 [0,0,0,0,1,0|2,0,0]=3 2437 B11R1.35 CC(Cc1cccs1)C(N)=O Amb27760469 [0,0,0,0,1,0|3,0,0]=4 2438 B11R1.35 CC(Cc1ccns1)C(=O)O Amb27407099 [0,0,0,0,1,0|3,0,0]=4 2439 B11R1.35 CC(Cc1ccoc1)C(=O)O Amb26970772 [0,0,0,0,1,0|2,0,0]=3 2440 B11R1.35 CC(Cc1ccon1)C(=O)O Amb33042782 [0,0,0,0,1,0|3,0,0]=4 2441 B11R1.35 CC(Cc1ccsc1)C(=O)O Amb17605844 [0,0,0,0,1,0|2,0,0]=3 2442 B11R1.35 CC(Cc1ccsn1)C(=O)O Amb28385563 [0,0,0,0,1,0|3,0,0]=4 2443 B11R1.35 CC(Cc1cnco1)C(=O)O Amb33415283 [0,0,0,0,1,0|3,0,0]=4 2444 B11R1.35 CC(Cc1cncs1)C(=O)O Amb26452858 [0,0,0,0,1,0|3,0,0]=4 2445 B11R1.35 CC(Cc1cnsc1)C(=O)O Amb35720171 [0,0,0,0,1,0|3,0,0]=4 2446 B11R1.35 CC(Cc1cscn1)C(=O)O Amb18292876 [0,0,0,0,1,0|3,0,0]=4 2447 B11R1.35 CC(Cc1nccs1)C(=O)O Amb17334845 [0,0,0,0,1,0|3,0,0]=4 2448 B11R1.35 CC(Cn1cccn1)C(=O)O Amb2569108 [0,0,0,0,1,0|3,0,0]=4 2449 B11R1.35 CC(Cn1ccnc1)C(=O)O Amb2797762 [0,0,0,0,1,0|3,0,0]=4 2450 B11R1.35 CC(Cn1ccnc1)C(=O)O Amb33012366 [0,0,0,0,1,0|3,0,0]=4 2451 B11R1.35 CC(Nc1cccs1)C(=O)O Amb27646118 [0,0,0,0,1,0|3,0,0]=4 2452 B11R1.35 CC(Nn1cccc1)C(=O)O Amb27645399 [0,0,0,0,1,0|3,0,0]=4 2453 B11R1.35 CC(Sc1cccs1)C(=O)O Amb2611557 [0,0,0,0,1,0|3,0,0]=4 2454 B11R1.35 C[C@H](Cc1cccs1)C(=O)O Amb10844000 [0,0,0,0,1,0|2,0,0]=3 2455 B11R1.35 C[C@H](Nc1cccs1)C(=O)O Amb10603707 [0,0,0,0,1,0|3,0,0]=4 2456 B11R1.35 C[C@H](Nc1ccsc1)C(=O)O Amb17912732 [0,0,0,0,1,0|3,0,0]=4 2457 B11R1.35 NC(=O)C(N)Cc1ccco1 Amb33066014 [0,0,0,0,1,0|2,0,0]=3 2458 B11R1.35 NC(=O)C(N)Cc1cccs1 Amb24487730 [0,0,0,0,1,0|2,0,0]=3 2459 B11R1.35 NC(=O)C(N)Cc1ccns1 Amb33036542 [0,0,0,0,1,0|3,0,0]=4 2460 B11R1.35 NC(=O)C(N)Cc1ccoc1 Amb33308808 [0,0,0,0,1,0|2,0,0]=3 2461 B11R1.35 NC(=O)C(N)Cc1ccsc1 Amb25092321 [0,0,0,0,1,0|2,0,0]=3 2462 B11R1.35 NC(=O)C(N)Cc1cncs1 Amb24413255 [0,0,0,0,1,0|3,0,0]=4 2463 B11R1.35 NC(=O)C(N)Cc1cscn1 Amb33066289 [0,0,0,0,1,0|3,0,0]=4 2464 B11R1.35 NC(=O)C(N)Cc1nccs1 Amb24533629 [0,0,0,0,1,0|3,0,0]=4 2465 B11R1.35 NC(=O)C(N)Cn1cccn1 Amb18984349 [0,0,0,0,1,0|3,0,0]=4 2466 B11R1.35 NC(=O)C(N)Cn1ccnc1 Amb18293875 [0,0,0,0,1,0|3,0,0]=4 2467 B11R1.35 NC(CC1=CCCC1)C(=O)O Amb2699167 [0,0,0,0,1,0|0,0,3]=4 2468 B11R1.35 NC(CC1=CCCO1)C(=O)O Amb27843735 [0,0,0,0,1,0|1,0,2]=4 2469 B11R1.35 NC(CC1CC=CC1)C(=O)O Amb25893245 [0,0,0,0,1,0|0,0,3]=4 2470 B11R1.35 NC(CN1CC=CC1)C(=O)O Amb27235386 [0,0,0,0,1,0|1,0,2]=4 2471 B11R1.35 NC(Cc1ccco1)C(=O)O Amb9724188 [0,0,0,0,1,0|1,0,0]=2 2472 B11R1.35 NC(Cc1cccs1)C(=O)O Amb9720695 [0,0,0,0,1,0|1,0,0]=2 2473 B11R1.35 NC(Cc1ccno1)C(=O)O Amb25891427 [0,0,0,0,1,0|2,0,0]=3 2474 B11R1.35 NC(Cc1ccno1)C(=O)O Amb28652917 [0,0,0,0,1,0|2,0,0]=3 2475 B11R1.35 NC(Cc1ccns1)C(=O)O Amb18198297 [0,0,0,0,1,0|2,0,0]=3 2476 B11R1.35 NC(Cc1ccoc1)C(=O)O Amb21858415 [0,0,0,0,1,0|1,0,0]=2 2477 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb2611710 [0,0,0,0,1,0|1,0,0]=2 2478 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb33527048 [0,0,0,0,1,0|1,0,0]=2 2479 B11R1.35 NC(Cc1ccsn1)C(=O)O Amb18198296 [0,0,0,0,1,0|2,0,0]=3 2480 B11R1.35 NC(Cc1cnco1)C(=O)O Amb33295162 [0,0,0,0,1,0|2,0,0]=3 2481 B11R1.35 NC(Cc1cncs1)C(=O)O Amb18301833 [0,0,0,0,1,0|2,0,0]=3 2482 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30584636 [0,0,0,0,1,0|2,0,0]=3 2483 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30869600 [0,0,0,0,1,0|2,0,0]=3 2484 B11R1.35 NC(Cc1cnns1)C(=O)O Amb33036593 [0,0,0,0,1,0|3,0,0]=4 2485 B11R1.35 NC(Cc1cnoc1)C(=O)O Amb18830802 [0,0,0,0,1,0|2,0,0]=3 2486 B11R1.35 NC(Cc1cnon1)C(=O)O Amb18200030 [0,0,0,0,1,0|3,0,0]=4 2487 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb24471428 [0,0,0,0,1,0|3,0,0]=4 2488 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb33620573 [0,0,0,0,1,0|3,0,0]=4 2489 B11R1.35 NC(Cc1cocn1)C(=O)O Amb24409031 [0,0,0,0,1,0|2,0,0]=3 2490 B11R1.35 NC(Cc1cocn1)C(=O)O Amb33620562 [0,0,0,0,1,0|2,0,0]=3 2491 B11R1.35 NC(Cc1cscn1)C(=O)O Amb33620569 [0,0,0,0,1,0|2,0,0]=3 2492 B11R1.35 NC(Cc1cscn1)C(=O)O Amb8631053 [0,0,0,0,1,0|2,0,0]=3 2493 B11R1.35 NC(Cc1csnn1)C(=O)O Amb24674512 [0,0,0,0,1,0|3,0,0]=4 2494 B11R1.35 NC(Cc1ncco1)C(=O)O Amb18200255 [0,0,0,0,1,0|2,0,0]=3 2495 B11R1.35 NC(Cc1nccs1)C(=O)O Amb16227038 [0,0,0,0,1,0|2,0,0]=3 2496 B11R1.35 NC(Cc1ncns1)C(=O)O Amb18198056 [0,0,0,0,1,0|3,0,0]=4 2497 B11R1.35 NC(Cc1ncns1)C(=O)O Amb35789445 [0,0,0,0,1,0|3,0,0]=4 2498 B11R1.35 NC(Cn1cccc1)C(=O)O Amb18200839 [0,0,0,0,1,0|1,0,0]=2 2499 B11R1.35 NC(Cn1cccn1)C(=O)O Amb18982290 [0,0,0,0,1,0|2,0,0]=3 2500 B11R1.35 NC(Cn1cccn1)C(=O)O Amb6893873 [0,0,0,0,1,0|2,0,0]=3 2501 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb18294042 [0,0,0,0,1,0|2,0,0]=3 2502 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb32664802 [0,0,0,0,1,0|2,0,0]=3 2503 B11R1.35 NC(Cn1cncn1)C(=O)O Amb18982288 [0,0,0,0,1,0|3,0,0]=4 2504 B11R1.35 NC(Cn1cncn1)C(=O)O Amb32675131 [0,0,0,0,1,0|3,0,0]=4 2505 B11R1.35 NC(Cn1cncn1)C(=O)O Amb6893871 [0,0,0,0,1,0|3,0,0]=4 2506 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O Amb27856498 [0,0,0,0,1,0|0,0,3]=4 2507 B11R1.35 N[C@@H](CC1=NC=CC1)C(=O)O Amb27947963 [0,0,0,0,1,0|1,0,1]=3 2508 B11R1.35 N[C@@H](CC1=NCN=C1)C(=O)O Amb27955778 [0,0,0,0,1,0|2,0,1]=4 2509 B11R1.35 N[C@@H](CC1CC=CC1)C(=O)O Amb30032914 [0,0,0,0,1,0|0,0,3]=4 2510 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb10068214 [0,0,0,0,1,0|1,0,0]=2 2511 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb31291682 [0,0,0,0,1,0|1,0,0]=2 2512 B11R1.35 N[C@@H](Cc1cccs1)C(=O)O Amb10068210 [0,0,0,0,1,0|1,0,0]=2 2513 B11R1.35 N[C@@H](Cc1cccs1)C(=O)O Amb22747410 [0,0,0,0,1,0|1,0,0]=2 2514 B11R1.35 N[C@@H](Cc1ccno1)C(=O)O Amb25891409 [0,0,0,0,1,0|2,0,0]=3 2515 B11R1.35 N[C@@H](Cc1ccns1)C(=O)O Amb29852557 [0,0,0,0,1,0|2,0,0]=3 2516 B11R1.35 N[C@@H](Cc1ccoc1)C(=O)O Amb22228970 [0,0,0,0,1,0|1,0,0]=2 2517 B11R1.35 N[C@@H](Cc1ccon1)C(=O)O Amb26486882 [0,0,0,0,1,0|2,0,0]=3 2518 B11R1.35 N[C@@H](Cc1ccsc1)C(=O)O Amb10068212 [0,0,0,0,1,0|1,0,0]=2 2519 B11R1.35 N[C@@H](Cc1cncs1)C(=O)O Amb22745840 [0,0,0,0,1,0|2,0,0]=3 2520 B11R1.35 N[C@@H](Cc1cnns1)C(=O)O Amb33066323 [0,0,0,0,1,0|3,0,0]=4 2521 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb28043541 [0,0,0,0,1,0|3,0,0]=4 2522 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb33620574 [0,0,0,0,1,0|3,0,0]=4 2523 B11R1.35 N[C@@H](Cc1cocn1)C(=O)O Amb27839934 [0,0,0,0,1,0|2,0,0]=3 2524 B11R1.35 N[C@@H](Cc1cscn1)C(=O)O Amb10069175 [0,0,0,0,1,0|2,0,0]=3 2525 B11R1.35 N[C@@H](Cc1csnn1)C(=O)O Amb27768430 [0,0,0,0,1,0|3,0,0]=4 2526 B11R1.35 N[C@@H](Cc1nccs1)C(=O)O Amb19149166 [0,0,0,0,1,0|2,0,0]=3 2527 B11R1.35 N[C@@H](Cn1cccn1)C(=O)O Amb8631343 [0,0,0,0,1,0|2,0,0]=3 2528 B11R1.35 N[C@@H](Cn1cccn1)C(=O)O Amb8631344 [0,0,0,0,1,0|2,0,0]=3 2529 B11R1.35 N[C@@H](Cn1cncn1)C(=O)O Amb17620828 [0,0,0,0,1,0|3,0,0]=4 2530 B11R1.35 N[C@@H](Cn1cncn1)C(=O)O Amb33309636 [0,0,0,0,1,0|3,0,0]=4 2531 B11R1.35 N[C@H](CC1=CCCC1)C(=O)O Amb26402835 [0,0,0,0,1,0|0,0,3]=4 2532 B11R1.35 N[C@H](CC1CC=CC1)C(=O)O Amb30032915 [0,0,0,0,1,0|0,0,3]=4 2533 B11R1.35 N[C@H](Cc1ccco1)C(=O)O Amb10068215 [0,0,0,0,1,0|1,0,0]=2 2534 B11R1.35 N[C@H](Cc1cccs1)C(=O)O Amb10068211 [0,0,0,0,1,0|1,0,0]=2 2535 B11R1.35 N[C@H](Cc1ccns1)C(=O)O Amb29852422 [0,0,0,0,1,0|2,0,0]=3 2536 B11R1.35 N[C@H](Cc1ccoc1)C(=O)O Amb22228969 [0,0,0,0,1,0|1,0,0]=2 2537 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb10068213 [0,0,0,0,1,0|1,0,0]=2 2538 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb33725979 [0,0,0,0,1,0|1,0,0]=2 2539 B11R1.35 N[C@H](Cc1cncs1)C(=O)O Amb26604609 [0,0,0,0,1,0|2,0,0]=3 2540 B11R1.35 N[C@H](Cc1cnns1)C(=O)O Amb33065876 [0,0,0,0,1,0|3,0,0]=4 2541 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb25260240 [0,0,0,0,1,0|3,0,0]=4 2542 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb33620572 [0,0,0,0,1,0|3,0,0]=4 2543 B11R1.35 N[C@H](Cc1cscn1)C(=O)O Amb10069174 [0,0,0,0,1,0|2,0,0]=3 2544 B11R1.35 N[C@H](Cc1csnn1)C(=O)O Amb27174873 [0,0,0,0,1,0|3,0,0]=4 2545 B11R1.35 N[C@H](Cn1cccn1)C(=O)O Amb27644346 [0,0,0,0,1,0|2,0,0]=3 2546 B11R1.35 N[C@H](Cn1ccnc1)C(=O)O Amb25887093 [0,0,0,0,1,0|2,0,0]=3 2547 B11R1.35 N[C@H](Cn1cncn1)C(=O)O Amb25843184 [0,0,0,0,1,0|3,0,0]=4 2548 B11R1.35 N[C@H](Cn1cncn1)C(=O)O Amb33309641 [0,0,0,0,1,0|3,0,0]=4 2549 B11R1.35 N\C(=C\c1ccco1)C(=O)O Amb27493744 [0,0,0,0,1,0|1,0,2]=4 2550 B11R1.35 O=C(O)C(=O)Cc1ccco1 Amb1137668 [0,0,0,0,1,0|2,0,1]=4 2551 B11R1.35 O=C(O)C(=O)Cc1cccs1 Amb1135982 [0,0,0,0,1,0|2,0,1]=4 2552 B11R1.35 O=C(O)C(=O)Cc1ccoc1 Amb26072039 [0,0,0,0,1,0|2,0,1]=4 2553 B11R1.35 O=C(O)C(=O)Cc1ccsc1 Amb1133942 [0,0,0,0,1,0|2,0,1]=4 2554 B11R1.35 O=C(O)C(=S)Cc1ccco1 Amb4026925 [0,0,0,0,1,0|2,0,1]=4 2555 B11R1.35 O=C(O)C(=S)Cc1ccsc1 Amb27407692 [0,0,0,0,1,0|2,0,1]=4 2556 B11R1.35 O=C(O)C(Cl)Cn1cccn1 Amb28045938 [0,0,0,0,1,0|3,0,0]=4 2557 B11R1.35 O=C(O)C(F)Cc1ccns1 Amb35704281 [0,0,0,0,1,0|3,0,0]=4 2558 B11R1.35 O=C(O)C(F)Cc1ccoc1 Amb27478909 [0,0,0,0,1,0|2,0,0]=3 2559 B11R1.35 O=C(O)C(F)Cc1cncs1 Amb27627166 [0,0,0,0,1,0|3,0,0]=4 2560 B11R1.35 O=C(O)C(F)Cn1cccc1 Amb27211041 [0,0,0,0,1,0|2,0,0]=3 2561 B11R1.35 O=C(O)C(F)Cn1cccn1 Amb27792436 [0,0,0,0,1,0|3,0,0]=4 2562 B11R1.35 O=C(O)C(F)Cn1ccnc1 Amb28385128 [0,0,0,0,1,0|3,0,0]=4 2563 B11R1.35 O=C(O)C(O)Cc1ccco1 Amb17138461 [0,0,0,0,1,0|2,0,0]=3 2564 B11R1.35 O=C(O)C(O)Cc1cccs1 Amb17138686 [0,0,0,0,1,0|2,0,0]=3 2565 B11R1.35 O=C(O)C(O)Cc1ccns1 Amb33353300 [0,0,0,0,1,0|3,0,0]=4 2566 B11R1.35 O=C(O)C(O)Cc1ccoc1 Amb26952187 [0,0,0,0,1,0|2,0,0]=3 2567 B11R1.35 O=C(O)C(O)Cc1ccon1 Amb33226161 [0,0,0,0,1,0|3,0,0]=4 2568 B11R1.35 O=C(O)C(O)Cc1ccsc1 Amb26887594 [0,0,0,0,1,0|2,0,0]=3 2569 B11R1.35 O=C(O)C(O)Cc1cnco1 Amb33226476 [0,0,0,0,1,0|3,0,0]=4 2570 B11R1.35 O=C(O)C(O)Cc1cncs1 Amb25986069 [0,0,0,0,1,0|3,0,0]=4 2571 B11R1.35 O=C(O)C(O)Cc1cnsc1 Amb33353410 [0,0,0,0,1,0|3,0,0]=4 2572 B11R1.35 O=C(O)C(O)Cc1cscn1 Amb33353293 [0,0,0,0,1,0|3,0,0]=4 2573 B11R1.35 O=C(O)C(O)Cc1ncco1 Amb28369831 [0,0,0,0,1,0|3,0,0]=4 2574 B11R1.35 O=C(O)C(O)Cc1nccs1 Amb26861593 [0,0,0,0,1,0|3,0,0]=4 2575 B11R1.35 O=C(O)C(O)Cn1cccn1 Amb27785438 [0,0,0,0,1,0|3,0,0]=4 2576 B11R1.35 O=C(O)C(O)Cn1ccnc1 Amb25143971 [0,0,0,0,1,0|3,0,0]=4 2577 B11R1.35 O=C(O)C(S)Cc1ccns1 Amb35720414 [0,0,0,0,1,0|3,0,0]=4 2578 B11R1.35 O=C(O)C(S)Cc1nccs1 Amb28079481 [0,0,0,0,1,0|3,0,0]=4 2579 B11R1.35 O=C(O)[C@H](O)Cc1cccs1 Amb25962724 [0,0,0,0,1,0|2,0,0]=3 2580 B11R1.36 C=C(C(=O)O)c1ccccc1 Amb8628277 [0,0,0,0,1,0|1,0,1]=3 2581 B11R1.36 C=C(C(=O)O)c1cccnc1 Amb24578705 [0,0,0,0,1,0|2,0,1]=4 2582 B11R1.36 C=C(C(=O)O)c1ccncc1 Amb26880206 [0,0,0,0,1,0|2,0,1]=4 2583 B11R1.36 C=C(C)C(C)c1ccccc1 Amb27633476 [0,0,0,0,1,0|3,0,0]=4 2584 B11R1.36 C=C(C)C(O)c1ccccc1 Amb10807411 [0,0,0,0,1,0|3,0,0]=4 2585 B11R1.36 C=C(C)[C@H](O)c1ccccc1 Amb27486178 [0,0,0,0,1,0|3,0,0]=4 2586 B11R1.36 C=C(Cl)C(O)c1ccccc1 Amb27801522 [0,0,0,0,1,0|3,0,0]=4 2587 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [0,0,0,0,1,0|2,0,1]=4 2588 B11R1.36 CC(=O)C(Br)c1ccccc1 Amb16234147 [0,0,0,0,1,0|2,0,0]=3 2589 B11R1.36 CC(=O)C(Br)c1ccccn1 Amb31193103 [0,0,0,0,1,0|3,0,0]=4 2590 B11R1.36 CC(=O)C(Br)c1cccnc1 Amb31193104 [0,0,0,0,1,0|3,0,0]=4 2591 B11R1.36 CC(=O)C(Br)c1ccncc1 Amb31193105 [0,0,0,0,1,0|3,0,0]=4 2592 B11R1.36 CC(=O)C(C)c1ccccc1 Amb17593697 [0,0,0,0,1,0|2,0,0]=3 2593 B11R1.36 CC(=O)C(C)c1ccccn1 Amb17593714 [0,0,0,0,1,0|3,0,0]=4 2594 B11R1.36 CC(=O)C(Cl)c1ccccc1 Amb387177 [0,0,0,0,1,0|2,0,0]=3 2595 B11R1.36 CC(=O)C(Cl)c1ccccn1 Amb17477809 [0,0,0,0,1,0|3,0,0]=4 2596 B11R1.36 CC(=O)C(Cl)c1cccnc1 Amb17477811 [0,0,0,0,1,0|3,0,0]=4 2597 B11R1.36 CC(=O)C(Cl)c1ccncc1 Amb17477810 [0,0,0,0,1,0|3,0,0]=4 2598 B11R1.36 CC(=O)C(F)c1ccccc1 Amb26477979 [0,0,0,0,1,0|2,0,0]=3 2599 B11R1.36 CC(=O)C(F)c1ccccn1 Amb28200147 [0,0,0,0,1,0|3,0,0]=4 2600 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,0,0,0,1,0|1,0,0]=2 2601 B11R1.36 CC(=O)C(N)c1ccccc1 Amb2725723 [0,0,0,0,1,0|1,0,0]=2 2602 B11R1.36 CC(=O)C(N)c1ccncc1 Amb27596048 [0,0,0,0,1,0|2,0,0]=3 2603 B11R1.36 CC(=O)C(N)c1cnccn1 Amb28397879 [0,0,0,0,1,0|3,0,0]=4 2604 B11R1.36 CC(=O)C(N)c1cncnc1 Amb28340899 [0,0,0,0,1,0|3,0,0]=4 2605 B11R1.36 CC(=O)C(O)c1ccccc1 Amb17593725 [0,0,0,0,1,0|2,0,0]=3 2606 B11R1.36 CC(=O)C(O)c1ccccn1 Amb24392468 [0,0,0,0,1,0|3,0,0]=4 2607 B11R1.36 CC(=O)C(O)c1cccnc1 Amb24486339 [0,0,0,0,1,0|3,0,0]=4 2608 B11R1.36 CC(=O)C(O)c1ccncc1 Amb26321275 [0,0,0,0,1,0|3,0,0]=4 2609 B11R1.36 CC(=O)C(S)c1ccccc1 Amb17594139 [0,0,0,0,1,0|2,0,0]=3 2610 B11R1.36 CC(=O)N(C)c1ccccc1 Amb2610164 [0,0,0,0,1,0|3,0,0]=4 2611 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,0,0,0,1,0|3,0,0]=4 2612 B11R1.36 CC(=O)N(N)c1ccccc1 Amb4018565 [0,0,0,0,1,0|2,0,0]=3 2613 B11R1.36 CC(=O)N(N)c1ccccn1 Amb33191442 [0,0,0,0,1,0|3,0,0]=4 2614 B11R1.36 CC(=O)N(O)c1ccccc1 Amb9786754 [0,0,0,0,1,0|3,0,0]=4 2615 B11R1.36 CC(=O)[C@@H](Br)c1ccccc1 Amb27176478 [0,0,0,0,1,0|2,0,0]=3 2616 B11R1.36 CC(=O)[C@@H](O)c1ccccc1 Amb17619252 [0,0,0,0,1,0|2,0,0]=3 2617 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,0,0,0,1,0|2,0,0]=3 2618 B11R1.36 CC(B(O)O)c1ccccc1 Amb26372362 [0,0,0,0,1,0|2,0,1]=4 2619 B11R1.36 CC(C(=N)N)c1ccccc1 Amb22886648 [0,0,0,0,1,0|3,0,0]=4 2620 B11R1.36 CC(C(=O)O)c1ccccc1 Amb2720839 [0,0,0,0,1,0|1,0,0]=2 2621 B11R1.36 CC(C(=O)O)c1ccccn1 Amb18951446 [0,0,0,0,1,0|2,0,0]=3 2622 B11R1.36 CC(C(=O)O)c1cccnc1 Amb33537627 [0,0,0,0,1,0|2,0,0]=3 2623 B11R1.36 CC(C(=O)O)c1ccncc1 Amb18952037 [0,0,0,0,1,0|2,0,0]=3 2624 B11R1.36 CC(C(=O)O)c1ccncn1 Amb18201427 [0,0,0,0,1,0|3,0,0]=4 2625 B11R1.36 CC(C(=O)O)c1cnccn1 Amb24070205 [0,0,0,0,1,0|3,0,0]=4 2626 B11R1.36 CC(C(=O)O)c1cncnc1 Amb18962092 [0,0,0,0,1,0|3,0,0]=4 2627 B11R1.36 CC(C(=O)O)c1cncnc1 Amb28652835 [0,0,0,0,1,0|3,0,0]=4 2628 B11R1.36 CC(C(=O)O)c1ncccn1 Amb7101498 [0,0,0,0,1,0|3,0,0]=4 2629 B11R1.36 CC(C(=O)[O-])c1ccccn1 Amb33528951 [0,0,0,0,1,0|2,0,1]=4 2630 B11R1.36 CC(C(=O)[O-])c1ccncc1 Amb28973217 [0,0,0,0,1,0|2,0,1]=4 2631 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,0,0,0,1,0|2,0,0]=3 2632 B11R1.36 CC(C(N)=O)c1cccnc1 Amb28068844 [0,0,0,0,1,0|3,0,0]=4 2633 B11R1.36 CC(C(N)=S)c1ccccc1 Amb17465747 [0,0,0,0,1,0|2,1,0]=4 2634 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [0,0,0,0,1,0|2,0,1]=4 2635 B11R1.36 CC(C)C(N)c1ccccc1 Amb9707459 [0,0,0,0,1,0|2,0,1]=4 2636 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb10608147 [0,0,0,0,1,0|2,0,1]=4 2637 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [0,0,0,0,1,0|2,0,1]=4 2638 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [0,0,0,0,1,0|2,0,1]=4 2639 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [0,0,0,0,1,0|2,0,1]=4 2640 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [0,0,0,0,1,0|2,0,1]=4 2641 B11R1.36 CC(O)C(Br)c1ccccc1 Amb28241304 [0,0,0,0,1,0|2,0,1]=4 2642 B11R1.36 CC(O)C(C)c1ccccc1 Amb4020076 [0,0,0,0,1,0|2,0,1]=4 2643 B11R1.36 CC(O)C(N)c1ccccc1 Amb28960311 [0,0,0,0,1,0|1,0,1]=3 2644 B11R1.36 CC(O)C(N)c1ccccc1 Amb8854990 [0,0,0,0,1,0|1,0,1]=3 2645 B11R1.36 CC(O)C(N)c1ccncc1 Amb27168210 [0,0,0,0,1,0|2,0,1]=4 2646 B11R1.36 CC(O)[C@H](N)c1cccnc1 Amb27163039 [0,0,0,0,1,0|2,0,1]=4 2647 B11R1.36 CC(c1ccccc1)[C@@H](C)O Amb26461660 [0,0,0,0,1,0|2,0,1]=4 2648 B11R1.36 CC(c1ccccc1)[C@H](C)O Amb4018956 [0,0,0,0,1,0|2,0,1]=4 2649 B11R1.36 CC(c1ccccc1)[N+](=O)[O-] Amb6298399 [0,0,0,0,1,0|2,0,1]=4 2650 B11R1.36 CC(c1ccccc1)[PH](=O)O Amb28422773 [0,0,0,0,1,0|2,0,0]=3 2651 B11R1.36 CN(C(=O)Cl)c1ccccc1 Amb8516708 [0,0,0,0,1,0|3,0,0]=4 2652 B11R1.36 CN(C(N)=O)c1ccccc1 Amb1137584 [0,0,0,0,1,0|3,0,0]=4 2653 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [0,0,0,0,1,0|3,0,0]=4 2654 B11R1.36 CS(=O)[C@@H](Cl)c1ccccc1 Amb27401935 [0,0,0,0,1,0|3,0,0]=4 2655 B11R1.36 C[C@@H](C(=O)O)c1ccccc1 Amb8514913 [0,0,0,0,1,0|1,0,0]=2 2656 B11R1.36 C[C@@H](C(=O)O)c1cccnc1 Amb33729606 [0,0,0,0,1,0|2,0,0]=3 2657 B11R1.36 C[C@@H](C(=O)O)c1ccncc1 Amb33729607 [0,0,0,0,1,0|2,0,0]=3 2658 B11R1.36 C[C@@H](C(=O)O)c1cnccn1 Amb33738417 [0,0,0,0,1,0|3,0,0]=4 2659 B11R1.36 C[C@@H](C(N)=O)c1ccccc1 Amb4166308 [0,0,0,0,1,0|2,0,0]=3 2660 B11R1.36 C[C@@H](O)[C@@H](F)c1ccccc1 Amb27664239 [0,0,0,0,1,0|2,0,1]=4 2661 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccn1 Amb27823281 [0,0,0,0,1,0|2,0,1]=4 2662 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)O Amb28256055 [0,0,0,0,1,0|2,0,1]=4 2663 B11R1.36 C[C@H](C(=O)O)c1ccccc1 Amb3938973 [0,0,0,0,1,0|1,0,0]=2 2664 B11R1.36 C[C@H](C(=O)O)c1cccnc1 Amb33747707 [0,0,0,0,1,0|2,0,0]=3 2665 B11R1.36 C[C@H](C(=O)O)c1ccncc1 Amb33744370 [0,0,0,0,1,0|2,0,0]=3 2666 B11R1.36 C[C@H](C(=O)O)c1cnccn1 Amb33744935 [0,0,0,0,1,0|3,0,0]=4 2667 B11R1.36 C[C@H](C(N)=O)c1ccccc1 Amb4166312 [0,0,0,0,1,0|2,0,0]=3 2668 B11R1.36 C[C@H](N)[C@H](N)c1ccccc1 Amb27772031 [0,0,0,0,1,0|2,0,1]=4 2669 B11R1.36 C[C@H](O)[C@@H](C)c1ccccc1 Amb16210577 [0,0,0,0,1,0|2,0,1]=4 2670 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [0,0,0,0,1,0|1,0,1]=3 2671 B11R1.36 C[C@H](O)[C@@H](N)c1cccnc1 Amb28046815 [0,0,0,0,1,0|2,0,1]=4 2672 B11R1.36 C[C@H](O)[C@H](Br)c1ccccc1 Amb27390103 [0,0,0,0,1,0|2,0,1]=4 2673 B11R1.36 C[C@H](O)[C@H](N)c1ccccc1 Amb33872242 [0,0,0,0,1,0|1,0,1]=3 2674 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,0,0,0,1,0|2,0,1]=4 2675 B11R1.36 N=C(N)C(O)c1ccccc1 Amb19890170 [0,0,0,0,1,0|3,0,0]=4 2676 B11R1.36 N=C(N)C(O)c1ccccc1 Amb6316124 [0,0,0,0,1,0|3,0,0]=4 2677 B11R1.36 N=C(N)[C@@H](O)c1ccccc1 Amb22587581 [0,0,0,0,1,0|3,0,0]=4 2678 B11R1.36 N=C(N)[C@H](O)c1ccccc1 Amb22587530 [0,0,0,0,1,0|3,0,0]=4 2679 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,0,0,1,0|2,0,1]=4 2680 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,0,0,0,1,0|2,0,0]=3 2681 B11R1.36 NC(=O)C(Cl)c1ccccc1 Amb1678054 [0,0,0,0,1,0|2,0,0]=3 2682 B11R1.36 NC(=O)C(Cl)c1cccnc1 Amb18185667 [0,0,0,0,1,0|3,0,0]=4 2683 B11R1.36 NC(=O)C(N)c1ccccc1 Amb13951330 [0,0,0,0,1,0|1,0,0]=2 2684 B11R1.36 NC(=O)C(N)c1ccccc1 Amb9720012 [0,0,0,0,1,0|1,0,0]=2 2685 B11R1.36 NC(=O)C(N)c1ccccn1 Amb17334311 [0,0,0,0,1,0|2,0,0]=3 2686 B11R1.36 NC(=O)C(N)c1cccnc1 Amb17334312 [0,0,0,0,1,0|2,0,0]=3 2687 B11R1.36 NC(=O)C(N)c1ccncc1 Amb17334313 [0,0,0,0,1,0|2,0,0]=3 2688 B11R1.36 NC(=O)C(N)c1cnccn1 Amb27650746 [0,0,0,0,1,0|3,0,0]=4 2689 B11R1.36 NC(=O)C(N)c1cncnc1 Amb27482798 [0,0,0,0,1,0|3,0,0]=4 2690 B11R1.36 NC(=O)C(O)c1ccccc1 Amb2611605 [0,0,0,0,1,0|2,0,0]=3 2691 B11R1.36 NC(=O)C(O)c1ccccn1 Amb24396108 [0,0,0,0,1,0|3,0,0]=4 2692 B11R1.36 NC(=O)C(O)c1cccnc1 Amb18182774 [0,0,0,0,1,0|3,0,0]=4 2693 B11R1.36 NC(=O)C(O)c1ccncc1 Amb25783931 [0,0,0,0,1,0|3,0,0]=4 2694 B11R1.36 NC(=O)C(S)c1ccccc1 Amb27823310 [0,0,0,0,1,0|2,0,0]=3 2695 B11R1.36 NC(=O)[C@@H](Cl)c1ccccc1 Amb28244737 [0,0,0,0,1,0|2,0,0]=3 2696 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb10603128 [0,0,0,0,1,0|1,0,0]=2 2697 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,0,0,0,1,0|1,0,0]=2 2698 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,0,0,1,0|2,0,0]=3 2699 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,0,0,0,1,0|1,0,0]=2 2700 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb8392882 [0,0,0,0,1,0|1,0,0]=2 2701 B11R1.36 NC(=O)[C@H](N)c1cccnc1 Amb28284923 [0,0,0,0,1,0|2,0,0]=3 2702 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,0,0,1,0|2,0,0]=3 2703 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [0,0,0,0,1,0|1,1,0]=3 2704 B11R1.36 NC(=S)N(N)c1ccccc1 Amb28342231 [0,0,0,0,1,0|2,1,0]=4 2705 B11R1.36 NC(=S)[C@@H](O)c1ccccc1 Amb27650180 [0,0,0,0,1,0|2,1,0]=4 2706 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,0,0,0,1,0|1,0,0]=2 2707 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb533254 [0,0,0,0,1,0|1,0,0]=2 2708 B11R1.36 NC(C(=O)O)C1=CCC=CC1 Amb8389171 [0,0,0,0,1,0|0,0,2]=3 2709 B11R1.36 NC(C(=O)O)c1ccccc1 Amb1869285 [0,0,0,0,1,0|0,0,0]=1 2710 B11R1.36 NC(C(=O)O)c1ccccn1 Amb2696726 [0,0,0,0,1,0|1,0,0]=2 2711 B11R1.36 NC(C(=O)O)c1cccnc1 Amb10632723 [0,0,0,0,1,0|1,0,0]=2 2712 B11R1.36 NC(C(=O)O)c1cccnc1 Amb2696725 [0,0,0,0,1,0|1,0,0]=2 2713 B11R1.36 NC(C(=O)O)c1cccnn1 Amb18201157 [0,0,0,0,1,0|2,0,0]=3 2714 B11R1.36 NC(C(=O)O)c1ccncc1 Amb2696724 [0,0,0,0,1,0|1,0,0]=2 2715 B11R1.36 NC(C(=O)O)c1ccncc1 Amb2699210 [0,0,0,0,1,0|1,0,0]=2 2716 B11R1.36 NC(C(=O)O)c1ccncn1 Amb18201161 [0,0,0,0,1,0|2,0,0]=3 2717 B11R1.36 NC(C(=O)O)c1cnccn1 Amb3941909 [0,0,0,0,1,0|2,0,0]=3 2718 B11R1.36 NC(C(=O)O)c1cncnc1 Amb24485788 [0,0,0,0,1,0|2,0,0]=3 2719 B11R1.36 NC(C(=O)O)c1ncccn1 Amb24738404 [0,0,0,0,1,0|2,0,0]=3 2720 B11R1.36 NC(C(O)=S)c1ccccc1 Amb27985091 [0,0,0,0,1,0|0,1,0]=2 2721 B11R1.36 NC(c1ccccc1)C(F)Cl Amb27776949 [0,0,0,0,1,0|2,0,1]=4 2722 B11R1.36 NC(c1ccccc1)C(F)F Amb28872274 [0,0,0,0,1,0|2,0,1]=4 2723 B11R1.36 NC(c1ccccc1)C(F)F Amb7783757 [0,0,0,0,1,0|2,0,1]=4 2724 B11R1.36 NC(c1ccccc1)P(O)O Amb27476186 [0,0,0,0,1,0|1,0,1]=3 2725 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,0,0,0,1,0|1,0,0]=2 2726 B11R1.36 N[C@@H](C(=O)O)C1=CCC=CC1 Amb3940862 [0,0,0,0,1,0|0,0,2]=3 2727 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 Amb22745585 [0,0,0,0,1,0|0,0,0]=1 2728 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 Amb2747967 [0,0,0,0,1,0|0,0,0]=1 2729 B11R1.36 N[C@@H](C(=O)O)c1ccccn1 Amb27410783 [0,0,0,0,1,0|1,0,0]=2 2730 B11R1.36 N[C@@H](C(=O)O)c1ccncc1 Amb27621348 [0,0,0,0,1,0|1,0,0]=2 2731 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb24485821 [0,0,0,0,1,0|2,0,1]=4 2732 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb33483668 [0,0,0,0,1,0|2,0,1]=4 2733 B11R1.36 N[C@H](C(=O)O)c1ccccc1 Amb533283 [0,0,0,0,1,0|0,0,0]=1 2734 B11R1.36 N[C@H](C(=O)O)c1ccncc1 Amb2694813 [0,0,0,0,1,0|1,0,0]=2 2735 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb27607103 [0,0,0,0,1,0|2,0,1]=4 2736 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb33483577 [0,0,0,0,1,0|2,0,1]=4 2737 B11R1.36 O=C(Cl)C(Br)c1ccccc1 Amb27597409 [0,0,0,0,1,0|2,0,0]=3 2738 B11R1.36 O=C(Cl)C(Cl)c1ccccc1 Amb9703183 [0,0,0,0,1,0|2,0,0]=3 2739 B11R1.36 O=C(Cl)C(F)c1ccccc1 Amb27617426 [0,0,0,0,1,0|2,0,0]=3 2740 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [0,0,0,0,1,0|1,0,1]=3 2741 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [0,0,0,0,1,0|1,0,1]=3 2742 B11R1.36 O=C(O)C(=O)c1ccccn1 Amb18831273 [0,0,0,0,1,0|2,0,1]=4 2743 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb15701278 [0,0,0,0,1,0|2,0,1]=4 2744 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb22492371 [0,0,0,0,1,0|2,0,1]=4 2745 B11R1.36 O=C(O)C(Br)c1ccccc1 Amb2720724 [0,0,0,0,1,0|1,0,0]=2 2746 B11R1.36 O=C(O)C(Cl)c1ccccc1 Amb518006 [0,0,0,0,1,0|1,0,0]=2 2747 B11R1.36 O=C(O)C(Cl)c1ccccn1 Amb26452015 [0,0,0,0,1,0|2,0,0]=3 2748 B11R1.36 O=C(O)C(Cl)c1cccnc1 Amb24089492 [0,0,0,0,1,0|2,0,0]=3 2749 B11R1.36 O=C(O)C(Cl)c1ccncc1 Amb24488132 [0,0,0,0,1,0|2,0,0]=3 2750 B11R1.36 O=C(O)C(F)c1ccccc1 Amb2688302 [0,0,0,0,1,0|1,0,0]=2 2751 B11R1.36 O=C(O)C(F)c1ccccn1 Amb25149165 [0,0,0,0,1,0|2,0,0]=3 2752 B11R1.36 O=C(O)C(F)c1cccnc1 Amb28128383 [0,0,0,0,1,0|2,0,0]=3 2753 B11R1.36 O=C(O)C(F)c1ccncc1 Amb24466152 [0,0,0,0,1,0|2,0,0]=3 2754 B11R1.36 O=C(O)C(F)c1cnccn1 Amb25358269 [0,0,0,0,1,0|3,0,0]=4 2755 B11R1.36 O=C(O)C(F)c1cncnc1 Amb26320155 [0,0,0,0,1,0|3,0,0]=4 2756 B11R1.36 O=C(O)C(F)c1ncccn1 Amb27237761 [0,0,0,0,1,0|3,0,0]=4 2757 B11R1.36 O=C(O)C(O)c1ccccc1 Amb4018578 [0,0,0,0,1,0|1,0,0]=2 2758 B11R1.36 O=C(O)C(O)c1ccccc1 Amb9703097 [0,0,0,0,1,0|1,0,0]=2 2759 B11R1.36 O=C(O)C(O)c1ccccn1 Amb18201201 [0,0,0,0,1,0|2,0,0]=3 2760 B11R1.36 O=C(O)C(O)c1cccnc1 Amb18952024 [0,0,0,0,1,0|2,0,0]=3 2761 B11R1.36 O=C(O)C(O)c1cccnc1 Amb19373382 [0,0,0,0,1,0|2,0,0]=3 2762 B11R1.36 O=C(O)C(O)c1ccncc1 Amb18201200 [0,0,0,0,1,0|2,0,0]=3 2763 B11R1.36 O=C(O)C(O)c1ccncn1 Amb33269064 [0,0,0,0,1,0|3,0,0]=4 2764 B11R1.36 O=C(O)C(O)c1cnccn1 Amb18200877 [0,0,0,0,1,0|3,0,0]=4 2765 B11R1.36 O=C(O)C(O)c1cncnc1 Amb26358014 [0,0,0,0,1,0|3,0,0]=4 2766 B11R1.36 O=C(O)C(O)c1ncccn1 Amb28315004 [0,0,0,0,1,0|3,0,0]=4 2767 B11R1.36 O=C(O)C(S)c1ccccc1 Amb6753823 [0,0,0,0,1,0|1,0,0]=2 2768 B11R1.36 O=C(O)C(S)c1ccncc1 Amb28291536 [0,0,0,0,1,0|2,0,0]=3 2769 B11R1.36 O=C(O)[C@@H](Br)c1ccccc1 Amb25056175 [0,0,0,0,1,0|1,0,0]=2 2770 B11R1.36 O=C(O)[C@@H](Cl)c1ccccc1 Amb27413742 [0,0,0,0,1,0|1,0,0]=2 2771 B11R1.36 O=C(O)[C@@H](F)c1ccccc1 Amb27632458 [0,0,0,0,1,0|1,0,0]=2 2772 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 Amb6354582 [0,0,0,0,1,0|1,0,0]=2 2773 B11R1.36 O=C(O)[C@@H](S)c1ccncc1 Amb28325592 [0,0,0,0,1,0|2,0,0]=3 2774 B11R1.36 O=C(O)[C@H](Br)c1ccccc1 Amb27176517 [0,0,0,0,1,0|1,0,0]=2 2775 B11R1.36 O=C(O)[C@H](F)c1ccccc1 Amb27955206 [0,0,0,0,1,0|1,0,0]=2 2776 B11R1.36 O=C(O)[C@H](O)c1ccccc1 Amb3428495 [0,0,0,0,1,0|1,0,0]=2 2777 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [0,0,0,0,1,0|1,0,2]=4 2778 B11R1.36 O=C([O-])C(F)c1ccccc1 Amb33512978 [0,0,0,0,1,0|1,0,1]=3 2779 B11R1.36 O=C([O-])C(F)c1ccccn1 Amb33473625 [0,0,0,0,1,0|2,0,1]=4 2780 B11R1.36 O=C([O-])C(O)c1ccccn1 Amb23452663 [0,0,0,0,1,0|2,0,1]=4 2781 B11R1.36 O=[PH](O)C(O)c1ccccc1 Amb21618921 [0,0,0,0,1,0|2,0,0]=3 2782 B11R1.36 O=[PH](O)C(O)c1ccncc1 Amb28061266 [0,0,0,0,1,0|3,0,0]=4 2783 B11R1.36 [NH3+]C(C(=O)O)c1ccccc1 Amb22641589 [0,0,0,0,1,0|0,0,1]=2 2784 B13R1.348 CC(=N)NC(C)Cc1ccccc1 Amb27460929 [0,0,0,0,0,1|3,0,0]=4 2785 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 Amb15692856 [0,0,0,0,0,1|2,0,1]=4 2786 B13R1.348 CC(=O)CC(C)Sc1ccccc1 Amb32683051 [0,0,0,0,0,1|3,0,0]=4 2787 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,0,0,0,0,1|3,0,0]=4 2788 B13R1.348 CC(=O)NC(C)Cc1ccccc1 Amb8503527 [0,0,0,0,0,1|2,0,0]=3 2789 B13R1.348 CC(=O)NC(C)Cc1ccccn1 Amb35596262 [0,0,0,0,0,1|3,0,0]=4 2790 B13R1.348 CC(=O)NC(O)Cc1ccccc1 Amb28132759 [0,0,0,0,0,1|2,0,0]=3 2791 B13R1.348 CC(=O)\C=C(/C)Cc1ccccc1 Amb17778969 [0,0,0,0,0,1|2,0,1]=4 2792 B13R1.348 CC(=O)\C=C(\N)Nc1ccccc1 Amb27876049 [0,0,0,0,0,1|2,0,1]=4 2793 B13R1.348 CC(C)=CC(O)Cc1ccccc1 Amb27262321 [0,0,0,0,0,1|3,0,0]=4 2794 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2237290 [0,0,0,0,0,1|2,0,1]=4 2795 B13R1.348 CC(C)CC(N)Cc1ccccc1 Amb2592669 [0,0,0,0,0,1|2,0,1]=4 2796 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [0,0,0,0,0,1|1,0,0]=2 2797 B13R1.348 CC(CC(=O)O)Cc1ccccn1 Amb17335285 [0,0,0,0,0,1|2,0,0]=3 2798 B13R1.348 CC(CC(=O)O)Cc1cccnc1 Amb17335287 [0,0,0,0,0,1|2,0,0]=3 2799 B13R1.348 CC(CC(=O)O)Cc1ccncc1 Amb17335288 [0,0,0,0,0,1|2,0,0]=3 2800 B13R1.348 CC(CC(=O)O)Nc1ccccc1 Amb9398389 [0,0,0,0,0,1|2,0,0]=3 2801 B13R1.348 CC(CC(=O)O)Oc1ccccc1 Amb9397751 [0,0,0,0,0,1|2,0,0]=3 2802 B13R1.348 CC(CC(=O)O)Sc1ccccn1 Amb9398091 [0,0,0,0,0,1|3,0,0]=4 2803 B13R1.348 CC(CC(N)=O)Nc1ccccc1 Amb17233441 [0,0,0,0,0,1|3,0,0]=4 2804 B13R1.348 CC(CC(N)=O)Oc1ccccc1 Amb17233539 [0,0,0,0,0,1|3,0,0]=4 2805 B13R1.348 CC(Cc1ccccc1)NC(=O)Cl Amb35625792 [0,0,0,0,0,1|2,0,0]=3 2806 B13R1.348 CC(Cc1ccccc1)NC(N)=S Amb4430630 [0,0,0,0,0,1|2,1,0]=4 2807 B13R1.348 CC(Cc1ccccc1)OC(=O)Cl Amb33297088 [0,0,0,0,0,1|2,0,0]=3 2808 B13R1.348 CC(Cc1ccccn1)NC(=O)Cl Amb29889121 [0,0,0,0,0,1|3,0,0]=4 2809 B13R1.348 CC(Cc1ccccn1)NC(N)=O Amb35692251 [0,0,0,0,0,1|3,0,0]=4 2810 B13R1.348 CC(Cc1ccccn1)OC(=O)Cl Amb33297149 [0,0,0,0,0,1|3,0,0]=4 2811 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb34913780 [0,0,0,0,0,1|3,0,0]=4 2812 B13R1.348 CN(C)CC(N)Cc1ccccc1 Amb5493964 [0,0,0,0,0,1|3,0,0]=4 2813 B13R1.348 CN(C)C[C@@H](N)Cc1ccccc1 Amb34198855 [0,0,0,0,0,1|3,0,0]=4 2814 B13R1.348 CN(C)C[C@H](N)Cc1ccccc1 Amb34198854 [0,0,0,0,0,1|3,0,0]=4 2815 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb33551957 [0,0,0,0,0,1|2,0,0]=3 2816 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb5768759 [0,0,0,0,0,1|2,0,0]=3 2817 B13R1.348 CN(CC(=O)O)Cc1ccccn1 Amb22586726 [0,0,0,0,0,1|3,0,0]=4 2818 B13R1.348 CN(CC(=O)O)Cc1ccccn1 Amb2721931 [0,0,0,0,0,1|3,0,0]=4 2819 B13R1.348 CN(CC(=O)O)Cc1cccnc1 Amb21955498 [0,0,0,0,0,1|3,0,0]=4 2820 B13R1.348 CN(CC(=O)O)Cc1cccnc1 Amb2721930 [0,0,0,0,0,1|3,0,0]=4 2821 B13R1.348 CN(CC(=O)O)Cc1ccncc1 Amb22586727 [0,0,0,0,0,1|3,0,0]=4 2822 B13R1.348 CN(CC(=O)O)Cc1ccncc1 Amb9301019 [0,0,0,0,0,1|3,0,0]=4 2823 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 Amb26519867 [0,0,0,0,0,1|2,0,0]=3 2824 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 Amb8397199 [0,0,0,0,0,1|2,0,0]=3 2825 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,0,0,0,0,1|2,0,0]=3 2826 B13R1.348 C\C(=C/C(=O)O)Cc1ccccc1 Amb17233183 [0,0,0,0,0,1|1,0,1]=3 2827 B13R1.348 C\C(=C/C(=O)O)Sc1ccccc1 Amb18130094 [0,0,0,0,0,1|2,0,1]=4 2828 B13R1.348 C\C(=C/c1ccccc1)CC(=O)O Amb17594482 [0,0,0,0,0,1|1,0,2]=4 2829 B13R1.348 N=C(Cc1ccccc1)NC(N)=O Amb27954665 [0,0,0,0,0,1|1,0,2]=4 2830 B13R1.348 NC(=O)CC(N)Cc1ccccc1 Amb32787647 [0,0,0,0,0,1|1,0,0]=2 2831 B13R1.348 NC(=O)CN(N)Cc1ccccc1 Amb27268266 [0,0,0,0,0,1|2,0,0]=3 2832 B13R1.348 NC(=O)NC(=O)Cc1ccccc1 Amb8513476 [0,0,0,0,0,1|2,0,1]=4 2833 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb20623358 [0,0,0,0,0,1|0,0,0]=1 2834 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb8631754 [0,0,0,0,0,1|0,0,0]=1 2835 B13R1.348 NC(CC(=O)O)Cc1ccccn1 Amb17470627 [0,0,0,0,0,1|1,0,0]=2 2836 B13R1.348 NC(CC(=O)O)Cc1cccnc1 Amb17470630 [0,0,0,0,0,1|1,0,0]=2 2837 B13R1.348 NC(CC(=O)O)Cc1ccncc1 Amb17470634 [0,0,0,0,0,1|1,0,0]=2 2838 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb16184010 [0,0,0,0,0,1|0,0,0]=1 2839 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb2697591 [0,0,0,0,0,1|0,0,0]=1 2840 B13R1.348 N[C@@H](CC(=O)O)Cc1cccnc1 Amb33933974 [0,0,0,0,0,1|1,0,0]=2 2841 B13R1.348 N[C@@H](CC(=O)O)Cc1ccncc1 Amb33726055 [0,0,0,0,0,1|1,0,0]=2 2842 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb2699235 [0,0,0,0,0,1|0,0,0]=1 2843 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb8629294 [0,0,0,0,0,1|0,0,0]=1 2844 B13R1.348 N[C@H](CC(=O)O)Cc1cccnc1 Amb22746342 [0,0,0,0,0,1|1,0,0]=2 2845 B13R1.348 N[C@H](CC(=O)O)Cc1ccncc1 Amb22746344 [0,0,0,0,0,1|1,0,0]=2 2846 B13R1.348 O=C(Cl)NC(=O)Cc1ccccc1 Amb27169467 [0,0,0,0,0,1|2,0,1]=4 2847 B13R1.348 O=C(O)CC(=O)Nc1ccccc1 Amb2436726 [0,0,0,0,0,1|2,0,1]=4 2848 B13R1.348 O=C(O)CC(Br)Cc1ccccc1 Amb18111137 [0,0,0,0,0,1|1,0,0]=2 2849 B13R1.348 O=C(O)CC(Cl)Cc1ccccc1 Amb18111136 [0,0,0,0,0,1|1,0,0]=2 2850 B13R1.348 O=C(O)CC(O)Cc1ccccc1 Amb17233662 [0,0,0,0,0,1|1,0,0]=2 2851 B13R1.348 O=C(O)C[C@@H](O)Cc1ccccc1 Amb32951764 [0,0,0,0,0,1|1,0,0]=2 2852 B13R1.348 O=C(O)C[C@H](O)Cc1ccccc1 Amb33082324 [0,0,0,0,0,1|1,0,0]=2 2853 B13R1.348 [2H]C(C=C(C)C)Cc1ccccc1 Amb22546630 [0,0,0,0,0,1|3,0,0]=4 2854 B13R1.351 C=C(C)C(O)CNc1ccccc1 Amb29875610 [0,0,0,0,0,1|3,0,0]=4 2855 B13R1.351 C=C(CCc1ccccc1)C(=O)O Amb18127719 [0,0,0,0,0,1|1,0,1]=3 2856 B13R1.351 C=C(\C=C\c1ccccc1)C(=O)O Amb33081816 [0,0,0,0,0,1|1,0,2]=4 2857 B13R1.351 CC(=O)C(=O)NCc1ccccc1 Amb17400597 [0,0,0,0,0,1|2,0,1]=4 2858 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,0,0,0,0,1|2,0,1]=4 2859 B13R1.351 CC(=O)C(C)OCc1ccccc1 Amb16231123 [0,0,0,0,0,1|2,0,0]=3 2860 B13R1.351 CC(=O)C(C)SCc1ccccc1 Amb9216163 [0,0,0,0,0,1|2,0,0]=3 2861 B13R1.351 CC(=O)C(O)\C=C\c1ccccc1 Amb27861376 [0,0,0,0,0,1|2,0,1]=4 2862 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,0,0,0,0,1|2,0,0]=3 2863 B13R1.351 CC(=O)\C(C)=N\Cc1ccccc1 Amb25130600 [0,0,0,0,0,1|2,0,1]=4 2864 B13R1.351 CC(=O)\C(N)=N\Nc1ccccc1 Amb2622246 [0,0,0,0,0,1|2,0,1]=4 2865 B13R1.351 CC(C)C(N)CCc1ccccc1 Amb8869744 [0,0,0,0,0,1|2,0,1]=4 2866 B13R1.351 CC(C)C(N)CSc1ccccc1 Amb22642718 [0,0,0,0,0,1|2,0,1]=4 2867 B13R1.351 CC(C)C(N)CSc1ccccc1 Amb32662312 [0,0,0,0,0,1|2,0,1]=4 2868 B13R1.351 CC(C)[C@@H](N)CNc1ccccc1 Amb27461689 [0,0,0,0,0,1|2,0,1]=4 2869 B13R1.351 CC(C)[C@@H](N)COc1ccccc1 Amb18538509 [0,0,0,0,0,1|2,0,1]=4 2870 B13R1.351 CC(CCc1ccccc1)C(=O)O Amb4011190 [0,0,0,0,0,1|1,0,0]=2 2871 B13R1.351 CC(CCc1ccccn1)C(=O)O Amb17335286 [0,0,0,0,0,1|2,0,0]=3 2872 B13R1.351 CC(CCc1cccnc1)C(=O)O Amb17233532 [0,0,0,0,0,1|2,0,0]=3 2873 B13R1.351 CC(CCc1ccncc1)C(=O)O Amb17335289 [0,0,0,0,0,1|2,0,0]=3 2874 B13R1.351 CC(CCc1ccncn1)C(=O)O Amb33267952 [0,0,0,0,0,1|3,0,0]=4 2875 B13R1.351 CC(CCc1cnccn1)C(=O)O Amb33429871 [0,0,0,0,0,1|3,0,0]=4 2876 B13R1.351 CC(CCc1cncnc1)C(=O)O Amb32876140 [0,0,0,0,0,1|3,0,0]=4 2877 B13R1.351 CC(CCc1ncccn1)C(=O)O Amb33269918 [0,0,0,0,0,1|3,0,0]=4 2878 B13R1.351 CC(CNc1ccccc1)C(=O)O Amb9400301 [0,0,0,0,0,1|1,0,0]=2 2879 B13R1.351 CC(CNc1ccccc1)C(N)=O Amb8944556 [0,0,0,0,0,1|2,0,0]=3 2880 B13R1.351 CC(CNc1ccncc1)C(=O)O Amb19027731 [0,0,0,0,0,1|2,0,0]=3 2881 B13R1.351 CC(COc1ccccc1)C(=O)O Amb9394526 [0,0,0,0,0,1|1,0,0]=2 2882 B13R1.351 CC(COc1ccccc1)C(N)=O Amb17233540 [0,0,0,0,0,1|2,0,0]=3 2883 B13R1.351 CC(CSc1ccccc1)C(=O)O Amb9400034 [0,0,0,0,0,1|1,0,0]=2 2884 B13R1.351 CC(CSc1ccccn1)C(=O)O Amb9400043 [0,0,0,0,0,1|2,0,0]=3 2885 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb10199880 [0,0,0,0,0,1|1,0,0]=2 2886 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb9704488 [0,0,0,0,0,1|1,0,0]=2 2887 B13R1.351 CC(NCc1ccccn1)C(=O)O Amb10609128 [0,0,0,0,0,1|2,0,0]=3 2888 B13R1.351 CC(NCc1ccccn1)C(=O)O Amb1110995 [0,0,0,0,0,1|2,0,0]=3 2889 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb10199875 [0,0,0,0,0,1|2,0,0]=3 2890 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb1110808 [0,0,0,0,0,1|2,0,0]=3 2891 B13R1.351 CC(NCc1ccncc1)C(=O)O Amb9326995 [0,0,0,0,0,1|2,0,0]=3 2892 B13R1.351 CC(NNc1ccccc1)C(N)=O Amb27845438 [0,0,0,0,0,1|3,0,0]=4 2893 B13R1.351 CC(O)C(C)CCc1ccccc1 Amb32944830 [0,0,0,0,0,1|2,0,1]=4 2894 B13R1.351 CC(O)C(C)CNc1ccccc1 Amb27751217 [0,0,0,0,0,1|2,0,1]=4 2895 B13R1.351 CC(O)C(C)NCc1ccccc1 Amb8630571 [0,0,0,0,0,1|2,0,1]=4 2896 B13R1.351 CC(O)C(C)OCc1ccccc1 Amb18809338 [0,0,0,0,0,1|2,0,1]=4 2897 B13R1.351 CC(O)C(N)CNc1ccncc1 Amb27647171 [0,0,0,0,0,1|2,0,1]=4 2898 B13R1.351 CC(O)[C@@H](O)OCc1ccccc1 Amb22736709 [0,0,0,0,0,1|2,0,1]=4 2899 B13R1.351 CC(O)[C@H](O)OCc1ccccc1 Amb22736708 [0,0,0,0,0,1|2,0,1]=4 2900 B13R1.351 CC(OCc1ccccc1)C(=O)O Amb6280663 [0,0,0,0,0,1|1,0,0]=2 2901 B13R1.351 CC(OCc1ccccc1)C(N)=O Amb9004024 [0,0,0,0,0,1|2,0,0]=3 2902 B13R1.351 CC(OCc1ccccc1)[C@H](C)O Amb27641399 [0,0,0,0,0,1|2,0,1]=4 2903 B13R1.351 CC(OCc1ccccn1)C(=O)O Amb32662745 [0,0,0,0,0,1|2,0,0]=3 2904 B13R1.351 CC(OCc1ccccn1)C(=O)O Amb32663141 [0,0,0,0,0,1|2,0,0]=3 2905 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662717 [0,0,0,0,0,1|2,0,0]=3 2906 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662837 [0,0,0,0,0,1|2,0,0]=3 2907 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb28556093 [0,0,0,0,0,1|2,0,0]=3 2908 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb32662726 [0,0,0,0,0,1|2,0,0]=3 2909 B13R1.351 CC(SCc1ccccc1)C(=O)O Amb9710523 [0,0,0,0,0,1|1,0,0]=2 2910 B13R1.351 CC(\C=C\c1ccccc1)C(=O)O Amb18127714 [0,0,0,0,0,1|1,0,1]=3 2911 B13R1.351 CC(\N=C\c1ccncc1)C(=O)O Amb28396599 [0,0,0,0,0,1|2,0,1]=4 2912 B13R1.351 CN(CCc1ccccc1)C(=O)Cl Amb33620302 [0,0,0,0,0,1|3,0,0]=4 2913 B13R1.351 CN(OCc1ccccc1)C(N)=O Amb28122231 [0,0,0,0,0,1|3,0,0]=4 2914 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O Amb16185448 [0,0,0,0,0,1|1,0,0]=2 2915 B13R1.351 C[C@@H](O)C(O)OCc1ccccc1 Amb19929337 [0,0,0,0,0,1|2,0,1]=4 2916 B13R1.351 C[C@@H](O)[C@@H](N)\C=C\c1ccccc1 Amb27623283 [0,0,0,0,0,1|1,0,2]=4 2917 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O Amb6357814 [0,0,0,0,0,1|1,0,0]=2 2918 B13R1.351 C[C@@H](\C=C\c1ccccc1)C(=O)O Amb27592192 [0,0,0,0,0,1|1,0,1]=3 2919 B13R1.351 C[C@@H](\N=C\c1ccccc1)C(=O)[O-] Amb27639352 [0,0,0,0,0,1|1,0,2]=4 2920 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O Amb26326642 [0,0,0,0,0,1|1,0,0]=2 2921 B13R1.351 C[C@H](O)C(O)OCc1ccccc1 Amb19929338 [0,0,0,0,0,1|2,0,1]=4 2922 B13R1.351 C[C@H](O)[C@@H](C)NCc1ccccc1 Amb27606376 [0,0,0,0,0,1|2,0,1]=4 2923 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O Amb25072743 [0,0,0,0,0,1|1,0,0]=2 2924 B13R1.351 C[C@H](OCc1ccccc1)C(N)=O Amb27411933 [0,0,0,0,0,1|2,0,0]=3 2925 B13R1.351 C[C@H](\C=C\c1ccccc1)C(=O)O Amb27179112 [0,0,0,0,0,1|1,0,1]=3 2926 B13R1.351 C\C(=N/Nc1ccccc1)C(=O)O Amb6487380 [0,0,0,0,0,1|2,0,1]=4 2927 B13R1.351 NC(=O)C(=O)OCc1ccccc1 Amb27608591 [0,0,0,0,0,1|2,0,1]=4 2928 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,0,0,0,0,1|1,0,0]=2 2929 B13R1.351 NC(=O)C(N)CCc1ccccn1 Amb33036746 [0,0,0,0,0,1|2,0,0]=3 2930 B13R1.351 NC(=O)C(N)CCc1cccnc1 Amb32796900 [0,0,0,0,0,1|2,0,0]=3 2931 B13R1.351 NC(=O)C(N)CCc1cccnn1 Amb33036559 [0,0,0,0,0,1|3,0,0]=4 2932 B13R1.351 NC(=O)C(N)CCc1ccncc1 Amb33309222 [0,0,0,0,0,1|2,0,0]=3 2933 B13R1.351 NC(=O)C(N)CCc1cnccn1 Amb33309095 [0,0,0,0,0,1|3,0,0]=4 2934 B13R1.351 NC(=O)C(N)CNc1ccccc1 Amb28324229 [0,0,0,0,0,1|1,0,0]=2 2935 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb33309501 [0,0,0,0,0,1|0,0,0]=1 2936 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb4134816 [0,0,0,0,0,1|0,0,0]=1 2937 B13R1.351 NC(CCc1ccccc1)C(F)F Amb32712116 [0,0,0,0,0,1|2,0,1]=4 2938 B13R1.351 NC(CCc1ccccc1)C(F)F Amb33470216 [0,0,0,0,0,1|2,0,1]=4 2939 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb1101108 [0,0,0,0,0,1|1,0,0]=2 2940 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb24117831 [0,0,0,0,0,1|1,0,0]=2 2941 B13R1.351 NC(CCc1cccnc1)C(=O)O Amb8385705 [0,0,0,0,0,1|1,0,0]=2 2942 B13R1.351 NC(CCc1cccnn1)C(=O)O Amb33036496 [0,0,0,0,0,1|2,0,0]=3 2943 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb17470633 [0,0,0,0,0,1|1,0,0]=2 2944 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb32795038 [0,0,0,0,0,1|1,0,0]=2 2945 B13R1.351 NC(CCc1cnccn1)C(=O)O Amb33065886 [0,0,0,0,0,1|2,0,0]=3 2946 B13R1.351 NC(CSc1ccccc1)C(=O)O Amb18325246 [0,0,0,0,0,1|0,0,0]=1 2947 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb6295860 [0,0,0,0,0,1|0,0,0]=1 2948 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb8393714 [0,0,0,0,0,1|0,0,0]=1 2949 B13R1.351 N[C@@H](CCc1ccccn1)C(=O)O Amb33065409 [0,0,0,0,0,1|1,0,0]=2 2950 B13R1.351 N[C@@H](CCc1cccnc1)C(=O)O Amb33066201 [0,0,0,0,0,1|1,0,0]=2 2951 B13R1.351 N[C@@H](CCc1cccnn1)C(=O)O Amb33033603 [0,0,0,0,0,1|2,0,0]=3 2952 B13R1.351 N[C@@H](CCc1ccncc1)C(=O)O Amb33036545 [0,0,0,0,0,1|1,0,0]=2 2953 B13R1.351 N[C@@H](CCc1cnccn1)C(=O)O Amb33066161 [0,0,0,0,0,1|2,0,0]=3 2954 B13R1.351 N[C@@H](CNc1ccccc1)C(=O)O Amb26880836 [0,0,0,0,0,1|0,0,0]=1 2955 B13R1.351 N[C@@H](CSc1ccccc1)C(=O)O Amb6357272 [0,0,0,0,0,1|0,0,0]=1 2956 B13R1.351 N[C@@H](\C=C\c1ccccc1)C(=O)O Amb2694855 [0,0,0,0,0,1|0,0,1]=2 2957 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O Amb6357139 [0,0,0,0,0,1|0,0,0]=1 2958 B13R1.351 N[C@H](CCc1ccccn1)C(=O)O Amb33036457 [0,0,0,0,0,1|1,0,0]=2 2959 B13R1.351 N[C@H](CCc1cccnc1)C(=O)O Amb33308822 [0,0,0,0,0,1|1,0,0]=2 2960 B13R1.351 N[C@H](CCc1cccnn1)C(=O)O Amb33066114 [0,0,0,0,0,1|2,0,0]=3 2961 B13R1.351 N[C@H](CCc1ccncc1)C(=O)O Amb32941145 [0,0,0,0,0,1|1,0,0]=2 2962 B13R1.351 N[C@H](CCc1cnccn1)C(=O)O Amb33308904 [0,0,0,0,0,1|2,0,0]=3 2963 B13R1.351 N\C(=C\Cc1cccnc1)C(=O)O Amb28370348 [0,0,0,0,0,1|1,0,1]=3 2964 B13R1.351 O=C(Cl)C(=O)OCc1ccccc1 Amb24687217 [0,0,0,0,0,1|2,0,1]=4 2965 B13R1.351 O=C(O)C(=O)CCc1ccccc1 Amb8391159 [0,0,0,0,0,1|1,0,1]=3 2966 B13R1.351 O=C(O)C(=O)NCc1ccccc1 Amb838961 [0,0,0,0,0,1|1,0,1]=3 2967 B13R1.351 O=C(O)C(=O)NCc1ccccn1 Amb33457520 [0,0,0,0,0,1|2,0,1]=4 2968 B13R1.351 O=C(O)C(=O)NCc1ccccn1 Amb9303999 [0,0,0,0,0,1|2,0,1]=4 2969 B13R1.351 O=C(O)C(=O)NCc1cccnc1 Amb9304022 [0,0,0,0,0,1|2,0,1]=4 2970 B13R1.351 O=C(O)C(=O)NCc1ccncc1 Amb9304023 [0,0,0,0,0,1|2,0,1]=4 2971 B13R1.351 O=C(O)C(=O)NNc1ccccc1 Amb18128574 [0,0,0,0,0,1|2,0,1]=4 2972 B13R1.351 O=C(O)C(=O)OCc1ccccc1 Amb18128558 [0,0,0,0,0,1|1,0,1]=3 2973 B13R1.351 O=C(O)C(=O)\C=C/c1ccccc1 Amb27628477 [0,0,0,0,0,1|1,0,2]=4 2974 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb16192457 [0,0,0,0,0,1|1,0,2]=4 2975 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb4477338 [0,0,0,0,0,1|1,0,2]=4 2976 B13R1.351 O=C(O)C(=S)NCc1ccccc1 Amb27645460 [0,0,0,0,0,1|1,0,1]=3 2977 B13R1.351 O=C(O)C(Br)CCc1ccccc1 Amb18662872 [0,0,0,0,0,1|1,0,0]=2 2978 B13R1.351 O=C(O)C(O)CCc1ccccc1 Amb2718777 [0,0,0,0,0,1|1,0,0]=2 2979 B13R1.351 O=C(O)C(O)CNc1ccccc1 Amb27179092 [0,0,0,0,0,1|1,0,0]=2 2980 B13R1.351 O=C(O)C(O)\C=C\c1ccccc1 Amb17594531 [0,0,0,0,0,1|1,0,1]=3 2981 B13R1.351 O=C(O)[C@@H](O)CCc1ccccc1 Amb10603260 [0,0,0,0,0,1|1,0,0]=2 2982 B13R1.351 O=C(O)[C@H](O)CCc1ccccc1 Amb8628145 [0,0,0,0,0,1|1,0,0]=2 2983 B13R1.351 O=C(O)[C@H](O)\C=C\c1ccccc1 Amb26621099 [0,0,0,0,0,1|1,0,1]=3 2984 B13R1.351 O=C(O)\C(Cl)=N\Nc1ccccc1 Amb27232838 [0,0,0,0,0,1|2,0,1]=4 2985 B13R1.351 O=C([O-])C(=O)CCc1ccccc1 Amb32662535 [0,0,0,0,0,1|1,0,2]=4 2986 B10R0.75 C=C\C=C\CCC(N)C(=O)O Amb33308773 [1,0,1,0,0,0|0,0,1]=3 2987 B10R0.75 C=C\C=C\CCC(N)C(N)=O Amb33036983 [1,0,1,0,0,0|1,0,1]=4 2988 B10R0.75 C=C\C=C\CC[C@@H](N)C(=O)O Amb33309012 [1,0,1,0,0,0|0,0,1]=3 2989 B10R0.75 C=C\C=C\CC[C@H](N)C(=O)O Amb33066030 [1,0,1,0,0,0|0,0,1]=3 2990 B10R1.17 BrCCCc1ccccc1 Amb2721516 [2,0,0,0,0,0|1,0,1]=4 2991 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [2,0,0,0,0,0|2,0,0]=4 2992 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [2,0,0,0,0,0|1,0,1]=4 2993 B10R1.17 C#CCCc1ccccc1 Amb6336492 [2,0,0,0,0,0|1,0,1]=4 2994 B10R1.17 C=CCCc1ccccc1 Amb2721241 [2,0,0,0,0,0|1,0,0]=3 2995 B10R1.17 C=CCCc1ccccn1 Amb25337662 [2,0,0,0,0,0|2,0,0]=4 2996 B10R1.17 C=CCCc1cccnc1 Amb24477186 [2,0,0,0,0,0|2,0,0]=4 2997 B10R1.17 C=CCNc1ccccc1 Amb2720315 [2,0,0,0,0,0|2,0,0]=4 2998 B10R1.17 C=CCOc1ccccc1 Amb2842273 [2,0,0,0,0,0|2,0,0]=4 2999 B10R1.17 C=CCSc1ccccc1 Amb3836099 [2,0,0,0,0,0|2,0,0]=4 3000 B10R1.17 C=COCc1ccccc1 Amb17940722 [2,0,0,0,0,0|2,0,0]=4 3001 B10R1.17 CCCCc1ccccc1 Amb6608912 [2,0,0,0,0,0|1,0,1]=4 3002 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|2,0,0]=4 3003 B10R1.17 CNCCc1ccccc1 Amb33545919 [2,0,0,0,0,0|2,0,0]=4 3004 B10R1.17 COCCc1ccccc1 Amb4020014 [2,0,0,0,0,0|2,0,0]=4 3005 B10R1.17 CSCCc1ccccc1 Amb26586093 [2,0,0,0,0,0|2,0,0]=4 3006 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [2,0,0,0,0,0|1,0,1]=4 3007 B10R1.17 ClCCCc1ccccc1 Amb3941487 [2,0,0,0,0,0|1,0,1]=4 3008 B10R1.17 ICCCc1ccccc1 Amb10605506 [2,0,0,0,0,0|1,0,1]=4 3009 B10R1.17 N#CCCc1ccccc1 Amb33551192 [2,0,0,0,0,0|1,0,1]=4 3010 B10R1.17 NCCCc1ccccc1 Amb844788 [2,0,0,0,0,0|1,0,1]=4 3011 B10R1.17 NNCCc1ccccc1 Amb10608987 [2,0,0,0,0,0|2,0,0]=4 3012 B10R1.17 NNCCc1ccccc1 Amb1117029 [2,0,0,0,0,0|2,0,0]=4 3013 B10R1.17 NNCCc1ccccc1 Amb33552804 [2,0,0,0,0,0|2,0,0]=4 3014 B10R1.17 NOCCc1ccccc1 Amb2899735 [2,0,0,0,0,0|2,0,0]=4 3015 B10R1.17 NOCCc1ccccc1 Amb6308543 [2,0,0,0,0,0|2,0,0]=4 3016 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [2,0,0,0,0,0|1,0,1]=4 3017 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [2,0,0,0,0,0|0,0,2]=4 3018 B10R1.17 O=CCCc1ccccc1 Amb2720576 [2,0,0,0,0,0|0,0,0]=2 3019 B10R1.17 O=CCCc1ccccn1 Amb17081674 [2,0,0,0,0,0|1,0,0]=3 3020 B10R1.17 O=CCCc1cccnc1 Amb17081675 [2,0,0,0,0,0|1,0,0]=3 3021 B10R1.17 O=CCCc1ccncc1 Amb8388451 [2,0,0,0,0,0|1,0,0]=3 3022 B10R1.17 O=CCCc1ccncn1 Amb26958514 [2,0,0,0,0,0|2,0,0]=4 3023 B10R1.17 O=CCCc1cnccn1 Amb25876683 [2,0,0,0,0,0|2,0,0]=4 3024 B10R1.17 O=CCCc1cncnc1 Amb24657168 [2,0,0,0,0,0|2,0,0]=4 3025 B10R1.17 O=CCCc1ncccn1 Amb24056162 [2,0,0,0,0,0|2,0,0]=4 3026 B10R1.17 O=CCOc1ccccc1 Amb3465095 [2,0,0,0,0,0|1,0,0]=3 3027 B10R1.17 O=CCOc1ccccn1 Amb27823582 [2,0,0,0,0,0|2,0,0]=4 3028 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|1,0,0]=3 3029 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,0]=3 3030 B10R1.17 O=CNCc1ccccn1 Amb22370826 [2,0,0,0,0,0|2,0,0]=4 3031 B10R1.17 O=CNCc1cccnc1 Amb2694543 [2,0,0,0,0,0|2,0,0]=4 3032 B10R1.17 O=CNNc1ccccc1 Amb2721099 [2,0,0,0,0,0|2,0,0]=4 3033 B10R1.17 O=COCc1ccccc1 Amb4605893 [2,0,0,0,0,0|1,0,0]=3 3034 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [2,0,0,0,0,0|0,0,1]=3 3035 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|0,0,2]=4 3036 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [2,0,0,0,0,0|0,0,2]=4 3037 B10R1.17 OCCCc1ccccc1 Amb3939054 [2,0,0,0,0,0|0,0,1]=3 3038 B10R1.17 OCCCc1ccccn1 Amb22749323 [2,0,0,0,0,0|1,0,1]=4 3039 B10R1.17 OCCCc1ccccn1 Amb3939333 [2,0,0,0,0,0|1,0,1]=4 3040 B10R1.17 OCCCc1cccnc1 Amb2694598 [2,0,0,0,0,0|1,0,1]=4 3041 B10R1.17 OCCCc1cccnc1 Amb33623848 [2,0,0,0,0,0|1,0,1]=4 3042 B10R1.17 OCCCc1ccncc1 Amb3650114 [2,0,0,0,0,0|1,0,1]=4 3043 B10R1.17 OCCNc1ccccc1 Amb3940335 [2,0,0,0,0,0|1,0,1]=4 3044 B10R1.17 OCCOc1ccccc1 Amb2209344 [2,0,0,0,0,0|1,0,1]=4 3045 B10R1.17 OCOCc1ccccc1 Amb25727798 [2,0,0,0,0,0|1,0,1]=4 3046 B10R1.17 OCSCc1ccccc1 Amb27839241 [2,0,0,0,0,0|1,0,1]=4 3047 B10R1.17 ONCCc1ccccc1 Amb33544180 [2,0,0,0,0,0|1,0,0]=3 3048 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [2,0,0,0,0,0|1,0,1]=4 3049 B10R1.17 SCCCc1ccccc1 Amb6255807 [2,0,0,0,0,0|0,1,1]=4 3050 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [2,0,0,0,0,0|2,0,0]=4 3051 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [2,0,0,0,0,0|1,0,1]=4 3052 B10R1.18 BrC(Br)Cc1ccccc1 Amb28049679 [2,0,0,0,0,0|2,0,0]=4 3053 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [2,0,0,0,0,0|1,0,1]=4 3054 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [2,0,0,0,0,0|1,0,1]=4 3055 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [2,0,0,0,0,0|0,0,1]=3 3056 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [2,0,0,0,0,0|1,0,1]=4 3057 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [2,0,0,0,0,0|1,0,1]=4 3058 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [2,0,0,0,0,0|1,0,1]=4 3059 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [2,0,0,0,0,0|0,0,1]=3 3060 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [2,0,0,0,0,0|0,0,1]=3 3061 B10R1.18 CC(N)Cc1ccccn1 Amb1995149 [2,0,0,0,0,0|1,0,1]=4 3062 B10R1.18 CC(N)Cc1cccnc1 Amb9712156 [2,0,0,0,0,0|1,0,1]=4 3063 B10R1.18 CC(N)Cc1ccncc1 Amb2592094 [2,0,0,0,0,0|1,0,1]=4 3064 B10R1.18 CC(O)C[n+]1ccccc1 Amb27213830 [2,0,0,0,0,0|2,0,0]=4 3065 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [2,0,0,0,0,0|1,0,0]=3 3066 B10R1.18 CC(O)Cc1ccccn1 Amb1995148 [2,0,0,0,0,0|2,0,0]=4 3067 B10R1.18 CC(O)Cc1cccnc1 Amb33530732 [2,0,0,0,0,0|2,0,0]=4 3068 B10R1.18 CC(O)Cc1ccncc1 Amb17477789 [2,0,0,0,0,0|2,0,0]=4 3069 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [2,0,0,0,0,0|2,0,0]=4 3070 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [2,0,0,0,0,0|2,0,0]=4 3071 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [2,0,0,0,0,0|1,0,1]=4 3072 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [2,0,0,0,0,0|1,0,1]=4 3073 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [2,0,0,0,0,0|2,0,0]=4 3074 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [2,0,0,0,0,0|2,0,0]=4 3075 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [2,0,0,0,0,0|1,0,1]=4 3076 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [2,0,0,0,0,0|1,0,1]=4 3077 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [2,0,0,0,0,0|1,0,1]=4 3078 B10R1.18 C[C@@H](N)Cc1ccccn1 Amb27754695 [2,0,0,0,0,0|1,0,1]=4 3079 B10R1.18 C[C@@H](N)Cc1cccnc1 Amb26602572 [2,0,0,0,0,0|1,0,1]=4 3080 B10R1.18 C[C@@H](N)Cc1ccncc1 Amb28044876 [2,0,0,0,0,0|1,0,1]=4 3081 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [2,0,0,0,0,0|1,0,0]=3 3082 B10R1.18 C[C@@H](O)Cc1ccccn1 Amb27839538 [2,0,0,0,0,0|2,0,0]=4 3083 B10R1.18 C[C@@H](O)Cc1cccnc1 Amb22896922 [2,0,0,0,0,0|2,0,0]=4 3084 B10R1.18 C[C@@H](O)Cc1ccncc1 Amb33380651 [2,0,0,0,0,0|2,0,0]=4 3085 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [2,0,0,0,0,0|1,0,1]=4 3086 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [2,0,0,0,0,0|1,0,1]=4 3087 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [2,0,0,0,0,0|0,0,1]=3 3088 B10R1.18 C[C@H](N)Cc1ccccn1 Amb24451425 [2,0,0,0,0,0|1,0,1]=4 3089 B10R1.18 C[C@H](N)Cc1cccnc1 Amb27145739 [2,0,0,0,0,0|1,0,1]=4 3090 B10R1.18 C[C@H](N)Cc1ccncc1 Amb28381274 [2,0,0,0,0,0|1,0,1]=4 3091 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [2,0,0,0,0,0|1,0,0]=3 3092 B10R1.18 C[C@H](O)Cc1ccccn1 Amb26605951 [2,0,0,0,0,0|2,0,0]=4 3093 B10R1.18 C[C@H](O)Cc1cccnc1 Amb28041599 [2,0,0,0,0,0|2,0,0]=4 3094 B10R1.18 C[C@H](O)Cc1ccncc1 Amb33380652 [2,0,0,0,0,0|2,0,0]=4 3095 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [2,0,0,0,0,0|2,0,0]=4 3096 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [2,0,0,0,0,0|1,0,1]=4 3097 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [2,0,0,0,0,0|1,0,1]=4 3098 B10R1.18 NC(=O)C[n+]1ccccc1 Amb2684428 [2,0,0,0,0,0|1,0,1]=4 3099 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [2,0,0,0,0,0|0,0,1]=3 3100 B10R1.18 NC(=O)Cc1cccnc1 Amb21856113 [2,0,0,0,0,0|1,0,1]=4 3101 B10R1.18 NC(=O)Cc1ccncc1 Amb4010849 [2,0,0,0,0,0|1,0,1]=4 3102 B10R1.18 NC(=O)Nc1ccccc1 Amb3106756 [2,0,0,0,0,0|1,0,1]=4 3103 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [2,0,0,0,0,0|1,0,1]=4 3104 B10R1.18 NC(=O)Sc1ccccc1 Amb28182472 [2,0,0,0,0,0|1,0,1]=4 3105 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [2,0,0,0,0,0|0,1,1]=4 3106 B10R1.18 NC(N)Cc1ccccc1 Amb27823264 [2,0,0,0,0,0|1,0,0]=3 3107 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [2,0,0,0,0,0|0,0,0]=2 3108 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [2,0,0,0,0,0|1,0,0]=3 3109 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [2,0,0,0,0,0|1,0,1]=4 3110 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [2,0,0,0,0,0|1,0,1]=4 3111 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [2,0,0,0,0,0|1,0,1]=4 3112 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [2,0,0,0,0,0|1,0,1]=4 3113 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [2,0,0,0,0,0|1,0,1]=4 3114 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [2,0,0,0,0,0|2,0,0]=4 3115 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [2,0,0,0,0,0|2,0,0]=4 3116 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [2,0,0,0,0,0|2,0,0]=4 3117 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [2,0,0,0,0,0|2,0,0]=4 3118 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [2,0,0,0,0,0|2,0,0]=4 3119 B10R1.18 OB(O)Cc1ccccc1 Amb10071580 [2,0,0,0,0,0|2,0,0]=4 3120 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [2,0,0,0,0,0|1,0,1]=4 3121 B10R1.18 OC(Cl)Cc1ccccc1 Amb27228646 [2,0,0,0,0,0|1,0,0]=3 3122 B10R1.18 OC(Cl)Oc1ccccc1 Amb28255528 [2,0,0,0,0,0|2,0,0]=4 3123 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [2,0,0,0,0,0|1,0,0]=3 3124 B10R1.18 OC(O)Oc1ccccc1 Amb27790325 [2,0,0,0,0,0|2,0,0]=4 3125 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [1,1,0,0,0,0|1,0,1]=4 3126 B12R1.32 C#CCC(N)Cc1ccccc1 Amb32652619 [1,1,0,0,0,0|1,0,1]=4 3127 B12R1.32 C=CCC(N)Cc1ccccc1 Amb32663713 [1,1,0,0,0,0|1,0,0]=3 3128 B12R1.32 C=CCC(N)Cc1ccccc1 Amb33538411 [1,1,0,0,0,0|1,0,0]=3 3129 B12R1.32 C=CCC(O)Cc1ccccc1 Amb18177786 [1,1,0,0,0,0|2,0,0]=4 3130 B12R1.32 C=CCN(N)Cc1ccccc1 Amb26501723 [1,1,0,0,0,0|2,0,0]=4 3131 B12R1.32 CC(CCO)Cc1ccccc1 Amb17232486 [1,1,0,0,0,0|1,0,1]=4 3132 B12R1.32 CC(CON)Cc1ccccc1 Amb32953166 [1,1,0,0,0,0|1,0,1]=4 3133 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,1,0,0,0,0|1,0,1]=4 3134 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [1,1,0,0,0,0|1,0,0]=3 3135 B12R1.32 CC(Cc1ccccn1)NC=O Amb29889266 [1,1,0,0,0,0|2,0,0]=4 3136 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [1,1,0,0,0,0|1,0,1]=4 3137 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [1,1,0,0,0,0|2,0,0]=4 3138 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [1,1,0,0,0,0|1,0,1]=4 3139 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [1,1,0,0,0,0|0,0,1]=3 3140 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb3940159 [1,1,0,0,0,0|0,0,1]=3 3141 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb4037107 [1,1,0,0,0,0|0,0,1]=3 3142 B12R1.32 COC[C@H](N)Cc1ccccc1 Amb33871543 [1,1,0,0,0,0|0,0,1]=3 3143 B12R1.32 CONC(C)Cc1ccccc1 Amb28984063 [1,1,0,0,0,0|2,0,0]=4 3144 B12R1.32 CO\N=C(\N)Cc1ccccc1 Amb27827154 [1,1,0,0,0,0|1,0,1]=4 3145 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [1,1,0,0,0,0|1,1,0]=4 3146 B12R1.32 C\C(=C\C=O)Cc1ccccc1 Amb27435409 [1,1,0,0,0,0|1,0,1]=4 3147 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [1,1,0,0,0,0|1,0,1]=4 3148 B12R1.32 C\C=C\C(O)Cc1ccccc1 Amb27641998 [1,1,0,0,0,0|2,0,0]=4 3149 B12R1.32 N#CC[C@@H](N)Cc1ccccc1 Amb27251534 [1,1,0,0,0,0|1,0,1]=4 3150 B12R1.32 N#C\C=C(/N)Cc1ccccc1 Amb28195853 [1,1,0,0,0,0|1,0,1]=4 3151 B12R1.32 NC(CCO)Cc1ccccc1 Amb28872403 [1,1,0,0,0,0|0,0,1]=3 3152 B12R1.32 NC(CCO)Cc1ccccc1 Amb8392175 [1,1,0,0,0,0|0,0,1]=3 3153 B12R1.32 NCCC(N)Cc1ccccc1 Amb33039576 [1,1,0,0,0,0|1,0,1]=4 3154 B12R1.32 O=CNC(=O)Cc1ccccc1 Amb6360720 [1,1,0,0,0,0|1,0,1]=4 3155 B12R1.32 OC\C=C(\Cl)Cc1ccccc1 Amb27841976 [1,1,0,0,0,0|1,0,1]=4 3156 B12R1.34 C=C(C=O)C(C)c1ccccc1 Amb8392634 [1,1,0,0,0,0|1,0,1]=4 3157 B12R1.34 C=CC(C)C(N)c1ccccc1 Amb27392398 [1,1,0,0,0,0|2,0,0]=4 3158 B12R1.34 C=CC(N)C(N)c1ccccc1 Amb27390654 [1,1,0,0,0,0|1,0,0]=3 3159 B12R1.34 C=CC(O)C(C)c1ccccc1 Amb25310831 [1,1,0,0,0,0|2,0,0]=4 3160 B12R1.34 C=C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27232990 [1,1,0,0,0,0|2,0,0]=4 3161 B12R1.34 C=C[C@@H](O)[C@H](O)c1ccccc1 Amb27615222 [1,1,0,0,0,0|2,0,0]=4 3162 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccccc1 Amb25071531 [1,1,0,0,0,0|2,0,0]=4 3163 B12R1.34 C=C[C@H](N)[C@H](O)c1ccccc1 Amb27876610 [1,1,0,0,0,0|1,0,0]=3 3164 B12R1.34 C=C[C@H](O)[C@@H](C)c1ccccc1 Amb27169905 [1,1,0,0,0,0|2,0,0]=4 3165 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [1,1,0,0,0,0|1,0,1]=4 3166 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [1,1,0,0,0,0|1,0,0]=3 3167 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [1,1,0,0,0,0|1,0,0]=3 3168 B12R1.34 CC(C=O)S(=O)c1ccccc1 Amb27224791 [1,1,0,0,0,0|2,0,0]=4 3169 B12R1.34 CC(CO)C(C)c1ccccc1 Amb26375616 [1,1,0,0,0,0|1,0,1]=4 3170 B12R1.34 CC(CO)[C@H](C)c1ccccc1 Amb28207416 [1,1,0,0,0,0|1,0,1]=4 3171 B12R1.34 CC(\C(N)=N\O)c1ccccc1 Amb24595995 [1,1,0,0,0,0|1,0,1]=4 3172 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [1,1,0,0,0,0|1,0,0]=3 3173 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [1,1,0,0,0,0|1,0,0]=3 3174 B12R1.34 CC(c1ccccc1)C(N)C#N Amb18953074 [1,1,0,0,0,0|1,0,1]=4 3175 B12R1.34 CC(c1ccccc1)C(N)CN Amb18972125 [1,1,0,0,0,0|1,0,1]=4 3176 B12R1.34 CC(c1ccccc1)C(N)CN Amb33537059 [1,1,0,0,0,0|1,0,1]=4 3177 B12R1.34 CC(c1ccccc1)C(N)CO Amb18975503 [1,1,0,0,0,0|0,0,1]=3 3178 B12R1.34 CC(c1ccccc1)C(N)CO Amb19349648 [1,1,0,0,0,0|0,0,1]=3 3179 B12R1.34 CC(c1ccccc1)C(O)CO Amb26021855 [1,1,0,0,0,0|1,0,1]=4 3180 B12R1.34 CC(c1ccccc1)N(O)C=O Amb10606548 [1,1,0,0,0,0|2,0,0]=4 3181 B12R1.34 CC(c1ccccc1)[C@@H](C)CO Amb33746406 [1,1,0,0,0,0|1,0,1]=4 3182 B12R1.34 CC(c1ccccc1)[C@@H](N)CO Amb33081836 [1,1,0,0,0,0|0,0,1]=3 3183 B12R1.34 CC(c1ccccc1)[C@H](C)CO Amb33727265 [1,1,0,0,0,0|1,0,1]=4 3184 B12R1.34 CC(c1ccccc1)[C@H](N)CO Amb33081833 [1,1,0,0,0,0|0,0,1]=3 3185 B12R1.34 CCC(N)C(C)c1ccccc1 Amb18829127 [1,1,0,0,0,0|1,0,1]=4 3186 B12R1.34 CCC(N)C(C)c1ccccc1 Amb20623710 [1,1,0,0,0,0|1,0,1]=4 3187 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [1,1,0,0,0,0|1,0,1]=4 3188 B12R1.34 CCC(N)C(O)c1ccccc1 Amb9428998 [1,1,0,0,0,0|1,0,1]=4 3189 B12R1.34 CC[C@@H](N)C(C)c1ccccc1 Amb29867804 [1,1,0,0,0,0|1,0,1]=4 3190 B12R1.34 CC[C@@H](N)C(O)c1ccccc1 Amb35602701 [1,1,0,0,0,0|1,0,1]=4 3191 B12R1.34 CC[C@@H](N)[C@@H](O)c1ccccc1 Amb27760494 [1,1,0,0,0,0|1,0,1]=4 3192 B12R1.34 CC[C@H](N)C(C)c1ccccc1 Amb29867785 [1,1,0,0,0,0|1,0,1]=4 3193 B12R1.34 CC[C@H](N)C(O)c1ccccc1 Amb35601261 [1,1,0,0,0,0|1,0,1]=4 3194 B12R1.34 CC[C@H](N)[C@H](O)c1ccccc1 Amb28121117 [1,1,0,0,0,0|1,0,1]=4 3195 B12R1.34 COC(N)C(O)c1ccccc1 Amb28397502 [1,1,0,0,0,0|2,0,0]=4 3196 B12R1.34 C[C@@H](CO)[C@@H](C)c1ccccc1 Amb27178556 [1,1,0,0,0,0|1,0,1]=4 3197 B12R1.34 C[C@@H](NO)[C@@H](O)c1ccccc1 Amb27770879 [1,1,0,0,0,0|2,0,0]=4 3198 B12R1.34 C[C@@H](c1ccccc1)[C@@H](O)CO Amb27763660 [1,1,0,0,0,0|1,0,1]=4 3199 B12R1.34 C[C@@H](c1ccccc1)[C@H](F)CO Amb27770738 [1,1,0,0,0,0|1,0,1]=4 3200 B12R1.34 C[C@H](C=O)N(O)c1ccccc1 Amb27780818 [1,1,0,0,0,0|2,0,0]=4 3201 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [1,1,0,0,0,0|1,0,0]=3 3202 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [1,1,0,0,0,0|1,0,0]=3 3203 B12R1.34 C[C@H](CO)C(N)c1ccccc1 Amb27614720 [1,1,0,0,0,0|1,0,1]=4 3204 B12R1.34 C[C@H](NO)[C@@H](O)c1ccccc1 Amb28242677 [1,1,0,0,0,0|2,0,0]=4 3205 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [1,1,0,0,0,0|1,0,0]=3 3206 B12R1.34 C[C@H](c1ccccc1)[C@H](F)CO Amb27766616 [1,1,0,0,0,0|1,0,1]=4 3207 B12R1.34 N#C[C@H](N)[C@@H](F)c1ccccc1 Amb28135510 [1,1,0,0,0,0|1,0,1]=4 3208 B12R1.34 NC(C=O)C(O)c1cccnc1 Amb27814200 [1,1,0,0,0,0|1,0,0]=3 3209 B12R1.34 NC(CO)C(N)c1ccccc1 Amb27430428 [1,1,0,0,0,0|0,0,1]=3 3210 B12R1.34 NC(CO)C(O)c1ccccc1 Amb4034588 [1,1,0,0,0,0|0,0,1]=3 3211 B12R1.34 NC(CO)C(O)c1ccccn1 Amb25736521 [1,1,0,0,0,0|1,0,1]=4 3212 B12R1.34 NC(CO)C(O)c1ccccn1 Amb30584998 [1,1,0,0,0,0|1,0,1]=4 3213 B12R1.34 NC(CO)C(O)c1cccnc1 Amb18826621 [1,1,0,0,0,0|1,0,1]=4 3214 B12R1.34 NC(CO)C(O)c1cccnc1 Amb32655984 [1,1,0,0,0,0|1,0,1]=4 3215 B12R1.34 NC(CO)C(O)c1ccncc1 Amb26322233 [1,1,0,0,0,0|1,0,1]=4 3216 B12R1.34 NC(CO)C(O)c1ccncc1 Amb30584999 [1,1,0,0,0,0|1,0,1]=4 3217 B12R1.34 NC(c1ccccc1)C(O)CO Amb18646773 [1,1,0,0,0,0|1,0,1]=4 3218 B12R1.34 N[C@@H](CO)[C@@H](O)c1ccccc1 Amb6298328 [1,1,0,0,0,0|0,0,1]=3 3219 B12R1.34 N[C@H](CO)[C@@H](Cl)c1ccccc1 Amb27791780 [1,1,0,0,0,0|0,0,1]=3 3220 B12R1.34 N[C@H](CO)[C@H](O)c1ccccc1 Amb8515836 [1,1,0,0,0,0|0,0,1]=3 3221 B12R1.34 N[C@H](c1ccccc1)[C@H](O)CO Amb27430365 [1,1,0,0,0,0|1,0,1]=4 3222 B12R1.34 N\C(=N/O)C(N)c1ccccc1 Amb26342170 [1,1,0,0,0,0|1,0,1]=4 3223 B12R1.34 N\C(=N/O)C(O)c1ccccc1 Amb6371814 [1,1,0,0,0,0|1,0,1]=4 3224 B12R1.34 N\C(=N\O)C(O)c1ccccc1 Amb22052910 [1,1,0,0,0,0|1,0,1]=4 3225 B12R1.34 O=CC(Cl)C(=O)c1ccccc1 Amb28364135 [1,1,0,0,0,0|1,0,1]=4 3226 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [1,1,0,0,0,0|1,0,0]=3 3227 B12R1.34 O=CC(F)C(=O)c1ccccc1 Amb26485248 [1,1,0,0,0,0|1,0,1]=4 3228 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [1,1,0,0,0,0|1,0,0]=3 3229 B12R1.34 OCC(Br)C(Br)c1ccccc1 Amb27393982 [1,1,0,0,0,0|1,0,1]=4 3230 B12R1.34 OC[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27983838 [1,1,0,0,0,0|1,0,1]=4 3231 B12R1.34 OC[C@@H](O)[C@@H](O)c1ccccc1 Amb28244272 [1,1,0,0,0,0|1,0,1]=4 3232 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [1,1,0,0,0,0|1,0,1]=4 3233 B12R1.34 OC[C@H](O)[C@H](Cl)c1ccccc1 Amb27231781 [1,1,0,0,0,0|1,0,1]=4 3234 B12R1.34 [NH3+]C(CO)C(O)c1ccccc1 Amb33513059 [1,1,0,0,0,0|0,0,2]=4 3235 B12R1.49 C#CC(N)Cc1ccc(Cl)cc1 Amb27663217 [1,1,0,0,0,0|1,0,1]=4 3236 B12R1.49 C=CC(Cl)Cc1ccc(Br)cc1 Amb27178578 [1,1,0,0,0,0|2,0,0]=4 3237 B12R1.49 C=CC(N)Cc1ccc(C)cc1 Amb28197514 [1,1,0,0,0,0|1,0,0]=3 3238 B12R1.49 C=CC(O)Cc1ccc(N)cc1 Amb35588601 [1,1,0,0,0,0|2,0,0]=4 3239 B12R1.49 CC(C=O)Cc1ccc(Br)cc1 Amb25060263 [1,1,0,0,0,0|1,0,0]=3 3240 B12R1.49 CC(C=O)Cc1ccc(Cl)cc1 Amb18648716 [1,1,0,0,0,0|1,0,0]=3 3241 B12R1.49 CC(C=O)Cc1ccc(F)cc1 Amb26011993 [1,1,0,0,0,0|1,0,0]=3 3242 B12R1.49 CC(C=O)Cc1ccc(I)cc1 Amb28187361 [1,1,0,0,0,0|1,0,0]=3 3243 B12R1.49 CC(C=O)Cc1ccc(N)cc1 Amb27398345 [1,1,0,0,0,0|1,0,0]=3 3244 B12R1.49 CC(C=O)Oc1ccc(Br)cc1 Amb30020612 [1,1,0,0,0,0|2,0,0]=4 3245 B12R1.49 CC(C=O)Oc1ccc(Cl)cc1 Amb27619207 [1,1,0,0,0,0|2,0,0]=4 3246 B12R1.49 CC(C=O)Oc1ccc(F)cc1 Amb30020594 [1,1,0,0,0,0|2,0,0]=4 3247 B12R1.49 CC(C=O)Oc1ccc(I)cc1 Amb30020617 [1,1,0,0,0,0|2,0,0]=4 3248 B12R1.49 CC(C=O)Sc1ccc(Br)cc1 Amb30020877 [1,1,0,0,0,0|2,0,0]=4 3249 B12R1.49 CC(C=O)Sc1ccc(Cl)cc1 Amb30020870 [1,1,0,0,0,0|2,0,0]=4 3250 B12R1.49 CC(C=O)Sc1ccc(F)cc1 Amb30020862 [1,1,0,0,0,0|2,0,0]=4 3251 B12R1.49 CC(CO)Cc1ccc(Br)cc1 Amb27794524 [1,1,0,0,0,0|1,0,1]=4 3252 B12R1.49 CC(CO)Cc1ccc(Cl)cc1 Amb26398800 [1,1,0,0,0,0|1,0,1]=4 3253 B12R1.49 CC(CO)Cc1ccc(F)cc1 Amb26963530 [1,1,0,0,0,0|1,0,1]=4 3254 B12R1.49 CC(Cc1ccc(Cl)cc1)NO Amb27751580 [1,1,0,0,0,0|2,0,0]=4 3255 B12R1.49 CC(Cc1ccc(F)cc1)NO Amb28255996 [1,1,0,0,0,0|2,0,0]=4 3256 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb28555695 [1,1,0,0,0,0|1,0,1]=4 3257 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb9428935 [1,1,0,0,0,0|1,0,1]=4 3258 B12R1.49 CCC(N)Cc1ccc(C)cc1 Amb9428909 [1,1,0,0,0,0|1,0,1]=4 3259 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [1,1,0,0,0,0|1,0,1]=4 3260 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb9428934 [1,1,0,0,0,0|1,0,1]=4 3261 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb28555694 [1,1,0,0,0,0|1,0,1]=4 3262 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb9428931 [1,1,0,0,0,0|1,0,1]=4 3263 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [1,1,0,0,0,0|1,0,1]=4 3264 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb33552371 [1,1,0,0,0,0|1,0,1]=4 3265 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb9428939 [1,1,0,0,0,0|1,0,1]=4 3266 B12R1.49 CC[C@@H](N)Cc1ccc(Br)cc1 Amb27830392 [1,1,0,0,0,0|1,0,1]=4 3267 B12R1.49 CC[C@H](N)Cc1ccc(Br)cc1 Amb27840450 [1,1,0,0,0,0|1,0,1]=4 3268 B12R1.49 CC[C@H](N)Cc1ccc(C)cc1 Amb28203344 [1,1,0,0,0,0|1,0,1]=4 3269 B12R1.49 CN(C=O)Cc1ccc(Br)cc1 Amb28456997 [1,1,0,0,0,0|2,0,0]=4 3270 B12R1.49 C[C@@H](CO)Cc1ccc(F)cc1 Amb27150747 [1,1,0,0,0,0|1,0,1]=4 3271 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [1,1,0,0,0,0|1,0,1]=4 3272 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [1,1,0,0,0,0|1,0,0]=3 3273 B12R1.49 Cc1ccc(CC(C)C=O)cn1 Amb28046135 [1,1,0,0,0,0|2,0,0]=4 3274 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [1,1,0,0,0,0|1,0,1]=4 3275 B12R1.49 Cc1ccc(CC(C)NO)cc1 Amb27602730 [1,1,0,0,0,0|2,0,0]=4 3276 B12R1.49 Cc1ccc(CC(Cl)C=O)cc1 Amb17204328 [1,1,0,0,0,0|1,0,0]=3 3277 B12R1.49 Cc1ccc(CC(Cl)CO)cc1 Amb28365747 [1,1,0,0,0,0|1,0,1]=4 3278 B12R1.49 Cc1ccc(CC(N)=S=O)cc1 Amb28250028 [1,1,0,0,0,0|1,0,1]=4 3279 B12R1.49 Cc1ccc(CC(N)C#N)cc1 Amb27879147 [1,1,0,0,0,0|1,0,1]=4 3280 B12R1.49 Cc1ccc(CC(N)CN)cc1 Amb26983073 [1,1,0,0,0,0|1,0,1]=4 3281 B12R1.49 Cc1ccc(CC(N)CN)cc1 Amb32684625 [1,1,0,0,0,0|1,0,1]=4 3282 B12R1.49 Cc1ccc(CC(N)CO)cc1 Amb17062687 [1,1,0,0,0,0|0,0,1]=3 3283 B12R1.49 Cc1ccc(CC(N)CO)cc1 Amb28872400 [1,1,0,0,0,0|0,0,1]=3 3284 B12R1.49 Cc1ccc(CC(N)CO)cn1 Amb32879680 [1,1,0,0,0,0|1,0,1]=4 3285 B12R1.49 Cc1ccc(CC(N)CO)nc1 Amb33198853 [1,1,0,0,0,0|1,0,1]=4 3286 B12R1.49 Cc1ccc(CC(O)CO)cc1 Amb27840444 [1,1,0,0,0,0|1,0,1]=4 3287 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [1,1,0,0,0,0|1,0,1]=4 3288 B12R1.49 Cc1ccc(C[C@@H](O)CO)cc1 Amb27458003 [1,1,0,0,0,0|1,0,1]=4 3289 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [1,1,0,0,0,0|1,0,1]=4 3290 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [1,1,0,0,0,0|0,0,1]=3 3291 B12R1.49 Cc1ccc(C\C(N)=N\O)cc1 Amb6248369 [1,1,0,0,0,0|1,0,1]=4 3292 B12R1.49 Cc1ccc(OC(C)C=O)cc1 Amb27827460 [1,1,0,0,0,0|2,0,0]=4 3293 B12R1.49 Cc1ccc(SC(C)C=O)cc1 Amb18648416 [1,1,0,0,0,0|2,0,0]=4 3294 B12R1.49 N#CC(N)Cc1ccc(Cl)cc1 Amb23557156 [1,1,0,0,0,0|1,0,1]=4 3295 B12R1.49 N#CC(N)Cc1ccc(F)cc1 Amb27596673 [1,1,0,0,0,0|1,0,1]=4 3296 B12R1.49 N#C[C@@H](N)Cc1ccc(I)cc1 Amb27426637 [1,1,0,0,0,0|1,0,1]=4 3297 B12R1.49 NC(C=O)Cc1ccc(O)cc1 Amb28208235 [1,1,0,0,0,0|0,0,0]=2 3298 B12R1.49 NC(CO)Cc1cc[n+]([O-])cc1 Amb27883106 [1,1,0,0,0,0|1,0,1]=4 3299 B12R1.49 NC(CO)Cc1ccc(Br)cc1 Amb17062713 [1,1,0,0,0,0|0,0,1]=3 3300 B12R1.49 NC(CO)Cc1ccc(Br)cn1 Amb26500211 [1,1,0,0,0,0|1,0,1]=4 3301 B12R1.49 NC(CO)Cc1ccc(Br)nc1 Amb25200151 [1,1,0,0,0,0|1,0,1]=4 3302 B12R1.49 NC(CO)Cc1ccc(Cl)cc1 Amb2719800 [1,1,0,0,0,0|0,0,1]=3 3303 B12R1.49 NC(CO)Cc1ccc(Cl)cc1 Amb30640025 [1,1,0,0,0,0|0,0,1]=3 3304 B12R1.49 NC(CO)Cc1ccc(Cl)cn1 Amb33220654 [1,1,0,0,0,0|1,0,1]=4 3305 B12R1.49 NC(CO)Cc1ccc(Cl)nc1 Amb27253397 [1,1,0,0,0,0|1,0,1]=4 3306 B12R1.49 NC(CO)Cc1ccc(F)cc1 Amb17062689 [1,1,0,0,0,0|0,0,1]=3 3307 B12R1.49 NC(CO)Cc1ccc(F)cc1 Amb28600205 [1,1,0,0,0,0|0,0,1]=3 3308 B12R1.49 NC(CO)Cc1ccc(F)cn1 Amb33315885 [1,1,0,0,0,0|1,0,1]=4 3309 B12R1.49 NC(CO)Cc1ccc(F)nc1 Amb33426219 [1,1,0,0,0,0|1,0,1]=4 3310 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [1,1,0,0,0,0|0,0,1]=3 3311 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb33362381 [1,1,0,0,0,0|0,0,1]=3 3312 B12R1.49 NC(CO)Cc1ccc(O)cc1 Amb17062710 [1,1,0,0,0,0|0,0,1]=3 3313 B12R1.49 NC(CO)Cc1ccc(O)cc1 Amb32665844 [1,1,0,0,0,0|0,0,1]=3 3314 B12R1.49 NC[C@@H](N)Cc1ccc(Cl)cc1 Amb27389196 [1,1,0,0,0,0|1,0,1]=4 3315 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [1,1,0,0,0,0|0,0,1]=3 3316 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [1,1,0,0,0,0|0,0,1]=3 3317 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb31289679 [1,1,0,0,0,0|0,0,1]=3 3318 B12R1.49 N[C@@H](CO)Cc1ccc(O)cc1 Amb6357315 [1,1,0,0,0,0|0,0,1]=3 3319 B12R1.49 N[C@@H](CO)Cc1ccc(O)cc1 Amb8387636 [1,1,0,0,0,0|0,0,1]=3 3320 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [1,1,0,0,0,0|0,0,1]=3 3321 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [1,1,0,0,0,0|0,0,1]=3 3322 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [1,1,0,0,0,0|0,0,1]=3 3323 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [1,1,0,0,0,0|0,0,1]=3 3324 B12R1.49 N[C@H](CO)Cc1ccc(O)cc1 Amb1157858 [1,1,0,0,0,0|0,0,1]=3 3325 B12R1.49 N[C@H](CO)Cc1ccc(O)cc1 Amb8516110 [1,1,0,0,0,0|0,0,1]=3 3326 B12R1.49 N\C(Cc1ccc(Br)cc1)=N/O Amb6243425 [1,1,0,0,0,0|1,0,1]=4 3327 B12R1.49 N\C(Cc1ccc(Br)cc1)=N\O Amb2685412 [1,1,0,0,0,0|1,0,1]=4 3328 B12R1.49 N\C(Cc1ccc(Cl)cc1)=N/O Amb1114808 [1,1,0,0,0,0|1,0,1]=4 3329 B12R1.49 N\C(Cc1ccc(Cl)cc1)=N\O Amb2696040 [1,1,0,0,0,0|1,0,1]=4 3330 B12R1.49 N\C(Cc1ccc(F)cc1)=N/O Amb6767541 [1,1,0,0,0,0|1,0,1]=4 3331 B12R1.49 N\C(Cc1ccc(F)cc1)=N\O Amb2696614 [1,1,0,0,0,0|1,0,1]=4 3332 B12R1.49 N\C(Cc1ccc(N)cc1)=N/O Amb33536512 [1,1,0,0,0,0|1,0,1]=4 3333 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [1,1,0,0,0,0|0,0,1]=3 3334 B12R1.49 O=CC(=O)Cc1ccc(Cl)cc1 Amb27873325 [1,1,0,0,0,0|1,0,1]=4 3335 B12R1.49 O=CC(=O)Cc1ccc(F)cc1 Amb28247135 [1,1,0,0,0,0|1,0,1]=4 3336 B12R1.49 O=CC(Cl)Cc1ccc(Br)cc1 Amb17204706 [1,1,0,0,0,0|1,0,0]=3 3337 B12R1.49 O=CC(Cl)Cc1ccc(Cl)cc1 Amb17204403 [1,1,0,0,0,0|1,0,0]=3 3338 B12R1.49 O=CC(Cl)Cc1ccc(F)cc1 Amb17204342 [1,1,0,0,0,0|1,0,0]=3 3339 B12R1.49 OCC(Cl)Cc1ccc(Cl)cc1 Amb27782418 [1,1,0,0,0,0|1,0,1]=4 3340 B12R1.49 OCC(O)Cc1ccc(Cl)cc1 Amb26318724 [1,1,0,0,0,0|1,0,1]=4 3341 B12R1.49 OCC(O)Cc1ccc(F)cc1 Amb27416534 [1,1,0,0,0,0|1,0,1]=4 3342 B12R1.49 OC[C@@H](F)Cc1ccc(F)cc1 Amb28455289 [1,1,0,0,0,0|1,0,1]=4 3343 B12R1.49 OC[C@@H](O)Cc1ccc(F)cc1 Amb27978223 [1,1,0,0,0,0|1,0,1]=4 3344 B12R1.49 OC[C@H](O)Cc1ccc(O)cc1 Amb28207388 [1,1,0,0,0,0|1,0,1]=4 3345 B12R1.50 C#CC(N)Cc1cccc(Br)c1 Amb27606207 [1,1,0,0,0,0|1,0,1]=4 3346 B12R1.50 C#CC(N)Cc1cccc(F)c1 Amb25886519 [1,1,0,0,0,0|1,0,1]=4 3347 B12R1.50 C#CC(N)Cc1cccc(F)c1 Amb31217544 [1,1,0,0,0,0|1,0,1]=4 3348 B12R1.50 C=CC(N)Cc1cccc(Br)c1 Amb28286567 [1,1,0,0,0,0|1,0,0]=3 3349 B12R1.50 C=CC(N)Cc1cccc(C)c1 Amb27494449 [1,1,0,0,0,0|1,0,0]=3 3350 B12R1.50 C=CC(O)Cc1cccc(Br)c1 Amb27840834 [1,1,0,0,0,0|2,0,0]=4 3351 B12R1.50 C=CC(O)Cc1cccc(F)c1 Amb27840833 [1,1,0,0,0,0|2,0,0]=4 3352 B12R1.50 C=CC(O)Cc1cccc(N)c1 Amb35620632 [1,1,0,0,0,0|2,0,0]=4 3353 B12R1.50 CC(C=O)Cc1cccc(Br)c1 Amb26348210 [1,1,0,0,0,0|1,0,0]=3 3354 B12R1.50 CC(C=O)Cc1cccc(F)c1 Amb25885683 [1,1,0,0,0,0|1,0,0]=3 3355 B12R1.50 CC(C=O)Cc1cccc(I)c1 Amb25850018 [1,1,0,0,0,0|1,0,0]=3 3356 B12R1.50 CC(C=O)Cc1cccc(N)c1 Amb25251154 [1,1,0,0,0,0|1,0,0]=3 3357 B12R1.50 CC(C=O)Cc1cccc(O)c1 Amb27601007 [1,1,0,0,0,0|1,0,0]=3 3358 B12R1.50 CC(C=O)Oc1cccc(Br)c1 Amb30020611 [1,1,0,0,0,0|2,0,0]=4 3359 B12R1.50 CC(C=O)Oc1cccc(F)c1 Amb30020587 [1,1,0,0,0,0|2,0,0]=4 3360 B12R1.50 CC(C=O)Oc1cccc(I)c1 Amb30020616 [1,1,0,0,0,0|2,0,0]=4 3361 B12R1.50 CC(C=O)Sc1cccc(Br)c1 Amb30020878 [1,1,0,0,0,0|2,0,0]=4 3362 B12R1.50 CC(C=O)Sc1cccc(Cl)c1 Amb30020871 [1,1,0,0,0,0|2,0,0]=4 3363 B12R1.50 CC(C=O)Sc1cccc(F)c1 Amb30020861 [1,1,0,0,0,0|2,0,0]=4 3364 B12R1.50 CC(CO)Cc1cccc(F)c1 Amb25228330 [1,1,0,0,0,0|1,0,1]=4 3365 B12R1.50 CCC(N)Cc1cccc(C)c1 Amb9428906 [1,1,0,0,0,0|1,0,1]=4 3366 B12R1.50 CCC(N)Cc1cccc(Cl)c1 Amb9428876 [1,1,0,0,0,0|1,0,1]=4 3367 B12R1.50 CCC(N)Cc1cccc(F)c1 Amb9428915 [1,1,0,0,0,0|1,0,1]=4 3368 B12R1.50 CCC(N)Cc1cccc(N)c1 Amb27467745 [1,1,0,0,0,0|1,0,1]=4 3369 B12R1.50 CC[C@@H](N)Cc1cccc(Cl)c1 Amb27950246 [1,1,0,0,0,0|1,0,1]=4 3370 B12R1.50 CC[C@H](N)Cc1cccc(C)c1 Amb27178383 [1,1,0,0,0,0|1,0,1]=4 3371 B12R1.50 CC[C@H](N)Cc1cccc(F)c1 Amb27770954 [1,1,0,0,0,0|1,0,1]=4 3372 B12R1.50 CN(C=O)Cc1cccc(Cl)c1 Amb27878332 [1,1,0,0,0,0|2,0,0]=4 3373 B12R1.50 CN(C=O)Cc1cccc(F)c1 Amb27616765 [1,1,0,0,0,0|2,0,0]=4 3374 B12R1.50 Cc1cc(CC(N)CO)ccn1 Amb33474488 [1,1,0,0,0,0|1,0,1]=4 3375 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [1,1,0,0,0,0|1,0,0]=3 3376 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [1,1,0,0,0,0|1,0,1]=4 3377 B12R1.50 Cc1cccc(CC(Cl)C=O)c1 Amb17204327 [1,1,0,0,0,0|1,0,0]=3 3378 B12R1.50 Cc1cccc(CC(F)C=O)c1 Amb28423095 [1,1,0,0,0,0|1,0,0]=3 3379 B12R1.50 Cc1cccc(CC(N)CO)c1 Amb17062686 [1,1,0,0,0,0|0,0,1]=3 3380 B12R1.50 Cc1cccc(CC(N)CO)c1 Amb28872399 [1,1,0,0,0,0|0,0,1]=3 3381 B12R1.50 Cc1cccc(CC(N)CO)n1 Amb25737795 [1,1,0,0,0,0|1,0,1]=4 3382 B12R1.50 Cc1cccc(CC(S)CO)c1 Amb27840605 [1,1,0,0,0,0|1,0,1]=4 3383 B12R1.50 Cc1cccc(C[C@@H](C)CO)c1 Amb33740504 [1,1,0,0,0,0|1,0,1]=4 3384 B12R1.50 Cc1cccc(C[C@@H](N)CO)c1 Amb24362986 [1,1,0,0,0,0|0,0,1]=3 3385 B12R1.50 Cc1cccc(C[C@H](C)CO)c1 Amb33737856 [1,1,0,0,0,0|1,0,1]=4 3386 B12R1.50 Cc1cccc(C[C@H](O)CO)c1 Amb27653167 [1,1,0,0,0,0|1,0,1]=4 3387 B12R1.50 Cc1cccc(C\C(N)=N\O)c1 Amb6244407 [1,1,0,0,0,0|1,0,1]=4 3388 B12R1.50 Cc1cccc(SC(C)C=O)c1 Amb30020857 [1,1,0,0,0,0|2,0,0]=4 3389 B12R1.50 Cc1ccnc(CC(N)CO)c1 Amb33226945 [1,1,0,0,0,0|1,0,1]=4 3390 B12R1.50 Cc1cncc(CC(N)CO)c1 Amb25374367 [1,1,0,0,0,0|1,0,1]=4 3391 B12R1.50 N#CC(N)Cc1cccc(O)c1 Amb28137831 [1,1,0,0,0,0|1,0,1]=4 3392 B12R1.50 NC(CF)Cc1cccc(Cl)c1 Amb27804222 [1,1,0,0,0,0|1,0,1]=4 3393 B12R1.50 NC(CF)Cc1cccc(O)c1 Amb27635618 [1,1,0,0,0,0|1,0,1]=4 3394 B12R1.50 NC(CO)Cc1cc(F)ccn1 Amb33414559 [1,1,0,0,0,0|1,0,1]=4 3395 B12R1.50 NC(CO)Cc1cccc(Br)c1 Amb17062712 [1,1,0,0,0,0|0,0,1]=3 3396 B12R1.50 NC(CO)Cc1cccc(Br)n1 Amb27635360 [1,1,0,0,0,0|1,0,1]=4 3397 B12R1.50 NC(CO)Cc1cccc(Cl)c1 Amb17062695 [1,1,0,0,0,0|0,0,1]=3 3398 B12R1.50 NC(CO)Cc1cccc(Cl)n1 Amb33222329 [1,1,0,0,0,0|1,0,1]=4 3399 B12R1.50 NC(CO)Cc1cccc(F)c1 Amb33543823 [1,1,0,0,0,0|0,0,1]=3 3400 B12R1.50 NC(CO)Cc1cccc(O)c1 Amb17062711 [1,1,0,0,0,0|0,0,1]=3 3401 B12R1.50 NC(CO)Cc1cncc(Br)c1 Amb25896814 [1,1,0,0,0,0|1,0,1]=4 3402 B12R1.50 NC(CO)Cc1cncc(F)c1 Amb25861660 [1,1,0,0,0,0|1,0,1]=4 3403 B12R1.50 N[C@@H](CO)Cc1cccc(F)c1 Amb27614706 [1,1,0,0,0,0|0,0,1]=3 3404 B12R1.50 N[C@@H](CO)Cc1cccc(O)c1 Amb27620894 [1,1,0,0,0,0|0,0,1]=3 3405 B12R1.50 N[C@H](CO)Cc1cccc(Br)c1 Amb26507618 [1,1,0,0,0,0|0,0,1]=3 3406 B12R1.50 N[C@H](CO)Cc1cccc(Cl)c1 Amb22233154 [1,1,0,0,0,0|0,0,1]=3 3407 B12R1.50 N[C@H](CO)Cc1cccc(Cl)c1 Amb33871627 [1,1,0,0,0,0|0,0,1]=3 3408 B12R1.50 N[C@H](CO)Cc1cccc(F)c1 Amb27490887 [1,1,0,0,0,0|0,0,1]=3 3409 B12R1.50 N[C@H](CO)Cc1cccc(O)c1 Amb22233156 [1,1,0,0,0,0|0,0,1]=3 3410 B12R1.50 N\C(Cc1cccc(Br)c1)=N/O Amb6246890 [1,1,0,0,0,0|1,0,1]=4 3411 B12R1.50 N\C(Cc1cccc(Cl)c1)=N/O Amb1117604 [1,1,0,0,0,0|1,0,1]=4 3412 B12R1.50 N\C(Cc1cccc(Cl)c1)=N/O Amb35826741 [1,1,0,0,0,0|1,0,1]=4 3413 B12R1.50 N\C(Cc1cccc(F)c1)=N/O Amb9713301 [1,1,0,0,0,0|1,0,1]=4 3414 B12R1.50 N\C(Cc1cccc(I)c1)=N\O Amb2696230 [1,1,0,0,0,0|1,0,1]=4 3415 B12R1.50 N\C(Cc1cccc(N)c1)=N\O Amb24711722 [1,1,0,0,0,0|1,0,1]=4 3416 B12R1.50 Nc1cc(CC(O)C=O)ccn1 Amb27170003 [1,1,0,0,0,0|2,0,0]=4 3417 B12R1.50 O=CC(=O)Cc1cccc(Cl)c1 Amb27488179 [1,1,0,0,0,0|1,0,1]=4 3418 B12R1.50 O=CC(Cl)Cc1cccc(Br)c1 Amb17204708 [1,1,0,0,0,0|1,0,0]=3 3419 B12R1.50 O=CC(Cl)Cc1cccc(Cl)c1 Amb17204402 [1,1,0,0,0,0|1,0,0]=3 3420 B12R1.50 O=CC(Cl)Cc1cccc(F)c1 Amb17204343 [1,1,0,0,0,0|1,0,0]=3 3421 B12R1.50 O=CC(Cl)Cc1cncc(Cl)c1 Amb35671333 [1,1,0,0,0,0|2,0,0]=4 3422 B12R1.50 O=CC(F)Cc1cccc(F)c1 Amb27595749 [1,1,0,0,0,0|1,0,0]=3 3423 B12R1.50 O=CC(O)Cc1cncc(Br)c1 Amb27196337 [1,1,0,0,0,0|2,0,0]=4 3424 B12R1.50 OCC(O)Cc1cccc(F)c1 Amb28138541 [1,1,0,0,0,0|1,0,1]=4 3425 B12R1.50 OC[C@H](O)Cc1cccc(F)c1 Amb27485894 [1,1,0,0,0,0|1,0,1]=4 3426 B12R1.118 CCC(CN)Cc1ccccc1 Amb5743867 [1,1,0,0,0,0|1,0,1]=4 3427 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [1,1,0,0,0,0|1,0,1]=4 3428 B12R1.118 CNC(C#N)Cc1ccccc1 Amb9205106 [1,1,0,0,0,0|1,0,1]=4 3429 B12R1.118 CNC(CN)Cc1ccccc1 Amb18800847 [1,1,0,0,0,0|1,0,1]=4 3430 B12R1.118 CNC(CO)Cc1ccccc1 Amb33536475 [1,1,0,0,0,0|0,0,1]=3 3431 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [1,1,0,0,0,0|0,0,1]=3 3432 B12R1.118 CN[C@H](CO)Cc1ccccc1 Amb33761130 [1,1,0,0,0,0|0,0,1]=3 3433 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [1,1,0,0,0,0|1,0,0]=3 3434 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [1,1,0,0,0,0|2,0,0]=4 3435 B12R1.118 COC(CO)Cc1ccccc1 Amb28963382 [1,1,0,0,0,0|1,0,1]=4 3436 B12R1.118 C\C=C(/C=O)Cc1ccccc1 Amb25743406 [1,1,0,0,0,0|1,0,1]=4 3437 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [1,1,0,0,0,0|0,0,2]=4 3438 B12R1.118 NCC(CO)Cc1ccccc1 Amb5744189 [1,1,0,0,0,0|0,0,1]=3 3439 B12R1.118 NCC(CO)Cc1ccccn1 Amb5744186 [1,1,0,0,0,0|1,0,1]=4 3440 B12R1.118 NCC(CO)Cc1cccnc1 Amb28872356 [1,1,0,0,0,0|1,0,1]=4 3441 B12R1.118 NCC(CO)Cc1cccnc1 Amb5744187 [1,1,0,0,0,0|1,0,1]=4 3442 B12R1.118 NCC(CO)Cc1ccncc1 Amb33379053 [1,1,0,0,0,0|1,0,1]=4 3443 B12R1.118 NCC(CO)Cc1ccncc1 Amb5744188 [1,1,0,0,0,0|1,0,1]=4 3444 B12R1.118 NC\C(=C\F)Cc1ccccc1 Amb26531075 [1,1,0,0,0,0|1,0,1]=4 3445 B12R1.118 O=CC(Cc1ccccc1)=S=O Amb27972982 [1,1,0,0,0,0|1,0,1]=4 3446 B12R1.118 O=C\C(=C/O)Cc1ccccc1 Amb27630435 [1,1,0,0,0,0|1,0,1]=4 3447 B12R1.118 O=C\C(=C\Cl)Cc1ccccc1 Amb27984848 [1,1,0,0,0,0|1,0,1]=4 3448 B12R1.118 OCC(CO)Cc1ccccc1 Amb4018930 [1,1,0,0,0,0|1,0,1]=4 3449 B12R1.194 C#C[C@](C)(N)Cc1ccccc1 Amb28319360 [1,1,0,0,0,0|1,0,1]=4 3450 B12R1.194 C=CC(C)(O)Cc1ccccc1 Amb27876057 [1,1,0,0,0,0|2,0,0]=4 3451 B12R1.194 CC(C)(C=O)Cc1ccccc1 Amb4358578 [1,1,0,0,0,0|1,0,0]=3 3452 B12R1.194 CC(C)(C=O)Cc1ccccn1 Amb27758131 [1,1,0,0,0,0|2,0,0]=4 3453 B12R1.194 CC(C)(C=O)Cc1cccnc1 Amb26481535 [1,1,0,0,0,0|2,0,0]=4 3454 B12R1.194 CC(C)(C=O)Cc1ccncc1 Amb27949144 [1,1,0,0,0,0|2,0,0]=4 3455 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [1,1,0,0,0,0|2,0,0]=4 3456 B12R1.194 CC(C)(C=O)Sc1ccccc1 Amb2412521 [1,1,0,0,0,0|2,0,0]=4 3457 B12R1.194 CC(C)(CO)Cc1ccccc1 Amb4021846 [1,1,0,0,0,0|1,0,1]=4 3458 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [1,1,0,0,0,0|2,0,0]=4 3459 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [1,1,0,0,0,0|2,0,0]=4 3460 B12R1.194 CC(N)(C#N)Cc1ccccc1 Amb17232330 [1,1,0,0,0,0|1,0,1]=4 3461 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [1,1,0,0,0,0|0,0,1]=3 3462 B12R1.194 CC(N)(CO)Cc1ccccn1 Amb33360492 [1,1,0,0,0,0|1,0,1]=4 3463 B12R1.194 CC(N)(CO)Cc1cccnc1 Amb33360053 [1,1,0,0,0,0|1,0,1]=4 3464 B12R1.194 CC(N)(CO)Cc1ccncc1 Amb33380644 [1,1,0,0,0,0|1,0,1]=4 3465 B12R1.194 CC(O)(C=O)Cc1ccccc1 Amb27399998 [1,1,0,0,0,0|1,0,0]=3 3466 B12R1.194 CC(O)(C=O)Cc1ccccn1 Amb27261274 [1,1,0,0,0,0|2,0,0]=4 3467 B12R1.194 CC(O)(C=O)Cc1ccncc1 Amb27870890 [1,1,0,0,0,0|2,0,0]=4 3468 B12R1.194 CC(O)(CO)Cc1ccccc1 Amb28138963 [1,1,0,0,0,0|1,0,1]=4 3469 B12R1.194 C[C@@](N)(CO)Cc1ccccc1 Amb26371721 [1,1,0,0,0,0|0,0,1]=3 3470 B12R1.194 C[C@@](O)(C=O)Cc1ccccc1 Amb27748618 [1,1,0,0,0,0|1,0,0]=3 3471 B12R1.194 C[C@](N)(CO)Cc1ccccc1 Amb28396546 [1,1,0,0,0,0|0,0,1]=3 3472 B12R1.194 O=CC(Cl)(Cl)Cc1ccccc1 Amb28129587 [1,1,0,0,0,0|1,0,0]=3 3473 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [1,1,0,0,0,0|1,0,1]=4 3474 B12R1.194 OC[C@](F)(Cl)Cc1ccccc1 Amb27652930 [1,1,0,0,0,0|1,0,1]=4 3475 B12R1.371 C#CC(N)Cc1ccccc1Cl Amb28245089 [1,1,0,0,0,0|1,0,1]=4 3476 B12R1.371 C=CC(N)Cc1ccccc1Br Amb27389711 [1,1,0,0,0,0|1,0,0]=3 3477 B12R1.371 C=CC(N)Cc1ccccc1C Amb27162019 [1,1,0,0,0,0|1,0,0]=3 3478 B12R1.371 C=CC(N)Cc1ccccc1Cl Amb28367910 [1,1,0,0,0,0|1,0,0]=3 3479 B12R1.371 C=CC(O)Cc1ccccc1C Amb28401244 [1,1,0,0,0,0|2,0,0]=4 3480 B12R1.371 C=CC(O)Cc1ccccc1Cl Amb27211337 [1,1,0,0,0,0|2,0,0]=4 3481 B12R1.371 C=CC(O)Cc1ccccc1F Amb27431183 [1,1,0,0,0,0|2,0,0]=4 3482 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [1,1,0,0,0,0|1,0,0]=3 3483 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [1,1,0,0,0,0|1,0,0]=3 3484 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [1,1,0,0,0,0|1,0,0]=3 3485 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [1,1,0,0,0,0|1,0,0]=3 3486 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [1,1,0,0,0,0|1,0,0]=3 3487 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [1,1,0,0,0,0|1,0,0]=3 3488 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [1,1,0,0,0,0|2,0,0]=4 3489 B12R1.371 CC(C=O)Oc1ccccc1F Amb35737124 [1,1,0,0,0,0|2,0,0]=4 3490 B12R1.371 CC(C=O)Oc1ccccc1I Amb30020615 [1,1,0,0,0,0|2,0,0]=4 3491 B12R1.371 CC(C=O)Sc1ccccc1Br Amb30020876 [1,1,0,0,0,0|2,0,0]=4 3492 B12R1.371 CC(C=O)Sc1ccccc1Cl Amb30020873 [1,1,0,0,0,0|2,0,0]=4 3493 B12R1.371 CC(C=O)Sc1ccccc1F Amb30020863 [1,1,0,0,0,0|2,0,0]=4 3494 B12R1.371 CC(CO)Cc1ccccc1F Amb26508993 [1,1,0,0,0,0|1,0,1]=4 3495 B12R1.371 CC(CO)Cc1ccccc1O Amb28061434 [1,1,0,0,0,0|1,0,1]=4 3496 B12R1.371 CC(Cc1ccccc1O)NO Amb28074598 [1,1,0,0,0,0|2,0,0]=4 3497 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [1,1,0,0,0,0|1,0,1]=4 3498 B12R1.371 CCC(N)Cc1ccccc1Br Amb9428862 [1,1,0,0,0,0|1,0,1]=4 3499 B12R1.371 CCC(N)Cc1ccccc1C Amb9428910 [1,1,0,0,0,0|1,0,1]=4 3500 B12R1.371 CCC(N)Cc1ccccc1Cl Amb9428938 [1,1,0,0,0,0|1,0,1]=4 3501 B12R1.371 CCC(N)Cc1ccccc1F Amb9428867 [1,1,0,0,0,0|1,0,1]=4 3502 B12R1.371 CC[C@@H](N)Cc1ccccc1Br Amb27459365 [1,1,0,0,0,0|1,0,1]=4 3503 B12R1.371 CC[C@@H](N)Cc1ccccc1Cl Amb27668323 [1,1,0,0,0,0|1,0,1]=4 3504 B12R1.371 CN(C=O)Cc1ccccc1Br Amb27228720 [1,1,0,0,0,0|2,0,0]=4 3505 B12R1.371 C[C@@H](CO)Cc1ccccc1Cl Amb28207131 [1,1,0,0,0,0|1,0,1]=4 3506 B12R1.371 C[C@@H](CO)Cc1ccccc1F Amb26956773 [1,1,0,0,0,0|1,0,1]=4 3507 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [1,1,0,0,0,0|1,0,1]=4 3508 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [1,1,0,0,0,0|1,0,0]=3 3509 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [1,1,0,0,0,0|1,0,1]=4 3510 B12R1.371 Cc1ccccc1CC(Cl)C=O Amb17204326 [1,1,0,0,0,0|1,0,0]=3 3511 B12R1.371 Cc1ccccc1CC(F)C=O Amb27251880 [1,1,0,0,0,0|1,0,0]=3 3512 B12R1.371 Cc1ccccc1CC(N)CO Amb17062685 [1,1,0,0,0,0|0,0,1]=3 3513 B12R1.371 Cc1ccccc1CC(N)CO Amb33329338 [1,1,0,0,0,0|0,0,1]=3 3514 B12R1.371 Cc1ccccc1C[C@@H](C)CO Amb33746673 [1,1,0,0,0,0|1,0,1]=4 3515 B12R1.371 Cc1ccccc1C[C@H](C)CO Amb33738161 [1,1,0,0,0,0|1,0,1]=4 3516 B12R1.371 Cc1ccccc1C[C@H](N)CO Amb26844931 [1,1,0,0,0,0|0,0,1]=3 3517 B12R1.371 Cc1ccccc1C\C(N)=N/O Amb2696221 [1,1,0,0,0,0|1,0,1]=4 3518 B12R1.371 Cc1ccccc1C\C(N)=N\O Amb1118586 [1,1,0,0,0,0|1,0,1]=4 3519 B12R1.371 Cc1ccccc1OC(C)C=O Amb27841630 [1,1,0,0,0,0|2,0,0]=4 3520 B12R1.371 Cc1ccccc1SC(C)C=O Amb30020858 [1,1,0,0,0,0|2,0,0]=4 3521 B12R1.371 Cc1cccnc1CC(N)CO Amb25751493 [1,1,0,0,0,0|1,0,1]=4 3522 B12R1.371 Cc1ccncc1CC(N)CO Amb33377024 [1,1,0,0,0,0|1,0,1]=4 3523 B12R1.371 Cc1cnccc1CC(N)CO Amb24549921 [1,1,0,0,0,0|1,0,1]=4 3524 B12R1.371 Cc1ncccc1CC(Cl)C=O Amb27646121 [1,1,0,0,0,0|2,0,0]=4 3525 B12R1.371 Cc1ncccc1CC(N)CO Amb26616316 [1,1,0,0,0,0|1,0,1]=4 3526 B12R1.371 N#CC(N)Cc1ccccc1Br Amb27635957 [1,1,0,0,0,0|1,0,1]=4 3527 B12R1.371 N#CC(N)Cc1ccccc1Cl Amb23557157 [1,1,0,0,0,0|1,0,1]=4 3528 B12R1.371 N#CC(N)Cc1ccccc1F Amb28243982 [1,1,0,0,0,0|1,0,1]=4 3529 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [1,1,0,0,0,0|0,0,1]=3 3530 B12R1.371 NC(CO)Cc1ccccc1Cl Amb17062694 [1,1,0,0,0,0|0,0,1]=3 3531 B12R1.371 NC(CO)Cc1ccccc1F Amb17062688 [1,1,0,0,0,0|0,0,1]=3 3532 B12R1.371 NC(CO)Cc1ccccc1O Amb18827210 [1,1,0,0,0,0|0,0,1]=3 3533 B12R1.371 NC(CO)Cc1cccnc1Br Amb27790025 [1,1,0,0,0,0|1,0,1]=4 3534 B12R1.371 NC(CO)Cc1cccnc1Cl Amb25241685 [1,1,0,0,0,0|1,0,1]=4 3535 B12R1.371 NC(CO)Cc1cccnc1F Amb33377936 [1,1,0,0,0,0|1,0,1]=4 3536 B12R1.371 NC(CO)Cc1ccncc1Br Amb24542635 [1,1,0,0,0,0|1,0,1]=4 3537 B12R1.371 NC(CO)Cc1ccncc1Cl Amb25669679 [1,1,0,0,0,0|1,0,1]=4 3538 B12R1.371 NC(CO)Cc1ccncc1F Amb25261338 [1,1,0,0,0,0|1,0,1]=4 3539 B12R1.371 NC(CO)Cc1ncccc1Br Amb24581707 [1,1,0,0,0,0|1,0,1]=4 3540 B12R1.371 NC(CO)Cc1ncccc1F Amb33420859 [1,1,0,0,0,0|1,0,1]=4 3541 B12R1.371 NCC(N)Cc1ccccc1F Amb27955290 [1,1,0,0,0,0|1,0,1]=4 3542 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [1,1,0,0,0,0|0,0,1]=3 3543 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [1,1,0,0,0,0|0,0,1]=3 3544 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [1,1,0,0,0,0|0,0,1]=3 3545 B12R1.371 N\C(Cc1ccccc1Br)=N/O Amb6243809 [1,1,0,0,0,0|1,0,1]=4 3546 B12R1.371 N\C(Cc1ccccc1Cl)=N/O Amb33547742 [1,1,0,0,0,0|1,0,1]=4 3547 B12R1.371 N\C(Cc1ccccc1Cl)=N/O Amb9711383 [1,1,0,0,0,0|1,0,1]=4 3548 B12R1.371 N\C(Cc1ccccc1F)=N/O Amb6249029 [1,1,0,0,0,0|1,0,1]=4 3549 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [1,1,0,0,0,0|0,0,1]=3 3550 B12R1.371 Nc1ccncc1CC(N)CO Amb27467939 [1,1,0,0,0,0|1,0,1]=4 3551 B12R1.371 O=CC(Cl)Cc1ccccc1Br Amb17204707 [1,1,0,0,0,0|1,0,0]=3 3552 B12R1.371 O=CC(Cl)Cc1ccccc1Cl Amb17204401 [1,1,0,0,0,0|1,0,0]=3 3553 B12R1.371 O=CC(Cl)Cc1ccccc1F Amb17204341 [1,1,0,0,0,0|1,0,0]=3 3554 B12R1.21 CC(=O)CCc1ccc(Br)cc1 Amb5740059 [1,1,0,0,0,0|1,0,0]=3 3555 B12R1.21 CC(=O)CCc1ccc(Br)cn1 Amb25729593 [1,1,0,0,0,0|2,0,0]=4 3556 B12R1.21 CC(=O)CCc1ccc(Br)nc1 Amb33388890 [1,1,0,0,0,0|2,0,0]=4 3557 B12R1.21 CC(=O)CCc1ccc(C)cc1 Amb5740050 [1,1,0,0,0,0|1,0,0]=3 3558 B12R1.21 CC(=O)CCc1ccc(C)cn1 Amb26963678 [1,1,0,0,0,0|2,0,0]=4 3559 B12R1.21 CC(=O)CCc1ccc(C)nc1 Amb25197877 [1,1,0,0,0,0|2,0,0]=4 3560 B12R1.21 CC(=O)CCc1ccc(Cl)cc1 Amb5740058 [1,1,0,0,0,0|1,0,0]=3 3561 B12R1.21 CC(=O)CCc1ccc(Cl)cn1 Amb33261956 [1,1,0,0,0,0|2,0,0]=4 3562 B12R1.21 CC(=O)CCc1ccc(Cl)nc1 Amb25725533 [1,1,0,0,0,0|2,0,0]=4 3563 B12R1.21 CC(=O)CCc1ccc(F)cc1 Amb5740057 [1,1,0,0,0,0|1,0,0]=3 3564 B12R1.21 CC(=O)CCc1ccc(F)cn1 Amb33172676 [1,1,0,0,0,0|2,0,0]=4 3565 B12R1.21 CC(=O)CCc1ccc(F)nc1 Amb27471964 [1,1,0,0,0,0|2,0,0]=4 3566 B12R1.21 CC(=O)CCc1ccc(I)cc1 Amb26325783 [1,1,0,0,0,0|1,0,0]=3 3567 B12R1.21 CC(=O)CCc1ccc(N)cc1 Amb27637738 [1,1,0,0,0,0|1,0,0]=3 3568 B12R1.21 CC(=O)CCc1ccc(O)cc1 Amb533055 [1,1,0,0,0,0|1,0,0]=3 3569 B12R1.21 CC(=O)COc1ccc(Cl)cc1 Amb1094739 [1,1,0,0,0,0|2,0,0]=4 3570 B12R1.21 CC(=O)COc1ccc(F)cc1 Amb9269853 [1,1,0,0,0,0|2,0,0]=4 3571 B12R1.21 CC(=O)COc1ccc(I)cc1 Amb26363908 [1,1,0,0,0,0|2,0,0]=4 3572 B12R1.21 CC(=O)COc1ccc(N)cc1 Amb17110083 [1,1,0,0,0,0|2,0,0]=4 3573 B12R1.21 CC(=O)CSc1ccc(Br)cc1 Amb2608948 [1,1,0,0,0,0|2,0,0]=4 3574 B12R1.21 CC(=O)CSc1ccc(C)cc1 Amb2725052 [1,1,0,0,0,0|2,0,0]=4 3575 B12R1.21 CC(=O)CSc1ccc(Cl)cc1 Amb2686419 [1,1,0,0,0,0|2,0,0]=4 3576 B12R1.21 CC(=O)CSc1ccc(F)cc1 Amb3429089 [1,1,0,0,0,0|2,0,0]=4 3577 B12R1.21 CC(=O)CSc1ccc(N)cc1 Amb28255271 [1,1,0,0,0,0|2,0,0]=4 3578 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [1,1,0,0,0,0|2,0,0]=4 3579 B12R1.21 CC(=O)NCc1ccc(C)cc1 Amb3358096 [1,1,0,0,0,0|2,0,0]=4 3580 B12R1.21 CC(=O)NCc1ccc(Cl)cc1 Amb3094821 [1,1,0,0,0,0|2,0,0]=4 3581 B12R1.21 CC(=O)NCc1ccc(F)cc1 Amb8020832 [1,1,0,0,0,0|2,0,0]=4 3582 B12R1.21 CC(=O)NCc1ccc(N)cc1 Amb4017045 [1,1,0,0,0,0|2,0,0]=4 3583 B12R1.21 CC(=O)NCc1ccc(O)cc1 Amb10549495 [1,1,0,0,0,0|2,0,0]=4 3584 B12R1.21 CC(=O)OCc1ccc(Cl)cc1 Amb2421366 [1,1,0,0,0,0|2,0,0]=4 3585 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [1,1,0,0,0,0|2,0,0]=4 3586 B12R1.21 CC(=O)SCc1ccc(O)cc1 Amb27256344 [1,1,0,0,0,0|2,0,0]=4 3587 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [1,1,0,0,0,0|1,0,1]=4 3588 B12R1.21 CC(O)CCc1ccc(Cl)cc1 Amb17507284 [1,1,0,0,0,0|1,0,1]=4 3589 B12R1.21 CC(O)CCc1ccc(F)cc1 Amb17507285 [1,1,0,0,0,0|1,0,1]=4 3590 B12R1.21 CC(O)CCc1ccc(I)cc1 Amb27669702 [1,1,0,0,0,0|1,0,1]=4 3591 B12R1.21 CC(O)CCc1ccc(N)cc1 Amb32671893 [1,1,0,0,0,0|1,0,1]=4 3592 B12R1.21 CC(O)CCc1ccc(O)cc1 Amb1110722 [1,1,0,0,0,0|1,0,1]=4 3593 B12R1.21 CN1C=CC(=NCC(=O)O)C=C1 Amb28434721 [1,1,0,0,0,0|2,0,0]=4 3594 B12R1.21 C[C@@H](O)CCc1ccc(Br)cc1 Amb33118743 [1,1,0,0,0,0|1,0,1]=4 3595 B12R1.21 C[C@@H](O)CCc1ccc(Cl)cc1 Amb26323258 [1,1,0,0,0,0|1,0,1]=4 3596 B12R1.21 C[C@@H](O)CCc1ccc(F)cc1 Amb33376264 [1,1,0,0,0,0|1,0,1]=4 3597 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [1,1,0,0,0,0|1,0,1]=4 3598 B12R1.21 C[C@H](O)CCc1ccc(Br)cc1 Amb33451473 [1,1,0,0,0,0|1,0,1]=4 3599 B12R1.21 C[C@H](O)CCc1ccc(Cl)cc1 Amb33052818 [1,1,0,0,0,0|1,0,1]=4 3600 B12R1.21 C[C@H](O)CCc1ccc(F)cc1 Amb33376265 [1,1,0,0,0,0|1,0,1]=4 3601 B12R1.21 C[C@H](O)CCc1ccc(O)cc1 Amb27433151 [1,1,0,0,0,0|1,0,1]=4 3602 B12R1.21 Cc1cc[n+](CCC(=O)O)cc1 Amb17098177 [1,1,0,0,0,0|1,0,0]=3 3603 B12R1.21 Cc1cc[n+](CCC(=O)O)cc1 Amb31127612 [1,1,0,0,0,0|1,0,0]=3 3604 B12R1.21 Cc1ccc(C#CC(=O)O)cc1 Amb17138496 [1,1,0,0,0,0|0,0,2]=4 3605 B12R1.21 Cc1ccc(CCB(O)O)cc1 Amb26580701 [1,1,0,0,0,0|1,0,1]=4 3606 B12R1.21 Cc1ccc(CCC(=N)N)cc1 Amb18065466 [1,1,0,0,0,0|2,0,0]=4 3607 B12R1.21 Cc1ccc(CCC(=O)Cl)cc1 Amb17142993 [1,1,0,0,0,0|1,0,0]=3 3608 B12R1.21 Cc1ccc(CCC(=O)O)cc1 Amb1225383 [1,1,0,0,0,0|0,0,0]=2 3609 B12R1.21 Cc1ccc(CCC(=O)O)cn1 Amb18828437 [1,1,0,0,0,0|1,0,0]=3 3610 B12R1.21 Cc1ccc(CCC(=O)O)nc1 Amb22886574 [1,1,0,0,0,0|1,0,0]=3 3611 B12R1.21 Cc1ccc(CCC(=O)O)nn1 Amb8011559 [1,1,0,0,0,0|2,0,0]=4 3612 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [1,1,0,0,0,0|1,0,1]=4 3613 B12R1.21 Cc1ccc(CCC(N)=O)cc1 Amb8998651 [1,1,0,0,0,0|1,0,0]=3 3614 B12R1.21 Cc1ccc(CCS(=O)[O-])cc1 Amb32755031 [1,1,0,0,0,0|1,0,1]=4 3615 B12R1.21 Cc1ccc(CCS(C)=O)cc1 Amb16185126 [1,1,0,0,0,0|2,0,0]=4 3616 B12R1.21 Cc1ccc(CC[C@@H](C)O)cc1 Amb27472608 [1,1,0,0,0,0|1,0,1]=4 3617 B12R1.21 Cc1ccc(CC[C@H](C)O)cc1 Amb33373954 [1,1,0,0,0,0|1,0,1]=4 3618 B12R1.21 Cc1ccc(CC[N+](=O)[O-])cc1 Amb17400178 [1,1,0,0,0,0|1,0,1]=4 3619 B12R1.21 Cc1ccc(CNC(=O)Cl)cc1 Amb35637117 [1,1,0,0,0,0|2,0,0]=4 3620 B12R1.21 Cc1ccc(CNC(N)=O)cc1 Amb1134976 [1,1,0,0,0,0|2,0,0]=4 3621 B12R1.21 Cc1ccc(COC(=O)Cl)cc1 Amb27816885 [1,1,0,0,0,0|2,0,0]=4 3622 B12R1.21 Cc1ccc(NCC(=O)Cl)cc1 Amb27425242 [1,1,0,0,0,0|2,0,0]=4 3623 B12R1.21 Cc1ccc(NCC(=O)O)cc1 Amb1106469 [1,1,0,0,0,0|1,0,0]=3 3624 B12R1.21 Cc1ccc(NCC(N)=O)cc1 Amb845278 [1,1,0,0,0,0|2,0,0]=4 3625 B12R1.21 Cc1ccc(OCC(=O)Cl)cc1 Amb10880011 [1,1,0,0,0,0|2,0,0]=4 3626 B12R1.21 Cc1ccc(OCC(=O)O)cc1 Amb6336447 [1,1,0,0,0,0|1,0,0]=3 3627 B12R1.21 Cc1ccc(OCC(=O)O)cn1 Amb18991754 [1,1,0,0,0,0|2,0,0]=4 3628 B12R1.21 Cc1ccc(OCC(=O)O)nc1 Amb24359369 [1,1,0,0,0,0|2,0,0]=4 3629 B12R1.21 Cc1ccc(OCC(N)=O)cc1 Amb6346004 [1,1,0,0,0,0|2,0,0]=4 3630 B12R1.21 Cc1ccc(SCC(=O)O)cc1 Amb1197696 [1,1,0,0,0,0|1,0,0]=3 3631 B12R1.21 Cc1ccc(SCC(=O)O)nc1 Amb6260300 [1,1,0,0,0,0|2,0,0]=4 3632 B12R1.21 Cc1ccc(SCC(N)=O)cc1 Amb3836116 [1,1,0,0,0,0|2,0,0]=4 3633 B12R1.21 Cc1ccc(\C=C/C(=O)O)cc1 Amb27474899 [1,1,0,0,0,0|0,0,2]=4 3634 B12R1.21 Cc1ccc(\C=C\C(=O)O)cc1 Amb8513247 [1,1,0,0,0,0|0,0,2]=4 3635 B12R1.21 Cc1cnc(CCC(=O)O)cn1 Amb18827880 [1,1,0,0,0,0|2,0,0]=4 3636 B12R1.21 Cc1cnc(CCC(=O)O)nc1 Amb26026209 [1,1,0,0,0,0|2,0,0]=4 3637 B12R1.21 N=C(N)CCc1ccc(Br)cc1 Amb18571448 [1,1,0,0,0,0|2,0,0]=4 3638 B12R1.21 N=C(N)CCc1ccc(Cl)cc1 Amb18564231 [1,1,0,0,0,0|2,0,0]=4 3639 B12R1.21 N=C(N)CCc1ccc(Cl)cc1 Amb33465354 [1,1,0,0,0,0|2,0,0]=4 3640 B12R1.21 N=C(N)CCc1ccc(F)cc1 Amb18563719 [1,1,0,0,0,0|2,0,0]=4 3641 B12R1.21 N=C(N)CCc1ccc(O)cc1 Amb13883011 [1,1,0,0,0,0|2,0,0]=4 3642 B12R1.21 N=C(N)CCc1ccc(O)cc1 Amb2696225 [1,1,0,0,0,0|2,0,0]=4 3643 B12R1.21 NC(=O)CCN1C=CC(=O)C=C1 Amb18788434 [1,1,0,0,0,0|2,0,0]=4 3644 B12R1.21 NC(=O)CCc1ccc(Br)cc1 Amb17407065 [1,1,0,0,0,0|1,0,0]=3 3645 B12R1.21 NC(=O)CCc1ccc(Cl)cc1 Amb17142998 [1,1,0,0,0,0|1,0,0]=3 3646 B12R1.21 NC(=O)CCc1ccc(F)cc1 Amb33545740 [1,1,0,0,0,0|1,0,0]=3 3647 B12R1.21 NC(=O)CCc1ccc(N)cc1 Amb8941624 [1,1,0,0,0,0|1,0,0]=3 3648 B12R1.21 NC(=O)CCc1ccc(O)cc1 Amb3939533 [1,1,0,0,0,0|1,0,0]=3 3649 B12R1.21 NC(=O)CNc1ccc(Br)cc1 Amb6712185 [1,1,0,0,0,0|2,0,0]=4 3650 B12R1.21 NC(=O)CNc1ccc(Cl)cc1 Amb6711941 [1,1,0,0,0,0|2,0,0]=4 3651 B12R1.21 NC(=O)CNc1ccc(F)cc1 Amb6712287 [1,1,0,0,0,0|2,0,0]=4 3652 B12R1.21 NC(=O)CNc1ccc(I)cc1 Amb7758090 [1,1,0,0,0,0|2,0,0]=4 3653 B12R1.21 NC(=O)CNc1ccc(O)cc1 Amb27814221 [1,1,0,0,0,0|2,0,0]=4 3654 B12R1.21 NC(=O)COc1ccc(Br)cc1 Amb6275646 [1,1,0,0,0,0|2,0,0]=4 3655 B12R1.21 NC(=O)COc1ccc(Cl)cc1 Amb2772617 [1,1,0,0,0,0|2,0,0]=4 3656 B12R1.21 NC(=O)COc1ccc(F)cc1 Amb2456996 [1,1,0,0,0,0|2,0,0]=4 3657 B12R1.21 NC(=O)COc1ccc(I)cc1 Amb173371 [1,1,0,0,0,0|2,0,0]=4 3658 B12R1.21 NC(=O)COc1ccc(N)cc1 Amb33536515 [1,1,0,0,0,0|2,0,0]=4 3659 B12R1.21 NC(=O)COc1ccc(O)cc1 Amb8837230 [1,1,0,0,0,0|2,0,0]=4 3660 B12R1.21 NC(=O)CSc1ccc(Br)cc1 Amb1218433 [1,1,0,0,0,0|2,0,0]=4 3661 B12R1.21 NC(=O)CSc1ccc(Cl)cc1 Amb1530887 [1,1,0,0,0,0|2,0,0]=4 3662 B12R1.21 NC(=O)CSc1ccc(F)cc1 Amb1646201 [1,1,0,0,0,0|2,0,0]=4 3663 B12R1.21 NC(=O)CSc1ccc(N)cc1 Amb8930380 [1,1,0,0,0,0|2,0,0]=4 3664 B12R1.21 NC(=O)NCc1ccc(Br)cc1 Amb1139295 [1,1,0,0,0,0|2,0,0]=4 3665 B12R1.21 NC(=O)NCc1ccc(Cl)cc1 Amb2435054 [1,1,0,0,0,0|2,0,0]=4 3666 B12R1.21 NC(=O)NCc1ccc(F)cc1 Amb1128118 [1,1,0,0,0,0|2,0,0]=4 3667 B12R1.21 NC(=O)NCc1ccc(N)cc1 Amb8631169 [1,1,0,0,0,0|2,0,0]=4 3668 B12R1.21 NC(=O)OCc1ccc(O)cc1 Amb28243920 [1,1,0,0,0,0|2,0,0]=4 3669 B12R1.21 NC(=O)SCc1ccc(Cl)cc1 Amb27636965 [1,1,0,0,0,0|2,0,0]=4 3670 B12R1.21 NC(=S)CCc1ccc(Br)cc1 Amb17256980 [1,1,0,0,0,0|1,1,0]=4 3671 B12R1.21 NC(=S)CCc1ccc(F)cc1 Amb17234011 [1,1,0,0,0,0|1,1,0]=4 3672 B12R1.21 Nc1ccc(C#CC(=O)O)cc1 Amb25111179 [1,1,0,0,0,0|0,0,2]=4 3673 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb30588024 [1,1,0,0,0,0|0,0,0]=2 3674 B12R1.21 Nc1ccc(CCC(=O)O)cc1 Amb6315800 [1,1,0,0,0,0|0,0,0]=2 3675 B12R1.21 Nc1ccc(CCC(=O)O)cn1 Amb19958679 [1,1,0,0,0,0|1,0,0]=3 3676 B12R1.21 Nc1ccc(CCC(=O)O)cn1 Amb22546430 [1,1,0,0,0,0|1,0,0]=3 3677 B12R1.21 Nc1ccc(CCC(=O)O)nc1 Amb24663664 [1,1,0,0,0,0|1,0,0]=3 3678 B12R1.21 Nc1ccc(CC[N+](=O)[O-])cc1 Amb24406773 [1,1,0,0,0,0|1,0,1]=4 3679 B12R1.21 Nc1ccc(NCC(=O)O)cc1 Amb18296058 [1,1,0,0,0,0|1,0,0]=3 3680 B12R1.21 Nc1ccc(NCC(=O)O)cn1 Amb18987715 [1,1,0,0,0,0|2,0,0]=4 3681 B12R1.21 Nc1ccc(NCC(=O)O)nc1 Amb17041212 [1,1,0,0,0,0|2,0,0]=4 3682 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb1034889 [1,1,0,0,0,0|1,0,0]=3 3683 B12R1.21 Nc1ccc(OCC(=O)O)cc1 Amb2608856 [1,1,0,0,0,0|1,0,0]=3 3684 B12R1.21 Nc1ccc(SCC(=O)O)cc1 Amb2684510 [1,1,0,0,0,0|1,0,0]=3 3685 B12R1.21 Nc1ccc(\C=C\C(=O)O)cc1 Amb30584953 [1,1,0,0,0,0|0,0,2]=4 3686 B12R1.21 O=C(Cl)CCc1ccc(Br)cc1 Amb28240937 [1,1,0,0,0,0|1,0,0]=3 3687 B12R1.21 O=C(Cl)CCc1ccc(Cl)cc1 Amb17143273 [1,1,0,0,0,0|1,0,0]=3 3688 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [1,1,0,0,0,0|1,0,0]=3 3689 B12R1.21 O=C(Cl)CCc1ccc(I)cc1 Amb27973226 [1,1,0,0,0,0|1,0,0]=3 3690 B12R1.21 O=C(Cl)COc1ccc(Br)cc1 Amb16186415 [1,1,0,0,0,0|2,0,0]=4 3691 B12R1.21 O=C(Cl)COc1ccc(Cl)cc1 Amb2716229 [1,1,0,0,0,0|2,0,0]=4 3692 B12R1.21 O=C(Cl)COc1ccc(F)cc1 Amb844299 [1,1,0,0,0,0|2,0,0]=4 3693 B12R1.21 O=C(Cl)COc1ccc(I)cc1 Amb28131033 [1,1,0,0,0,0|2,0,0]=4 3694 B12R1.21 O=C(Cl)CSc1ccc(Br)cc1 Amb27770810 [1,1,0,0,0,0|2,0,0]=4 3695 B12R1.21 O=C(Cl)CSc1ccc(Cl)cc1 Amb17143821 [1,1,0,0,0,0|2,0,0]=4 3696 B12R1.21 O=C(Cl)CSc1ccc(F)cc1 Amb9174973 [1,1,0,0,0,0|2,0,0]=4 3697 B12R1.21 O=C(Cl)NCc1ccc(Br)cc1 Amb35625815 [1,1,0,0,0,0|2,0,0]=4 3698 B12R1.21 O=C(Cl)NCc1ccc(F)cc1 Amb27178203 [1,1,0,0,0,0|2,0,0]=4 3699 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [1,1,0,0,0,0|2,0,0]=4 3700 B12R1.21 O=C(Cl)OCc1ccc(Cl)cc1 Amb33531980 [1,1,0,0,0,0|2,0,0]=4 3701 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [1,1,0,0,0,0|2,0,0]=4 3702 B12R1.21 O=C(F)NCc1ccc(Cl)cc1 Amb27876366 [1,1,0,0,0,0|2,0,0]=4 3703 B12R1.21 O=C(O)C#Cc1ccc(Br)cc1 Amb2610347 [1,1,0,0,0,0|0,0,2]=4 3704 B12R1.21 O=C(O)C#Cc1ccc(Cl)cc1 Amb10575987 [1,1,0,0,0,0|0,0,2]=4 3705 B12R1.21 O=C(O)C#Cc1ccc(F)cc1 Amb17138570 [1,1,0,0,0,0|0,0,2]=4 3706 B12R1.21 O=C(O)C#Cc1ccc(O)cc1 Amb23569631 [1,1,0,0,0,0|0,0,2]=4 3707 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 Amb25980784 [1,1,0,0,0,0|1,0,0]=3 3708 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 Amb28600252 [1,1,0,0,0,0|1,0,0]=3 3709 B12R1.21 O=C(O)CCC1=CNC(=O)C=C1 Amb32757591 [1,1,0,0,0,0|1,0,0]=3 3710 B12R1.21 O=C(O)CCC1=NNC(=O)C=C1 Amb18212062 [1,1,0,0,0,0|2,0,0]=4 3711 B12R1.21 O=C(O)CC[n+]1ccc(F)cc1 Amb27259679 [1,1,0,0,0,0|1,0,0]=3 3712 B12R1.21 O=C(O)CCc1ccc(Br)cc1 Amb1220330 [1,1,0,0,0,0|0,0,0]=2 3713 B12R1.21 O=C(O)CCc1ccc(Br)cn1 Amb28323137 [1,1,0,0,0,0|1,0,0]=3 3714 B12R1.21 O=C(O)CCc1ccc(Br)nc1 Amb22292277 [1,1,0,0,0,0|1,0,0]=3 3715 B12R1.21 O=C(O)CCc1ccc(Cl)cc1 Amb1093991 [1,1,0,0,0,0|0,0,0]=2 3716 B12R1.21 O=C(O)CCc1ccc(Cl)cn1 Amb26633045 [1,1,0,0,0,0|1,0,0]=3 3717 B12R1.21 O=C(O)CCc1ccc(Cl)nc1 Amb18649204 [1,1,0,0,0,0|1,0,0]=3 3718 B12R1.21 O=C(O)CCc1ccc(Cl)nc1 Amb28555773 [1,1,0,0,0,0|1,0,0]=3 3719 B12R1.21 O=C(O)CCc1ccc(F)cc1 Amb1214879 [1,1,0,0,0,0|0,0,0]=2 3720 B12R1.21 O=C(O)CCc1ccc(F)cn1 Amb26927594 [1,1,0,0,0,0|1,0,0]=3 3721 B12R1.21 O=C(O)CCc1ccc(F)cn1 Amb33620714 [1,1,0,0,0,0|1,0,0]=3 3722 B12R1.21 O=C(O)CCc1ccc(F)nc1 Amb22886575 [1,1,0,0,0,0|1,0,0]=3 3723 B12R1.21 O=C(O)CCc1ccc(I)cc1 Amb6297807 [1,1,0,0,0,0|0,0,0]=2 3724 B12R1.21 O=C(O)CCc1ccc(O)cc1 Amb533172 [1,1,0,0,0,0|0,0,0]=2 3725 B12R1.21 O=C(O)CCc1ccc(O)nn1 Amb21937853 [1,1,0,0,0,0|2,0,0]=4 3726 B12R1.21 O=C(O)CCc1ccc(S)cc1 Amb6296145 [1,1,0,0,0,0|0,0,0]=2 3727 B12R1.21 O=C(O)CCc1cnc(Cl)cn1 Amb25993889 [1,1,0,0,0,0|2,0,0]=4 3728 B12R1.21 O=C(O)CCc1cnc(O)cn1 Amb27194915 [1,1,0,0,0,0|2,0,0]=4 3729 B12R1.21 O=C(O)CCc1ncc(Br)cn1 Amb27437152 [1,1,0,0,0,0|2,0,0]=4 3730 B12R1.21 O=C(O)CCc1ncc(F)cn1 Amb24673852 [1,1,0,0,0,0|2,0,0]=4 3731 B12R1.21 O=C(O)CNc1ccc(Br)cc1 Amb1981434 [1,1,0,0,0,0|1,0,0]=3 3732 B12R1.21 O=C(O)CNc1ccc(Cl)cc1 Amb1486152 [1,1,0,0,0,0|1,0,0]=3 3733 B12R1.21 O=C(O)CNc1ccc(F)cc1 Amb840523 [1,1,0,0,0,0|1,0,0]=3 3734 B12R1.21 O=C(O)CNc1ccc(I)cc1 Amb4598598 [1,1,0,0,0,0|1,0,0]=3 3735 B12R1.21 O=C(O)CNc1ccc(O)cc1 Amb1950558 [1,1,0,0,0,0|1,0,0]=3 3736 B12R1.21 O=C(O)COc1ccc(Br)cc1 Amb6336449 [1,1,0,0,0,0|1,0,0]=3 3737 B12R1.21 O=C(O)COc1ccc(Br)cn1 Amb8439031 [1,1,0,0,0,0|2,0,0]=4 3738 B12R1.21 O=C(O)COc1ccc(Br)nc1 Amb32946300 [1,1,0,0,0,0|2,0,0]=4 3739 B12R1.21 O=C(O)COc1ccc(Cl)cc1 Amb1830178 [1,1,0,0,0,0|1,0,0]=3 3740 B12R1.21 O=C(O)COc1ccc(Cl)cn1 Amb33543498 [1,1,0,0,0,0|2,0,0]=4 3741 B12R1.21 O=C(O)COc1ccc(Cl)nc1 Amb28138011 [1,1,0,0,0,0|2,0,0]=4 3742 B12R1.21 O=C(O)COc1ccc(F)cc1 Amb1210357 [1,1,0,0,0,0|1,0,0]=3 3743 B12R1.21 O=C(O)COc1ccc(F)cn1 Amb24748685 [1,1,0,0,0,0|2,0,0]=4 3744 B12R1.21 O=C(O)COc1ccc(F)nc1 Amb26424670 [1,1,0,0,0,0|2,0,0]=4 3745 B12R1.21 O=C(O)COc1ccc(I)cc1 Amb1152251 [1,1,0,0,0,0|1,0,0]=3 3746 B12R1.21 O=C(O)COc1ccc(O)cc1 Amb2819510 [1,1,0,0,0,0|1,0,0]=3 3747 B12R1.21 O=C(O)CSc1cc[n+]([O-])cc1 Amb27645851 [1,1,0,0,0,0|2,0,0]=4 3748 B12R1.21 O=C(O)CSc1ccc(Br)cc1 Amb1208368 [1,1,0,0,0,0|1,0,0]=3 3749 B12R1.21 O=C(O)CSc1ccc(Br)cn1 Amb6273364 [1,1,0,0,0,0|2,0,0]=4 3750 B12R1.21 O=C(O)CSc1ccc(Cl)cc1 Amb6335201 [1,1,0,0,0,0|1,0,0]=3 3751 B12R1.21 O=C(O)CSc1ccc(F)cc1 Amb1209262 [1,1,0,0,0,0|1,0,0]=3 3752 B12R1.21 O=C(O)CSc1ccc(O)cc1 Amb18291566 [1,1,0,0,0,0|1,0,0]=3 3753 B12R1.21 O=C(O)NCc1ccc(Cl)nc1 Amb24068954 [1,1,0,0,0,0|2,0,0]=4 3754 B12R1.21 O=C(O)\C=C/c1ccc(Cl)cc1 Amb2553273 [1,1,0,0,0,0|0,0,2]=4 3755 B12R1.21 O=C(O)\C=C/c1ccc(F)cc1 Amb24712642 [1,1,0,0,0,0|0,0,2]=4 3756 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb33714741 [1,1,0,0,0,0|0,0,2]=4 3757 B12R1.21 O=C(O)\C=C\c1ccc(Br)cc1 Amb8517406 [1,1,0,0,0,0|0,0,2]=4 3758 B12R1.21 O=C(O)\C=C\c1ccc(Cl)cc1 Amb6608688 [1,1,0,0,0,0|0,0,2]=4 3759 B12R1.21 O=C(O)\C=C\c1ccc(F)cc1 Amb6608746 [1,1,0,0,0,0|0,0,2]=4 3760 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb24079623 [1,1,0,0,0,0|0,0,2]=4 3761 B12R1.21 O=C(O)\C=C\c1ccc(I)cc1 Amb35826750 [1,1,0,0,0,0|0,0,2]=4 3762 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 Amb1207922 [1,1,0,0,0,0|0,0,2]=4 3763 B12R1.21 O=C([O-])CCc1ccc(F)cc1 Amb33513062 [1,1,0,0,0,0|0,0,1]=3 3764 B12R1.21 O=C([O-])COc1ccc(Cl)cc1 Amb8383883 [1,1,0,0,0,0|1,0,1]=4 3765 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb2371026 [1,1,0,0,0,0|1,0,1]=4 3766 B12R1.21 O=C([O-])CSc1ccc(F)cc1 Amb44363 [1,1,0,0,0,0|1,0,1]=4 3767 B12R1.21 O=C1C=CC(=NCC(=O)O)C=C1 Amb26847942 [1,1,0,0,0,0|1,0,0]=3 3768 B12R1.21 O=C1C=CN(CCC(=O)O)C=C1 Amb18534262 [1,1,0,0,0,0|1,0,0]=3 3769 B12R1.21 O=C1C=CN(OCC(=O)O)C=C1 Amb18647100 [1,1,0,0,0,0|2,0,0]=4 3770 B12R1.21 O=S([O-])CCc1ccc(Cl)cc1 Amb32755579 [1,1,0,0,0,0|1,0,1]=4 3771 B12R1.21 O=S([O-])CCc1ccc(F)cc1 Amb32755446 [1,1,0,0,0,0|1,0,1]=4 3772 B12R1.21 O=[N+]([O-])CCc1ccc(Br)cc1 Amb6297629 [1,1,0,0,0,0|1,0,1]=4 3773 B12R1.21 O=[N+]([O-])CCc1ccc(Cl)cc1 Amb6298188 [1,1,0,0,0,0|1,0,1]=4 3774 B12R1.21 O=[N+]([O-])CCc1ccc(F)cc1 Amb18542361 [1,1,0,0,0,0|1,0,1]=4 3775 B12R1.21 O=[N+]([O-])CCc1ccc(O)cc1 Amb27960305 [1,1,0,0,0,0|1,0,1]=4 3776 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [1,1,0,0,0,0|1,0,1]=4 3777 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [1,1,0,0,0,0|1,0,0]=3 3778 B12R1.27 C#CC(=O)CCc1ccccn1 Amb27411050 [1,1,0,0,0,0|2,0,0]=4 3779 B12R1.27 C#CC(=O)CSc1ccccc1 Amb27961049 [1,1,0,0,0,0|2,0,0]=4 3780 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [1,1,0,0,0,0|2,0,0]=4 3781 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [1,1,0,0,0,0|2,0,0]=4 3782 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [1,1,0,0,0,0|1,0,1]=4 3783 B12R1.27 C=C(CBr)CCc1ccccc1 Amb32951881 [1,1,0,0,0,0|2,0,0]=4 3784 B12R1.27 C=C(CCl)CCc1ccccc1 Amb32951884 [1,1,0,0,0,0|2,0,0]=4 3785 B12R1.27 C=C(CN)CCc1ccccc1 Amb32954092 [1,1,0,0,0,0|2,0,0]=4 3786 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [1,1,0,0,0,0|1,0,0]=3 3787 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [1,1,0,0,0,0|2,0,0]=4 3788 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [1,1,0,0,0,0|2,0,0]=4 3789 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [1,1,0,0,0,0|2,0,0]=4 3790 B12R1.27 C=CC(O)CCc1ccccc1 Amb33082669 [1,1,0,0,0,0|1,0,1]=4 3791 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [1,1,0,0,0,0|1,0,1]=4 3792 B12R1.27 CC(CCc1ccccc1)ON Amb32951848 [1,1,0,0,0,0|1,0,1]=4 3793 B12R1.27 CC(CO)CCc1ccccc1 Amb32413001 [1,1,0,0,0,0|1,0,1]=4 3794 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [1,1,0,0,0,0|1,0,0]=3 3795 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [1,1,0,0,0,0|2,0,0]=4 3796 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [1,1,0,0,0,0|2,0,0]=4 3797 B12R1.27 CCC(=O)NCc1ccccc1 Amb3097295 [1,1,0,0,0,0|2,0,0]=4 3798 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [1,1,0,0,0,0|2,0,0]=4 3799 B12R1.27 CCC(O)CCc1ccccc1 Amb17138574 [1,1,0,0,0,0|1,0,1]=4 3800 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [1,1,0,0,0,0|1,0,0]=3 3801 B12R1.27 CNC(=O)CCc1cccnc1 Amb27256880 [1,1,0,0,0,0|2,0,0]=4 3802 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [1,1,0,0,0,0|2,0,0]=4 3803 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [1,1,0,0,0,0|2,0,0]=4 3804 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [1,1,0,0,0,0|2,0,0]=4 3805 B12R1.27 CNC(=S)CCc1ccccc1 Amb4430624 [1,1,0,0,0,0|1,1,0]=4 3806 B12R1.27 COC(=N)CCc1ccccn1 Amb18563625 [1,1,0,0,0,0|2,0,0]=4 3807 B12R1.27 COC(=N)CCc1cccnc1 Amb18563630 [1,1,0,0,0,0|2,0,0]=4 3808 B12R1.27 COC(=N)CCc1ccncc1 Amb18563635 [1,1,0,0,0,0|2,0,0]=4 3809 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [1,1,0,0,0,0|2,0,0]=4 3810 B12R1.27 COC(=O)C#Cc1ccccc1 Amb4019367 [1,1,0,0,0,0|0,0,2]=4 3811 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [1,1,0,0,0,0|0,0,0]=2 3812 B12R1.27 COC(=O)CCc1cccnc1 Amb6357821 [1,1,0,0,0,0|1,0,0]=3 3813 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [1,1,0,0,0,0|1,0,0]=3 3814 B12R1.27 COC(=O)CCc1cncnc1 Amb21922892 [1,1,0,0,0,0|2,0,0]=4 3815 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [1,1,0,0,0,0|1,0,0]=3 3816 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [1,1,0,0,0,0|1,0,0]=3 3817 B12R1.27 COC(=O)CNc1ccccn1 Amb6649089 [1,1,0,0,0,0|2,0,0]=4 3818 B12R1.27 COC(=O)CNc1cccnc1 Amb18270093 [1,1,0,0,0,0|2,0,0]=4 3819 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [1,1,0,0,0,0|2,0,0]=4 3820 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [1,1,0,0,0,0|1,0,0]=3 3821 B12R1.27 COC(=O)COc1ccccn1 Amb24095859 [1,1,0,0,0,0|2,0,0]=4 3822 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [1,1,0,0,0,0|1,0,0]=3 3823 B12R1.27 COC(=O)NCc1ccccc1 Amb2746993 [1,1,0,0,0,0|1,0,0]=3 3824 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [1,1,0,0,0,0|1,0,0]=3 3825 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [1,1,0,0,0,0|0,0,2]=4 3826 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [1,1,0,0,0,0|0,0,2]=4 3827 B12R1.27 COC(=S)NCc1ccccc1 Amb27388388 [1,1,0,0,0,0|1,1,0]=4 3828 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [1,1,0,0,0,0|1,0,1]=4 3829 B12R1.27 C\C(=C\Cl)CCc1ccccc1 Amb27658993 [1,1,0,0,0,0|2,0,0]=4 3830 B12R1.27 C\C(COc1ccccc1)=N\O Amb35672643 [1,1,0,0,0,0|2,0,0]=4 3831 B12R1.27 N#CC(=O)OCc1ccccc1 Amb9786353 [1,1,0,0,0,0|2,0,0]=4 3832 B12R1.27 N=C(CO)OCc1ccccc1 Amb27598593 [1,1,0,0,0,0|2,0,0]=4 3833 B12R1.27 NC(CO)CCc1ccccc1 Amb18315307 [1,1,0,0,0,0|1,0,1]=4 3834 B12R1.27 NC(CO)CCc1ccccc1 Amb32753518 [1,1,0,0,0,0|1,0,1]=4 3835 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [1,1,0,0,0,0|1,0,0]=3 3836 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [1,1,0,0,0,0|1,0,0]=3 3837 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [1,1,0,0,0,0|2,0,0]=4 3838 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [1,1,0,0,0,0|2,0,0]=4 3839 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [1,1,0,0,0,0|2,0,0]=4 3840 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [1,1,0,0,0,0|2,0,0]=4 3841 B12R1.27 NCC(O)CCc1ccccc1 Amb18315280 [1,1,0,0,0,0|1,0,1]=4 3842 B12R1.27 NC[C@@H](O)CCc1ccccc1 Amb32952383 [1,1,0,0,0,0|1,0,1]=4 3843 B12R1.27 NC[C@H](O)CCc1ccccc1 Amb33081741 [1,1,0,0,0,0|1,0,1]=4 3844 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [1,1,0,0,0,0|1,0,0]=3 3845 B12R1.27 NNC(=O)CCc1cccnc1 Amb8387840 [1,1,0,0,0,0|2,0,0]=4 3846 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [1,1,0,0,0,0|2,0,0]=4 3847 B12R1.27 NNC(=O)CNc1ccccc1 Amb29844457 [1,1,0,0,0,0|2,0,0]=4 3848 B12R1.27 NNC(=O)COc1ccccc1 Amb6402305 [1,1,0,0,0,0|2,0,0]=4 3849 B12R1.27 NNC(=O)CSc1ccccc1 Amb4065797 [1,1,0,0,0,0|2,0,0]=4 3850 B12R1.27 NNC(=O)NCc1ccccc1 Amb8853874 [1,1,0,0,0,0|2,0,0]=4 3851 B12R1.27 NNC(=O)OCc1ccccc1 Amb33422006 [1,1,0,0,0,0|2,0,0]=4 3852 B12R1.27 NNC(=O)OCc1ccccc1 Amb8516532 [1,1,0,0,0,0|2,0,0]=4 3853 B12R1.27 NNC(=S)CCc1ccccc1 Amb27492786 [1,1,0,0,0,0|1,1,0]=4 3854 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb32683468 [1,1,0,0,0,0|1,0,1]=4 3855 B12R1.27 N[C@@H](CO)CCc1ccccc1 Amb6308799 [1,1,0,0,0,0|1,0,1]=4 3856 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683465 [1,1,0,0,0,0|1,0,1]=4 3857 B12R1.27 N[C@H](CO)CCc1ccccc1 Amb32683466 [1,1,0,0,0,0|1,0,1]=4 3858 B12R1.27 N\C(CCc1ccccc1)=N/O Amb1115853 [1,1,0,0,0,0|1,0,0]=3 3859 B12R1.27 N\C(CCc1ccccc1)=N\O Amb22053006 [1,1,0,0,0,0|1,0,0]=3 3860 B12R1.27 N\C(CCc1ccccn1)=N/O Amb18792639 [1,1,0,0,0,0|2,0,0]=4 3861 B12R1.27 N\C(CCc1cccnc1)=N/O Amb24678911 [1,1,0,0,0,0|2,0,0]=4 3862 B12R1.27 N\C(CCc1ccncc1)=N/O Amb18792640 [1,1,0,0,0,0|2,0,0]=4 3863 B12R1.27 N\C(COc1ccccc1)=N/O Amb6666310 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.27 N\C(CSc1ccccc1)=N/O Amb6677887 [1,1,0,0,0,0|2,0,0]=4 3865 B12R1.27 O=C(C#Cc1ccccc1)NO Amb27755294 [1,1,0,0,0,0|0,0,2]=4 3866 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [1,1,0,0,0,0|1,0,0]=3 3867 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [1,1,0,0,0,0|2,0,0]=4 3868 B12R1.27 O=C(CBr)NCc1ccccc1 Amb2221074 [1,1,0,0,0,0|2,0,0]=4 3869 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [1,1,0,0,0,0|2,0,0]=4 3870 B12R1.27 O=C(CCc1ccccc1)NO Amb6277186 [1,1,0,0,0,0|0,0,0]=2 3871 B12R1.27 O=C(CCc1ccncn1)NO Amb27163861 [1,1,0,0,0,0|2,0,0]=4 3872 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [1,1,0,0,0,0|1,0,0]=3 3873 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [1,1,0,0,0,0|2,0,0]=4 3875 B12R1.27 O=C(CCl)NCc1ccccc1 Amb6324481 [1,1,0,0,0,0|2,0,0]=4 3876 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [1,1,0,0,0,0|2,0,0]=4 3877 B12R1.27 O=C(CF)NCc1ccccc1 Amb27237611 [1,1,0,0,0,0|2,0,0]=4 3878 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [1,1,0,0,0,0|2,0,0]=4 3879 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [1,1,0,0,0,0|2,0,0]=4 3880 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [1,1,0,0,0,0|0,0,0]=2 3881 B12R1.27 O=C(CO)CCc1ccccn1 Amb18563673 [1,1,0,0,0,0|1,0,0]=3 3882 B12R1.27 O=C(CO)CCc1cccnc1 Amb18563674 [1,1,0,0,0,0|1,0,0]=3 3883 B12R1.27 O=C(CO)CCc1ccncc1 Amb18563675 [1,1,0,0,0,0|1,0,0]=3 3884 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [1,1,0,0,0,0|1,0,0]=3 3885 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [1,1,0,0,0,0|1,0,0]=3 3886 B12R1.27 O=C(CO)NCc1ccccn1 Amb17334667 [1,1,0,0,0,0|2,0,0]=4 3887 B12R1.27 O=C(CO)NCc1cccnc1 Amb17334668 [1,1,0,0,0,0|2,0,0]=4 3888 B12R1.27 O=C(CO)NCc1ccncc1 Amb17334669 [1,1,0,0,0,0|2,0,0]=4 3889 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [1,1,0,0,0,0|2,0,0]=4 3890 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [1,1,0,0,0,0|1,0,0]=3 3891 B12R1.27 O=C(COc1ccccc1)NO Amb6270455 [1,1,0,0,0,0|1,0,0]=3 3892 B12R1.27 O=C(COc1cccnc1)NO Amb28043772 [1,1,0,0,0,0|2,0,0]=4 3893 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [1,1,0,0,0,0|1,1,0]=4 3894 B12R1.27 O=C(CSc1ccccc1)NO Amb27590137 [1,1,0,0,0,0|1,0,0]=3 3895 B12R1.27 O=C(CSc1ccncc1)NO Amb28140463 [1,1,0,0,0,0|2,0,0]=4 3896 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [1,1,0,0,0,0|2,0,0]=4 3897 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [1,1,0,0,0,0|2,0,0]=4 3898 B12R1.27 O=C(NO)NCc1ccccn1 Amb28317440 [1,1,0,0,0,0|2,0,0]=4 3899 B12R1.27 O=C(NO)NNc1ccccc1 Amb3427817 [1,1,0,0,0,0|2,0,0]=4 3900 B12R1.27 O=C(NO)OCc1ccccc1 Amb2445312 [1,1,0,0,0,0|1,0,0]=3 3901 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [1,1,0,0,0,0|1,0,1]=4 3902 B12R1.27 O=C\C(F)=C\Cc1ccccc1 Amb27166149 [1,1,0,0,0,0|1,0,1]=4 3903 B12R1.27 O=C\C(O)=C/Nc1ccccc1 Amb27476557 [1,1,0,0,0,0|1,0,1]=4 3904 B12R1.27 OC(CBr)CCc1ccccc1 Amb32951853 [1,1,0,0,0,0|1,0,1]=4 3905 B12R1.27 OC(CCl)CCc1ccccc1 Amb32954413 [1,1,0,0,0,0|1,0,1]=4 3906 B12R1.27 OC(CF)CCc1ccccc1 Amb32954420 [1,1,0,0,0,0|1,0,1]=4 3907 B12R1.27 OCC(=S)OCc1ccccc1 Amb27835138 [1,1,0,0,0,0|1,1,0]=4 3908 B12R1.27 OCC(O)CCc1ccccc1 Amb17508778 [1,1,0,0,0,0|0,0,2]=4 3909 B12R1.27 O\N=C(/Cl)CCc1ccccc1 Amb32661748 [1,1,0,0,0,0|1,0,0]=3 3910 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [1,1,0,0,0,0|2,0,0]=4 3911 B12R1.107 C=C(C)C[C@@H](O)c1ccccc1 Amb27396487 [1,1,0,0,0,0|2,0,0]=4 3912 B12R1.107 C=C(CC(C)=O)c1ccccc1 Amb27802448 [1,1,0,0,0,0|1,0,1]=4 3913 B12R1.107 C=C(Cl)CC(N)c1ccccc1 Amb27259258 [1,1,0,0,0,0|2,0,0]=4 3914 B12R1.107 C=C(Cl)C[C@@H](O)c1ccccc1 Amb27834223 [1,1,0,0,0,0|2,0,0]=4 3915 B12R1.107 C=C(O)CC(C)c1ccncc1 Amb27163578 [1,1,0,0,0,0|2,0,0]=4 3916 B12R1.107 CC(=O)CC(=O)c1ccccc1 Amb534154 [1,1,0,0,0,0|1,0,1]=4 3917 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [1,1,0,0,0,0|1,0,0]=3 3918 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [1,1,0,0,0,0|1,0,0]=3 3919 B12R1.107 CC(=O)CC(O)c1ccccn1 Amb1016907 [1,1,0,0,0,0|2,0,0]=4 3920 B12R1.107 CC(=O)CC(O)c1cccnc1 Amb28399354 [1,1,0,0,0,0|2,0,0]=4 3921 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [1,1,0,0,0,0|1,0,0]=3 3922 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [1,1,0,0,0,0|1,0,0]=3 3923 B12R1.107 CC(=O)C[C@H](O)c1ccncc1 Amb27227062 [1,1,0,0,0,0|2,0,0]=4 3924 B12R1.107 CC(=O)NC(C)c1ccccc1 Amb6390965 [1,1,0,0,0,0|2,0,0]=4 3925 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 Amb8516282 [1,1,0,0,0,0|2,0,0]=4 3926 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 Amb2742666 [1,1,0,0,0,0|2,0,0]=4 3927 B12R1.107 CC(=O)OC(C)c1ccccc1 Amb4037062 [1,1,0,0,0,0|2,0,0]=4 3928 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [1,1,0,0,0,0|2,0,0]=4 3929 B12R1.107 CC(CC(=N)N)c1ccccc1 Amb25898810 [1,1,0,0,0,0|2,0,0]=4 3930 B12R1.107 CC(CC(=O)Cl)c1ccccc1 Amb2690275 [1,1,0,0,0,0|1,0,0]=3 3931 B12R1.107 CC(CC(=O)O)c1ccccc1 Amb1207393 [1,1,0,0,0,0|0,0,0]=2 3932 B12R1.107 CC(CC(=O)O)c1ccccn1 Amb6749249 [1,1,0,0,0,0|1,0,0]=3 3933 B12R1.107 CC(CC(=O)O)c1cccnc1 Amb6749217 [1,1,0,0,0,0|1,0,0]=3 3934 B12R1.107 CC(CC(=O)O)c1ccncc1 Amb32668732 [1,1,0,0,0,0|1,0,0]=3 3935 B12R1.107 CC(CC(=O)O)c1ccncc1 Amb33528474 [1,1,0,0,0,0|1,0,0]=3 3936 B12R1.107 CC(CC(=O)O)c1ccncn1 Amb24589784 [1,1,0,0,0,0|2,0,0]=4 3937 B12R1.107 CC(CC(=O)O)c1cnccn1 Amb24487345 [1,1,0,0,0,0|2,0,0]=4 3938 B12R1.107 CC(CC(=O)O)c1cncnc1 Amb25938150 [1,1,0,0,0,0|2,0,0]=4 3939 B12R1.107 CC(CC(=O)O)c1ncccn1 Amb25135402 [1,1,0,0,0,0|2,0,0]=4 3940 B12R1.107 CC(CC(N)=O)c1ccccc1 Amb3886650 [1,1,0,0,0,0|1,0,0]=3 3941 B12R1.107 CC(CC(N)=O)c1cccnc1 Amb27832020 [1,1,0,0,0,0|2,0,0]=4 3942 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [1,1,0,0,0,0|1,1,0]=4 3943 B12R1.107 CC(CN(C)O)c1ccccc1 Amb33081590 [1,1,0,0,0,0|2,0,0]=4 3944 B12R1.107 CC(CS(=O)Cl)c1ccccc1 Amb28286106 [1,1,0,0,0,0|2,0,0]=4 3945 B12R1.107 CC(CS(=O)[O-])c1ccccc1 Amb24385785 [1,1,0,0,0,0|1,0,1]=4 3946 B12R1.107 CC(C[C@@H](C)O)c1ccccc1 Amb28207302 [1,1,0,0,0,0|1,0,1]=4 3947 B12R1.107 CC(C[C@H](C)O)c1ccccc1 Amb33081855 [1,1,0,0,0,0|1,0,1]=4 3948 B12R1.107 CC(C[N+](=O)[O-])c1ccccc1 Amb28200114 [1,1,0,0,0,0|1,0,1]=4 3949 B12R1.107 CC(NC(N)=O)c1ccccc1 Amb1135151 [1,1,0,0,0,0|2,0,0]=4 3950 B12R1.107 CC(NC(O)=S)c1ccccc1 Amb27614814 [1,1,0,0,0,0|1,1,0]=4 3951 B12R1.107 CC(O)CC(C)c1ccccc1 Amb27651998 [1,1,0,0,0,0|1,0,1]=4 3952 B12R1.107 CC(O)CC(F)c1ccccc1 Amb27588281 [1,1,0,0,0,0|1,0,1]=4 3953 B12R1.107 CC(O)CC(O)c1ccccc1 Amb1110547 [1,1,0,0,0,0|1,0,1]=4 3954 B12R1.107 CC(O)C[C@@H](O)c1ccccc1 Amb27748936 [1,1,0,0,0,0|1,0,1]=4 3955 B12R1.107 CC(OC(=O)Cl)c1ccccc1 Amb27181225 [1,1,0,0,0,0|2,0,0]=4 3956 B12R1.107 CN(CC(=O)Cl)c1ccccc1 Amb17142999 [1,1,0,0,0,0|2,0,0]=4 3957 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb10610413 [1,1,0,0,0,0|1,0,0]=3 3958 B12R1.107 CN(CC(=O)O)c1ccccc1 Amb4598567 [1,1,0,0,0,0|1,0,0]=3 3959 B12R1.107 CN(CC(=O)O)c1ccccn1 Amb22275945 [1,1,0,0,0,0|2,0,0]=4 3960 B12R1.107 CN(CC(=O)O)c1ccccn1 Amb6261942 [1,1,0,0,0,0|2,0,0]=4 3961 B12R1.107 CN(CC(=O)O)c1cccnc1 Amb18268673 [1,1,0,0,0,0|2,0,0]=4 3962 B12R1.107 CN(CC(=O)O)c1ccncc1 Amb33532730 [1,1,0,0,0,0|2,0,0]=4 3963 B12R1.107 CN(CC(N)=O)c1ccccc1 Amb8342086 [1,1,0,0,0,0|2,0,0]=4 3964 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [1,1,0,0,0,0|2,0,0]=4 3965 B12R1.107 CS(=O)C[C@@H](N)c1ccccc1 Amb28195318 [1,1,0,0,0,0|2,0,0]=4 3966 B12R1.107 C[C@@H](CC(=O)Cl)c1ccccc1 Amb28139675 [1,1,0,0,0,0|1,0,0]=3 3967 B12R1.107 C[C@@H](CC(=O)O)c1ccccc1 Amb10844379 [1,1,0,0,0,0|0,0,0]=2 3968 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [1,1,0,0,0,0|2,0,0]=4 3969 B12R1.107 C[C@@H](O)C[C@@H](C)c1ccccc1 Amb27457680 [1,1,0,0,0,0|1,0,1]=4 3970 B12R1.107 C[C@@H](O)C[C@@H](S)c1ccccc1 Amb27218944 [1,1,0,0,0,0|1,0,1]=4 3971 B12R1.107 C[C@@H](OC(=O)Cl)c1ccccc1 Amb33297316 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.107 C[C@H](CC(=O)O)c1ccccc1 Amb10844340 [1,1,0,0,0,0|0,0,0]=2 3973 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [1,1,0,0,0,0|2,0,0]=4 3974 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [1,1,0,0,0,0|1,0,1]=4 3975 B12R1.107 C[C@H](OC(=O)Cl)c1ccccc1 Amb33297317 [1,1,0,0,0,0|2,0,0]=4 3976 B12R1.107 C\C(=C/C(=O)O)c1ccccc1 Amb6749182 [1,1,0,0,0,0|0,0,2]=4 3977 B12R1.107 NC(=O)CC(=O)c1ccccc1 Amb2734576 [1,1,0,0,0,0|1,0,1]=4 3978 B12R1.107 NC(=O)CC(=S)c1ccccc1 Amb28384134 [1,1,0,0,0,0|1,0,1]=4 3979 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609847 [1,1,0,0,0,0|1,0,0]=3 3980 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb10609952 [1,1,0,0,0,0|1,0,0]=3 3981 B12R1.107 NC(=O)CC(N)c1ccccc1 Amb6264599 [1,1,0,0,0,0|1,0,0]=3 3982 B12R1.107 NC(=O)CC(N)c1ccccn1 Amb7800654 [1,1,0,0,0,0|2,0,0]=4 3983 B12R1.107 NC(=O)CC(N)c1cccnc1 Amb7800599 [1,1,0,0,0,0|2,0,0]=4 3984 B12R1.107 NC(=O)CC(N)c1ccncc1 Amb7800608 [1,1,0,0,0,0|2,0,0]=4 3985 B12R1.107 NC(=O)CC(O)c1cccnc1 Amb27596700 [1,1,0,0,0,0|2,0,0]=4 3986 B12R1.107 NC(=O)CS(=O)c1ccccc1 Amb26536440 [1,1,0,0,0,0|2,0,0]=4 3987 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [1,1,0,0,0,0|1,0,0]=3 3988 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb32661465 [1,1,0,0,0,0|1,0,0]=3 3989 B12R1.107 NC(=O)C[C@@H](N)c1ccccn1 Amb26506910 [1,1,0,0,0,0|2,0,0]=4 3990 B12R1.107 NC(=O)C[C@@H](N)c1cccnc1 Amb18792646 [1,1,0,0,0,0|2,0,0]=4 3991 B12R1.107 NC(=O)C[C@@H](N)c1ccncc1 Amb28313197 [1,1,0,0,0,0|2,0,0]=4 3992 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb28129120 [1,1,0,0,0,0|1,0,0]=3 3993 B12R1.107 NC(=O)C[C@H](N)c1ccccc1 Amb32661309 [1,1,0,0,0,0|1,0,0]=3 3994 B12R1.107 NC(=O)C[C@H](N)c1ccccn1 Amb25049883 [1,1,0,0,0,0|2,0,0]=4 3995 B12R1.107 NC(=O)C[C@H](N)c1cccnc1 Amb25137393 [1,1,0,0,0,0|2,0,0]=4 3996 B12R1.107 NC(=O)C[C@H](N)c1ccncc1 Amb26638475 [1,1,0,0,0,0|2,0,0]=4 3997 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [1,1,0,0,0,0|1,1,0]=4 3998 B12R1.107 NC(=S)C[C@@H](O)c1ccccc1 Amb27494152 [1,1,0,0,0,0|1,1,0]=4 3999 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb8566722 [1,1,0,0,0,0|0,0,0]=2 4000 B12R1.107 NC(CC(=O)O)c1ccccc1 Amb9730098 [1,1,0,0,0,0|0,0,0]=2 4001 B12R1.107 NC(CC(=O)O)c1ccccn1 Amb22898991 [1,1,0,0,0,0|1,0,0]=3 4002 B12R1.107 NC(CC(=O)O)c1ccccn1 Amb2697563 [1,1,0,0,0,0|1,0,0]=3 4003 B12R1.107 NC(CC(=O)O)c1cccnc1 Amb1993735 [1,1,0,0,0,0|1,0,0]=3 4004 B12R1.107 NC(CC(=O)O)c1ccncc1 Amb2697359 [1,1,0,0,0,0|1,0,0]=3 4005 B12R1.107 NC(CC(=O)O)c1ccncc1 Amb32666622 [1,1,0,0,0,0|1,0,0]=3 4006 B12R1.107 NC(CC(=O)O)c1ccncn1 Amb25148500 [1,1,0,0,0,0|2,0,0]=4 4007 B12R1.107 NC(CC(=O)O)c1cnccn1 Amb24377112 [1,1,0,0,0,0|2,0,0]=4 4008 B12R1.107 NC(CC(=O)O)c1cncnc1 Amb2697375 [1,1,0,0,0,0|2,0,0]=4 4009 B12R1.107 NC(CC(=O)O)c1ncccn1 Amb33079385 [1,1,0,0,0,0|2,0,0]=4 4010 B12R1.107 NC(C[N+](=O)[O-])c1ccccc1 Amb27443064 [1,1,0,0,0,0|1,0,1]=4 4011 B12R1.107 NN(CC(=O)O)c1ccccc1 Amb22757137 [1,1,0,0,0,0|1,0,0]=3 4012 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8384247 [1,1,0,0,0,0|0,0,0]=2 4013 B12R1.107 N[C@@H](CC(=O)O)c1ccccc1 Amb8396895 [1,1,0,0,0,0|0,0,0]=2 4014 B12R1.107 N[C@@H](CC(=O)O)c1ccccn1 Amb20241102 [1,1,0,0,0,0|1,0,0]=3 4015 B12R1.107 N[C@@H](CC(=O)O)c1cccnc1 Amb35788157 [1,1,0,0,0,0|1,0,0]=3 4016 B12R1.107 N[C@@H](CC(=O)O)c1cccnc1 Amb8627845 [1,1,0,0,0,0|1,0,0]=3 4017 B12R1.107 N[C@@H](CC(=O)O)c1ccncc1 Amb20240885 [1,1,0,0,0,0|1,0,0]=3 4018 B12R1.107 N[C@@H](CC(=O)O)c1ccncn1 Amb26417472 [1,1,0,0,0,0|2,0,0]=4 4019 B12R1.107 N[C@@H](CC(=O)O)c1cnccn1 Amb25800392 [1,1,0,0,0,0|2,0,0]=4 4020 B12R1.107 N[C@@H](CC(=O)O)c1cncnc1 Amb25324427 [1,1,0,0,0,0|2,0,0]=4 4021 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb4296884 [1,1,0,0,0,0|0,0,0]=2 4022 B12R1.107 N[C@H](CC(=O)O)c1ccccc1 Amb6365358 [1,1,0,0,0,0|0,0,0]=2 4023 B12R1.107 N[C@H](CC(=O)O)c1ccccn1 Amb20241101 [1,1,0,0,0,0|1,0,0]=3 4024 B12R1.107 N[C@H](CC(=O)O)c1cccnc1 Amb35788756 [1,1,0,0,0,0|1,0,0]=3 4025 B12R1.107 N[C@H](CC(=O)O)c1cccnc1 Amb8627846 [1,1,0,0,0,0|1,0,0]=3 4026 B12R1.107 N[C@H](CC(=O)O)c1ccncc1 Amb20241136 [1,1,0,0,0,0|1,0,0]=3 4027 B12R1.107 N[C@H](CC(=O)O)c1ccncn1 Amb27798138 [1,1,0,0,0,0|2,0,0]=4 4028 B12R1.107 N[C@H](CC(=O)O)c1cnccn1 Amb28288623 [1,1,0,0,0,0|2,0,0]=4 4029 B12R1.107 N[C@H](CC(=O)O)c1cncnc1 Amb28072918 [1,1,0,0,0,0|2,0,0]=4 4030 B12R1.107 N[C@H](C[N+](=O)[O-])c1ccccc1 Amb27491689 [1,1,0,0,0,0|1,0,1]=4 4031 B12R1.107 O=C(O)CC(=S)c1ccccc1 Amb27433886 [1,1,0,0,0,0|0,0,1]=3 4032 B12R1.107 O=C(O)CC(Br)c1ccccc1 Amb2721208 [1,1,0,0,0,0|0,0,0]=2 4033 B12R1.107 O=C(O)CC(Br)c1ccccn1 Amb17596297 [1,1,0,0,0,0|1,0,0]=3 4034 B12R1.107 O=C(O)CC(Cl)c1ccccc1 Amb18120400 [1,1,0,0,0,0|0,0,0]=2 4035 B12R1.107 O=C(O)CC(Cl)c1ccccn1 Amb18120042 [1,1,0,0,0,0|1,0,0]=3 4036 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [1,1,0,0,0,0|0,0,0]=2 4037 B12R1.107 O=C(O)CC(O)c1ccccn1 Amb18563782 [1,1,0,0,0,0|1,0,0]=3 4038 B12R1.107 O=C(O)CC(O)c1ccncc1 Amb18563783 [1,1,0,0,0,0|1,0,0]=3 4039 B12R1.107 O=C(O)CC(O)c1ccncn1 Amb33269013 [1,1,0,0,0,0|2,0,0]=4 4040 B12R1.107 O=C(O)CC(O)c1cnccn1 Amb33359994 [1,1,0,0,0,0|2,0,0]=4 4041 B12R1.107 O=C(O)CC(O)c1cncnc1 Amb32954017 [1,1,0,0,0,0|2,0,0]=4 4042 B12R1.107 O=C(O)CC(O)c1ncccn1 Amb33270409 [1,1,0,0,0,0|2,0,0]=4 4043 B12R1.107 O=C(O)CN(Cl)c1ccccc1 Amb27984830 [1,1,0,0,0,0|1,0,0]=3 4044 B12R1.107 O=C(O)CN(O)c1ccccc1 Amb27984844 [1,1,0,0,0,0|1,0,0]=3 4045 B12R1.107 O=C(O)CS(=O)c1ccccc1 Amb18290924 [1,1,0,0,0,0|1,0,0]=3 4046 B12R1.107 O=C(O)CS(=O)c1ccncc1 Amb28321121 [1,1,0,0,0,0|2,0,0]=4 4047 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [1,1,0,0,0,0|0,0,0]=2 4048 B12R1.107 O=C(O)C[C@@H](O)c1ccccn1 Amb33360785 [1,1,0,0,0,0|1,0,0]=3 4049 B12R1.107 O=C(O)C[C@@H](O)c1cccnc1 Amb33360064 [1,1,0,0,0,0|1,0,0]=3 4050 B12R1.107 O=C(O)C[C@@H](O)c1ccncc1 Amb33380661 [1,1,0,0,0,0|1,0,0]=3 4051 B12R1.107 O=C(O)C[C@@H](O)c1ccncn1 Amb33269010 [1,1,0,0,0,0|2,0,0]=4 4052 B12R1.107 O=C(O)C[C@@H](O)c1cnccn1 Amb33359992 [1,1,0,0,0,0|2,0,0]=4 4053 B12R1.107 O=C(O)C[C@@H](O)c1cncnc1 Amb33149204 [1,1,0,0,0,0|2,0,0]=4 4054 B12R1.107 O=C(O)C[C@@H](O)c1ncccn1 Amb33270406 [1,1,0,0,0,0|2,0,0]=4 4055 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [1,1,0,0,0,0|0,0,0]=2 4056 B12R1.107 O=C(O)C[C@H](O)c1ccccn1 Amb33360787 [1,1,0,0,0,0|1,0,0]=3 4057 B12R1.107 O=C(O)C[C@H](O)c1cccnc1 Amb33360065 [1,1,0,0,0,0|1,0,0]=3 4058 B12R1.107 O=C(O)C[C@H](O)c1ccncc1 Amb33380662 [1,1,0,0,0,0|1,0,0]=3 4059 B12R1.107 O=C(O)C[C@H](O)c1ccncn1 Amb33269011 [1,1,0,0,0,0|2,0,0]=4 4060 B12R1.107 O=C(O)C[C@H](O)c1cnccn1 Amb33359993 [1,1,0,0,0,0|2,0,0]=4 4061 B12R1.107 O=C(O)C[C@H](O)c1cncnc1 Amb33149205 [1,1,0,0,0,0|2,0,0]=4 4062 B12R1.107 O=C(O)C[C@H](O)c1ncccn1 Amb33270408 [1,1,0,0,0,0|2,0,0]=4 4063 B12R1.107 O=C(O)\C=C(/Cl)c1ccccc1 Amb17594707 [1,1,0,0,0,0|0,0,2]=4 4064 B12R1.107 O=C(O)\C=C(/I)c1ccccc1 Amb33620462 [1,1,0,0,0,0|0,0,2]=4 4065 B12R1.107 O=C(O)\C=C(\O)c1ccccc1 Amb28052099 [1,1,0,0,0,0|0,0,2]=4 4066 B12R1.107 O=C(S)CC(O)c1ccccc1 Amb27197171 [1,1,0,0,0,0|0,1,0]=3 4067 B12R1.107 O=[N+]([O-])CC(O)c1ccccc1 Amb1048142 [1,1,0,0,0,0|1,0,1]=4 4068 B12R1.125 C=C(Cl)CCc1ccccc1Cl Amb6298966 [1,1,0,0,0,0|2,0,0]=4 4069 B12R1.125 CC(=O)CCc1ccccc1Br Amb9031563 [1,1,0,0,0,0|1,0,0]=3 4070 B12R1.125 CC(=O)CCc1ccccc1C Amb9031558 [1,1,0,0,0,0|1,0,0]=3 4071 B12R1.125 CC(=O)CCc1ccccc1Cl Amb9031570 [1,1,0,0,0,0|1,0,0]=3 4072 B12R1.125 CC(=O)CCc1ccccc1F Amb9031573 [1,1,0,0,0,0|1,0,0]=3 4073 B12R1.125 CC(=O)CCc1ccccc1N Amb27246247 [1,1,0,0,0,0|1,0,0]=3 4074 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [1,1,0,0,0,0|1,0,0]=3 4075 B12R1.125 CC(=O)CCc1cccnc1Br Amb33388129 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.125 CC(=O)CCc1cccnc1C Amb25859556 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.125 CC(=O)CCc1cccnc1Cl Amb25731066 [1,1,0,0,0,0|2,0,0]=4 4078 B12R1.125 CC(=O)CCc1cccnc1F Amb33377141 [1,1,0,0,0,0|2,0,0]=4 4079 B12R1.125 CC(=O)CCc1ccncc1Br Amb33385809 [1,1,0,0,0,0|2,0,0]=4 4080 B12R1.125 CC(=O)CCc1ccncc1C Amb26449976 [1,1,0,0,0,0|2,0,0]=4 4081 B12R1.125 CC(=O)CCc1ccncc1Cl Amb24678607 [1,1,0,0,0,0|2,0,0]=4 4082 B12R1.125 CC(=O)CCc1ccncc1F Amb26657206 [1,1,0,0,0,0|2,0,0]=4 4083 B12R1.125 CC(=O)CCc1cnccc1C Amb28205627 [1,1,0,0,0,0|2,0,0]=4 4084 B12R1.125 CC(=O)CCc1ncccc1Br Amb25703295 [1,1,0,0,0,0|2,0,0]=4 4085 B12R1.125 CC(=O)CCc1ncccc1C Amb26961458 [1,1,0,0,0,0|2,0,0]=4 4086 B12R1.125 CC(=O)CCc1ncccc1F Amb33419609 [1,1,0,0,0,0|2,0,0]=4 4087 B12R1.125 CC(=O)CNc1ccccc1C Amb25062983 [1,1,0,0,0,0|2,0,0]=4 4088 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [1,1,0,0,0,0|2,0,0]=4 4089 B12R1.125 CC(=O)COc1ccccc1F Amb9269602 [1,1,0,0,0,0|2,0,0]=4 4090 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.125 CC(=O)CSc1ccccc1Br Amb9229574 [1,1,0,0,0,0|2,0,0]=4 4092 B12R1.125 CC(=O)CSc1ccccc1C Amb18796318 [1,1,0,0,0,0|2,0,0]=4 4093 B12R1.125 CC(=O)CSc1ccccc1Cl Amb4744662 [1,1,0,0,0,0|2,0,0]=4 4094 B12R1.125 CC(=O)CSc1ccccc1F Amb9268572 [1,1,0,0,0,0|2,0,0]=4 4095 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [1,1,0,0,0,0|2,0,0]=4 4096 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [1,1,0,0,0,0|2,0,0]=4 4097 B12R1.125 CC(=O)NCc1ccccc1Cl Amb3094828 [1,1,0,0,0,0|2,0,0]=4 4098 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [1,1,0,0,0,0|2,0,0]=4 4099 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [1,1,0,0,0,0|2,0,0]=4 4100 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [1,1,0,0,0,0|2,0,0]=4 4101 B12R1.125 CC(=O)OCc1ccccc1N Amb27985013 [1,1,0,0,0,0|2,0,0]=4 4102 B12R1.125 CC(=O)SCc1ccccc1Cl Amb27767953 [1,1,0,0,0,0|2,0,0]=4 4103 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [1,1,0,0,0,0|1,0,1]=4 4104 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [1,1,0,0,0,0|1,0,1]=4 4105 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [1,1,0,0,0,0|1,0,1]=4 4106 B12R1.125 CC(O)CCc1ccccc1O Amb17507249 [1,1,0,0,0,0|1,0,1]=4 4107 B12R1.125 CN1C=CC=C\C1=N/CC(=O)O Amb26390980 [1,1,0,0,0,0|2,0,0]=4 4108 B12R1.125 C[C@@H](O)CCc1ccccc1Br Amb33387630 [1,1,0,0,0,0|1,0,1]=4 4109 B12R1.125 C[C@@H](O)CCc1ccccc1Cl Amb33052597 [1,1,0,0,0,0|1,0,1]=4 4110 B12R1.125 C[C@@H](O)CCc1ccccc1F Amb33361481 [1,1,0,0,0,0|1,0,1]=4 4111 B12R1.125 C[C@@H](O)CCc1ccccc1O Amb33196173 [1,1,0,0,0,0|1,0,1]=4 4112 B12R1.125 C[C@H](O)CCc1ccccc1Br Amb33387628 [1,1,0,0,0,0|1,0,1]=4 4113 B12R1.125 C[C@H](O)CCc1ccccc1Cl Amb33052594 [1,1,0,0,0,0|1,0,1]=4 4114 B12R1.125 C[C@H](O)CCc1ccccc1F Amb33361482 [1,1,0,0,0,0|1,0,1]=4 4115 B12R1.125 C[C@H](O)CCc1ccccc1O Amb33196408 [1,1,0,0,0,0|1,0,1]=4 4116 B12R1.125 Cc1cccc[n+]1CCC(=O)O Amb31127611 [1,1,0,0,0,0|1,0,0]=3 4117 B12R1.125 Cc1ccccc1C#CC(=O)O Amb20673097 [1,1,0,0,0,0|0,0,2]=4 4118 B12R1.125 Cc1ccccc1CCC(=N)N Amb18065464 [1,1,0,0,0,0|2,0,0]=4 4119 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [1,1,0,0,0,0|1,0,0]=3 4120 B12R1.125 Cc1ccccc1CCC(=O)O Amb2689629 [1,1,0,0,0,0|0,0,0]=2 4121 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [1,1,0,0,0,0|1,0,1]=4 4122 B12R1.125 Cc1ccccc1CCC(N)=O Amb17400134 [1,1,0,0,0,0|1,0,0]=3 4123 B12R1.125 Cc1ccccc1CC[C@@H](C)O Amb33360566 [1,1,0,0,0,0|1,0,1]=4 4124 B12R1.125 Cc1ccccc1CC[C@H](C)O Amb33360567 [1,1,0,0,0,0|1,0,1]=4 4125 B12R1.125 Cc1ccccc1CC[N+](=O)[O-] Amb17400176 [1,1,0,0,0,0|1,0,1]=4 4126 B12R1.125 Cc1ccccc1CNC(=O)Cl Amb35625504 [1,1,0,0,0,0|2,0,0]=4 4127 B12R1.125 Cc1ccccc1COC(=O)Cl Amb27416351 [1,1,0,0,0,0|2,0,0]=4 4128 B12R1.125 Cc1ccccc1NCC(=O)Cl Amb27400550 [1,1,0,0,0,0|2,0,0]=4 4129 B12R1.125 Cc1ccccc1NCC(=O)O Amb1258286 [1,1,0,0,0,0|1,0,0]=3 4130 B12R1.125 Cc1ccccc1NCC(N)=O Amb845279 [1,1,0,0,0,0|2,0,0]=4 4131 B12R1.125 Cc1ccccc1OCC(=O)Cl Amb10880009 [1,1,0,0,0,0|2,0,0]=4 4132 B12R1.125 Cc1ccccc1OCC(=O)O Amb1215022 [1,1,0,0,0,0|1,0,0]=3 4133 B12R1.125 Cc1ccccc1OCC(N)=O Amb6334508 [1,1,0,0,0,0|2,0,0]=4 4134 B12R1.125 Cc1ccccc1SCC(=O)O Amb1205492 [1,1,0,0,0,0|1,0,0]=3 4135 B12R1.125 Cc1ccccc1\C=C/C(=O)O Amb27871584 [1,1,0,0,0,0|0,0,2]=4 4136 B12R1.125 Cc1ccccc1\C=C\C(=O)O Amb6555165 [1,1,0,0,0,0|0,0,2]=4 4137 B12R1.125 Cc1cccnc1CCC(=O)O Amb8009794 [1,1,0,0,0,0|1,0,0]=3 4138 B12R1.125 Cc1cccnc1OCC(=O)O Amb25154207 [1,1,0,0,0,0|2,0,0]=4 4139 B12R1.125 Cc1cccnc1SCC(=O)O Amb18989775 [1,1,0,0,0,0|2,0,0]=4 4140 B12R1.125 Cc1ccncc1CCC(=O)O Amb18828438 [1,1,0,0,0,0|1,0,0]=3 4141 B12R1.125 Cc1ccncc1CCC(N)=O Amb28077684 [1,1,0,0,0,0|2,0,0]=4 4142 B12R1.125 Cc1ccncc1OCC(=O)O Amb32946290 [1,1,0,0,0,0|2,0,0]=4 4143 B12R1.125 Cc1cnccc1CCC(=O)O Amb8009991 [1,1,0,0,0,0|1,0,0]=3 4144 B12R1.125 Cc1cnccc1NCC(=O)O Amb27393345 [1,1,0,0,0,0|2,0,0]=4 4145 B12R1.125 Cc1cnccc1OCC(=O)O Amb25705533 [1,1,0,0,0,0|2,0,0]=4 4146 B12R1.125 Cc1cncnc1CCC(=O)O Amb18827882 [1,1,0,0,0,0|2,0,0]=4 4147 B12R1.125 Cc1ncccc1CCC(=O)O Amb18853387 [1,1,0,0,0,0|1,0,0]=3 4148 B12R1.125 Cc1ncccc1CCC(=O)O Amb31307907 [1,1,0,0,0,0|1,0,0]=3 4149 B12R1.125 Cc1ncccc1OCC(=O)O Amb24729073 [1,1,0,0,0,0|2,0,0]=4 4150 B12R1.125 Cc1nccnc1CCC(=O)O Amb33142866 [1,1,0,0,0,0|2,0,0]=4 4151 B12R1.125 Cc1ncncc1CCC(=O)O Amb18827881 [1,1,0,0,0,0|2,0,0]=4 4152 B12R1.125 Cc1nnccc1CCC(=O)O Amb33470277 [1,1,0,0,0,0|2,0,0]=4 4153 B12R1.125 N=C(N)CCc1ccccc1Br Amb18070244 [1,1,0,0,0,0|2,0,0]=4 4154 B12R1.125 N=C(N)CCc1ccccc1Cl Amb10844871 [1,1,0,0,0,0|2,0,0]=4 4155 B12R1.125 N=C(N)CCc1ccccc1F Amb18563718 [1,1,0,0,0,0|2,0,0]=4 4156 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [1,1,0,0,0,0|1,0,0]=3 4157 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [1,1,0,0,0,0|1,0,0]=3 4158 B12R1.125 NC(=O)CCc1ccccc1F Amb8341221 [1,1,0,0,0,0|1,0,0]=3 4159 B12R1.125 NC(=O)CCc1ccccc1N Amb8941622 [1,1,0,0,0,0|1,0,0]=3 4160 B12R1.125 NC(=O)CCc1ccccc1O Amb2695332 [1,1,0,0,0,0|1,0,0]=3 4161 B12R1.125 NC(=O)CNc1ccccc1Br Amb6712122 [1,1,0,0,0,0|2,0,0]=4 4162 B12R1.125 NC(=O)CNc1ccccc1Cl Amb500616 [1,1,0,0,0,0|2,0,0]=4 4163 B12R1.125 NC(=O)CNc1ccccc1F Amb6712534 [1,1,0,0,0,0|2,0,0]=4 4164 B12R1.125 NC(=O)CNc1ccccc1O Amb28323151 [1,1,0,0,0,0|2,0,0]=4 4165 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [1,1,0,0,0,0|2,0,0]=4 4166 B12R1.125 NC(=O)COc1ccccc1Cl Amb3738387 [1,1,0,0,0,0|2,0,0]=4 4167 B12R1.125 NC(=O)COc1ccccc1F Amb8335270 [1,1,0,0,0,0|2,0,0]=4 4168 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [1,1,0,0,0,0|2,0,0]=4 4169 B12R1.125 NC(=O)COc1ccccc1N Amb6662641 [1,1,0,0,0,0|2,0,0]=4 4170 B12R1.125 NC(=O)COc1ccccc1O Amb8505284 [1,1,0,0,0,0|2,0,0]=4 4171 B12R1.125 NC(=O)CSc1ccccc1Cl Amb4534168 [1,1,0,0,0,0|2,0,0]=4 4172 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [1,1,0,0,0,0|2,0,0]=4 4173 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [1,1,0,0,0,0|2,0,0]=4 4174 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [1,1,0,0,0,0|2,0,0]=4 4175 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [1,1,0,0,0,0|2,0,0]=4 4176 B12R1.125 NC(=O)NCc1ccccc1O Amb27401863 [1,1,0,0,0,0|2,0,0]=4 4177 B12R1.125 NC(=O)OCc1ccccc1Cl Amb27233024 [1,1,0,0,0,0|2,0,0]=4 4178 B12R1.125 NC(=O)OCc1ccccc1F Amb27770205 [1,1,0,0,0,0|2,0,0]=4 4179 B12R1.125 Nc1cccc[n+]1CCC(=O)[O-] Amb27607731 [1,1,0,0,0,0|1,0,1]=4 4180 B12R1.125 Nc1ccccc1C#CC(=O)O Amb24355867 [1,1,0,0,0,0|0,0,2]=4 4181 B12R1.125 Nc1ccccc1CCC(=O)O Amb17477727 [1,1,0,0,0,0|0,0,0]=2 4182 B12R1.125 Nc1ccccc1CCC(=O)O Amb24118035 [1,1,0,0,0,0|0,0,0]=2 4183 B12R1.125 Nc1ccccc1CCC(=O)[O-] Amb34189651 [1,1,0,0,0,0|0,0,1]=3 4184 B12R1.125 Nc1ccccc1NCS(=O)O Amb27986124 [1,1,0,0,0,0|2,0,0]=4 4185 B12R1.125 Nc1ccccc1OCC(=O)O Amb4065760 [1,1,0,0,0,0|1,0,0]=3 4186 B12R1.125 Nc1ccccc1OCC(=O)[O-] Amb21972214 [1,1,0,0,0,0|1,0,1]=4 4187 B12R1.125 Nc1ccccc1SCC(=O)Cl Amb28073003 [1,1,0,0,0,0|2,0,0]=4 4188 B12R1.125 Nc1ccccc1SCC(=O)O Amb6267584 [1,1,0,0,0,0|1,0,0]=3 4189 B12R1.125 Nc1ccccc1\C=C\C(=O)O Amb17777291 [1,1,0,0,0,0|0,0,2]=4 4190 B12R1.125 Nc1cccnc1NCC(=O)O Amb18989766 [1,1,0,0,0,0|2,0,0]=4 4191 B12R1.125 Nc1cnccc1NCC(=O)O Amb18987716 [1,1,0,0,0,0|2,0,0]=4 4192 B12R1.125 O=C(Br)COc1ccccc1Cl Amb27481125 [1,1,0,0,0,0|2,0,0]=4 4193 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [1,1,0,0,0,0|1,0,0]=3 4194 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [1,1,0,0,0,0|1,0,0]=3 4195 B12R1.125 O=C(Cl)CCc1ccccc1F Amb10838958 [1,1,0,0,0,0|1,0,0]=3 4196 B12R1.125 O=C(Cl)CNc1ccccc1Cl Amb28239488 [1,1,0,0,0,0|2,0,0]=4 4197 B12R1.125 O=C(Cl)COc1ccccc1Br Amb16230053 [1,1,0,0,0,0|2,0,0]=4 4198 B12R1.125 O=C(Cl)COc1ccccc1Cl Amb16230049 [1,1,0,0,0,0|2,0,0]=4 4199 B12R1.125 O=C(Cl)COc1ccccc1F Amb10880012 [1,1,0,0,0,0|2,0,0]=4 4200 B12R1.125 O=C(Cl)CSc1ccccc1Cl Amb17143819 [1,1,0,0,0,0|2,0,0]=4 4201 B12R1.125 O=C(Cl)NCc1ccccc1Br Amb35625598 [1,1,0,0,0,0|2,0,0]=4 4202 B12R1.125 O=C(Cl)NCc1ccccc1Cl Amb35637057 [1,1,0,0,0,0|2,0,0]=4 4203 B12R1.125 O=C(Cl)NCc1ccccc1F Amb35625946 [1,1,0,0,0,0|2,0,0]=4 4204 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [1,1,0,0,0,0|2,0,0]=4 4205 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [1,1,0,0,0,0|2,0,0]=4 4206 B12R1.125 O=C(O)C#Cc1ccccc1Br Amb25266206 [1,1,0,0,0,0|0,0,2]=4 4207 B12R1.125 O=C(O)C#Cc1ccccc1Cl Amb2616696 [1,1,0,0,0,0|0,0,2]=4 4208 B12R1.125 O=C(O)C#Cc1ccccc1F Amb7172545 [1,1,0,0,0,0|0,0,2]=4 4209 B12R1.125 O=C(O)C#Cc1ccccc1O Amb25921689 [1,1,0,0,0,0|0,0,2]=4 4210 B12R1.125 O=C(O)CCC1=CN=CNC1=O Amb23248037 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.125 O=C(O)CCC1=CNC=CC1=O Amb33470235 [1,1,0,0,0,0|1,0,0]=3 4212 B12R1.125 O=C(O)CCC1=NC=CNC1=O Amb26459147 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.125 O=C(O)CCN1C=CC=CC1=O Amb18534261 [1,1,0,0,0,0|1,0,0]=3 4214 B12R1.125 O=C(O)CCN1C=CC=CC1=S Amb28076674 [1,1,0,0,0,0|1,0,0]=3 4215 B12R1.125 O=C(O)CCN1C=CC=NC1=O Amb19372721 [1,1,0,0,0,0|2,0,0]=4 4216 B12R1.125 O=C(O)CCN1C=NC=CC1=O Amb33530561 [1,1,0,0,0,0|2,0,0]=4 4217 B12R1.125 O=C(O)CCN1N=CC=CC1=O Amb18998778 [1,1,0,0,0,0|2,0,0]=4 4218 B12R1.125 O=C(O)CCc1ccccc1Br Amb2685458 [1,1,0,0,0,0|0,0,0]=2 4219 B12R1.125 O=C(O)CCc1ccccc1Cl Amb1209214 [1,1,0,0,0,0|0,0,0]=2 4220 B12R1.125 O=C(O)CCc1ccccc1F Amb6336154 [1,1,0,0,0,0|0,0,0]=2 4221 B12R1.125 O=C(O)CCc1ccccc1I Amb10071543 [1,1,0,0,0,0|0,0,0]=2 4222 B12R1.125 O=C(O)CCc1ccccc1O Amb1211927 [1,1,0,0,0,0|0,0,0]=2 4223 B12R1.125 O=C(O)CCc1ccccc1S Amb18648646 [1,1,0,0,0,0|0,0,0]=2 4224 B12R1.125 O=C(O)CCc1cccnc1Br Amb24525068 [1,1,0,0,0,0|1,0,0]=3 4225 B12R1.125 O=C(O)CCc1cccnc1Cl Amb24484270 [1,1,0,0,0,0|1,0,0]=3 4226 B12R1.125 O=C(O)CCc1cccnc1F Amb25295347 [1,1,0,0,0,0|1,0,0]=3 4227 B12R1.125 O=C(O)CCc1ccncc1Br Amb33242388 [1,1,0,0,0,0|1,0,0]=3 4228 B12R1.125 O=C(O)CCc1ccncc1Cl Amb23596515 [1,1,0,0,0,0|1,0,0]=3 4229 B12R1.125 O=C(O)CCc1ccncc1F Amb26644078 [1,1,0,0,0,0|1,0,0]=3 4230 B12R1.125 O=C(O)CCc1ccncc1O Amb27201932 [1,1,0,0,0,0|1,0,0]=3 4231 B12R1.125 O=C(O)CCc1cncnc1Cl Amb18821790 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.125 O=C(O)CCc1ncccc1Br Amb25898946 [1,1,0,0,0,0|1,0,0]=3 4233 B12R1.125 O=C(O)CCc1ncccc1Cl Amb33470280 [1,1,0,0,0,0|1,0,0]=3 4234 B12R1.125 O=C(O)CCc1ncccc1F Amb25311377 [1,1,0,0,0,0|1,0,0]=3 4235 B12R1.125 O=C(O)CCc1ncccc1O Amb28249996 [1,1,0,0,0,0|1,0,0]=3 4236 B12R1.125 O=C(O)CCc1ncncc1Br Amb33470251 [1,1,0,0,0,0|2,0,0]=4 4237 B12R1.125 O=C(O)CNc1ccccc1Br Amb840526 [1,1,0,0,0,0|1,0,0]=3 4238 B12R1.125 O=C(O)CNc1ccccc1Cl Amb33528017 [1,1,0,0,0,0|1,0,0]=3 4239 B12R1.125 O=C(O)CNc1ccccc1F Amb840521 [1,1,0,0,0,0|1,0,0]=3 4240 B12R1.125 O=C(O)CNc1ccccc1O Amb842591 [1,1,0,0,0,0|1,0,0]=3 4241 B12R1.125 O=C(O)CNc1cccnc1Cl Amb27770209 [1,1,0,0,0,0|2,0,0]=4 4242 B12R1.125 O=C(O)CNc1ccncc1Br Amb27826042 [1,1,0,0,0,0|2,0,0]=4 4243 B12R1.125 O=C(O)CNc1ccncc1F Amb30036425 [1,1,0,0,0,0|2,0,0]=4 4244 B12R1.125 O=C(O)CNc1cnccc1Cl Amb22495942 [1,1,0,0,0,0|2,0,0]=4 4245 B12R1.125 O=C(O)CNc1ncccc1Cl Amb2372425 [1,1,0,0,0,0|2,0,0]=4 4246 B12R1.125 O=C(O)CNc1ncccc1O Amb25891362 [1,1,0,0,0,0|2,0,0]=4 4247 B12R1.125 O=C(O)COC1=CC=CCC1=S Amb28366613 [1,1,0,0,0,0|1,0,1]=4 4248 B12R1.125 O=C(O)COC1=CC=CNC1=O Amb32946096 [1,1,0,0,0,0|2,0,0]=4 4249 B12R1.125 O=C(O)COC1=CNC=CC1=O Amb27985853 [1,1,0,0,0,0|2,0,0]=4 4250 B12R1.125 O=C(O)COC1=COC=CC1=O Amb27875124 [1,1,0,0,0,0|2,0,0]=4 4251 B12R1.125 O=C(O)COc1ccccc1Br Amb6364728 [1,1,0,0,0,0|1,0,0]=3 4252 B12R1.125 O=C(O)COc1ccccc1Cl Amb6336452 [1,1,0,0,0,0|1,0,0]=3 4253 B12R1.125 O=C(O)COc1ccccc1F Amb6335614 [1,1,0,0,0,0|1,0,0]=3 4254 B12R1.125 O=C(O)COc1ccccc1I Amb9339538 [1,1,0,0,0,0|1,0,0]=3 4255 B12R1.125 O=C(O)COc1ccccc1O Amb1030005 [1,1,0,0,0,0|1,0,0]=3 4256 B12R1.125 O=C(O)COc1cccnc1Br Amb9768119 [1,1,0,0,0,0|2,0,0]=4 4257 B12R1.125 O=C(O)COc1cccnc1Cl Amb32946272 [1,1,0,0,0,0|2,0,0]=4 4258 B12R1.125 O=C(O)COc1cccnc1F Amb32946301 [1,1,0,0,0,0|2,0,0]=4 4259 B12R1.125 O=C(O)COc1ccncc1Br Amb26428934 [1,1,0,0,0,0|2,0,0]=4 4260 B12R1.125 O=C(O)COc1ccncc1Cl Amb25877223 [1,1,0,0,0,0|2,0,0]=4 4261 B12R1.125 O=C(O)COc1ccncc1F Amb32797349 [1,1,0,0,0,0|2,0,0]=4 4262 B12R1.125 O=C(O)COc1ncccc1Br Amb27967686 [1,1,0,0,0,0|2,0,0]=4 4263 B12R1.125 O=C(O)COc1ncccc1F Amb28139994 [1,1,0,0,0,0|2,0,0]=4 4264 B12R1.125 O=C(O)CSc1cccc[n+]1[O-] Amb1104911 [1,1,0,0,0,0|2,0,0]=4 4265 B12R1.125 O=C(O)CSc1ccccc1Br Amb1113386 [1,1,0,0,0,0|1,0,0]=3 4266 B12R1.125 O=C(O)CSc1ccccc1Cl Amb1105912 [1,1,0,0,0,0|1,0,0]=3 4267 B12R1.125 O=C(O)CSc1ccccc1F Amb1105913 [1,1,0,0,0,0|1,0,0]=3 4268 B12R1.125 O=C(O)CSc1ccccc1O Amb18294823 [1,1,0,0,0,0|1,0,0]=3 4269 B12R1.125 O=C(O)CSc1ccncc1Br Amb27615473 [1,1,0,0,0,0|2,0,0]=4 4270 B12R1.125 O=C(O)CSc1ccncc1Cl Amb23557951 [1,1,0,0,0,0|2,0,0]=4 4271 B12R1.125 O=C(O)CSc1ccncc1F Amb35737115 [1,1,0,0,0,0|2,0,0]=4 4272 B12R1.125 O=C(O)CSc1ncccc1Br Amb18979322 [1,1,0,0,0,0|2,0,0]=4 4273 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb33718813 [1,1,0,0,0,0|0,0,2]=4 4274 B12R1.125 O=C(O)\C=C\c1ccccc1Br Amb6664185 [1,1,0,0,0,0|0,0,2]=4 4275 B12R1.125 O=C(O)\C=C\c1ccccc1Cl Amb6336512 [1,1,0,0,0,0|0,0,2]=4 4276 B12R1.125 O=C(O)\C=C\c1ccccc1F Amb6545502 [1,1,0,0,0,0|0,0,2]=4 4277 B12R1.125 O=C(O)\C=C\c1ccccc1I Amb22584152 [1,1,0,0,0,0|0,0,2]=4 4278 B12R1.125 O=C(O)\C=C\c1ccccc1O Amb8513188 [1,1,0,0,0,0|0,0,2]=4 4279 B12R1.125 O=C([O-])CCc1ccccc1F Amb15692476 [1,1,0,0,0,0|0,0,1]=3 4280 B12R1.125 O=S([O-])CCc1ccccc1Br Amb32755052 [1,1,0,0,0,0|1,0,1]=4 4281 B12R1.125 O=S([O-])CCc1ccccc1Cl Amb32755617 [1,1,0,0,0,0|1,0,1]=4 4282 B12R1.125 O=S([O-])CCc1ccccc1F Amb32755634 [1,1,0,0,0,0|1,0,1]=4 4283 B12R1.125 O=[N+]([O-])CCc1ccccc1Br Amb26372563 [1,1,0,0,0,0|1,0,1]=4 4284 B12R1.125 O=[N+]([O-])CCc1ccccc1Cl Amb17401072 [1,1,0,0,0,0|1,0,1]=4 4285 B12R1.125 O=[N+]([O-])CCc1ccccc1F Amb17400297 [1,1,0,0,0,0|1,0,1]=4 4286 B12R1.125 O=[N+]([O-])CCc1ccccc1O Amb25892692 [1,1,0,0,0,0|1,0,1]=4 4287 B12R1.125 OB(O)CCc1ccccc1Br Amb27986176 [1,1,0,0,0,0|1,0,1]=4 4288 B12R1.125 OB(O)CCc1ccccc1Cl Amb27639202 [1,1,0,0,0,0|1,0,1]=4 4289 B12R1.125 OB(O)CCc1ccccc1F Amb26016822 [1,1,0,0,0,0|1,0,1]=4 4290 B12R1.226 C=C(C)CCc1cccc(O)c1 Amb8388640 [1,1,0,0,0,0|2,0,0]=4 4291 B12R1.226 CC(=O)CCc1cc(C)ccn1 Amb33317812 [1,1,0,0,0,0|2,0,0]=4 4292 B12R1.226 CC(=O)CCc1cc(F)ccn1 Amb33325516 [1,1,0,0,0,0|2,0,0]=4 4293 B12R1.226 CC(=O)CCc1cccc(Br)c1 Amb9031557 [1,1,0,0,0,0|1,0,0]=3 4294 B12R1.226 CC(=O)CCc1cccc(Br)n1 Amb33433542 [1,1,0,0,0,0|2,0,0]=4 4295 B12R1.226 CC(=O)CCc1cccc(C)c1 Amb8869632 [1,1,0,0,0,0|1,0,0]=3 4296 B12R1.226 CC(=O)CCc1cccc(C)n1 Amb27480062 [1,1,0,0,0,0|2,0,0]=4 4297 B12R1.226 CC(=O)CCc1cccc(Cl)c1 Amb9031572 [1,1,0,0,0,0|1,0,0]=3 4298 B12R1.226 CC(=O)CCc1cccc(Cl)n1 Amb33222652 [1,1,0,0,0,0|2,0,0]=4 4299 B12R1.226 CC(=O)CCc1cccc(F)c1 Amb9031555 [1,1,0,0,0,0|1,0,0]=3 4300 B12R1.226 CC(=O)CCc1cccc(N)c1 Amb26452029 [1,1,0,0,0,0|1,0,0]=3 4301 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [1,1,0,0,0,0|1,0,0]=3 4302 B12R1.226 CC(=O)CCc1cccc(O)n1 Amb24605336 [1,1,0,0,0,0|2,0,0]=4 4303 B12R1.226 CC(=O)CCc1ccnc(C)c1 Amb24677051 [1,1,0,0,0,0|2,0,0]=4 4304 B12R1.226 CC(=O)CCc1cncc(Br)c1 Amb28401345 [1,1,0,0,0,0|2,0,0]=4 4305 B12R1.226 CC(=O)CCc1cncc(C)c1 Amb27657326 [1,1,0,0,0,0|2,0,0]=4 4306 B12R1.226 CC(=O)CCc1cncc(F)c1 Amb25034788 [1,1,0,0,0,0|2,0,0]=4 4307 B12R1.226 CC(=O)COc1cccc(Br)c1 Amb17226706 [1,1,0,0,0,0|2,0,0]=4 4308 B12R1.226 CC(=O)COc1cccc(I)c1 Amb27829069 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.226 CC(=O)COc1cccc(N)c1 Amb17110084 [1,1,0,0,0,0|2,0,0]=4 4310 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.226 CC(=O)CSc1cccc(C)c1 Amb18791171 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.226 CC(=O)CSc1cccc(F)c1 Amb28386048 [1,1,0,0,0,0|2,0,0]=4 4314 B12R1.226 CC(=O)NCc1cccc(Br)c1 Amb2085743 [1,1,0,0,0,0|2,0,0]=4 4315 B12R1.226 CC(=O)NCc1cccc(Cl)c1 Amb2023612 [1,1,0,0,0,0|2,0,0]=4 4316 B12R1.226 CC(=O)NCc1cccc(F)c1 Amb33546305 [1,1,0,0,0,0|2,0,0]=4 4317 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [1,1,0,0,0,0|2,0,0]=4 4318 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [1,1,0,0,0,0|2,0,0]=4 4319 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [1,1,0,0,0,0|2,0,0]=4 4320 B12R1.226 CC(=O)OCc1cccc(O)c1 Amb26427066 [1,1,0,0,0,0|2,0,0]=4 4321 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [1,1,0,0,0,0|2,0,0]=4 4322 B12R1.226 CC(=O)SCc1cccc(I)c1 Amb27770074 [1,1,0,0,0,0|2,0,0]=4 4323 B12R1.226 CC(O)CCc1cccc(Br)c1 Amb27972790 [1,1,0,0,0,0|1,0,1]=4 4324 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [1,1,0,0,0,0|1,0,1]=4 4325 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [1,1,0,0,0,0|1,0,1]=4 4326 B12R1.226 CC(O)CCc1cccc(N)c1 Amb27482979 [1,1,0,0,0,0|1,0,1]=4 4327 B12R1.226 CC(O)CCc1cccc(O)c1 Amb25251886 [1,1,0,0,0,0|1,0,1]=4 4328 B12R1.226 C[C@@H](O)CCc1cccc(Br)c1 Amb33451604 [1,1,0,0,0,0|1,0,1]=4 4329 B12R1.226 C[C@@H](O)CCc1cccc(Cl)c1 Amb33223349 [1,1,0,0,0,0|1,0,1]=4 4330 B12R1.226 C[C@@H](O)CCc1cccc(F)c1 Amb33316033 [1,1,0,0,0,0|1,0,1]=4 4331 B12R1.226 C[C@@H](O)CCc1cccc(O)c1 Amb33310960 [1,1,0,0,0,0|1,0,1]=4 4332 B12R1.226 C[C@H](O)CCc1cccc(Br)c1 Amb33451603 [1,1,0,0,0,0|1,0,1]=4 4333 B12R1.226 C[C@H](O)CCc1cccc(Cl)c1 Amb33223330 [1,1,0,0,0,0|1,0,1]=4 4334 B12R1.226 C[C@H](O)CCc1cccc(F)c1 Amb33316035 [1,1,0,0,0,0|1,0,1]=4 4335 B12R1.226 C[C@H](O)CCc1cccc(O)c1 Amb33310962 [1,1,0,0,0,0|1,0,1]=4 4336 B12R1.226 Cc1cc(CCC(=O)O)ccn1 Amb22886572 [1,1,0,0,0,0|1,0,0]=3 4337 B12R1.226 Cc1cc(CCC(=O)O)ncn1 Amb18827877 [1,1,0,0,0,0|2,0,0]=4 4338 B12R1.226 Cc1cc(OCC(=O)O)ccn1 Amb24450470 [1,1,0,0,0,0|2,0,0]=4 4339 B12R1.226 Cc1cccc(C#CC(=O)O)c1 Amb20673071 [1,1,0,0,0,0|0,0,2]=4 4340 B12R1.226 Cc1cccc(CCB(O)O)c1 Amb25790748 [1,1,0,0,0,0|1,0,1]=4 4341 B12R1.226 Cc1cccc(CCC(=N)N)c1 Amb18065465 [1,1,0,0,0,0|2,0,0]=4 4342 B12R1.226 Cc1cccc(CCC(=O)Cl)c1 Amb18325287 [1,1,0,0,0,0|1,0,0]=3 4343 B12R1.226 Cc1cccc(CCC(=O)O)c1 Amb1106242 [1,1,0,0,0,0|0,0,0]=2 4344 B12R1.226 Cc1cccc(CCC(=O)O)n1 Amb8009795 [1,1,0,0,0,0|1,0,0]=3 4345 B12R1.226 Cc1cccc(CCC(C)O)c1 Amb17507253 [1,1,0,0,0,0|1,0,1]=4 4346 B12R1.226 Cc1cccc(CCC(N)=O)c1 Amb17400135 [1,1,0,0,0,0|1,0,0]=3 4347 B12R1.226 Cc1cccc(CC[C@@H](C)O)c1 Amb33203919 [1,1,0,0,0,0|1,0,1]=4 4348 B12R1.226 Cc1cccc(CC[C@H](C)O)c1 Amb33203920 [1,1,0,0,0,0|1,0,1]=4 4349 B12R1.226 Cc1cccc(CC[N+](=O)[O-])c1 Amb17400177 [1,1,0,0,0,0|1,0,1]=4 4350 B12R1.226 Cc1cccc(CNC(=O)Cl)c1 Amb35625652 [1,1,0,0,0,0|2,0,0]=4 4351 B12R1.226 Cc1cccc(COC(N)=O)c1 Amb27165818 [1,1,0,0,0,0|2,0,0]=4 4352 B12R1.226 Cc1cccc(NCC(=O)O)c1 Amb840514 [1,1,0,0,0,0|1,0,0]=3 4353 B12R1.226 Cc1cccc(NCC(N)=O)c1 Amb6706700 [1,1,0,0,0,0|2,0,0]=4 4354 B12R1.226 Cc1cccc(OCC(=O)Cl)c1 Amb10880010 [1,1,0,0,0,0|2,0,0]=4 4355 B12R1.226 Cc1cccc(OCC(=O)O)c1 Amb6336446 [1,1,0,0,0,0|1,0,0]=3 4356 B12R1.226 Cc1cccc(OCC(=O)O)n1 Amb24389213 [1,1,0,0,0,0|2,0,0]=4 4357 B12R1.226 Cc1cccc(OCC(N)=O)c1 Amb6346003 [1,1,0,0,0,0|2,0,0]=4 4358 B12R1.226 Cc1cccc(SCC(=O)Cl)c1 Amb17143249 [1,1,0,0,0,0|2,0,0]=4 4359 B12R1.226 Cc1cccc(SCC(=O)O)c1 Amb5768509 [1,1,0,0,0,0|1,0,0]=3 4360 B12R1.226 Cc1cccc(SCC(N)=O)c1 Amb17142988 [1,1,0,0,0,0|2,0,0]=4 4361 B12R1.226 Cc1cccc(\C=C\C(=O)O)c1 Amb2720533 [1,1,0,0,0,0|0,0,2]=4 4362 B12R1.226 Cc1ccnc(CCC(=O)O)c1 Amb18828439 [1,1,0,0,0,0|1,0,0]=3 4363 B12R1.226 Cc1ccnc(CCC(=O)O)n1 Amb18862660 [1,1,0,0,0,0|2,0,0]=4 4364 B12R1.226 Cc1ccnc(NCC(=O)O)c1 Amb10597602 [1,1,0,0,0,0|2,0,0]=4 4365 B12R1.226 Cc1ccnc(OCC(=O)O)c1 Amb25154209 [1,1,0,0,0,0|2,0,0]=4 4366 B12R1.226 Cc1cncc(CCC(=O)O)c1 Amb22886573 [1,1,0,0,0,0|1,0,0]=3 4367 B12R1.226 Cc1cncc(CCC(=O)O)n1 Amb18827855 [1,1,0,0,0,0|2,0,0]=4 4368 B12R1.226 Cc1cncc(OCC(=O)O)c1 Amb33317153 [1,1,0,0,0,0|2,0,0]=4 4369 B12R1.226 Cc1nccc(CCC(=O)O)n1 Amb33540349 [1,1,0,0,0,0|2,0,0]=4 4370 B12R1.226 N=C(N)CCc1cccc(Br)c1 Amb18571443 [1,1,0,0,0,0|2,0,0]=4 4371 B12R1.226 N=C(N)CCc1cccc(Cl)c1 Amb18564230 [1,1,0,0,0,0|2,0,0]=4 4372 B12R1.226 N=C(N)CCc1cccc(F)c1 Amb18563720 [1,1,0,0,0,0|2,0,0]=4 4373 B12R1.226 NC(=O)CCc1cccc(Br)c1 Amb8997695 [1,1,0,0,0,0|1,0,0]=3 4374 B12R1.226 NC(=O)CCc1cccc(Cl)c1 Amb17400995 [1,1,0,0,0,0|1,0,0]=3 4375 B12R1.226 NC(=O)CCc1cncc(Br)c1 Amb28255889 [1,1,0,0,0,0|2,0,0]=4 4376 B12R1.226 NC(=O)CNc1cccc(Br)c1 Amb143565 [1,1,0,0,0,0|2,0,0]=4 4377 B12R1.226 NC(=O)CNc1cccc(Cl)c1 Amb6711826 [1,1,0,0,0,0|2,0,0]=4 4378 B12R1.226 NC(=O)CNc1cccc(F)c1 Amb6711883 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.226 NC(=O)CNc1cccc(I)c1 Amb7758310 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.226 NC(=O)CNc1cccc(O)c1 Amb26868898 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.226 NC(=O)COc1cccc(Br)c1 Amb192032 [1,1,0,0,0,0|2,0,0]=4 4382 B12R1.226 NC(=O)COc1cccc(Cl)c1 Amb2726046 [1,1,0,0,0,0|2,0,0]=4 4383 B12R1.226 NC(=O)COc1cccc(I)c1 Amb181273 [1,1,0,0,0,0|2,0,0]=4 4384 B12R1.226 NC(=O)COc1cccc(N)c1 Amb1112358 [1,1,0,0,0,0|2,0,0]=4 4385 B12R1.226 NC(=O)COc1cccc(O)c1 Amb9210998 [1,1,0,0,0,0|2,0,0]=4 4386 B12R1.226 NC(=O)CSc1cccc(Cl)c1 Amb17143258 [1,1,0,0,0,0|2,0,0]=4 4387 B12R1.226 NC(=O)CSc1cccc(N)c1 Amb27770252 [1,1,0,0,0,0|2,0,0]=4 4388 B12R1.226 NC(=O)NCc1cccc(Br)c1 Amb26315359 [1,1,0,0,0,0|2,0,0]=4 4389 B12R1.226 NC(=O)NCc1cccc(F)c1 Amb7782143 [1,1,0,0,0,0|2,0,0]=4 4390 B12R1.226 NC(=O)OCc1cccc(F)c1 Amb27392390 [1,1,0,0,0,0|2,0,0]=4 4391 B12R1.226 NC(=S)CCc1cccc(Br)c1 Amb17256979 [1,1,0,0,0,0|1,1,0]=4 4392 B12R1.226 Nc1cc(CCC(=O)O)ccn1 Amb24105413 [1,1,0,0,0,0|1,0,0]=3 4393 B12R1.226 Nc1cccc(C#CC(=O)O)c1 Amb24650985 [1,1,0,0,0,0|0,0,2]=4 4394 B12R1.226 Nc1cccc(CCC(=O)Cl)c1 Amb27453550 [1,1,0,0,0,0|1,0,0]=3 4395 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2684507 [1,1,0,0,0,0|0,0,0]=2 4396 B12R1.226 Nc1cccc(CCC(=O)O)c1 Amb2692058 [1,1,0,0,0,0|0,0,0]=2 4397 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22408735 [1,1,0,0,0,0|0,0,1]=3 4398 B12R1.226 Nc1cccc(CCC(=O)[O-])c1 Amb22757721 [1,1,0,0,0,0|0,0,1]=3 4399 B12R1.226 Nc1cccc(OCC(=O)O)c1 Amb839769 [1,1,0,0,0,0|1,0,0]=3 4400 B12R1.226 Nc1cccc(\C=C\C(=O)O)c1 Amb34916041 [1,1,0,0,0,0|0,0,2]=4 4401 B12R1.226 Nc1ccnc(CCC(=O)O)n1 Amb18827285 [1,1,0,0,0,0|2,0,0]=4 4402 B12R1.226 Nc1nccc(CCC(=O)O)n1 Amb18827317 [1,1,0,0,0,0|2,0,0]=4 4403 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [1,1,0,0,0,0|1,0,0]=3 4404 B12R1.226 O=C(Cl)COc1cccc(Br)c1 Amb16230149 [1,1,0,0,0,0|2,0,0]=4 4405 B12R1.226 O=C(Cl)COc1cccc(F)c1 Amb27406717 [1,1,0,0,0,0|2,0,0]=4 4406 B12R1.226 O=C(Cl)CSc1cccc(Cl)c1 Amb17143820 [1,1,0,0,0,0|2,0,0]=4 4407 B12R1.226 O=C(Cl)NCc1cccc(Br)c1 Amb35625550 [1,1,0,0,0,0|2,0,0]=4 4408 B12R1.226 O=C(Cl)NCc1cccc(Cl)c1 Amb35637058 [1,1,0,0,0,0|2,0,0]=4 4409 B12R1.226 O=C(Cl)NCc1cccc(F)c1 Amb27238851 [1,1,0,0,0,0|2,0,0]=4 4410 B12R1.226 O=C(Cl)OCc1cccc(Cl)c1 Amb26597913 [1,1,0,0,0,0|2,0,0]=4 4411 B12R1.226 O=C(O)C#Cc1cccc(Br)c1 Amb23504362 [1,1,0,0,0,0|0,0,2]=4 4412 B12R1.226 O=C(O)C#Cc1cccc(Cl)c1 Amb20673086 [1,1,0,0,0,0|0,0,2]=4 4413 B12R1.226 O=C(O)C#Cc1cccc(F)c1 Amb20673102 [1,1,0,0,0,0|0,0,2]=4 4414 B12R1.226 O=C(O)C#Cc1cccc(O)c1 Amb23569602 [1,1,0,0,0,0|0,0,2]=4 4415 B12R1.226 O=C(O)CCC1=CC=CC(=O)N1 Amb26373711 [1,1,0,0,0,0|1,0,0]=3 4416 B12R1.226 O=C(O)CCC1=CC=CC(=O)N1 Amb33620710 [1,1,0,0,0,0|1,0,0]=3 4417 B12R1.226 O=C(O)CCC1=CC=CC(=O)O1 Amb27865517 [1,1,0,0,0,0|1,0,0]=3 4418 B12R1.226 O=C(O)CCc1cc(Br)ccn1 Amb27780846 [1,1,0,0,0,0|1,0,0]=3 4419 B12R1.226 O=C(O)CCc1cc(F)ccn1 Amb22886576 [1,1,0,0,0,0|1,0,0]=3 4420 B12R1.226 O=C(O)CCc1cc(O)ncn1 Amb18862743 [1,1,0,0,0,0|2,0,0]=4 4421 B12R1.226 O=C(O)CCc1cccc(Br)c1 Amb1209216 [1,1,0,0,0,0|0,0,0]=2 4422 B12R1.226 O=C(O)CCc1cccc(Br)n1 Amb26023781 [1,1,0,0,0,0|1,0,0]=3 4423 B12R1.226 O=C(O)CCc1cccc(Cl)c1 Amb1672952 [1,1,0,0,0,0|0,0,0]=2 4424 B12R1.226 O=C(O)CCc1cccc(Cl)n1 Amb27774864 [1,1,0,0,0,0|1,0,0]=3 4425 B12R1.226 O=C(O)CCc1cccc(F)c1 Amb1091868 [1,1,0,0,0,0|0,0,0]=2 4426 B12R1.226 O=C(O)CCc1cccc(F)n1 Amb27395763 [1,1,0,0,0,0|1,0,0]=3 4427 B12R1.226 O=C(O)CCc1cccc(I)c1 Amb16232982 [1,1,0,0,0,0|0,0,0]=2 4428 B12R1.226 O=C(O)CCc1cccc(O)c1 Amb2688781 [1,1,0,0,0,0|0,0,0]=2 4429 B12R1.226 O=C(O)CCc1ccnc(Cl)c1 Amb27458246 [1,1,0,0,0,0|1,0,0]=3 4430 B12R1.226 O=C(O)CCc1ccnc(O)c1 Amb26859372 [1,1,0,0,0,0|1,0,0]=3 4431 B12R1.226 O=C(O)CCc1ccnc(O)n1 Amb18826808 [1,1,0,0,0,0|2,0,0]=4 4432 B12R1.226 O=C(O)CCc1cncc(Br)c1 Amb27197768 [1,1,0,0,0,0|1,0,0]=3 4433 B12R1.226 O=C(O)CCc1cncc(Br)c1 Amb28600243 [1,1,0,0,0,0|1,0,0]=3 4434 B12R1.226 O=C(O)CCc1cncc(F)c1 Amb23450303 [1,1,0,0,0,0|1,0,0]=3 4435 B12R1.226 O=C(O)CCc1cncc(O)c1 Amb24435210 [1,1,0,0,0,0|1,0,0]=3 4436 B12R1.226 O=C(O)CCc1nccc(O)n1 Amb18862742 [1,1,0,0,0,0|2,0,0]=4 4437 B12R1.226 O=C(O)CNc1cccc(Br)c1 Amb840527 [1,1,0,0,0,0|1,0,0]=3 4438 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb10609174 [1,1,0,0,0,0|1,0,0]=3 4439 B12R1.226 O=C(O)CNc1cccc(Cl)c1 Amb840525 [1,1,0,0,0,0|1,0,0]=3 4440 B12R1.226 O=C(O)CNc1cccc(Cl)n1 Amb25736170 [1,1,0,0,0,0|2,0,0]=4 4441 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb19341704 [1,1,0,0,0,0|1,0,0]=3 4442 B12R1.226 O=C(O)CNc1cccc(F)c1 Amb840522 [1,1,0,0,0,0|1,0,0]=3 4443 B12R1.226 O=C(O)CNc1cccc(F)n1 Amb27471101 [1,1,0,0,0,0|2,0,0]=4 4444 B12R1.226 O=C(O)CNc1ccnc(Cl)c1 Amb27598005 [1,1,0,0,0,0|2,0,0]=4 4445 B12R1.226 O=C(O)CNc1cncc(Cl)c1 Amb35706919 [1,1,0,0,0,0|2,0,0]=4 4446 B12R1.226 O=C(O)CNc1cncc(F)c1 Amb28251708 [1,1,0,0,0,0|2,0,0]=4 4447 B12R1.226 O=C(O)COC1=CC(=O)NC=C1 Amb32946294 [1,1,0,0,0,0|2,0,0]=4 4448 B12R1.226 O=C(O)COc1cc(Br)ccn1 Amb18660970 [1,1,0,0,0,0|2,0,0]=4 4449 B12R1.226 O=C(O)COc1cc(Cl)ccn1 Amb2609896 [1,1,0,0,0,0|2,0,0]=4 4450 B12R1.226 O=C(O)COc1cc(F)ccn1 Amb33325484 [1,1,0,0,0,0|2,0,0]=4 4451 B12R1.226 O=C(O)COc1cccc(Br)c1 Amb6336684 [1,1,0,0,0,0|1,0,0]=3 4452 B12R1.226 O=C(O)COc1cccc(Br)n1 Amb33433825 [1,1,0,0,0,0|2,0,0]=4 4453 B12R1.226 O=C(O)COc1cccc(Cl)c1 Amb1211231 [1,1,0,0,0,0|1,0,0]=3 4454 B12R1.226 O=C(O)COc1cccc(Cl)n1 Amb28365549 [1,1,0,0,0,0|2,0,0]=4 4455 B12R1.226 O=C(O)COc1cccc(F)c1 Amb1102803 [1,1,0,0,0,0|1,0,0]=3 4456 B12R1.226 O=C(O)COc1cccc(I)c1 Amb4574102 [1,1,0,0,0,0|1,0,0]=3 4457 B12R1.226 O=C(O)COc1cccc(O)c1 Amb6360813 [1,1,0,0,0,0|1,0,0]=3 4458 B12R1.226 O=C(O)COc1ccnc(Br)c1 Amb18660965 [1,1,0,0,0,0|2,0,0]=4 4459 B12R1.226 O=C(O)COc1ccnc(Cl)c1 Amb25792389 [1,1,0,0,0,0|2,0,0]=4 4460 B12R1.226 O=C(O)COc1cncc(Br)c1 Amb33545391 [1,1,0,0,0,0|2,0,0]=4 4461 B12R1.226 O=C(O)COc1cncc(Cl)c1 Amb26875815 [1,1,0,0,0,0|2,0,0]=4 4462 B12R1.226 O=C(O)COc1cncc(F)c1 Amb25760871 [1,1,0,0,0,0|2,0,0]=4 4463 B12R1.226 O=C(O)CSc1cccc(Br)c1 Amb2372547 [1,1,0,0,0,0|1,0,0]=3 4464 B12R1.226 O=C(O)CSc1cccc(Cl)c1 Amb2794096 [1,1,0,0,0,0|1,0,0]=3 4465 B12R1.226 O=C(O)CSc1cccc(F)c1 Amb19887452 [1,1,0,0,0,0|1,0,0]=3 4466 B12R1.226 O=C(O)CSc1cccc(O)c1 Amb28385688 [1,1,0,0,0,0|1,0,0]=3 4467 B12R1.226 O=C(O)CSc1cncc(Br)c1 Amb28062088 [1,1,0,0,0,0|2,0,0]=4 4468 B12R1.226 O=C(O)\C=C\c1cccc(Br)c1 Amb1207365 [1,1,0,0,0,0|0,0,2]=4 4469 B12R1.226 O=C(O)\C=C\c1cccc(Cl)c1 Amb33513177 [1,1,0,0,0,0|0,0,2]=4 4470 B12R1.226 O=C(O)\C=C\c1cccc(F)c1 Amb1210956 [1,1,0,0,0,0|0,0,2]=4 4471 B12R1.226 O=C(O)\C=C\c1cccc(I)c1 Amb2236388 [1,1,0,0,0,0|0,0,2]=4 4472 B12R1.226 O=C(O)\C=C\c1cccc(O)c1 Amb8513189 [1,1,0,0,0,0|0,0,2]=4 4473 B12R1.226 O=S([O-])CCc1cccc(Cl)c1 Amb26056860 [1,1,0,0,0,0|1,0,1]=4 4474 B12R1.226 O=S([O-])CCc1cccc(F)c1 Amb32755838 [1,1,0,0,0,0|1,0,1]=4 4475 B12R1.226 O=[N+]([O-])CCc1cccc(Br)c1 Amb6298655 [1,1,0,0,0,0|1,0,1]=4 4476 B12R1.226 O=[N+]([O-])CCc1cccc(Cl)c1 Amb17401073 [1,1,0,0,0,0|1,0,1]=4 4477 B12R1.226 O=[N+]([O-])CCc1cccc(F)c1 Amb6296470 [1,1,0,0,0,0|1,0,1]=4 4478 B12R1.226 O=[N+]([O-])CCc1cccc(O)c1 Amb25141958 [1,1,0,0,0,0|1,0,1]=4 4479 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [1,1,0,0,0,0|1,0,1]=4 4480 B12R1.226 OB(O)CCc1cccc(O)c1 Amb27215942 [1,1,0,0,0,0|1,0,1]=4 4481 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [1,1,0,0,0,0|1,0,1]=4 4482 B12R1.891 NS(=O)(=O)CCc1ccccc1 Amb4435162 [1,1,0,0,0,0|1,0,1]=4 4483 B12R1.891 O=P(O)(Cl)CCc1ccccc1 Amb28435339 [1,1,0,0,0,0|1,0,0]=3 4484 B12R1.891 O=P(O)(O)CCc1ccccc1 Amb9786423 [1,1,0,0,0,0|1,0,0]=3 4485 B12R1.891 O=P(O)(O)CCc1ccccn1 Amb3354896 [1,1,0,0,0,0|2,0,0]=4 4486 B12R1.891 O=P(O)(O)OCc1ccccc1 Amb4297430 [1,1,0,0,0,0|2,0,0]=4 4487 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [1,1,0,0,0,0|1,0,1]=4 4488 B12R1.891 O=S(=O)(Cl)CCc1ccccc1 Amb1130049 [1,1,0,0,0,0|1,0,1]=4 4489 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [1,1,0,0,0,0|1,0,1]=4 4490 B12R1.891 O=S(=O)(O)CCc1ccccc1 Amb19866568 [1,1,0,0,0,0|1,0,0]=3 4491 B12R1.891 O=S(=O)(O)CCc1ccccn1 Amb2721298 [1,1,0,0,0,0|2,0,0]=4 4492 B12R1.891 O=S(=O)(O)CCc1ccncc1 Amb8394834 [1,1,0,0,0,0|2,0,0]=4 4493 B12R1.891 O=S(=O)(O)NCc1ccccc1 Amb22551828 [1,1,0,0,0,0|2,0,0]=4 4494 B12R1.891 O=S(=O)([O-])CCc1ccccc1 Amb22457030 [1,1,0,0,0,0|1,0,1]=4 4495 B12R1.104 CC(Cc1cc(Br)co1)C(=O)O Amb33431191 [0,1,0,0,1,0|2,0,0]=4 4496 B12R1.104 CC(Cc1cc(Br)cs1)C(=O)O Amb18981859 [0,1,0,0,1,0|2,0,0]=4 4497 B12R1.104 CC(Cc1cc(Cl)cs1)C(=O)O Amb24569327 [0,1,0,0,1,0|2,0,0]=4 4498 B12R1.104 CC(Cc1ccc(Br)o1)C(=O)O Amb25297998 [0,1,0,0,1,0|2,0,0]=4 4499 B12R1.104 CC(Cc1ccc(Br)s1)C(=O)O Amb18290324 [0,1,0,0,1,0|2,0,0]=4 4500 B12R1.104 CC(Cc1ccc(Cl)o1)C(=O)O Amb28142508 [0,1,0,0,1,0|2,0,0]=4 4501 B12R1.104 CC(Cc1ccc(Cl)s1)C(=O)O Amb18290306 [0,1,0,0,1,0|2,0,0]=4 4502 B12R1.104 CC(Cc1csc(Br)c1)C(=O)O Amb27867943 [0,1,0,0,1,0|2,0,0]=4 4503 B12R1.104 CC(Cc1csc(Cl)c1)C(=O)O Amb25032087 [0,1,0,0,1,0|2,0,0]=4 4504 B12R1.104 Cc1cc(CC(N)C(=O)O)co1 Amb18826155 [0,1,0,0,1,0|1,0,0]=3 4505 B12R1.104 Cc1cc(CC(N)C(=O)O)no1 Amb18825740 [0,1,0,0,1,0|2,0,0]=4 4506 B12R1.104 Cc1cc(CC(N)C(=O)O)on1 Amb8439770 [0,1,0,0,1,0|2,0,0]=4 4507 B12R1.104 Cc1cc(CC(N)C(N)=O)cs1 Amb25884795 [0,1,0,0,1,0|2,0,0]=4 4508 B12R1.104 Cc1cc(CC(O)C(=O)O)cs1 Amb28288979 [0,1,0,0,1,0|2,0,0]=4 4509 B12R1.104 Cc1cc(CC(S)C(=O)O)cs1 Amb28121769 [0,1,0,0,1,0|2,0,0]=4 4510 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)cs1 Amb24446585 [0,1,0,0,1,0|1,0,0]=3 4511 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)on1 Amb30621868 [0,1,0,0,1,0|2,0,0]=4 4512 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)sn1 Amb29852558 [0,1,0,0,1,0|2,0,0]=4 4513 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)cs1 Amb25877757 [0,1,0,0,1,0|1,0,0]=3 4514 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)sn1 Amb29852559 [0,1,0,0,1,0|2,0,0]=4 4515 B12R1.104 Cc1ccc(CC(C)C(=O)O)o1 Amb17605842 [0,1,0,0,1,0|2,0,0]=4 4516 B12R1.104 Cc1ccc(CC(C)C(=O)O)s1 Amb17605840 [0,1,0,0,1,0|2,0,0]=4 4517 B12R1.104 Cc1ccc(CC(F)C(=O)O)s1 Amb27776268 [0,1,0,0,1,0|2,0,0]=4 4518 B12R1.104 Cc1ccc(CC(N)C(=O)O)o1 Amb6267158 [0,1,0,0,1,0|1,0,0]=3 4519 B12R1.104 Cc1ccc(CC(N)C(=O)O)s1 Amb3788396 [0,1,0,0,1,0|1,0,0]=3 4520 B12R1.104 Cc1ccc(CC(N)C(N)=O)o1 Amb33065551 [0,1,0,0,1,0|2,0,0]=4 4521 B12R1.104 Cc1ccc(CC(O)C(=O)O)o1 Amb32668561 [0,1,0,0,1,0|2,0,0]=4 4522 B12R1.104 Cc1ccc(CC(O)C(=O)O)s1 Amb32668563 [0,1,0,0,1,0|2,0,0]=4 4523 B12R1.104 Cc1ccc(C[C@@H](N)C(=O)O)o1 Amb18801199 [0,1,0,0,1,0|1,0,0]=3 4524 B12R1.104 Cc1ccc(C[C@H](N)C(=O)O)o1 Amb24380249 [0,1,0,0,1,0|1,0,0]=3 4525 B12R1.104 Cc1ccn(CC(N)C(=O)O)n1 Amb27964954 [0,1,0,0,1,0|2,0,0]=4 4526 B12R1.104 Cc1cnc(CC(N)C(=O)O)s1 Amb27427824 [0,1,0,0,1,0|2,0,0]=4 4527 B12R1.104 Cc1cnc(C[C@@H](N)C(=O)O)s1 Amb27208416 [0,1,0,0,1,0|2,0,0]=4 4528 B12R1.104 Cc1cnc(C[C@H](N)C(=O)O)s1 Amb27427822 [0,1,0,0,1,0|2,0,0]=4 4529 B12R1.104 Cc1cnn(CC(N)C(=O)O)c1 Amb18984357 [0,1,0,0,1,0|2,0,0]=4 4530 B12R1.104 Cc1cnn(CC(N)C(=O)O)c1 Amb33553000 [0,1,0,0,1,0|2,0,0]=4 4531 B12R1.104 Cc1coc(CC(N)C(=O)O)n1 Amb18825741 [0,1,0,0,1,0|2,0,0]=4 4532 B12R1.104 Cc1coc(CC(O)C(=O)O)c1 Amb33353263 [0,1,0,0,1,0|2,0,0]=4 4533 B12R1.104 Cc1csc(CC(C)C(=O)O)c1 Amb18822839 [0,1,0,0,1,0|2,0,0]=4 4534 B12R1.104 Cc1csc(CC(N)C(=O)O)c1 Amb18822423 [0,1,0,0,1,0|1,0,0]=3 4535 B12R1.104 Cc1csc(CC(O)C(=O)O)c1 Amb33427637 [0,1,0,0,1,0|2,0,0]=4 4536 B12R1.104 Cc1csc(C[C@@H](N)C(=O)O)n1 Amb24450434 [0,1,0,0,1,0|2,0,0]=4 4537 B12R1.104 Cc1csc(C[C@H](N)C(=O)O)n1 Amb25770644 [0,1,0,0,1,0|2,0,0]=4 4538 B12R1.104 Cc1nc(CC(N)C(=O)O)cs1 Amb17065744 [0,1,0,0,1,0|2,0,0]=4 4539 B12R1.104 Cc1nc(C[C@@H](N)C(=O)O)cs1 Amb25667151 [0,1,0,0,1,0|2,0,0]=4 4540 B12R1.104 Cc1nc(C[C@H](N)C(=O)O)cs1 Amb26024394 [0,1,0,0,1,0|2,0,0]=4 4541 B12R1.104 Cc1ncc(CC(N)C(=O)O)s1 Amb18822037 [0,1,0,0,1,0|2,0,0]=4 4542 B12R1.104 Cc1ncc(C[C@@H](N)C(=O)O)s1 Amb27146199 [0,1,0,0,1,0|2,0,0]=4 4543 B12R1.104 Cc1ncc(C[C@H](N)C(=O)O)s1 Amb24346493 [0,1,0,0,1,0|2,0,0]=4 4544 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb19429078 [0,1,0,0,1,0|2,0,0]=4 4545 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb6715945 [0,1,0,0,1,0|2,0,0]=4 4546 B12R1.104 Cn1cc(C[C@@H](N)C(=O)O)cn1 Amb18801206 [0,1,0,0,1,0|2,0,0]=4 4547 B12R1.104 Cn1cc(C[C@H](N)C(=O)O)cn1 Amb25740928 [0,1,0,0,1,0|2,0,0]=4 4548 B12R1.104 Cn1ccc(CC(N)C(=O)O)c1 Amb18563843 [0,1,0,0,1,0|1,0,0]=3 4549 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb30622858 [0,1,0,0,1,0|2,0,0]=4 4550 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb6890914 [0,1,0,0,1,0|2,0,0]=4 4551 B12R1.104 Cn1ccc(C[C@@H](N)C(=O)O)n1 Amb28456301 [0,1,0,0,1,0|2,0,0]=4 4552 B12R1.104 Cn1ccc(C[C@H](N)C(=O)O)n1 Amb28244347 [0,1,0,0,1,0|2,0,0]=4 4553 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb16233066 [0,1,0,0,1,0|2,0,0]=4 4554 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb32651823 [0,1,0,0,1,0|2,0,0]=4 4555 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22747829 [0,1,0,0,1,0|2,0,0]=4 4556 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22801373 [0,1,0,0,1,0|2,0,0]=4 4557 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb22349466 [0,1,0,0,1,0|2,0,0]=4 4558 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb2698980 [0,1,0,0,1,0|2,0,0]=4 4559 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb8629064 [0,1,0,0,1,0|2,0,0]=4 4560 B12R1.104 NC(=O)C(N)Cc1cc(Br)cs1 Amb24699965 [0,1,0,0,1,0|2,0,0]=4 4561 B12R1.104 NC(=O)C(N)Cc1ccc(Br)o1 Amb27198829 [0,1,0,0,1,0|2,0,0]=4 4562 B12R1.104 NC(=O)C(N)Cc1ccc(Br)s1 Amb26333365 [0,1,0,0,1,0|2,0,0]=4 4563 B12R1.104 NC(=O)C(N)Cc1ccc(Cl)s1 Amb25793775 [0,1,0,0,1,0|2,0,0]=4 4564 B12R1.104 NC(=O)C(N)Cc1coc(Br)c1 Amb26042457 [0,1,0,0,1,0|2,0,0]=4 4565 B12R1.104 NC(=O)C(N)Cc1csc(Cl)c1 Amb26842308 [0,1,0,0,1,0|2,0,0]=4 4566 B12R1.104 NC(Cc1cc(Br)co1)C(=O)O Amb26915240 [0,1,0,0,1,0|1,0,0]=3 4567 B12R1.104 NC(Cc1cc(Br)cs1)C(=O)O Amb7783541 [0,1,0,0,1,0|1,0,0]=3 4568 B12R1.104 NC(Cc1cc(Cl)cs1)C(=O)O Amb27803431 [0,1,0,0,1,0|1,0,0]=3 4569 B12R1.104 NC(Cc1ccc(Br)o1)C(=O)O Amb6269286 [0,1,0,0,1,0|1,0,0]=3 4570 B12R1.104 NC(Cc1ccc(Br)s1)C(=O)O Amb3791488 [0,1,0,0,1,0|1,0,0]=3 4571 B12R1.104 NC(Cc1ccc(Cl)o1)C(=O)O Amb19000858 [0,1,0,0,1,0|1,0,0]=3 4572 B12R1.104 NC(Cc1ccc(Cl)s1)C(=O)O Amb6267566 [0,1,0,0,1,0|1,0,0]=3 4573 B12R1.104 NC(Cc1cnc(Br)s1)C(=O)O Amb27965453 [0,1,0,0,1,0|2,0,0]=4 4574 B12R1.104 NC(Cc1cnc(Cl)s1)C(=O)O Amb25995163 [0,1,0,0,1,0|2,0,0]=4 4575 B12R1.104 NC(Cc1coc(Br)c1)C(=O)O Amb25807466 [0,1,0,0,1,0|1,0,0]=3 4576 B12R1.104 NC(Cc1csc(Br)c1)C(=O)O Amb26317142 [0,1,0,0,1,0|1,0,0]=3 4577 B12R1.104 NC(Cc1csc(Br)n1)C(=O)O Amb33334914 [0,1,0,0,1,0|2,0,0]=4 4578 B12R1.104 NC(Cc1csc(Cl)c1)C(=O)O Amb28062223 [0,1,0,0,1,0|1,0,0]=3 4579 B12R1.104 NC(Cc1csc(Cl)c1)C(=O)O Amb33743920 [0,1,0,0,1,0|1,0,0]=3 4580 B12R1.104 NC(Cc1csc(Cl)n1)C(=O)O Amb33308855 [0,1,0,0,1,0|2,0,0]=4 4581 B12R1.104 NC(Cc1ncc(Br)s1)C(=O)O Amb33435429 [0,1,0,0,1,0|2,0,0]=4 4582 B12R1.104 NC(Cc1ncc(Cl)s1)C(=O)O Amb27448242 [0,1,0,0,1,0|2,0,0]=4 4583 B12R1.104 NC(Cn1cc(Br)cn1)C(=O)O Amb18984365 [0,1,0,0,1,0|2,0,0]=4 4584 B12R1.104 NC(Cn1cc(Br)cn1)C(=O)O Amb24271207 [0,1,0,0,1,0|2,0,0]=4 4585 B12R1.104 NC(Cn1cc(Cl)cn1)C(=O)O Amb18984361 [0,1,0,0,1,0|2,0,0]=4 4586 B12R1.104 NC(Cn1cc(Cl)cn1)C(=O)O Amb24271206 [0,1,0,0,1,0|2,0,0]=4 4587 B12R1.104 NC(Cn1cc(I)cn1)C(=O)O Amb25151054 [0,1,0,0,1,0|2,0,0]=4 4588 B12R1.104 N[C@@H](CC1=CNC(=S)N1)C(=O)O Amb19133014 [0,1,0,0,1,0|2,0,0]=4 4589 B12R1.104 N[C@@H](CC1=NC(=S)N=C1)C(=O)O Amb24401476 [0,1,0,0,1,0|2,0,0]=4 4590 B12R1.104 N[C@@H](Cc1cc(Br)co1)C(=O)O Amb27778491 [0,1,0,0,1,0|1,0,0]=3 4591 B12R1.104 N[C@@H](Cc1cc(Br)cs1)C(=O)O Amb27175091 [0,1,0,0,1,0|1,0,0]=3 4592 B12R1.104 N[C@@H](Cc1ccc(Br)o1)C(=O)O Amb24488678 [0,1,0,0,1,0|1,0,0]=3 4593 B12R1.104 N[C@@H](Cc1ccc(Br)s1)C(=O)O Amb22746252 [0,1,0,0,1,0|1,0,0]=3 4594 B12R1.104 N[C@@H](Cc1ccc(Cl)o1)C(=O)O Amb27596523 [0,1,0,0,1,0|1,0,0]=3 4595 B12R1.104 N[C@@H](Cc1ccc(Cl)s1)C(=O)O Amb25885904 [0,1,0,0,1,0|1,0,0]=3 4596 B12R1.104 N[C@@H](Cc1coc(Br)c1)C(=O)O Amb24690262 [0,1,0,0,1,0|1,0,0]=3 4597 B12R1.104 N[C@@H](Cc1csc(Cl)c1)C(=O)O Amb25138005 [0,1,0,0,1,0|1,0,0]=3 4598 B12R1.104 N[C@@H](Cc1csc(Cl)n1)C(=O)O Amb33308794 [0,1,0,0,1,0|2,0,0]=4 4599 B12R1.104 N[C@@H](Cc1ncc(Br)s1)C(=O)O Amb33065987 [0,1,0,0,1,0|2,0,0]=4 4600 B12R1.104 N[C@@H](Cc1ncc(Cl)s1)C(=O)O Amb28206528 [0,1,0,0,1,0|2,0,0]=4 4601 B12R1.104 N[C@H](CC1=CC(=O)ON1)C(=O)O Amb27869994 [0,1,0,0,1,0|2,0,0]=4 4602 B12R1.104 N[C@H](CC1=CNC(=S)N1)C(=O)O Amb25827584 [0,1,0,0,1,0|2,0,0]=4 4603 B12R1.104 N[C@H](Cc1cc(Br)cs1)C(=O)O Amb24431257 [0,1,0,0,1,0|1,0,0]=3 4604 B12R1.104 N[C@H](Cc1ccc(Br)o1)C(=O)O Amb25791878 [0,1,0,0,1,0|1,0,0]=3 4605 B12R1.104 N[C@H](Cc1ccc(Br)s1)C(=O)O Amb27425316 [0,1,0,0,1,0|1,0,0]=3 4606 B12R1.104 N[C@H](Cc1ccc(Cl)s1)C(=O)O Amb24462225 [0,1,0,0,1,0|1,0,0]=3 4607 B12R1.104 N[C@H](Cc1coc(Br)c1)C(=O)O Amb25986220 [0,1,0,0,1,0|1,0,0]=3 4608 B12R1.104 N[C@H](Cc1csc(Cl)c1)C(=O)O Amb24735847 [0,1,0,0,1,0|1,0,0]=3 4609 B12R1.104 N[C@H](Cc1csc(Cl)n1)C(=O)O Amb33308525 [0,1,0,0,1,0|2,0,0]=4 4610 B12R1.104 N[C@H](Cc1ncc(Br)s1)C(=O)O Amb33065417 [0,1,0,0,1,0|2,0,0]=4 4611 B12R1.104 N[C@H](Cc1ncc(Cl)s1)C(=O)O Amb28127148 [0,1,0,0,1,0|2,0,0]=4 4612 B12R1.104 Nc1nc(CC(N)C(=O)O)cs1 Amb25109207 [0,1,0,0,1,0|2,0,0]=4 4613 B12R1.104 Nc1nc(CC(N)C(=O)O)cs1 Amb33803281 [0,1,0,0,1,0|2,0,0]=4 4614 B12R1.104 O=C(O)C(F)Cc1cc(Br)cs1 Amb27653807 [0,1,0,0,1,0|2,0,0]=4 4615 B12R1.104 O=C(O)C(F)Cc1csc(Br)c1 Amb28197357 [0,1,0,0,1,0|2,0,0]=4 4616 B12R1.104 O=C(O)C(O)Cc1cc(Br)co1 Amb33431513 [0,1,0,0,1,0|2,0,0]=4 4617 B12R1.104 O=C(O)C(O)Cc1cc(Br)cs1 Amb26022797 [0,1,0,0,1,0|2,0,0]=4 4618 B12R1.104 O=C(O)C(O)Cc1cc(Cl)cs1 Amb33353486 [0,1,0,0,1,0|2,0,0]=4 4619 B12R1.104 O=C(O)C(O)Cc1ccc(Br)o1 Amb27768369 [0,1,0,0,1,0|2,0,0]=4 4620 B12R1.104 O=C(O)C(O)Cc1ccc(Br)s1 Amb24376472 [0,1,0,0,1,0|2,0,0]=4 4621 B12R1.104 O=C(O)C(O)Cc1ccc(Cl)o1 Amb33258328 [0,1,0,0,1,0|2,0,0]=4 4622 B12R1.104 O=C(O)C(O)Cc1ccc(Cl)s1 Amb24483662 [0,1,0,0,1,0|2,0,0]=4 4623 B12R1.104 O=C(O)C(O)Cc1coc(Br)c1 Amb27226516 [0,1,0,0,1,0|2,0,0]=4 4624 B12R1.104 O=C(O)C(O)Cc1csc(Br)c1 Amb33353269 [0,1,0,0,1,0|2,0,0]=4 4625 B12R1.108 CNC(=O)[C@H](N)Cc1ccco1 Amb28384625 [0,1,0,0,1,0|2,0,0]=4 4626 B12R1.108 COC(=O)C(N)Cc1ccco1 Amb33308805 [0,1,0,0,1,0|1,0,0]=3 4627 B12R1.108 COC(=O)C(N)Cc1cccs1 Amb32665943 [0,1,0,0,1,0|1,0,0]=3 4628 B12R1.108 COC(=O)C(N)Cc1cccs1 Amb33330278 [0,1,0,0,1,0|1,0,0]=3 4629 B12R1.108 COC(=O)C(N)Cc1ccno1 Amb33726912 [0,1,0,0,1,0|2,0,0]=4 4630 B12R1.108 COC(=O)C(N)Cc1ccns1 Amb33036458 [0,1,0,0,1,0|2,0,0]=4 4631 B12R1.108 COC(=O)C(N)Cc1ccoc1 Amb33127528 [0,1,0,0,1,0|1,0,0]=3 4632 B12R1.108 COC(=O)C(N)Cc1ccsc1 Amb33036796 [0,1,0,0,1,0|1,0,0]=3 4633 B12R1.108 COC(=O)C(N)Cc1ccsc1 Amb33607446 [0,1,0,0,1,0|1,0,0]=3 4634 B12R1.108 COC(=O)C(N)Cc1cncs1 Amb32670883 [0,1,0,0,1,0|2,0,0]=4 4635 B12R1.108 COC(=O)C(N)Cc1cscn1 Amb33309061 [0,1,0,0,1,0|2,0,0]=4 4636 B12R1.108 COC(=O)C(N)Cc1nccs1 Amb33042858 [0,1,0,0,1,0|2,0,0]=4 4637 B12R1.108 COC(=O)C(N)Cn1cccc1 Amb33746606 [0,1,0,0,1,0|1,0,0]=3 4638 B12R1.108 COC(=O)C(N)Cn1cccn1 Amb18788967 [0,1,0,0,1,0|2,0,0]=4 4639 B12R1.108 COC(=O)C(N)Cn1cccn1 Amb30584858 [0,1,0,0,1,0|2,0,0]=4 4640 B12R1.108 COC(=O)C(N)Cn1ccnc1 Amb33553060 [0,1,0,0,1,0|2,0,0]=4 4641 B12R1.108 COC(=O)C(O)Cc1ccco1 Amb17138659 [0,1,0,0,1,0|2,0,0]=4 4642 B12R1.108 COC(=O)C(O)Cc1cccs1 Amb17139129 [0,1,0,0,1,0|2,0,0]=4 4643 B12R1.108 COC(=O)C(O)Cc1ccoc1 Amb33474605 [0,1,0,0,1,0|2,0,0]=4 4644 B12R1.108 COC(=O)C(O)Cc1ccsc1 Amb33448426 [0,1,0,0,1,0|2,0,0]=4 4645 B12R1.108 COC(=O)[C@@H](N)Cc1cccs1 Amb19149172 [0,1,0,0,1,0|1,0,0]=3 4646 B12R1.108 COC(=O)[C@H](N)Cc1cscn1 Amb34157789 [0,1,0,0,1,0|2,0,0]=4 4647 B12R1.120 CC(C(=O)O)C(C)c1ccco1 Amb18199302 [0,1,0,0,1,0|2,0,0]=4 4648 B12R1.120 CC(C(=O)O)C(C)c1cccs1 Amb18822834 [0,1,0,0,1,0|2,0,0]=4 4649 B12R1.120 CC(C(=O)O)C(C)c1ccsc1 Amb27615249 [0,1,0,0,1,0|2,0,0]=4 4650 B12R1.120 CC(C(=O)O)C(C)n1cccc1 Amb28240651 [0,1,0,0,1,0|2,0,0]=4 4651 B12R1.120 CC(C(=O)O)C(N)c1ccsc1 Amb28324127 [0,1,0,0,1,0|2,0,0]=4 4652 B12R1.120 CC(C(=O)O)C(O)c1ccco1 Amb27667048 [0,1,0,0,1,0|2,0,0]=4 4653 B12R1.120 CC(C(=O)O)C(O)c1cccs1 Amb18990634 [0,1,0,0,1,0|2,0,0]=4 4654 B12R1.120 CC(C(N)C(=O)O)n1cccn1 Amb33129054 [0,1,0,0,1,0|2,0,0]=4 4655 B12R1.120 CC(C(N)C(=O)O)n1ccnc1 Amb33129053 [0,1,0,0,1,0|2,0,0]=4 4656 B12R1.120 CC(c1ccco1)C(N)C(=O)O Amb35663086 [0,1,0,0,1,0|1,0,0]=3 4657 B12R1.120 CC(c1cccs1)C(N)C(=O)O Amb35660777 [0,1,0,0,1,0|1,0,0]=3 4658 B12R1.120 CC(c1ccoc1)C(N)C(=O)O Amb35663085 [0,1,0,0,1,0|1,0,0]=3 4659 B12R1.120 CC(c1ccsc1)C(F)C(=O)O Amb27969593 [0,1,0,0,1,0|2,0,0]=4 4660 B12R1.120 CC(c1ccsc1)C(N)C(=O)O Amb30040033 [0,1,0,0,1,0|1,0,0]=3 4661 B12R1.120 CC(c1nccs1)C(N)C(=O)O Amb29892394 [0,1,0,0,1,0|2,0,0]=4 4662 B12R1.120 C[C@@H](C(=O)O)[C@@H](O)c1cccs1 Amb28124104 [0,1,0,0,1,0|2,0,0]=4 4663 B12R1.120 NC(C(=O)O)C(O)c1ccco1 Amb2699161 [0,1,0,0,1,0|1,0,0]=3 4664 B12R1.120 NC(C(=O)O)C(O)c1cccs1 Amb18649596 [0,1,0,0,1,0|1,0,0]=3 4665 B12R1.120 NC(C(=O)O)C(O)c1ccns1 Amb35730833 [0,1,0,0,1,0|2,0,0]=4 4666 B12R1.120 NC(C(=O)O)C(O)c1ccoc1 Amb24411867 [0,1,0,0,1,0|1,0,0]=3 4667 B12R1.120 NC(C(=O)O)C(O)c1ccon1 Amb33198342 [0,1,0,0,1,0|2,0,0]=4 4668 B12R1.120 NC(C(=O)O)C(O)c1ccsc1 Amb25273231 [0,1,0,0,1,0|1,0,0]=3 4669 B12R1.120 NC(C(=O)O)C(O)c1cnco1 Amb33414853 [0,1,0,0,1,0|2,0,0]=4 4670 B12R1.120 NC(C(=O)O)C(O)c1cncs1 Amb18821128 [0,1,0,0,1,0|2,0,0]=4 4671 B12R1.120 NC(C(=O)O)C(O)c1cscn1 Amb26943513 [0,1,0,0,1,0|2,0,0]=4 4672 B12R1.120 NC(C(=O)O)C(O)c1nccs1 Amb26562085 [0,1,0,0,1,0|2,0,0]=4 4673 B12R1.120 N[C@@H](C(=O)O)[C@@H](O)c1cccs1 Amb27863494 [0,1,0,0,1,0|1,0,0]=3 4674 B12R1.120 N[C@@H](c1ccco1)[C@@H](O)C(=O)O Amb27209254 [0,1,0,0,1,0|2,0,0]=4 4675 B12R1.120 N[C@H](C(=O)O)[C@@H](O)c1ccco1 Amb27862565 [0,1,0,0,1,0|1,0,0]=3 4676 B12R1.120 N[C@H](C(=O)O)[C@@H](O)c1cccs1 Amb27444659 [0,1,0,0,1,0|1,0,0]=3 4677 B12R1.120 N[C@H](C(=O)O)[C@H](O)c1cccs1 Amb27491025 [0,1,0,0,1,0|1,0,0]=3 4678 B12R1.120 N[C@H](c1ccco1)[C@H](O)C(=O)O Amb27462481 [0,1,0,0,1,0|2,0,0]=4 4679 B12R1.120 N[C@H](c1cccs1)[C@H](O)C(=O)O Amb27631516 [0,1,0,0,1,0|2,0,0]=4 4680 B12R1.145 CC(Cc1cccn1C)C(=O)O Amb27626329 [0,1,0,0,1,0|2,0,0]=4 4681 B12R1.145 CC(Cc1cscc1Br)C(=O)O Amb28143561 [0,1,0,0,1,0|2,0,0]=4 4682 B12R1.145 CC(Cc1sccc1Br)C(=O)O Amb18981853 [0,1,0,0,1,0|2,0,0]=4 4683 B12R1.145 CC(Cc1sccc1Cl)C(=O)O Amb25303584 [0,1,0,0,1,0|2,0,0]=4 4684 B12R1.145 Cc1cccn1CC(N)C(=O)O Amb18826692 [0,1,0,0,1,0|1,0,0]=3 4685 B12R1.145 Cc1ccnn1CC(N)C(=O)O Amb25724699 [0,1,0,0,1,0|2,0,0]=4 4686 B12R1.145 Cc1ccoc1CC(C)C(=O)O Amb25304965 [0,1,0,0,1,0|2,0,0]=4 4687 B12R1.145 Cc1ccoc1CC(N)C(=O)O Amb18826171 [0,1,0,0,1,0|1,0,0]=3 4688 B12R1.145 Cc1ccoc1CC(O)C(=O)O Amb33353274 [0,1,0,0,1,0|2,0,0]=4 4689 B12R1.145 Cc1ccsc1CC(C)C(=O)O Amb27159627 [0,1,0,0,1,0|2,0,0]=4 4690 B12R1.145 Cc1ccsc1CC(F)C(=O)O Amb28430315 [0,1,0,0,1,0|2,0,0]=4 4691 B12R1.145 Cc1ccsc1CC(N)C(=O)O Amb3788399 [0,1,0,0,1,0|1,0,0]=3 4692 B12R1.145 Cc1ccsc1CC(O)C(=O)O Amb32668562 [0,1,0,0,1,0|2,0,0]=4 4693 B12R1.145 Cc1ccsc1C[C@@H](N)C(=O)O Amb19069332 [0,1,0,0,1,0|1,0,0]=3 4694 B12R1.145 Cc1ccsc1C[C@H](N)C(=O)O Amb26450865 [0,1,0,0,1,0|1,0,0]=3 4695 B12R1.145 Cc1cocc1CC(N)C(=O)O Amb18826156 [0,1,0,0,1,0|1,0,0]=3 4696 B12R1.145 Cc1cscc1CC(C)C(=O)O Amb33147698 [0,1,0,0,1,0|2,0,0]=4 4697 B12R1.145 Cc1cscc1CC(N)C(=O)O Amb33065909 [0,1,0,0,1,0|1,0,0]=3 4698 B12R1.145 Cc1cscc1CC(N)C(N)=O Amb33308554 [0,1,0,0,1,0|2,0,0]=4 4699 B12R1.145 Cc1cscc1CC(O)C(=O)O Amb33146697 [0,1,0,0,1,0|2,0,0]=4 4700 B12R1.145 Cc1cscc1C[C@@H](N)C(=O)O Amb33036557 [0,1,0,0,1,0|1,0,0]=3 4701 B12R1.145 Cc1cscc1C[C@H](N)C(=O)O Amb33065918 [0,1,0,0,1,0|1,0,0]=3 4702 B12R1.145 Cc1nccn1CC(N)C(=O)O Amb18294531 [0,1,0,0,1,0|2,0,0]=4 4703 B12R1.145 Cc1ncsc1CC(N)C(=O)O Amb18822033 [0,1,0,0,1,0|2,0,0]=4 4704 B12R1.145 Cc1ncsc1C[C@@H](N)C(=O)O Amb28396540 [0,1,0,0,1,0|2,0,0]=4 4705 B12R1.145 Cc1occc1CC(C)C(=O)O Amb27233805 [0,1,0,0,1,0|2,0,0]=4 4706 B12R1.145 Cc1occc1CC(N)C(=O)O Amb26526981 [0,1,0,0,1,0|1,0,0]=3 4707 B12R1.145 Cc1occc1CC(O)C(=O)O Amb32668569 [0,1,0,0,1,0|2,0,0]=4 4708 B12R1.145 Cc1oncc1CC(N)C(=O)O Amb18825754 [0,1,0,0,1,0|2,0,0]=4 4709 B12R1.145 Cc1sccc1CC(O)C(=O)O Amb33353289 [0,1,0,0,1,0|2,0,0]=4 4710 B12R1.145 Cc1sccc1C[C@@H](N)C(=O)O Amb27482297 [0,1,0,0,1,0|1,0,0]=3 4711 B12R1.145 Cn1cccc1CC(F)C(=O)O Amb28142519 [0,1,0,0,1,0|2,0,0]=4 4712 B12R1.145 Cn1cccc1CC(N)C(=O)O Amb7796010 [0,1,0,0,1,0|1,0,0]=3 4713 B12R1.145 Cn1cccc1CC(O)C(=O)O Amb33315155 [0,1,0,0,1,0|2,0,0]=4 4714 B12R1.145 Cn1cccc1C[C@H](N)C(=O)O Amb28248841 [0,1,0,0,1,0|1,0,0]=3 4715 B12R1.145 Cn1ccnc1CC(N)C(=O)O Amb18302430 [0,1,0,0,1,0|2,0,0]=4 4716 B12R1.145 Cn1ccnc1C[C@@H](N)C(=O)O Amb32788599 [0,1,0,0,1,0|2,0,0]=4 4717 B12R1.145 Cn1ccnc1C[C@H](N)C(=O)O Amb33037063 [0,1,0,0,1,0|2,0,0]=4 4718 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb18647156 [0,1,0,0,1,0|2,0,0]=4 4719 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb31291637 [0,1,0,0,1,0|2,0,0]=4 4720 B12R1.145 Cn1cncc1C[C@@H](N)C(=O)O Amb2699163 [0,1,0,0,1,0|2,0,0]=4 4721 B12R1.145 Cn1cncc1C[C@H](N)C(=O)O Amb6600147 [0,1,0,0,1,0|2,0,0]=4 4722 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb35788785 [0,1,0,0,1,0|2,0,0]=4 4723 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb9777886 [0,1,0,0,1,0|2,0,0]=4 4724 B12R1.145 Cn1nccc1C[C@@H](N)C(=O)O Amb35733298 [0,1,0,0,1,0|2,0,0]=4 4725 B12R1.145 NC(=O)C(N)Cc1ccsc1Br Amb25181478 [0,1,0,0,1,0|2,0,0]=4 4726 B12R1.145 NC(=O)C(N)Cc1ccsc1Cl Amb33309234 [0,1,0,0,1,0|2,0,0]=4 4727 B12R1.145 NC(=O)C(N)Cc1sccc1Br Amb25131511 [0,1,0,0,1,0|2,0,0]=4 4728 B12R1.145 NC(=O)C(N)Cc1sccc1Cl Amb25738868 [0,1,0,0,1,0|2,0,0]=4 4729 B12R1.145 NC(Cc1ccnn1O)C(=O)O Amb27602908 [0,1,0,0,1,0|2,0,0]=4 4730 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb25795560 [0,1,0,0,1,0|1,0,0]=3 4731 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb33743565 [0,1,0,0,1,0|1,0,0]=3 4732 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb24399335 [0,1,0,0,1,0|1,0,0]=3 4733 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb33299257 [0,1,0,0,1,0|1,0,0]=3 4734 B12R1.145 NC(Cc1cncn1O)C(=O)O Amb27214198 [0,1,0,0,1,0|2,0,0]=4 4735 B12R1.145 NC(Cc1conc1O)C(=O)O Amb26032245 [0,1,0,0,1,0|2,0,0]=4 4736 B12R1.145 NC(Cc1cscc1Br)C(=O)O Amb27642505 [0,1,0,0,1,0|1,0,0]=3 4737 B12R1.145 NC(Cc1ncsc1Cl)C(=O)O Amb33036885 [0,1,0,0,1,0|2,0,0]=4 4738 B12R1.145 NC(Cc1ncsc1Cl)C(=O)O Amb33803973 [0,1,0,0,1,0|2,0,0]=4 4739 B12R1.145 NC(Cc1occc1Br)C(=O)O Amb28456942 [0,1,0,0,1,0|1,0,0]=3 4740 B12R1.145 NC(Cc1sccc1Br)C(=O)O Amb27410749 [0,1,0,0,1,0|1,0,0]=3 4741 B12R1.145 NC(Cc1sccc1Cl)C(=O)O Amb28132824 [0,1,0,0,1,0|1,0,0]=3 4742 B12R1.145 N[C@@H](CC1CC=CC1=O)C(=O)O Amb27975228 [0,1,0,0,1,0|0,0,2]=4 4743 B12R1.145 N[C@@H](Cc1ccsc1Br)C(=O)O Amb25335861 [0,1,0,0,1,0|1,0,0]=3 4744 B12R1.145 N[C@@H](Cc1ccsc1Cl)C(=O)O Amb24350624 [0,1,0,0,1,0|1,0,0]=3 4745 B12R1.145 N[C@@H](Cc1ncsc1Cl)C(=O)O Amb33065882 [0,1,0,0,1,0|2,0,0]=4 4746 B12R1.145 N[C@@H](Cc1sccc1Br)C(=O)O Amb24615699 [0,1,0,0,1,0|1,0,0]=3 4747 B12R1.145 N[C@@H](Cc1sccc1Cl)C(=O)O Amb25267667 [0,1,0,0,1,0|1,0,0]=3 4748 B12R1.145 N[C@@H](Cc1scnc1Cl)C(=O)O Amb33036143 [0,1,0,0,1,0|2,0,0]=4 4749 B12R1.145 N[C@@H](Cc1sncc1Br)C(=O)O Amb33037097 [0,1,0,0,1,0|2,0,0]=4 4750 B12R1.145 N[C@H](Cc1ccsc1Br)C(=O)O Amb24600296 [0,1,0,0,1,0|1,0,0]=3 4751 B12R1.145 N[C@H](Cc1ccsc1Cl)C(=O)O Amb28186495 [0,1,0,0,1,0|1,0,0]=3 4752 B12R1.145 N[C@H](Cc1ncsc1Cl)C(=O)O Amb33308574 [0,1,0,0,1,0|2,0,0]=4 4753 B12R1.145 N[C@H](Cc1sccc1Br)C(=O)O Amb26976119 [0,1,0,0,1,0|1,0,0]=3 4754 B12R1.145 N[C@H](Cc1sccc1Cl)C(=O)O Amb28123220 [0,1,0,0,1,0|1,0,0]=3 4755 B12R1.145 N[C@H](Cc1scnc1Cl)C(=O)O Amb33065656 [0,1,0,0,1,0|2,0,0]=4 4756 B12R1.145 N[C@H](Cc1sncc1Br)C(=O)O Amb32867931 [0,1,0,0,1,0|2,0,0]=4 4757 B12R1.145 O=C(O)C(F)Cc1ccsc1Cl Amb27845252 [0,1,0,0,1,0|2,0,0]=4 4758 B12R1.145 O=C(O)C(F)Cc1cscc1Br Amb27867945 [0,1,0,0,1,0|2,0,0]=4 4759 B12R1.145 O=C(O)C(F)Cc1occc1Br Amb27780216 [0,1,0,0,1,0|2,0,0]=4 4760 B12R1.145 O=C(O)C(F)Cn1cccc1Cl Amb27482015 [0,1,0,0,1,0|2,0,0]=4 4761 B12R1.145 O=C(O)C(O)Cc1ccsc1Br Amb27657975 [0,1,0,0,1,0|2,0,0]=4 4762 B12R1.145 O=C(O)C(O)Cc1ccsc1Cl Amb33353362 [0,1,0,0,1,0|2,0,0]=4 4763 B12R1.145 O=C(O)C(O)Cc1cscc1Br Amb33353261 [0,1,0,0,1,0|2,0,0]=4 4764 B12R1.145 O=C(O)C(O)Cc1cscc1Cl Amb33353478 [0,1,0,0,1,0|2,0,0]=4 4765 B12R1.145 O=C(O)C(O)Cc1occc1Br Amb33353341 [0,1,0,0,1,0|2,0,0]=4 4766 B12R1.145 O=C(O)C(O)Cc1sccc1Br Amb25071900 [0,1,0,0,1,0|2,0,0]=4 4767 B12R1.145 O=C(O)C(O)Cc1sccc1Cl Amb26923733 [0,1,0,0,1,0|2,0,0]=4 4768 B12R1.298 CCC(Cc1ccco1)C(=O)O Amb5744031 [0,1,0,0,1,0|2,0,0]=4 4769 B12R1.298 CCC(Cc1cccs1)C(=O)O Amb5744032 [0,1,0,0,1,0|2,0,0]=4 4770 B12R1.298 CCC(Cc1ccsc1)C(=O)O Amb17605845 [0,1,0,0,1,0|2,0,0]=4 4771 B12R1.298 CNC(Cn1cccn1)C(=O)O Amb18788966 [0,1,0,0,1,0|2,0,0]=4 4772 B12R1.298 CNC(Cn1ccnc1)C(=O)O Amb18788964 [0,1,0,0,1,0|2,0,0]=4 4773 B12R1.298 COC(Cc1ccco1)C(=O)O Amb33360945 [0,1,0,0,1,0|2,0,0]=4 4774 B12R1.298 COC(Cc1cccs1)C(=O)O Amb33361315 [0,1,0,0,1,0|2,0,0]=4 4775 B12R1.298 COC(Cc1ccoc1)C(=O)O Amb33360377 [0,1,0,0,1,0|2,0,0]=4 4776 B12R1.298 COC(Cc1ccsc1)C(=O)O Amb33428907 [0,1,0,0,1,0|2,0,0]=4 4777 B12R1.298 N#CC(Cc1ccco1)C(=O)O Amb17090105 [0,1,0,0,1,0|1,0,1]=4 4778 B12R1.298 N#CC(Cc1cccs1)C(=O)O Amb17090106 [0,1,0,0,1,0|1,0,1]=4 4779 B12R1.298 N#CC(Cc1ccoc1)C(=O)O Amb35584079 [0,1,0,0,1,0|1,0,1]=4 4780 B12R1.298 N#CC(Cc1ccsc1)C(=O)O Amb35584086 [0,1,0,0,1,0|1,0,1]=4 4781 B12R1.298 NCC(Cc1ccco1)C(=O)O Amb5744246 [0,1,0,0,1,0|1,0,0]=3 4782 B12R1.298 NCC(Cc1ccco1)C(N)=O Amb9211714 [0,1,0,0,1,0|2,0,0]=4 4783 B12R1.298 NCC(Cc1cccs1)C(=O)O Amb28555777 [0,1,0,0,1,0|1,0,0]=3 4784 B12R1.298 NCC(Cc1cccs1)C(=O)O Amb5744247 [0,1,0,0,1,0|1,0,0]=3 4785 B12R1.298 NCC(Nc1ccsc1)C(=O)O Amb28124232 [0,1,0,0,1,0|2,0,0]=4 4786 B12R1.1373 CC(C)(Cc1ccco1)C(=O)O Amb18303224 [0,1,0,0,1,0|2,0,0]=4 4787 B12R1.1373 CC(C)(Cc1cccs1)C(=O)O Amb18999501 [0,1,0,0,1,0|2,0,0]=4 4788 B12R1.1373 CC(C)(Cc1ccoc1)C(=O)O Amb25336532 [0,1,0,0,1,0|2,0,0]=4 4789 B12R1.1373 CC(C)(Cc1ccsc1)C(=O)O Amb18302688 [0,1,0,0,1,0|2,0,0]=4 4790 B12R1.1373 CC(N)(Cc1ccco1)C(=O)O Amb17232695 [0,1,0,0,1,0|1,0,0]=3 4791 B12R1.1373 CC(N)(Cc1cccs1)C(=O)O Amb17234195 [0,1,0,0,1,0|1,0,0]=3 4792 B12R1.1373 CC(N)(Cc1cccs1)C(N)=O Amb29859697 [0,1,0,0,1,0|2,0,0]=4 4793 B12R1.1373 CC(N)(Cc1ccsc1)C(N)=O Amb35690846 [0,1,0,0,1,0|2,0,0]=4 4794 B12R1.1373 CC(N)(Cn1cccn1)C(=O)O Amb18984348 [0,1,0,0,1,0|2,0,0]=4 4795 B12R1.1373 CC(N)(Cn1cccn1)C(=O)O Amb30584857 [0,1,0,0,1,0|2,0,0]=4 4796 B12R1.1373 CC(N)(Cn1ccnc1)C(=O)O Amb18294519 [0,1,0,0,1,0|2,0,0]=4 4797 B12R1.1373 CC(O)(Cc1ccco1)C(=O)O Amb33360942 [0,1,0,0,1,0|2,0,0]=4 4798 B12R1.1373 CC(O)(Cc1cccs1)C(=O)O Amb33361314 [0,1,0,0,1,0|2,0,0]=4 4799 B12R1.1373 CC(O)(Cc1ccoc1)C(=O)O Amb33360373 [0,1,0,0,1,0|2,0,0]=4 4800 B12R1.1373 CC(O)(Cc1ccsc1)C(=O)O Amb33428904 [0,1,0,0,1,0|2,0,0]=4 4801 B12R1.1373 O=C(O)C(F)(F)Cc1ccco1 Amb33170639 [0,1,0,0,1,0|2,0,0]=4 4802 B12R1.1373 O=C(O)C(F)(F)Cc1cccs1 Amb33170640 [0,1,0,0,1,0|2,0,0]=4 4803 B12R1.1373 O=C(O)C(F)(F)Cc1ccoc1 Amb33170638 [0,1,0,0,1,0|2,0,0]=4 4804 B12R1.1373 O=C(O)C(F)(F)Cc1ccsc1 Amb33170641 [0,1,0,0,1,0|2,0,0]=4 4805 B12R1.1373 O=C(O)C(F)(F)Cn1cccc1 Amb28454449 [0,1,0,0,1,0|2,0,0]=4 4806 B12R1.20 C=C(C(=O)O)c1ccc(Br)cc1 Amb17322199 [0,1,0,0,1,0|1,0,1]=4 4807 B12R1.20 C=C(C(=O)O)c1ccc(C)cc1 Amb17322163 [0,1,0,0,1,0|1,0,1]=4 4808 B12R1.20 C=C(C(=O)O)c1ccc(Cl)cc1 Amb17322176 [0,1,0,0,1,0|1,0,1]=4 4809 B12R1.20 C=C(C(=O)O)c1ccc(F)cc1 Amb17322166 [0,1,0,0,1,0|1,0,1]=4 4810 B12R1.20 C=C(C(=O)O)c1ccc(N)cc1 Amb32687898 [0,1,0,0,1,0|1,0,1]=4 4811 B12R1.20 C=C(C(=O)O)c1ccc(O)cc1 Amb33269492 [0,1,0,0,1,0|1,0,1]=4 4812 B12R1.20 CC(=O)C(Br)c1ccc(Br)cc1 Amb27613731 [0,1,0,0,1,0|2,0,0]=4 4813 B12R1.20 CC(=O)C(Br)c1ccc(C)cc1 Amb17142262 [0,1,0,0,1,0|2,0,0]=4 4814 B12R1.20 CC(=O)C(Br)c1ccc(Cl)cc1 Amb27613733 [0,1,0,0,1,0|2,0,0]=4 4815 B12R1.20 CC(=O)C(Br)c1ccc(F)cc1 Amb17142689 [0,1,0,0,1,0|2,0,0]=4 4816 B12R1.20 CC(=O)C(Br)c1ccc(I)cc1 Amb27670231 [0,1,0,0,1,0|2,0,0]=4 4817 B12R1.20 CC(=O)C(C)c1ccc(Cl)cc1 Amb26370672 [0,1,0,0,1,0|2,0,0]=4 4818 B12R1.20 CC(=O)C(C)c1ccc(F)cc1 Amb25802289 [0,1,0,0,1,0|2,0,0]=4 4819 B12R1.20 CC(=O)C(C)c1ccc(I)cc1 Amb27980602 [0,1,0,0,1,0|2,0,0]=4 4820 B12R1.20 CC(=O)C(C)c1ccc(O)cc1 Amb28141295 [0,1,0,0,1,0|2,0,0]=4 4821 B12R1.20 CC(=O)C(Cl)c1ccc(C)cc1 Amb17139039 [0,1,0,0,1,0|2,0,0]=4 4822 B12R1.20 CC(=O)C(Cl)c1ccc(F)cc1 Amb17139154 [0,1,0,0,1,0|2,0,0]=4 4823 B12R1.20 CC(=O)C(F)c1ccc(F)cc1 Amb26873927 [0,1,0,0,1,0|2,0,0]=4 4824 B12R1.20 CC(=O)C(N)c1ccc(Br)nc1 Amb27239764 [0,1,0,0,1,0|2,0,0]=4 4825 B12R1.20 CC(=O)C(N)c1ccc(C)cc1 Amb27655460 [0,1,0,0,1,0|1,0,0]=3 4826 B12R1.20 CC(=O)C(N)c1ccc(C)nc1 Amb27413876 [0,1,0,0,1,0|2,0,0]=4 4827 B12R1.20 CC(=O)C(N)c1ccc(Cl)cc1 Amb24376685 [0,1,0,0,1,0|1,0,0]=3 4828 B12R1.20 CC(=O)C(N)c1ccc(F)cc1 Amb25865447 [0,1,0,0,1,0|1,0,0]=3 4829 B12R1.20 CC(=O)C(N)c1ccc(N)nc1 Amb28040891 [0,1,0,0,1,0|2,0,0]=4 4830 B12R1.20 CC(=O)C(N)c1ccc(O)cc1 Amb27468663 [0,1,0,0,1,0|1,0,0]=3 4831 B12R1.20 CC(=O)C(N)c1ccc(S)cc1 Amb27425197 [0,1,0,0,1,0|1,0,0]=3 4832 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [0,1,0,0,1,0|2,0,0]=4 4833 B12R1.20 CC(=O)C(O)c1ccc(C)cc1 Amb26972409 [0,1,0,0,1,0|2,0,0]=4 4834 B12R1.20 CC(=O)C(O)c1ccc(Cl)cc1 Amb27968684 [0,1,0,0,1,0|2,0,0]=4 4835 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [0,1,0,0,1,0|2,0,0]=4 4836 B12R1.20 CC(=O)N(N)c1ccc(Br)cc1 Amb18070169 [0,1,0,0,1,0|2,0,0]=4 4837 B12R1.20 CC(=O)N(N)c1ccc(C)cc1 Amb18563638 [0,1,0,0,1,0|2,0,0]=4 4838 B12R1.20 CC(=O)N(N)c1ccc(Cl)cc1 Amb18564312 [0,1,0,0,1,0|2,0,0]=4 4839 B12R1.20 CC(=O)N(N)c1ccc(F)cc1 Amb18563834 [0,1,0,0,1,0|2,0,0]=4 4840 B12R1.20 CC(=O)[C@H](O)c1ccc(C)cc1 Amb27828871 [0,1,0,0,1,0|2,0,0]=4 4841 B12R1.20 CC(C(=O)Cl)c1ccc(Cl)cc1 Amb27947950 [0,1,0,0,1,0|2,0,0]=4 4842 B12R1.20 CC(C(=O)Cl)c1ccc(F)cc1 Amb27461690 [0,1,0,0,1,0|2,0,0]=4 4843 B12R1.20 CC(C(=O)O)N1C=CC(=O)C=C1 Amb18534254 [0,1,0,0,1,0|2,0,0]=4 4844 B12R1.20 CC(C(=O)O)c1ccc(Br)cc1 Amb33548920 [0,1,0,0,1,0|1,0,0]=3 4845 B12R1.20 CC(C(=O)O)c1ccc(Br)cn1 Amb26982144 [0,1,0,0,1,0|2,0,0]=4 4846 B12R1.20 CC(C(=O)O)c1ccc(Br)nc1 Amb33388091 [0,1,0,0,1,0|2,0,0]=4 4847 B12R1.20 CC(C(=O)O)c1ccc(Cl)cc1 Amb3939887 [0,1,0,0,1,0|1,0,0]=3 4848 B12R1.20 CC(C(=O)O)c1ccc(Cl)cn1 Amb27953254 [0,1,0,0,1,0|2,0,0]=4 4849 B12R1.20 CC(C(=O)O)c1ccc(Cl)nc1 Amb19944615 [0,1,0,0,1,0|2,0,0]=4 4850 B12R1.20 CC(C(=O)O)c1ccc(F)cc1 Amb3940743 [0,1,0,0,1,0|1,0,0]=3 4851 B12R1.20 CC(C(=O)O)c1ccc(F)cn1 Amb27598868 [0,1,0,0,1,0|2,0,0]=4 4852 B12R1.20 CC(C(=O)O)c1ccc(F)nc1 Amb33426579 [0,1,0,0,1,0|2,0,0]=4 4853 B12R1.20 CC(C(=O)O)c1ccc(I)cc1 Amb20619418 [0,1,0,0,1,0|1,0,0]=3 4854 B12R1.20 CC(C(=O)O)c1ccc(N)cc1 Amb24113246 [0,1,0,0,1,0|1,0,0]=3 4855 B12R1.20 CC(C(=O)O)c1ccc(N)cc1 Amb9776208 [0,1,0,0,1,0|1,0,0]=3 4856 B12R1.20 CC(C(=O)O)c1ccc(N)cn1 Amb33097422 [0,1,0,0,1,0|2,0,0]=4 4857 B12R1.20 CC(C(=O)O)c1ccc(O)cc1 Amb2720239 [0,1,0,0,1,0|1,0,0]=3 4858 B12R1.20 CC(C(=O)O)c1ccc(S)cc1 Amb26371549 [0,1,0,0,1,0|1,0,0]=3 4859 B12R1.20 CC(C(N)=O)c1ccc(Br)cc1 Amb25966803 [0,1,0,0,1,0|2,0,0]=4 4860 B12R1.20 CC(O)C(N)c1ccc(Br)cc1 Amb17248848 [0,1,0,0,1,0|1,0,1]=4 4861 B12R1.20 CC(O)[C@@H](N)c1ccc(Br)cc1 Amb27389646 [0,1,0,0,1,0|1,0,1]=4 4862 B12R1.20 CC(O)[C@H](N)c1ccc(Br)cc1 Amb25850041 [0,1,0,0,1,0|1,0,1]=4 4863 B12R1.20 CC(O)[C@H](N)c1ccc(I)cc1 Amb27961203 [0,1,0,0,1,0|1,0,1]=4 4864 B12R1.20 C[C@@H](C(=O)O)c1ccc(Cl)cc1 Amb24182093 [0,1,0,0,1,0|1,0,0]=3 4865 B12R1.20 C[C@@H](C(=O)O)c1ccc(F)cc1 Amb10843989 [0,1,0,0,1,0|1,0,0]=3 4866 B12R1.20 C[C@@H](C(=O)O)c1ccc(F)cn1 Amb33727759 [0,1,0,0,1,0|2,0,0]=4 4867 B12R1.20 C[C@@H](C(=O)O)c1ccc(O)cc1 Amb10843991 [0,1,0,0,1,0|1,0,0]=3 4868 B12R1.20 C[C@@H](C(N)=O)c1ccc(F)cc1 Amb28367943 [0,1,0,0,1,0|2,0,0]=4 4869 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(F)cc1 Amb27247738 [0,1,0,0,1,0|1,0,1]=4 4870 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(O)cc1 Amb27244891 [0,1,0,0,1,0|1,0,1]=4 4871 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(I)cc1 Amb27224057 [0,1,0,0,1,0|1,0,1]=4 4872 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(S)cc1 Amb27265882 [0,1,0,0,1,0|1,0,1]=4 4873 B12R1.20 C[C@H](C(=O)O)c1ccc(F)cc1 Amb27251587 [0,1,0,0,1,0|1,0,0]=3 4874 B12R1.20 C[C@H](C(=O)O)c1ccc(F)cn1 Amb33749529 [0,1,0,0,1,0|2,0,0]=4 4875 B12R1.20 C[C@H](C(=O)O)c1ccc(O)cc1 Amb21855850 [0,1,0,0,1,0|1,0,0]=3 4876 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(Br)cc1 Amb27393626 [0,1,0,0,1,0|1,0,1]=4 4877 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(F)cc1 Amb27786322 [0,1,0,0,1,0|1,0,1]=4 4878 B12R1.20 C[C@H](O)[C@H](N)c1ccc(Cl)cc1 Amb27241334 [0,1,0,0,1,0|1,0,1]=4 4879 B12R1.20 C[C@H](O)[C@H](N)c1ccc(F)cc1 Amb27259152 [0,1,0,0,1,0|1,0,1]=4 4880 B12R1.20 C[C@H](O)[C@H](N)c1ccc(N)cc1 Amb28057162 [0,1,0,0,1,0|1,0,1]=4 4881 B12R1.20 Cc1ccc(C(=O)C(=O)O)cc1 Amb1220932 [0,1,0,0,1,0|1,0,1]=4 4882 B12R1.20 Cc1ccc(C(Br)C(=O)O)cc1 Amb27264776 [0,1,0,0,1,0|1,0,0]=3 4883 B12R1.20 Cc1ccc(C(C)C(=O)O)cc1 Amb17678847 [0,1,0,0,1,0|1,0,0]=3 4884 B12R1.20 Cc1ccc(C(C)C(=O)O)cn1 Amb18828385 [0,1,0,0,1,0|2,0,0]=4 4885 B12R1.20 Cc1ccc(C(C)C(=O)O)nc1 Amb25894919 [0,1,0,0,1,0|2,0,0]=4 4886 B12R1.20 Cc1ccc(C(C)C(=O)[O-])cc1 Amb22274331 [0,1,0,0,1,0|1,0,1]=4 4887 B12R1.20 Cc1ccc(C(Cl)C(=O)Cl)cc1 Amb17506249 [0,1,0,0,1,0|2,0,0]=4 4888 B12R1.20 Cc1ccc(C(Cl)C(=O)O)cc1 Amb17234143 [0,1,0,0,1,0|1,0,0]=3 4889 B12R1.20 Cc1ccc(C(F)C(=O)O)cc1 Amb25320951 [0,1,0,0,1,0|1,0,0]=3 4890 B12R1.20 Cc1ccc(C(F)C(=O)O)cn1 Amb27755813 [0,1,0,0,1,0|2,0,0]=4 4891 B12R1.20 Cc1ccc(C(N)C(=O)O)cc1 Amb9727092 [0,1,0,0,1,0|0,0,0]=2 4892 B12R1.20 Cc1ccc(C(N)C(=O)O)cn1 Amb27175363 [0,1,0,0,1,0|1,0,0]=3 4893 B12R1.20 Cc1ccc(C(N)C(=O)O)nc1 Amb3941906 [0,1,0,0,1,0|1,0,0]=3 4894 B12R1.20 Cc1ccc(C(N)C(N)=O)cc1 Amb17334619 [0,1,0,0,1,0|1,0,0]=3 4895 B12R1.20 Cc1ccc(C(N)[PH](=O)O)cc1 Amb27863479 [0,1,0,0,1,0|1,0,0]=3 4896 B12R1.20 Cc1ccc(C(O)C(=O)O)cc1 Amb2699824 [0,1,0,0,1,0|1,0,0]=3 4897 B12R1.20 Cc1ccc(C(O)C(=O)O)cn1 Amb26489618 [0,1,0,0,1,0|2,0,0]=4 4898 B12R1.20 Cc1ccc(C(O)C(=O)O)nc1 Amb8386314 [0,1,0,0,1,0|2,0,0]=4 4899 B12R1.20 Cc1ccc(C(O)C(N)=O)cc1 Amb18800898 [0,1,0,0,1,0|2,0,0]=4 4900 B12R1.20 Cc1ccc(C(S)C(=O)O)cc1 Amb27966844 [0,1,0,0,1,0|1,0,0]=3 4901 B12R1.20 Cc1ccc([C@@H](C)C(=O)O)cc1 Amb22736712 [0,1,0,0,1,0|1,0,0]=3 4902 B12R1.20 Cc1ccc([C@@H](C)C(=O)O)cn1 Amb33729608 [0,1,0,0,1,0|2,0,0]=4 4903 B12R1.20 Cc1ccc([C@@H](N)C(=O)O)cc1 Amb22747999 [0,1,0,0,1,0|0,0,0]=2 4904 B12R1.20 Cc1ccc([C@@H](N)C(=O)O)cn1 Amb27760372 [0,1,0,0,1,0|1,0,0]=3 4905 B12R1.20 Cc1ccc([C@@H](N)[C@@H](C)O)cc1 Amb28137794 [0,1,0,0,1,0|1,0,1]=4 4906 B12R1.20 Cc1ccc([C@@H](O)C(=O)O)cc1 Amb10808019 [0,1,0,0,1,0|1,0,0]=3 4907 B12R1.20 Cc1ccc([C@@H](O)C(N)=O)cc1 Amb27394745 [0,1,0,0,1,0|2,0,0]=4 4908 B12R1.20 Cc1ccc([C@H](C)C(=O)O)cc1 Amb22736713 [0,1,0,0,1,0|1,0,0]=3 4909 B12R1.20 Cc1ccc([C@H](C)C(=O)O)cn1 Amb33747709 [0,1,0,0,1,0|2,0,0]=4 4910 B12R1.20 Cc1ccc([C@H](N)C(=O)O)cc1 Amb17621414 [0,1,0,0,1,0|0,0,0]=2 4911 B12R1.20 Cc1ccc([C@H](N)C(C)O)cc1 Amb28047370 [0,1,0,0,1,0|1,0,1]=4 4912 B12R1.20 Cc1ccc([C@H](N)[C@@H](C)O)cc1 Amb27476110 [0,1,0,0,1,0|1,0,1]=4 4913 B12R1.20 Cc1ccc([C@H](N)[C@H](C)O)cc1 Amb27451602 [0,1,0,0,1,0|1,0,1]=4 4914 B12R1.20 Cc1cnc(C(N)C(=O)O)cn1 Amb33375119 [0,1,0,0,1,0|2,0,0]=4 4915 B12R1.20 NC(=O)C(Br)c1ccc(Br)cc1 Amb23510123 [0,1,0,0,1,0|2,0,0]=4 4916 B12R1.20 NC(=O)C(Br)c1ccc(F)cc1 Amb487220 [0,1,0,0,1,0|2,0,0]=4 4917 B12R1.20 NC(=O)C(Cl)c1ccc(Br)cc1 Amb1199712 [0,1,0,0,1,0|2,0,0]=4 4918 B12R1.20 NC(=O)C(Cl)c1ccc(Cl)cc1 Amb27460223 [0,1,0,0,1,0|2,0,0]=4 4919 B12R1.20 NC(=O)C(Cl)c1ccc(F)cc1 Amb18329809 [0,1,0,0,1,0|2,0,0]=4 4920 B12R1.20 NC(=O)C(F)c1ccc(Cl)cc1 Amb27750802 [0,1,0,0,1,0|2,0,0]=4 4921 B12R1.20 NC(=O)C(N)c1ccc(Br)cc1 Amb13951626 [0,1,0,0,1,0|1,0,0]=3 4922 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb17335727 [0,1,0,0,1,0|1,0,0]=3 4923 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb19400288 [0,1,0,0,1,0|1,0,0]=3 4924 B12R1.20 NC(=O)C(N)c1ccc(F)cc1 Amb17334711 [0,1,0,0,1,0|1,0,0]=3 4925 B12R1.20 NC(=O)C(N)c1ccc(I)cc1 Amb27590062 [0,1,0,0,1,0|1,0,0]=3 4926 B12R1.20 NC(=O)C(N)c1ccc(O)cc1 Amb17334665 [0,1,0,0,1,0|1,0,0]=3 4927 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [0,1,0,0,1,0|2,0,0]=4 4928 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [0,1,0,0,1,0|2,0,0]=4 4929 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [0,1,0,0,1,0|2,0,0]=4 4930 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [0,1,0,0,1,0|2,0,0]=4 4931 B12R1.20 NC(=O)[C@@H](N)c1ccc(F)cc1 Amb27400415 [0,1,0,0,1,0|1,0,0]=3 4932 B12R1.20 NC(=O)[C@@H](N)c1ccc(O)cc1 Amb28520639 [0,1,0,0,1,0|1,0,0]=3 4933 B12R1.20 NC(=O)[C@H](N)c1ccc(O)cc1 Amb15741205 [0,1,0,0,1,0|1,0,0]=3 4934 B12R1.20 NC(=S)C(N)c1ccc(F)cc1 Amb19374912 [0,1,0,0,1,0|1,1,0]=4 4935 B12R1.20 NC(C(=O)O)c1ccc(Br)cc1 Amb9722729 [0,1,0,0,1,0|0,0,0]=2 4936 B12R1.20 NC(C(=O)O)c1ccc(Br)cn1 Amb26995494 [0,1,0,0,1,0|1,0,0]=3 4937 B12R1.20 NC(C(=O)O)c1ccc(Br)nc1 Amb2684119 [0,1,0,0,1,0|1,0,0]=3 4938 B12R1.20 NC(C(=O)O)c1ccc(Cl)cc1 Amb9723681 [0,1,0,0,1,0|0,0,0]=2 4939 B12R1.20 NC(C(=O)O)c1ccc(Cl)cn1 Amb24081006 [0,1,0,0,1,0|1,0,0]=3 4940 B12R1.20 NC(C(=O)O)c1ccc(F)cc1 Amb2688343 [0,1,0,0,1,0|0,0,0]=2 4941 B12R1.20 NC(C(=O)O)c1ccc(F)cn1 Amb28424167 [0,1,0,0,1,0|1,0,0]=3 4942 B12R1.20 NC(C(=O)O)c1ccc(F)nc1 Amb26025544 [0,1,0,0,1,0|1,0,0]=3 4943 B12R1.20 NC(C(=O)O)c1ccc(I)cc1 Amb2234604 [0,1,0,0,1,0|0,0,0]=2 4944 B12R1.20 NC(C(=O)O)c1ccc(I)cn1 Amb27402490 [0,1,0,0,1,0|1,0,0]=3 4945 B12R1.20 NC(C(=O)O)c1ccc(O)cc1 Amb29847170 [0,1,0,0,1,0|0,0,0]=2 4946 B12R1.20 NC(C(=O)O)c1ccc(O)cc1 Amb9718293 [0,1,0,0,1,0|0,0,0]=2 4947 B12R1.20 NC(C(=O)O)c1ncc(Br)cn1 Amb33334350 [0,1,0,0,1,0|2,0,0]=4 4948 B12R1.20 NC(c1ccc(Br)cc1)[PH](=O)O Amb28127783 [0,1,0,0,1,0|1,0,0]=3 4949 B12R1.20 NC(c1ccc(F)cc1)[PH](=O)O Amb27483009 [0,1,0,0,1,0|1,0,0]=3 4950 B12R1.20 N[C@@H](C(=O)O)c1ccc(Br)cc1 Amb22745984 [0,1,0,0,1,0|0,0,0]=2 4951 B12R1.20 N[C@@H](C(=O)O)c1ccc(Br)cn1 Amb25824057 [0,1,0,0,1,0|1,0,0]=3 4952 B12R1.20 N[C@@H](C(=O)O)c1ccc(Cl)cc1 Amb19889601 [0,1,0,0,1,0|0,0,0]=2 4953 B12R1.20 N[C@@H](C(=O)O)c1ccc(Cl)cc1 Amb3903895 [0,1,0,0,1,0|0,0,0]=2 4954 B12R1.20 N[C@@H](C(=O)O)c1ccc(F)cc1 Amb19889896 [0,1,0,0,1,0|0,0,0]=2 4955 B12R1.20 N[C@@H](C(=O)O)c1ccc(F)cc1 Amb8516394 [0,1,0,0,1,0|0,0,0]=2 4956 B12R1.20 N[C@@H](C(=O)O)c1ccc(I)cn1 Amb28323100 [0,1,0,0,1,0|1,0,0]=3 4957 B12R1.20 N[C@@H](C(=O)O)c1ccc(O)cc1 Amb6357414 [0,1,0,0,1,0|0,0,0]=2 4958 B12R1.20 N[C@H](C(=O)O)c1ccc(Br)cc1 Amb26859346 [0,1,0,0,1,0|0,0,0]=2 4959 B12R1.20 N[C@H](C(=O)O)c1ccc(Br)cn1 Amb24451007 [0,1,0,0,1,0|1,0,0]=3 4960 B12R1.20 N[C@H](C(=O)O)c1ccc(Cl)cc1 Amb3903896 [0,1,0,0,1,0|0,0,0]=2 4961 B12R1.20 N[C@H](C(=O)O)c1ccc(F)cc1 Amb19889897 [0,1,0,0,1,0|0,0,0]=2 4962 B12R1.20 N[C@H](C(=O)O)c1ccc(F)cc1 Amb2694824 [0,1,0,0,1,0|0,0,0]=2 4963 B12R1.20 N[C@H](C(=O)O)c1ccc(I)cn1 Amb28383428 [0,1,0,0,1,0|1,0,0]=3 4964 B12R1.20 N[C@H](C(=O)O)c1ccc(I)nc1 Amb27800830 [0,1,0,0,1,0|1,0,0]=3 4965 B12R1.20 N[C@H](C(=O)O)c1ccc(O)cc1 Amb8627698 [0,1,0,0,1,0|0,0,0]=2 4966 B12R1.20 N[C@H](C(=O)O)c1ccc(O)cn1 Amb27470839 [0,1,0,0,1,0|1,0,0]=3 4967 B12R1.20 Nc1ccc(C(=O)C(=O)O)cc1 Amb2695217 [0,1,0,0,1,0|1,0,1]=4 4968 B12R1.20 Nc1ccc(C(N)C(=O)O)cc1 Amb18646484 [0,1,0,0,1,0|0,0,0]=2 4969 B12R1.20 Nc1ccc(C(N)C(=O)O)cn1 Amb27413070 [0,1,0,0,1,0|1,0,0]=3 4970 B12R1.20 Nc1ccc(C(O)C(=O)O)cc1 Amb20668152 [0,1,0,0,1,0|1,0,0]=3 4971 B12R1.20 Nc1ccc(C(O)C(=O)O)cc1 Amb30666657 [0,1,0,0,1,0|1,0,0]=3 4972 B12R1.20 Nc1ccc([C@@H](N)C(=O)O)cc1 Amb30634169 [0,1,0,0,1,0|0,0,0]=2 4973 B12R1.20 Nc1ccc([C@H](N)C(=O)O)nc1 Amb27175667 [0,1,0,0,1,0|1,0,0]=3 4974 B12R1.20 O=C(Cl)C(Br)c1ccc(Cl)cc1 Amb27654041 [0,1,0,0,1,0|2,0,0]=4 4975 B12R1.20 O=C(Cl)C(Cl)c1ccc(F)cc1 Amb17098059 [0,1,0,0,1,0|2,0,0]=4 4976 B12R1.20 O=C(Cl)C(F)c1ccc(F)cc1 Amb27495543 [0,1,0,0,1,0|2,0,0]=4 4977 B12R1.20 O=C(O)C(=O)c1ccc(Br)cc1 Amb8834323 [0,1,0,0,1,0|1,0,1]=4 4978 B12R1.20 O=C(O)C(=O)c1ccc(Cl)cc1 Amb8834322 [0,1,0,0,1,0|1,0,1]=4 4979 B12R1.20 O=C(O)C(=O)c1ccc(F)cc1 Amb8834309 [0,1,0,0,1,0|1,0,1]=4 4980 B12R1.20 O=C(O)C(=O)c1ccc(I)cc1 Amb9210543 [0,1,0,0,1,0|1,0,1]=4 4981 B12R1.20 O=C(O)C(=O)c1ccc(O)cc1 Amb16231521 [0,1,0,0,1,0|1,0,1]=4 4982 B12R1.20 O=C(O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,1,0,0,1,0|1,0,0]=3 4983 B12R1.20 O=C(O)C(Cl)c1ccc(Br)cc1 Amb17261128 [0,1,0,0,1,0|1,0,0]=3 4984 B12R1.20 O=C(O)C(Cl)c1ccc(Cl)cc1 Amb17238287 [0,1,0,0,1,0|1,0,0]=3 4985 B12R1.20 O=C(O)C(Cl)c1ccc(F)cc1 Amb17234610 [0,1,0,0,1,0|1,0,0]=3 4986 B12R1.20 O=C(O)C(F)c1ccc(Br)cc1 Amb27871352 [0,1,0,0,1,0|1,0,0]=3 4987 B12R1.20 O=C(O)C(F)c1ccc(Br)cn1 Amb32713067 [0,1,0,0,1,0|2,0,0]=4 4988 B12R1.20 O=C(O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,1,0,0,1,0|1,0,0]=3 4989 B12R1.20 O=C(O)C(F)c1ccc(F)cc1 Amb33550136 [0,1,0,0,1,0|1,0,0]=3 4990 B12R1.20 O=C(O)C(O)c1ccc(Br)cc1 Amb9762912 [0,1,0,0,1,0|1,0,0]=3 4991 B12R1.20 O=C(O)C(O)c1ccc(Br)nc1 Amb33387725 [0,1,0,0,1,0|2,0,0]=4 4992 B12R1.20 O=C(O)C(O)c1ccc(Cl)cc1 Amb9762911 [0,1,0,0,1,0|1,0,0]=3 4993 B12R1.20 O=C(O)C(O)c1ccc(Cl)nc1 Amb27261816 [0,1,0,0,1,0|2,0,0]=4 4994 B12R1.20 O=C(O)C(O)c1ccc(F)cc1 Amb1218322 [0,1,0,0,1,0|1,0,0]=3 4995 B12R1.20 O=C(O)C(O)c1ccc(F)cn1 Amb33316223 [0,1,0,0,1,0|2,0,0]=4 4996 B12R1.20 O=C(O)C(O)c1ccc(F)nc1 Amb33426565 [0,1,0,0,1,0|2,0,0]=4 4997 B12R1.20 O=C(O)C(O)c1ccc(I)cc1 Amb25798219 [0,1,0,0,1,0|1,0,0]=3 4998 B12R1.20 O=C(O)C(O)c1ccc(O)cc1 Amb3940870 [0,1,0,0,1,0|1,0,0]=3 4999 B12R1.20 O=C(O)C(O)c1ccc(O)cc1 Amb8517220 [0,1,0,0,1,0|1,0,0]=3 5000 B12R1.20 O=C(O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,1,0,0,1,0|1,0,0]=3 5001 B12R1.20 O=C(O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,1,0,0,1,0|1,0,0]=3 5002 B12R1.20 O=C(O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,1,0,0,1,0|1,0,0]=3 5003 B12R1.20 O=C(O)[C@@H](O)c1ccc(O)cc1 Amb26013525 [0,1,0,0,1,0|1,0,0]=3 5004 B12R1.20 O=C(O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,1,0,0,1,0|1,0,0]=3 5005 B12R1.20 O=C(O)[C@H](O)c1ccc(Cl)cc1 Amb8386166 [0,1,0,0,1,0|1,0,0]=3 5006 B12R1.20 O=C(O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,1,0,0,1,0|1,0,0]=3 5007 B12R1.20 O=C(O)[C@H](S)c1ccc(Cl)cc1 Amb27224861 [0,1,0,0,1,0|1,0,0]=3 5008 B12R1.20 O=C([O-])C(O)c1ccc(O)cc1 Amb21964739 [0,1,0,0,1,0|1,0,1]=4 5009 B12R1.20 [NH3+]C(C(=O)Cl)c1ccc(O)cc1 Amb24104191 [0,1,0,0,1,0|1,0,1]=4 5010 B12R1.124 C=C(C(=O)O)c1ccccc1Br Amb33389493 [0,1,0,0,1,0|1,0,1]=4 5011 B12R1.124 C=C(C(=O)O)c1ccccc1F Amb17322167 [0,1,0,0,1,0|1,0,1]=4 5012 B12R1.124 C=C(C(=O)O)c1ccccc1O Amb33196168 [0,1,0,0,1,0|1,0,1]=4 5013 B12R1.124 C=C(C)C(N)c1ccccc1Br Amb27218658 [0,1,0,0,1,0|2,0,0]=4 5014 B12R1.124 C=C(C)C(N)c1ccccc1Cl Amb27471683 [0,1,0,0,1,0|2,0,0]=4 5015 B12R1.124 CC(=O)C(Br)c1ccccc1C Amb26644309 [0,1,0,0,1,0|2,0,0]=4 5016 B12R1.124 CC(=O)C(Br)c1ccccc1Cl Amb26445212 [0,1,0,0,1,0|2,0,0]=4 5017 B12R1.124 CC(=O)C(Br)c1ccccc1F Amb17142690 [0,1,0,0,1,0|2,0,0]=4 5018 B12R1.124 CC(=O)C(Br)c1ccccc1O Amb26906253 [0,1,0,0,1,0|2,0,0]=4 5019 B12R1.124 CC(=O)C(C)c1ccccc1Cl Amb22753501 [0,1,0,0,1,0|2,0,0]=4 5020 B12R1.124 CC(=O)C(Cl)c1ccccc1Br Amb25942518 [0,1,0,0,1,0|2,0,0]=4 5021 B12R1.124 CC(=O)C(Cl)c1ccccc1C Amb17477626 [0,1,0,0,1,0|2,0,0]=4 5022 B12R1.124 CC(=O)C(Cl)c1ccccc1Cl Amb17477761 [0,1,0,0,1,0|2,0,0]=4 5023 B12R1.124 CC(=O)C(Cl)c1ccccc1F Amb17139155 [0,1,0,0,1,0|2,0,0]=4 5024 B12R1.124 CC(=O)C(Cl)c1ccccc1I Amb27782144 [0,1,0,0,1,0|2,0,0]=4 5025 B12R1.124 CC(=O)C(Cl)c1ccccc1O Amb27192269 [0,1,0,0,1,0|2,0,0]=4 5026 B12R1.124 CC(=O)C(Cl)c1ccccc1S Amb27847061 [0,1,0,0,1,0|2,0,0]=4 5027 B12R1.124 CC(=O)C(N)c1ccccc1F Amb26857596 [0,1,0,0,1,0|1,0,0]=3 5028 B12R1.124 CC(=O)C(N)c1ccccc1F Amb28555778 [0,1,0,0,1,0|1,0,0]=3 5029 B12R1.124 CC(=O)C(N)c1ccccc1I Amb27441793 [0,1,0,0,1,0|1,0,0]=3 5030 B12R1.124 CC(=O)C(N)c1ccccc1O Amb27168593 [0,1,0,0,1,0|1,0,0]=3 5031 B12R1.124 CC(=O)C(N)c1ccncc1Cl Amb28457730 [0,1,0,0,1,0|2,0,0]=4 5032 B12R1.124 CC(=O)C(N)c1cnccc1C Amb27413877 [0,1,0,0,1,0|2,0,0]=4 5033 B12R1.124 CC(=O)C(N)c1cnccc1N Amb28314142 [0,1,0,0,1,0|2,0,0]=4 5034 B12R1.124 CC(=O)C(N)c1ncccc1Br Amb27259464 [0,1,0,0,1,0|2,0,0]=4 5035 B12R1.124 CC(=O)C(N)c1ncccc1Cl Amb28043062 [0,1,0,0,1,0|2,0,0]=4 5036 B12R1.124 CC(=O)C(N)c1ncccc1F Amb27450210 [0,1,0,0,1,0|2,0,0]=4 5037 B12R1.124 CC(=O)C(O)c1ccccc1Br Amb26883809 [0,1,0,0,1,0|2,0,0]=4 5038 B12R1.124 CC(=O)C(O)c1ccccc1C Amb25712931 [0,1,0,0,1,0|2,0,0]=4 5039 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [0,1,0,0,1,0|2,0,0]=4 5040 B12R1.124 CC(=O)C(O)c1ccccc1F Amb27177820 [0,1,0,0,1,0|2,0,0]=4 5041 B12R1.124 CC(=O)C(O)c1ccccc1O Amb8395178 [0,1,0,0,1,0|2,0,0]=4 5042 B12R1.124 CC(=O)N(N)c1ccccc1Br Amb18571906 [0,1,0,0,1,0|2,0,0]=4 5043 B12R1.124 CC(=O)N(N)c1ccccc1C Amb18563636 [0,1,0,0,1,0|2,0,0]=4 5044 B12R1.124 CC(=O)N(N)c1ccccc1Cl Amb18564310 [0,1,0,0,1,0|2,0,0]=4 5045 B12R1.124 CC(=O)N(N)c1ccccc1F Amb18563833 [0,1,0,0,1,0|2,0,0]=4 5046 B12R1.124 CC(=O)[C@H](O)c1ccccc1Cl Amb27426617 [0,1,0,0,1,0|2,0,0]=4 5047 B12R1.124 CC(C(=O)O)N1C=CC=CC1=O Amb18040083 [0,1,0,0,1,0|2,0,0]=4 5048 B12R1.124 CC(C(=O)O)c1ccccc1Br Amb10844025 [0,1,0,0,1,0|1,0,0]=3 5049 B12R1.124 CC(C(=O)O)c1ccccc1Cl Amb8629127 [0,1,0,0,1,0|1,0,0]=3 5050 B12R1.124 CC(C(=O)O)c1ccccc1F Amb10843985 [0,1,0,0,1,0|1,0,0]=3 5051 B12R1.124 CC(C(=O)O)c1ccccc1I Amb27814520 [0,1,0,0,1,0|1,0,0]=3 5052 B12R1.124 CC(C(=O)O)c1ccccc1N Amb9776198 [0,1,0,0,1,0|1,0,0]=3 5053 B12R1.124 CC(C(=O)O)c1ccccc1O Amb22228079 [0,1,0,0,1,0|1,0,0]=3 5054 B12R1.124 CC(C(=O)O)c1cccnc1Br Amb33387414 [0,1,0,0,1,0|2,0,0]=4 5055 B12R1.124 CC(C(=O)O)c1cccnc1Cl Amb33257009 [0,1,0,0,1,0|2,0,0]=4 5056 B12R1.124 CC(C(=O)O)c1cccnc1F Amb33378340 [0,1,0,0,1,0|2,0,0]=4 5057 B12R1.124 CC(C(=O)O)c1ccncc1Cl Amb25850310 [0,1,0,0,1,0|2,0,0]=4 5058 B12R1.124 CC(C(=O)O)c1ccncc1F Amb25682826 [0,1,0,0,1,0|2,0,0]=4 5059 B12R1.124 CC(C(=O)O)c1ncccc1Br Amb25751488 [0,1,0,0,1,0|2,0,0]=4 5060 B12R1.124 CC(C(N)=O)c1ccccc1Br Amb26860565 [0,1,0,0,1,0|2,0,0]=4 5061 B12R1.124 CC(C(N)=O)c1ccccc1O Amb27607071 [0,1,0,0,1,0|2,0,0]=4 5062 B12R1.124 CC(O)C(N)c1ccccc1Br Amb27616654 [0,1,0,0,1,0|1,0,1]=4 5063 B12R1.124 CC(O)C(N)c1ccccc1F Amb17232699 [0,1,0,0,1,0|1,0,1]=4 5064 B12R1.124 CC(O)C(N)c1ccccc1S Amb28397891 [0,1,0,0,1,0|1,0,1]=4 5065 B12R1.124 CC(O)[C@@H](N)c1ccccc1Br Amb27851093 [0,1,0,0,1,0|1,0,1]=4 5066 B12R1.124 CC(O)[C@@H](N)c1ccccc1Cl Amb27426818 [0,1,0,0,1,0|1,0,1]=4 5067 B12R1.124 CC(O)[C@@H](N)c1ccccc1I Amb27879756 [0,1,0,0,1,0|1,0,1]=4 5068 B12R1.124 CC(O)[C@@H](N)c1ccccc1O Amb27641226 [0,1,0,0,1,0|1,0,1]=4 5069 B12R1.124 C[C@@H](C(=O)O)c1ccccc1Cl Amb28457033 [0,1,0,0,1,0|1,0,0]=3 5070 B12R1.124 C[C@@H](C(=O)O)c1ccccc1F Amb33727419 [0,1,0,0,1,0|1,0,0]=3 5071 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1Cl Amb27172472 [0,1,0,0,1,0|1,0,1]=4 5072 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1S Amb27175583 [0,1,0,0,1,0|1,0,1]=4 5073 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1O Amb27616764 [0,1,0,0,1,0|1,0,1]=4 5074 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1S Amb28322814 [0,1,0,0,1,0|1,0,1]=4 5075 B12R1.124 C[C@H](C(=O)O)c1ccccc1F Amb33744348 [0,1,0,0,1,0|1,0,0]=3 5076 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1I Amb27616964 [0,1,0,0,1,0|1,0,1]=4 5077 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1N Amb27592430 [0,1,0,0,1,0|1,0,1]=4 5078 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1O Amb27759998 [0,1,0,0,1,0|1,0,1]=4 5079 B12R1.124 Cc1ccccc1C(=O)C(=O)O Amb16231619 [0,1,0,0,1,0|1,0,1]=4 5080 B12R1.124 Cc1ccccc1C(Br)C(=O)O Amb25136873 [0,1,0,0,1,0|1,0,0]=3 5081 B12R1.124 Cc1ccccc1C(C)C(=O)O Amb4017629 [0,1,0,0,1,0|1,0,0]=3 5082 B12R1.124 Cc1ccccc1C(Cl)C(=O)O Amb18564301 [0,1,0,0,1,0|1,0,0]=3 5083 B12R1.124 Cc1ccccc1C(F)C(=O)O Amb27983754 [0,1,0,0,1,0|1,0,0]=3 5084 B12R1.124 Cc1ccccc1C(N)C(=O)O Amb2683974 [0,1,0,0,1,0|0,0,0]=2 5085 B12R1.124 Cc1ccccc1C(N)C(=O)O Amb9725058 [0,1,0,0,1,0|0,0,0]=2 5086 B12R1.124 Cc1ccccc1C(N)C(N)=O Amb17334617 [0,1,0,0,1,0|1,0,0]=3 5087 B12R1.124 Cc1ccccc1C(O)C(=O)O Amb2693034 [0,1,0,0,1,0|1,0,0]=3 5088 B12R1.124 Cc1ccccc1[C@@H](C)C(=O)O Amb24426211 [0,1,0,0,1,0|1,0,0]=3 5089 B12R1.124 Cc1ccccc1[C@@H](N)C(C)O Amb27416719 [0,1,0,0,1,0|1,0,1]=4 5090 B12R1.124 Cc1ccccc1[C@@H](O)C(=O)O Amb27781543 [0,1,0,0,1,0|1,0,0]=3 5091 B12R1.124 Cc1ccccc1[C@H](C)C(=O)O Amb25798862 [0,1,0,0,1,0|1,0,0]=3 5092 B12R1.124 Cc1ccccc1[C@H](N)C(=O)O Amb2694832 [0,1,0,0,1,0|0,0,0]=2 5093 B12R1.124 Cc1ccccc1[C@H](O)C(=O)O Amb27408988 [0,1,0,0,1,0|1,0,0]=3 5094 B12R1.124 Cc1cccnc1C(C)C(=O)O Amb25710871 [0,1,0,0,1,0|2,0,0]=4 5095 B12R1.124 Cc1cccnc1C(N)C(=O)O Amb2695615 [0,1,0,0,1,0|1,0,0]=3 5096 B12R1.124 Cc1cccnc1C(O)C(=O)O Amb28872401 [0,1,0,0,1,0|2,0,0]=4 5097 B12R1.124 Cc1cccnc1C(O)C(=O)O Amb8386310 [0,1,0,0,1,0|2,0,0]=4 5098 B12R1.124 Cc1cccnc1[C@H](N)C(=O)O Amb27175656 [0,1,0,0,1,0|1,0,0]=3 5099 B12R1.124 Cc1ccncc1C(C)C(=O)O Amb25759366 [0,1,0,0,1,0|2,0,0]=4 5100 B12R1.124 Cc1ccncc1C(F)C(=O)O Amb26472592 [0,1,0,0,1,0|2,0,0]=4 5101 B12R1.124 Cc1ccncc1C(N)C(=O)O Amb18827789 [0,1,0,0,1,0|1,0,0]=3 5102 B12R1.124 Cc1ccncc1C(O)C(=O)O Amb25035168 [0,1,0,0,1,0|2,0,0]=4 5103 B12R1.124 Cc1ccncc1[C@@H](N)C(=O)O Amb28137766 [0,1,0,0,1,0|1,0,0]=3 5104 B12R1.124 Cc1cnccc1C(C)C(=O)O Amb27459389 [0,1,0,0,1,0|2,0,0]=4 5105 B12R1.124 Cc1cnccc1C(C)C(=O)O Amb35750409 [0,1,0,0,1,0|2,0,0]=4 5106 B12R1.124 Cc1cnccc1C(F)C(=O)O Amb25958154 [0,1,0,0,1,0|2,0,0]=4 5107 B12R1.124 Cc1cnccc1C(N)C(=O)O Amb2695616 [0,1,0,0,1,0|1,0,0]=3 5108 B12R1.124 Cc1cnccc1C(O)C(=O)O Amb33226324 [0,1,0,0,1,0|2,0,0]=4 5109 B12R1.124 Cc1ncccc1C(C)C(=O)O Amb32713340 [0,1,0,0,1,0|2,0,0]=4 5110 B12R1.124 Cc1ncccc1C(F)C(=O)O Amb32713342 [0,1,0,0,1,0|2,0,0]=4 5111 B12R1.124 Cc1ncccc1C(N)C(=O)O Amb26911625 [0,1,0,0,1,0|1,0,0]=3 5112 B12R1.124 Cc1ncccc1C(O)C(=O)O Amb32880136 [0,1,0,0,1,0|2,0,0]=4 5113 B12R1.124 Cc1nccnc1C(N)C(=O)O Amb18827277 [0,1,0,0,1,0|2,0,0]=4 5114 B12R1.124 Cc1ncncc1C(N)C(=O)O Amb33472859 [0,1,0,0,1,0|2,0,0]=4 5115 B12R1.124 NC(=O)C(Cl)c1ccccc1F Amb18329810 [0,1,0,0,1,0|2,0,0]=4 5116 B12R1.124 NC(=O)C(N)c1ccccc1Br Amb18282827 [0,1,0,0,1,0|1,0,0]=3 5117 B12R1.124 NC(=O)C(N)c1ccccc1Cl Amb17335725 [0,1,0,0,1,0|1,0,0]=3 5118 B12R1.124 NC(=O)C(N)c1ccccc1F Amb17334710 [0,1,0,0,1,0|1,0,0]=3 5119 B12R1.124 NC(=O)C(N)c1ccccc1F Amb33548385 [0,1,0,0,1,0|1,0,0]=3 5120 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [0,1,0,0,1,0|2,0,0]=4 5121 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [0,1,0,0,1,0|2,0,0]=4 5122 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [0,1,0,0,1,0|2,0,0]=4 5123 B12R1.124 NC(=O)[C@H](N)c1ccccc1Cl Amb27770670 [0,1,0,0,1,0|1,0,0]=3 5124 B12R1.124 NC(C(=O)O)c1ccccc1Br Amb9722950 [0,1,0,0,1,0|0,0,0]=2 5125 B12R1.124 NC(C(=O)O)c1ccccc1Cl Amb1841983 [0,1,0,0,1,0|0,0,0]=2 5126 B12R1.124 NC(C(=O)O)c1ccccc1Cl Amb2683964 [0,1,0,0,1,0|0,0,0]=2 5127 B12R1.124 NC(C(=O)O)c1ccccc1F Amb9724243 [0,1,0,0,1,0|0,0,0]=2 5128 B12R1.124 NC(C(=O)O)c1ccccc1I Amb30584993 [0,1,0,0,1,0|0,0,0]=2 5129 B12R1.124 NC(C(=O)O)c1ccccc1I Amb3941763 [0,1,0,0,1,0|0,0,0]=2 5130 B12R1.124 NC(C(=O)O)c1ccccc1O Amb2695279 [0,1,0,0,1,0|0,0,0]=2 5131 B12R1.124 NC(C(=O)O)c1ccccc1S Amb28132684 [0,1,0,0,1,0|0,0,0]=2 5132 B12R1.124 NC(C(=O)O)c1cccnc1Br Amb24420309 [0,1,0,0,1,0|1,0,0]=3 5133 B12R1.124 NC(C(=O)O)c1cccnc1F Amb24697660 [0,1,0,0,1,0|1,0,0]=3 5134 B12R1.124 NC(C(=O)O)c1ccncc1Br Amb25327473 [0,1,0,0,1,0|1,0,0]=3 5135 B12R1.124 NC(C(=O)O)c1ccncc1Cl Amb27425334 [0,1,0,0,1,0|1,0,0]=3 5136 B12R1.124 NC(C(=O)O)c1ccncc1F Amb28456632 [0,1,0,0,1,0|1,0,0]=3 5137 B12R1.124 NC(C(=O)O)c1ccncc1O Amb27254201 [0,1,0,0,1,0|1,0,0]=3 5138 B12R1.124 NC(C(=O)O)c1ncccc1Br Amb24695377 [0,1,0,0,1,0|1,0,0]=3 5139 B12R1.124 NC(C(=O)O)c1ncccc1F Amb27882725 [0,1,0,0,1,0|1,0,0]=3 5140 B12R1.124 N[C@@H](C(=O)O)c1ccccc1Cl Amb8629135 [0,1,0,0,1,0|0,0,0]=2 5141 B12R1.124 N[C@@H](C(=O)O)c1ccccc1Cl Amb8631092 [0,1,0,0,1,0|0,0,0]=2 5142 B12R1.124 N[C@@H](C(=O)O)c1ccccc1F Amb22747759 [0,1,0,0,1,0|0,0,0]=2 5143 B12R1.124 N[C@@H](C(=O)O)c1ccccc1O Amb25134608 [0,1,0,0,1,0|0,0,0]=2 5144 B12R1.124 N[C@@H](C(=O)O)c1ccccc1O Amb31204648 [0,1,0,0,1,0|0,0,0]=2 5145 B12R1.124 N[C@@H](C(=O)O)c1cccnc1O Amb27193064 [0,1,0,0,1,0|1,0,0]=3 5146 B12R1.124 N[C@@H](C(=O)O)c1cccnc1S Amb27860220 [0,1,0,0,1,0|1,0,0]=3 5147 B12R1.124 N[C@@H](C(=O)O)c1ccncc1Br Amb27667908 [0,1,0,0,1,0|1,0,0]=3 5148 B12R1.124 N[C@H](C(=O)O)c1ccccc1Br Amb27264794 [0,1,0,0,1,0|0,0,0]=2 5149 B12R1.124 N[C@H](C(=O)O)c1ccccc1Cl Amb2694829 [0,1,0,0,1,0|0,0,0]=2 5150 B12R1.124 N[C@H](C(=O)O)c1ccccc1F Amb2694830 [0,1,0,0,1,0|0,0,0]=2 5151 B12R1.124 N[C@H](C(=O)O)c1ccccc1O Amb22748113 [0,1,0,0,1,0|0,0,0]=2 5152 B12R1.124 N[C@H](C(=O)O)c1cccnc1Br Amb27239942 [0,1,0,0,1,0|1,0,0]=3 5153 B12R1.124 N[C@H](C(=O)O)c1cccnc1Cl Amb27175716 [0,1,0,0,1,0|1,0,0]=3 5154 B12R1.124 N[C@H](C(=O)O)c1ccncc1Br Amb27461932 [0,1,0,0,1,0|1,0,0]=3 5155 B12R1.124 N[C@H](C(=O)O)c1ncccc1Br Amb28135429 [0,1,0,0,1,0|1,0,0]=3 5156 B12R1.124 Nc1ccccc1C(=O)C(=O)O Amb17594093 [0,1,0,0,1,0|1,0,1]=4 5157 B12R1.124 Nc1ccccc1C(F)C(=O)O Amb27961469 [0,1,0,0,1,0|1,0,0]=3 5158 B12R1.124 Nc1ccccc1C(N)C(=O)O Amb27473277 [0,1,0,0,1,0|0,0,0]=2 5159 B12R1.124 Nc1ccccc1C(O)C(=O)[O-] Amb21963741 [0,1,0,0,1,0|1,0,1]=4 5160 B12R1.124 Nc1cccnc1[C@@H](N)C(=O)O Amb27470728 [0,1,0,0,1,0|1,0,0]=3 5161 B12R1.124 Nc1ccncc1C(N)C(=O)O Amb27627395 [0,1,0,0,1,0|1,0,0]=3 5162 B12R1.124 Nc1ccncc1C(O)C(=O)O Amb27478966 [0,1,0,0,1,0|2,0,0]=4 5163 B12R1.124 Nc1ncccc1C(N)C(=O)O Amb27174209 [0,1,0,0,1,0|1,0,0]=3 5164 B12R1.124 Nc1ncccc1C(O)C(=O)O Amb27972645 [0,1,0,0,1,0|2,0,0]=4 5165 B12R1.124 Nc1ncccc1[C@H](N)C(=O)O Amb27834383 [0,1,0,0,1,0|1,0,0]=3 5166 B12R1.124 O=C(Cl)C(F)c1ccccc1F Amb27257812 [0,1,0,0,1,0|2,0,0]=4 5167 B12R1.124 O=C(O)C(=O)c1ccccc1Br Amb13883630 [0,1,0,0,1,0|1,0,1]=4 5168 B12R1.124 O=C(O)C(=O)c1ccccc1Cl Amb8385880 [0,1,0,0,1,0|1,0,1]=4 5169 B12R1.124 O=C(O)C(=O)c1ccccc1F Amb13883629 [0,1,0,0,1,0|1,0,1]=4 5170 B12R1.124 O=C(O)C(=O)c1ccccc1O Amb18646415 [0,1,0,0,1,0|1,0,1]=4 5171 B12R1.124 O=C(O)C(Br)c1ccccc1Cl Amb8387470 [0,1,0,0,1,0|1,0,0]=3 5172 B12R1.124 O=C(O)C(Cl)c1ccccc1Br Amb24060809 [0,1,0,0,1,0|1,0,0]=3 5173 B12R1.124 O=C(O)C(Cl)c1ccccc1Cl Amb18066587 [0,1,0,0,1,0|1,0,0]=3 5174 B12R1.124 O=C(O)C(Cl)c1ccccc1F Amb18564556 [0,1,0,0,1,0|1,0,0]=3 5175 B12R1.124 O=C(O)C(F)c1ccccc1Br Amb8629402 [0,1,0,0,1,0|1,0,0]=3 5176 B12R1.124 O=C(O)C(F)c1ccccc1Cl Amb27858880 [0,1,0,0,1,0|1,0,0]=3 5177 B12R1.124 O=C(O)C(F)c1ccccc1F Amb26337991 [0,1,0,0,1,0|1,0,0]=3 5178 B12R1.124 O=C(O)C(F)c1ccncc1F Amb27837343 [0,1,0,0,1,0|2,0,0]=4 5179 B12R1.124 O=C(O)C(O)c1ccccc1Br Amb8629388 [0,1,0,0,1,0|1,0,0]=3 5180 B12R1.124 O=C(O)C(O)c1ccccc1Cl Amb2720173 [0,1,0,0,1,0|1,0,0]=3 5181 B12R1.124 O=C(O)C(O)c1ccccc1F Amb2688138 [0,1,0,0,1,0|1,0,0]=3 5182 B12R1.124 O=C(O)C(O)c1ccccc1I Amb25117434 [0,1,0,0,1,0|1,0,0]=3 5183 B12R1.124 O=C(O)C(O)c1ccccc1O Amb26490928 [0,1,0,0,1,0|1,0,0]=3 5184 B12R1.124 O=C(O)C(O)c1cccnc1Br Amb33389448 [0,1,0,0,1,0|2,0,0]=4 5185 B12R1.124 O=C(O)C(O)c1cccnc1Cl Amb33256965 [0,1,0,0,1,0|2,0,0]=4 5186 B12R1.124 O=C(O)C(O)c1cccnc1F Amb26502279 [0,1,0,0,1,0|2,0,0]=4 5187 B12R1.124 O=C(O)C(O)c1ccncc1Br Amb33451508 [0,1,0,0,1,0|2,0,0]=4 5188 B12R1.124 O=C(O)C(O)c1ccncc1Cl Amb33413527 [0,1,0,0,1,0|2,0,0]=4 5189 B12R1.124 O=C(O)C(O)c1ccncc1F Amb27866532 [0,1,0,0,1,0|2,0,0]=4 5190 B12R1.124 O=C(O)C(O)c1ncccc1Br Amb33335739 [0,1,0,0,1,0|2,0,0]=4 5191 B12R1.124 O=C(O)C(O)c1ncccc1F Amb25820427 [0,1,0,0,1,0|2,0,0]=4 5192 B12R1.124 O=C(O)[C@@H](O)c1ccccc1Cl Amb8514801 [0,1,0,0,1,0|1,0,0]=3 5193 B12R1.124 O=C(O)[C@@H](O)c1ccccc1O Amb28183796 [0,1,0,0,1,0|1,0,0]=3 5194 B12R1.124 O=C(O)[C@H](O)c1ccccc1Br Amb26404658 [0,1,0,0,1,0|1,0,0]=3 5195 B12R1.124 O=C(O)[C@H](O)c1ccccc1Cl Amb8515807 [0,1,0,0,1,0|1,0,0]=3 5196 B12R1.124 O=C(O)[C@H](O)c1ccccc1F Amb24428765 [0,1,0,0,1,0|1,0,0]=3 5197 B12R1.225 C=C(C(=O)O)c1cccc(Br)c1 Amb32687903 [0,1,0,0,1,0|1,0,1]=4 5198 B12R1.225 C=C(C(=O)O)c1cccc(C)c1 Amb17322165 [0,1,0,0,1,0|1,0,1]=4 5199 B12R1.225 C=C(C(=O)O)c1cccc(Cl)c1 Amb17322175 [0,1,0,0,1,0|1,0,1]=4 5200 B12R1.225 C=C(C(=O)O)c1cccc(F)c1 Amb17322168 [0,1,0,0,1,0|1,0,1]=4 5201 B12R1.225 C=C(C(=O)O)c1cccc(O)c1 Amb33310954 [0,1,0,0,1,0|1,0,1]=4 5202 B12R1.225 C=C(C)C(N)c1cccc(C)c1 Amb27248242 [0,1,0,0,1,0|2,0,0]=4 5203 B12R1.225 CC(=O)C(Br)c1cccc(Br)c1 Amb27613730 [0,1,0,0,1,0|2,0,0]=4 5204 B12R1.225 CC(=O)C(Br)c1cccc(C)c1 Amb25942041 [0,1,0,0,1,0|2,0,0]=4 5205 B12R1.225 CC(=O)C(Br)c1cccc(Cl)c1 Amb27613732 [0,1,0,0,1,0|2,0,0]=4 5206 B12R1.225 CC(=O)C(Br)c1cccc(F)c1 Amb24537119 [0,1,0,0,1,0|2,0,0]=4 5207 B12R1.225 CC(=O)C(Br)c1cccc(I)c1 Amb27782142 [0,1,0,0,1,0|2,0,0]=4 5208 B12R1.225 CC(=O)C(Br)c1cccc(S)c1 Amb28133124 [0,1,0,0,1,0|2,0,0]=4 5209 B12R1.225 CC(=O)C(C)c1cccc(Br)c1 Amb22753504 [0,1,0,0,1,0|2,0,0]=4 5210 B12R1.225 CC(=O)C(C)c1cccc(Cl)c1 Amb22753502 [0,1,0,0,1,0|2,0,0]=4 5211 B12R1.225 CC(=O)C(C)c1cccc(I)c1 Amb22753511 [0,1,0,0,1,0|2,0,0]=4 5212 B12R1.225 CC(=O)C(Cl)c1cccc(Br)c1 Amb17477760 [0,1,0,0,1,0|2,0,0]=4 5213 B12R1.225 CC(=O)C(Cl)c1cccc(C)c1 Amb17477625 [0,1,0,0,1,0|2,0,0]=4 5214 B12R1.225 CC(=O)C(Cl)c1cccc(N)c1 Amb27613729 [0,1,0,0,1,0|2,0,0]=4 5215 B12R1.225 CC(=O)C(Cl)c1cccc(O)c1 Amb27192271 [0,1,0,0,1,0|2,0,0]=4 5216 B12R1.225 CC(=O)C(N)c1cc(C)ccn1 Amb27975656 [0,1,0,0,1,0|2,0,0]=4 5217 B12R1.225 CC(=O)C(N)c1cc(Cl)ccn1 Amb27391697 [0,1,0,0,1,0|2,0,0]=4 5218 B12R1.225 CC(=O)C(N)c1cc(N)ccn1 Amb27440254 [0,1,0,0,1,0|2,0,0]=4 5219 B12R1.225 CC(=O)C(N)c1cccc(Br)c1 Amb27463251 [0,1,0,0,1,0|1,0,0]=3 5220 B12R1.225 CC(=O)C(N)c1cccc(Br)n1 Amb27215313 [0,1,0,0,1,0|2,0,0]=4 5221 B12R1.225 CC(=O)C(N)c1cccc(C)n1 Amb27168267 [0,1,0,0,1,0|2,0,0]=4 5222 B12R1.225 CC(=O)C(N)c1cccc(Cl)c1 Amb28247956 [0,1,0,0,1,0|1,0,0]=3 5223 B12R1.225 CC(=O)C(N)c1cccc(I)c1 Amb27487346 [0,1,0,0,1,0|1,0,0]=3 5224 B12R1.225 CC(=O)C(N)c1cccc(O)n1 Amb27856093 [0,1,0,0,1,0|2,0,0]=4 5225 B12R1.225 CC(=O)C(N)c1cccc(S)c1 Amb27792585 [0,1,0,0,1,0|1,0,0]=3 5226 B12R1.225 CC(=O)C(N)c1ccnc(N)c1 Amb27873982 [0,1,0,0,1,0|2,0,0]=4 5227 B12R1.225 CC(=O)C(N)c1cncc(Cl)c1 Amb27473224 [0,1,0,0,1,0|2,0,0]=4 5228 B12R1.225 CC(=O)C(N)c1cncc(F)c1 Amb28429844 [0,1,0,0,1,0|2,0,0]=4 5229 B12R1.225 CC(=O)C(O)c1cccc(Br)c1 Amb28348599 [0,1,0,0,1,0|2,0,0]=4 5230 B12R1.225 CC(=O)C(O)c1cccc(C)c1 Amb25801127 [0,1,0,0,1,0|2,0,0]=4 5231 B12R1.225 CC(=O)C(O)c1cccc(Cl)c1 Amb17611032 [0,1,0,0,1,0|2,0,0]=4 5232 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [0,1,0,0,1,0|2,0,0]=4 5233 B12R1.225 CC(=O)C(O)c1cccc(O)c1 Amb17594122 [0,1,0,0,1,0|2,0,0]=4 5234 B12R1.225 CC(=O)N(N)c1cccc(Br)c1 Amb18070415 [0,1,0,0,1,0|2,0,0]=4 5235 B12R1.225 CC(=O)N(N)c1cccc(C)c1 Amb18563637 [0,1,0,0,1,0|2,0,0]=4 5236 B12R1.225 CC(=O)N(N)c1cccc(Cl)c1 Amb18564311 [0,1,0,0,1,0|2,0,0]=4 5237 B12R1.225 CC(=O)N(N)c1cccc(F)c1 Amb18563835 [0,1,0,0,1,0|2,0,0]=4 5238 B12R1.225 CC(=O)[C@@H](O)c1cccc(F)c1 Amb27177649 [0,1,0,0,1,0|2,0,0]=4 5239 B12R1.225 CC(=O)[C@H](C)c1cccc(Cl)c1 Amb27977784 [0,1,0,0,1,0|2,0,0]=4 5240 B12R1.225 CC(=O)[C@H](O)c1cccc(C)c1 Amb27615519 [0,1,0,0,1,0|2,0,0]=4 5241 B12R1.225 CC(C(=O)Cl)c1cccc(Cl)c1 Amb27614752 [0,1,0,0,1,0|2,0,0]=4 5242 B12R1.225 CC(C(=O)O)c1cc(Br)ccn1 Amb33502741 [0,1,0,0,1,0|2,0,0]=4 5243 B12R1.225 CC(C(=O)O)c1cc(Cl)ccn1 Amb33502746 [0,1,0,0,1,0|2,0,0]=4 5244 B12R1.225 CC(C(=O)O)c1cc(F)ccn1 Amb33502740 [0,1,0,0,1,0|2,0,0]=4 5245 B12R1.225 CC(C(=O)O)c1cc(N)ccn1 Amb33502739 [0,1,0,0,1,0|2,0,0]=4 5246 B12R1.225 CC(C(=O)O)c1cccc(Br)c1 Amb33549253 [0,1,0,0,1,0|1,0,0]=3 5247 B12R1.225 CC(C(=O)O)c1cccc(Br)n1 Amb33432785 [0,1,0,0,1,0|2,0,0]=4 5248 B12R1.225 CC(C(=O)O)c1cccc(Cl)c1 Amb33530441 [0,1,0,0,1,0|1,0,0]=3 5249 B12R1.225 CC(C(=O)O)c1cccc(Cl)n1 Amb27148604 [0,1,0,0,1,0|2,0,0]=4 5250 B12R1.225 CC(C(=O)O)c1cccc(F)c1 Amb17232662 [0,1,0,0,1,0|1,0,0]=3 5251 B12R1.225 CC(C(=O)O)c1cccc(F)n1 Amb28143185 [0,1,0,0,1,0|2,0,0]=4 5252 B12R1.225 CC(C(=O)O)c1cccc(I)c1 Amb26065677 [0,1,0,0,1,0|1,0,0]=3 5253 B12R1.225 CC(C(=O)O)c1cccc(N)c1 Amb22265668 [0,1,0,0,1,0|1,0,0]=3 5254 B12R1.225 CC(C(=O)O)c1cccc(N)c1 Amb24061864 [0,1,0,0,1,0|1,0,0]=3 5255 B12R1.225 CC(C(=O)O)c1cccc(O)c1 Amb18646445 [0,1,0,0,1,0|1,0,0]=3 5256 B12R1.225 CC(C(=O)O)c1ccnc(Cl)c1 Amb25322122 [0,1,0,0,1,0|2,0,0]=4 5257 B12R1.225 CC(C(=O)O)c1ccnc(F)c1 Amb33744668 [0,1,0,0,1,0|2,0,0]=4 5258 B12R1.225 CC(C(=O)O)c1cncc(Br)c1 Amb25894941 [0,1,0,0,1,0|2,0,0]=4 5259 B12R1.225 CC(C(=O)O)c1cncc(F)c1 Amb18961443 [0,1,0,0,1,0|2,0,0]=4 5260 B12R1.225 CC(C(N)=O)c1cccc(Cl)c1 Amb27255571 [0,1,0,0,1,0|2,0,0]=4 5261 B12R1.225 CC(O)C(N)c1cccc(Br)c1 Amb17248845 [0,1,0,0,1,0|1,0,1]=4 5262 B12R1.225 CC(O)C(N)c1cccc(O)c1 Amb27881708 [0,1,0,0,1,0|1,0,1]=4 5263 B12R1.225 CC(O)[C@@H](N)c1cccc(F)c1 Amb27426651 [0,1,0,0,1,0|1,0,1]=4 5264 B12R1.225 CC(O)[C@@H](N)c1cccc(O)c1 Amb27867399 [0,1,0,0,1,0|1,0,1]=4 5265 B12R1.225 C[C@@H](C(=O)O)c1cccc(Cl)c1 Amb27402003 [0,1,0,0,1,0|1,0,0]=3 5266 B12R1.225 C[C@@H](C(=O)O)c1cccc(F)c1 Amb25108167 [0,1,0,0,1,0|1,0,0]=3 5267 B12R1.225 C[C@@H](C(=O)O)c1cccc(N)c1 Amb24182071 [0,1,0,0,1,0|1,0,0]=3 5268 B12R1.225 C[C@@H](C(=O)O)c1ccnc(F)c1 Amb33729202 [0,1,0,0,1,0|2,0,0]=4 5269 B12R1.225 C[C@@H](C(N)=O)c1cccc(O)c1 Amb27473363 [0,1,0,0,1,0|2,0,0]=4 5270 B12R1.225 C[C@@H](O)[C@@H](N)c1cccc(Br)c1 Amb27209517 [0,1,0,0,1,0|1,0,1]=4 5271 B12R1.225 C[C@@H](O)[C@@H](N)c1cccc(F)c1 Amb27228850 [0,1,0,0,1,0|1,0,1]=4 5272 B12R1.225 C[C@@H](O)[C@H](N)c1cccc(I)c1 Amb27392130 [0,1,0,0,1,0|1,0,1]=4 5273 B12R1.225 C[C@@H](O)[C@H](N)c1cccc(O)c1 Amb27464889 [0,1,0,0,1,0|1,0,1]=4 5274 B12R1.225 C[C@H](C(=O)O)c1cccc(Cl)c1 Amb25124032 [0,1,0,0,1,0|1,0,0]=3 5275 B12R1.225 C[C@H](C(=O)O)c1cccc(F)c1 Amb28244217 [0,1,0,0,1,0|1,0,0]=3 5276 B12R1.225 C[C@H](C(=O)O)c1ccnc(F)c1 Amb33728497 [0,1,0,0,1,0|2,0,0]=4 5277 B12R1.225 C[C@H](C(N)=O)c1cccc(N)c1 Amb27260808 [0,1,0,0,1,0|2,0,0]=4 5278 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(I)c1 Amb28388855 [0,1,0,0,1,0|1,0,1]=4 5279 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(N)c1 Amb27170668 [0,1,0,0,1,0|1,0,1]=4 5280 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(O)c1 Amb27461293 [0,1,0,0,1,0|1,0,1]=4 5281 B12R1.225 C[C@H](O)[C@H](N)c1cccc(Br)c1 Amb28323051 [0,1,0,0,1,0|1,0,1]=4 5282 B12R1.225 C[C@H](O)[C@H](N)c1cccc(I)c1 Amb28312972 [0,1,0,0,1,0|1,0,1]=4 5283 B12R1.225 C[C@H](O)[C@H](N)c1cccc(S)c1 Amb27444944 [0,1,0,0,1,0|1,0,1]=4 5284 B12R1.225 Cc1cc(C(C)C(=O)O)ccn1 Amb24584555 [0,1,0,0,1,0|2,0,0]=4 5285 B12R1.225 Cc1cc(C(F)C(=O)O)ccn1 Amb28399079 [0,1,0,0,1,0|2,0,0]=4 5286 B12R1.225 Cc1cc(C(N)C(=O)O)ccn1 Amb18827868 [0,1,0,0,1,0|1,0,0]=3 5287 B12R1.225 Cc1cc(C(O)C(=O)O)ccn1 Amb33268224 [0,1,0,0,1,0|2,0,0]=4 5288 B12R1.225 Cc1cccc(C(=O)C(=O)O)c1 Amb18645964 [0,1,0,0,1,0|1,0,1]=4 5289 B12R1.225 Cc1cccc(C(C)C(=O)O)c1 Amb17232469 [0,1,0,0,1,0|1,0,0]=3 5290 B12R1.225 Cc1cccc(C(C)C(=O)O)n1 Amb25894980 [0,1,0,0,1,0|2,0,0]=4 5291 B12R1.225 Cc1cccc(C(C)C(N)=O)c1 Amb27589453 [0,1,0,0,1,0|2,0,0]=4 5292 B12R1.225 Cc1cccc(C(Cl)C(=O)Cl)c1 Amb28122179 [0,1,0,0,1,0|2,0,0]=4 5293 B12R1.225 Cc1cccc(C(Cl)C(=O)O)c1 Amb18564302 [0,1,0,0,1,0|1,0,0]=3 5294 B12R1.225 Cc1cccc(C(F)C(=O)O)c1 Amb27657651 [0,1,0,0,1,0|1,0,0]=3 5295 B12R1.225 Cc1cccc(C(N)C(=O)O)c1 Amb1840070 [0,1,0,0,1,0|0,0,0]=2 5296 B12R1.225 Cc1cccc(C(N)C(=O)O)c1 Amb2683970 [0,1,0,0,1,0|0,0,0]=2 5297 B12R1.225 Cc1cccc(C(N)C(=O)O)n1 Amb2696723 [0,1,0,0,1,0|1,0,0]=3 5298 B12R1.225 Cc1cccc(C(N)C(N)=O)c1 Amb17334618 [0,1,0,0,1,0|1,0,0]=3 5299 B12R1.225 Cc1cccc(C(O)C(=O)O)c1 Amb2689507 [0,1,0,0,1,0|1,0,0]=3 5300 B12R1.225 Cc1cccc(C(O)C(=O)O)n1 Amb8386309 [0,1,0,0,1,0|2,0,0]=4 5301 B12R1.225 Cc1cccc(C(O)C(N)=O)c1 Amb18800895 [0,1,0,0,1,0|2,0,0]=4 5302 B12R1.225 Cc1cccc([C@@H](C)C(=O)O)c1 Amb25065324 [0,1,0,0,1,0|1,0,0]=3 5303 B12R1.225 Cc1cccc([C@@H](N)C(=O)O)c1 Amb24182070 [0,1,0,0,1,0|0,0,0]=2 5304 B12R1.225 Cc1cccc([C@@H](N)C(C)O)c1 Amb27951576 [0,1,0,0,1,0|1,0,1]=4 5305 B12R1.225 Cc1cccc([C@@H](N)C(N)=O)c1 Amb27615620 [0,1,0,0,1,0|1,0,0]=3 5306 B12R1.225 Cc1cccc([C@@H](N)[C@@H](C)O)c1 Amb27483160 [0,1,0,0,1,0|1,0,1]=4 5307 B12R1.225 Cc1cccc([C@@H](N)[C@H](C)O)c1 Amb28282684 [0,1,0,0,1,0|1,0,1]=4 5308 B12R1.225 Cc1cccc([C@H](C)C(=O)O)c1 Amb26371631 [0,1,0,0,1,0|1,0,0]=3 5309 B12R1.225 Cc1cccc([C@H](N)C(=O)O)n1 Amb2694812 [0,1,0,0,1,0|1,0,0]=3 5310 B12R1.225 Cc1cccc([C@H](O)C(=O)O)c1 Amb28138076 [0,1,0,0,1,0|1,0,0]=3 5311 B12R1.225 Cc1cccc([C@H]([NH3+])C(=O)[O-])c1 Amb24068288 [0,1,0,0,1,0|0,0,2]=4 5312 B12R1.225 Cc1ccnc(C(C)C(=O)O)c1 Amb27410919 [0,1,0,0,1,0|2,0,0]=4 5313 B12R1.225 Cc1ccnc(C(N)C(=O)O)c1 Amb27244702 [0,1,0,0,1,0|1,0,0]=3 5314 B12R1.225 Cc1ccnc(C(O)C(=O)O)c1 Amb8386313 [0,1,0,0,1,0|2,0,0]=4 5315 B12R1.225 Cc1ccnc([C@H](N)C(=O)O)c1 Amb27807251 [0,1,0,0,1,0|1,0,0]=3 5316 B12R1.225 Cc1cncc(C(C)C(=O)O)c1 Amb27748439 [0,1,0,0,1,0|2,0,0]=4 5317 B12R1.225 Cc1cncc(C(F)C(=O)O)c1 Amb25953815 [0,1,0,0,1,0|2,0,0]=4 5318 B12R1.225 Cc1cncc(C(N)C(=O)O)c1 Amb24488617 [0,1,0,0,1,0|1,0,0]=3 5319 B12R1.225 Cc1cncc(C(O)C(=O)O)c1 Amb27407762 [0,1,0,0,1,0|2,0,0]=4 5320 B12R1.225 NC(=O)C(Cl)c1cccc(Br)c1 Amb22059075 [0,1,0,0,1,0|2,0,0]=4 5321 B12R1.225 NC(=O)C(Cl)c1cccc(F)c1 Amb18329808 [0,1,0,0,1,0|2,0,0]=4 5322 B12R1.225 NC(=O)C(Cl)c1cccc(I)c1 Amb27187553 [0,1,0,0,1,0|2,0,0]=4 5323 B12R1.225 NC(=O)C(N)c1cccc(Br)c1 Amb13951644 [0,1,0,0,1,0|1,0,0]=3 5324 B12R1.225 NC(=O)C(N)c1cccc(Cl)c1 Amb17335726 [0,1,0,0,1,0|1,0,0]=3 5325 B12R1.225 NC(=O)C(N)c1cccc(I)c1 Amb27860980 [0,1,0,0,1,0|1,0,0]=3 5326 B12R1.225 NC(=O)C(N)c1cccc(O)c1 Amb17334666 [0,1,0,0,1,0|1,0,0]=3 5327 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [0,1,0,0,1,0|2,0,0]=4 5328 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [0,1,0,0,1,0|2,0,0]=4 5329 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [0,1,0,0,1,0|2,0,0]=4 5330 B12R1.225 NC(=O)[C@@H](N)c1cccc(Cl)c1 Amb27400985 [0,1,0,0,1,0|1,0,0]=3 5331 B12R1.225 NC(=O)[C@@H](O)c1cccc(Cl)c1 Amb27620331 [0,1,0,0,1,0|2,0,0]=4 5332 B12R1.225 NC(=O)[C@H](N)c1cccc(Cl)c1 Amb27758645 [0,1,0,0,1,0|1,0,0]=3 5333 B12R1.225 NC(=O)[C@H](N)c1cccc(F)c1 Amb27398179 [0,1,0,0,1,0|1,0,0]=3 5334 B12R1.225 NC(C(=O)O)c1cc(Br)ccn1 Amb27755173 [0,1,0,0,1,0|1,0,0]=3 5335 B12R1.225 NC(C(=O)O)c1cc(Cl)ccn1 Amb27224679 [0,1,0,0,1,0|1,0,0]=3 5336 B12R1.225 NC(C(=O)O)c1cc(F)ccn1 Amb26024784 [0,1,0,0,1,0|1,0,0]=3 5337 B12R1.225 NC(C(=O)O)c1cccc(Br)c1 Amb2683968 [0,1,0,0,1,0|0,0,0]=2 5338 B12R1.225 NC(C(=O)O)c1cccc(Br)c1 Amb9719474 [0,1,0,0,1,0|0,0,0]=2 5339 B12R1.225 NC(C(=O)O)c1cccc(Cl)c1 Amb2699068 [0,1,0,0,1,0|0,0,0]=2 5340 B12R1.225 NC(C(=O)O)c1cccc(Cl)c1 Amb9727391 [0,1,0,0,1,0|0,0,0]=2 5341 B12R1.225 NC(C(=O)O)c1cccc(Cl)n1 Amb24531519 [0,1,0,0,1,0|1,0,0]=3 5342 B12R1.225 NC(C(=O)O)c1cccc(F)c1 Amb2699066 [0,1,0,0,1,0|0,0,0]=2 5343 B12R1.225 NC(C(=O)O)c1cccc(F)c1 Amb9729625 [0,1,0,0,1,0|0,0,0]=2 5344 B12R1.225 NC(C(=O)O)c1cccc(I)c1 Amb2683967 [0,1,0,0,1,0|0,0,0]=2 5345 B12R1.225 NC(C(=O)O)c1cccc(I)c1 Amb3941764 [0,1,0,0,1,0|0,0,0]=2 5346 B12R1.225 NC(C(=O)O)c1cccc(O)c1 Amb2695280 [0,1,0,0,1,0|0,0,0]=2 5347 B12R1.225 NC(C(=O)O)c1cccc(O)c1 Amb33550799 [0,1,0,0,1,0|0,0,0]=2 5348 B12R1.225 NC(C(=O)O)c1cccc(O)n1 Amb27882706 [0,1,0,0,1,0|1,0,0]=3 5349 B12R1.225 NC(C(=O)O)c1cccc(S)c1 Amb27405494 [0,1,0,0,1,0|0,0,0]=2 5350 B12R1.225 NC(C(=O)O)c1ccnc(Cl)c1 Amb27751053 [0,1,0,0,1,0|1,0,0]=3 5351 B12R1.225 NC(C(=O)O)c1ccnc(O)c1 Amb27596608 [0,1,0,0,1,0|1,0,0]=3 5352 B12R1.225 NC(C(=O)O)c1cncc(Br)c1 Amb2684121 [0,1,0,0,1,0|1,0,0]=3 5353 B12R1.225 NC(C(=O)O)c1cncc(F)c1 Amb25751298 [0,1,0,0,1,0|1,0,0]=3 5354 B12R1.225 N[C@@H](C(=O)O)c1cccc(Br)c1 Amb25122869 [0,1,0,0,1,0|0,0,0]=2 5355 B12R1.225 N[C@@H](C(=O)O)c1cccc(Br)n1 Amb27597458 [0,1,0,0,1,0|1,0,0]=3 5356 B12R1.225 N[C@@H](C(=O)O)c1cccc(Cl)c1 Amb22899025 [0,1,0,0,1,0|0,0,0]=2 5357 B12R1.225 N[C@@H](C(=O)O)c1cccc(Cl)c1 Amb23399639 [0,1,0,0,1,0|0,0,0]=2 5358 B12R1.225 N[C@@H](C(=O)O)c1cccc(F)c1 Amb28280245 [0,1,0,0,1,0|0,0,0]=2 5359 B12R1.225 N[C@@H](C(=O)O)c1cccc(F)n1 Amb27668981 [0,1,0,0,1,0|1,0,0]=3 5360 B12R1.225 N[C@@H](C(=O)O)c1cccc(O)c1 Amb27592433 [0,1,0,0,1,0|0,0,0]=2 5361 B12R1.225 N[C@@H](C(=O)O)c1ccnc(Cl)c1 Amb27862093 [0,1,0,0,1,0|1,0,0]=3 5362 B12R1.225 N[C@@H](C(=O)O)c1cncc(O)c1 Amb27391235 [0,1,0,0,1,0|1,0,0]=3 5363 B12R1.225 N[C@H](C(=O)O)c1cccc(Br)c1 Amb25150059 [0,1,0,0,1,0|0,0,0]=2 5364 B12R1.225 N[C@H](C(=O)O)c1cccc(Cl)c1 Amb19889600 [0,1,0,0,1,0|0,0,0]=2 5365 B12R1.225 N[C@H](C(=O)O)c1cccc(F)c1 Amb2694827 [0,1,0,0,1,0|0,0,0]=2 5366 B12R1.225 N[C@H](C(=O)O)c1cccc(F)n1 Amb27650860 [0,1,0,0,1,0|1,0,0]=3 5367 B12R1.225 N[C@H](C(=O)O)c1cccc(I)c1 Amb27463075 [0,1,0,0,1,0|0,0,0]=2 5368 B12R1.225 N[C@H](C(=O)O)c1cccc(O)c1 Amb25294728 [0,1,0,0,1,0|0,0,0]=2 5369 B12R1.225 N[C@H](C(=O)O)c1ccnc(O)c1 Amb27175582 [0,1,0,0,1,0|1,0,0]=3 5370 B12R1.225 Nc1cc(C(N)C(=O)O)ccn1 Amb27425194 [0,1,0,0,1,0|1,0,0]=3 5371 B12R1.225 Nc1cccc(C(N)C(=O)O)c1 Amb18646483 [0,1,0,0,1,0|0,0,0]=2 5372 B12R1.225 Nc1cccc(C(O)C(=O)O)c1 Amb18646668 [0,1,0,0,1,0|1,0,0]=3 5373 B12R1.225 Nc1cccc([C@@H](N)C(=O)O)c1 Amb27400263 [0,1,0,0,1,0|0,0,0]=2 5374 B12R1.225 Nc1cccc([C@@H](N)C(=O)O)n1 Amb27862524 [0,1,0,0,1,0|1,0,0]=3 5375 B12R1.225 Nc1cccc([C@@H](O)C(=O)O)c1 Amb27831344 [0,1,0,0,1,0|1,0,0]=3 5376 B12R1.225 Nc1cccc([C@H](N)C(=O)O)n1 Amb27607223 [0,1,0,0,1,0|1,0,0]=3 5377 B12R1.225 Nc1ccnc(C(N)C(=O)O)c1 Amb28388314 [0,1,0,0,1,0|1,0,0]=3 5378 B12R1.225 O=C(Cl)C(Cl)c1cccc(F)c1 Amb27389502 [0,1,0,0,1,0|2,0,0]=4 5379 B12R1.225 O=C(O)C(=O)c1cccc(Br)c1 Amb18135081 [0,1,0,0,1,0|1,0,1]=4 5380 B12R1.225 O=C(O)C(=O)c1cccc(Cl)c1 Amb18649007 [0,1,0,0,1,0|1,0,1]=4 5381 B12R1.225 O=C(O)C(=O)c1cccc(F)c1 Amb18646830 [0,1,0,0,1,0|1,0,1]=4 5382 B12R1.225 O=C(O)C(=O)c1cccc(I)c1 Amb26880756 [0,1,0,0,1,0|1,0,1]=4 5383 B12R1.225 O=C(O)C(=O)c1cccc(O)c1 Amb27974142 [0,1,0,0,1,0|1,0,1]=4 5384 B12R1.225 O=C(O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,1,0,0,1,0|1,0,0]=3 5385 B12R1.225 O=C(O)C(Br)c1cccc(F)c1 Amb28141108 [0,1,0,0,1,0|1,0,0]=3 5386 B12R1.225 O=C(O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,1,0,0,1,0|1,0,0]=3 5387 B12R1.225 O=C(O)C(Cl)c1cccc(Cl)c1 Amb18066588 [0,1,0,0,1,0|1,0,0]=3 5388 B12R1.225 O=C(O)C(Cl)c1cccc(Cl)n1 Amb27622198 [0,1,0,0,1,0|2,0,0]=4 5389 B12R1.225 O=C(O)C(Cl)c1cccc(F)c1 Amb26981138 [0,1,0,0,1,0|1,0,0]=3 5390 B12R1.225 O=C(O)C(F)c1cccc(Br)c1 Amb26362988 [0,1,0,0,1,0|1,0,0]=3 5391 B12R1.225 O=C(O)C(F)c1cccc(Cl)c1 Amb26980981 [0,1,0,0,1,0|1,0,0]=3 5392 B12R1.225 O=C(O)C(F)c1cccc(F)c1 Amb25967637 [0,1,0,0,1,0|1,0,0]=3 5393 B12R1.225 O=C(O)C(F)c1cccc(O)c1 Amb27478567 [0,1,0,0,1,0|1,0,0]=3 5394 B12R1.225 O=C(O)C(F)c1cncc(F)c1 Amb26371902 [0,1,0,0,1,0|2,0,0]=4 5395 B12R1.225 O=C(O)C(O)c1cc(F)ccn1 Amb33415285 [0,1,0,0,1,0|2,0,0]=4 5396 B12R1.225 O=C(O)C(O)c1cccc(Br)c1 Amb2685288 [0,1,0,0,1,0|1,0,0]=3 5397 B12R1.225 O=C(O)C(O)c1cccc(Br)n1 Amb33432754 [0,1,0,0,1,0|2,0,0]=4 5398 B12R1.225 O=C(O)C(O)c1cccc(Cl)c1 Amb2732563 [0,1,0,0,1,0|1,0,0]=3 5399 B12R1.225 O=C(O)C(O)c1cccc(Cl)n1 Amb33223282 [0,1,0,0,1,0|2,0,0]=4 5400 B12R1.225 O=C(O)C(O)c1cccc(F)c1 Amb2688139 [0,1,0,0,1,0|1,0,0]=3 5401 B12R1.225 O=C(O)C(O)c1cccc(I)c1 Amb25223767 [0,1,0,0,1,0|1,0,0]=3 5402 B12R1.225 O=C(O)C(O)c1cccc(O)c1 Amb6297864 [0,1,0,0,1,0|1,0,0]=3 5403 B12R1.225 O=C(O)C(O)c1cncc(Br)c1 Amb25829664 [0,1,0,0,1,0|2,0,0]=4 5404 B12R1.225 O=C(O)C(O)c1cncc(F)c1 Amb25131443 [0,1,0,0,1,0|2,0,0]=4 5405 B12R1.225 O=C(O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,1,0,0,1,0|1,0,0]=3 5406 B12R1.225 O=C(O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,1,0,0,1,0|1,0,0]=3 5407 B12R1.225 O=C(O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,1,0,0,1,0|1,0,0]=3 5408 B12R1.253 CC(=O)C(C)(C)c1ccccc1 Amb5753154 [0,1,0,0,1,0|2,0,0]=4 5409 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb24738601 [0,1,0,0,1,0|1,0,0]=3 5410 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb35751478 [0,1,0,0,1,0|1,0,0]=3 5411 B12R1.253 CC(=O)C(C)(O)c1ccccc1 Amb4017345 [0,1,0,0,1,0|2,0,0]=4 5412 B12R1.253 CC(=O)C(F)(F)c1ccccc1 Amb24105402 [0,1,0,0,1,0|2,0,0]=4 5413 B12R1.253 CC(=O)[C@@](C)(F)c1ccccc1 Amb27227007 [0,1,0,0,1,0|2,0,0]=4 5414 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 Amb28397134 [0,1,0,0,1,0|2,0,0]=4 5415 B12R1.253 CC(C)(C(=O)Cl)c1ccccc1 Amb5753221 [0,1,0,0,1,0|2,0,0]=4 5416 B12R1.253 CC(C)(C(=O)O)c1ccccc1 Amb17773441 [0,1,0,0,1,0|1,0,0]=3 5417 B12R1.253 CC(C)(C(=O)O)c1ccccn1 Amb19930001 [0,1,0,0,1,0|2,0,0]=4 5418 B12R1.253 CC(C)(C(=O)O)c1cccnc1 Amb18285914 [0,1,0,0,1,0|2,0,0]=4 5419 B12R1.253 CC(C)(C(=O)O)c1cccnc1 Amb30584869 [0,1,0,0,1,0|2,0,0]=4 5420 B12R1.253 CC(C)(C(=O)O)c1ccncc1 Amb18828397 [0,1,0,0,1,0|2,0,0]=4 5421 B12R1.253 CC(C)(C(N)=O)c1ccccc1 Amb8341219 [0,1,0,0,1,0|2,0,0]=4 5422 B12R1.253 CC(Cl)(C(=O)O)c1ccccc1 Amb18649035 [0,1,0,0,1,0|1,0,0]=3 5423 B12R1.253 CC(F)(C(=O)O)c1ccccc1 Amb22547630 [0,1,0,0,1,0|1,0,0]=3 5424 B12R1.253 CC(F)(C(=O)O)c1ccccn1 Amb27389119 [0,1,0,0,1,0|2,0,0]=4 5425 B12R1.253 CC(F)(C(=O)O)c1cccnc1 Amb26583824 [0,1,0,0,1,0|2,0,0]=4 5426 B12R1.253 CC(F)(C(N)=O)c1ccccc1 Amb22547011 [0,1,0,0,1,0|2,0,0]=4 5427 B12R1.253 CC(N)(B(O)O)c1ccccc1 Amb28292677 [0,1,0,0,1,0|1,0,1]=4 5428 B12R1.253 CC(N)(C(=O)O)c1ccccc1 Amb10711147 [0,1,0,0,1,0|0,0,0]=2 5429 B12R1.253 CC(N)(C(=O)O)c1ccccc1 Amb32666392 [0,1,0,0,1,0|0,0,0]=2 5430 B12R1.253 CC(N)(C(=O)O)c1ccccc1 Amb9719473 [0,1,0,0,1,0|0,0,0]=2 5431 B12R1.253 CC(N)(C(=O)O)c1ccccn1 Amb3941905 [0,1,0,0,1,0|1,0,0]=3 5432 B12R1.253 CC(N)(C(=O)O)c1ccncn1 Amb27228279 [0,1,0,0,1,0|2,0,0]=4 5433 B12R1.253 CC(N)(C(=O)[O-])c1ccccc1 Amb32666353 [0,1,0,0,1,0|0,0,1]=3 5434 B12R1.253 CC(N)(C(N)=O)c1ccccc1 Amb13952027 [0,1,0,0,1,0|1,0,0]=3 5435 B12R1.253 CC(N)(C(N)=O)c1ccccc1 Amb2713836 [0,1,0,0,1,0|1,0,0]=3 5436 B12R1.253 CC(N)(C(N)=O)c1ccccn1 Amb18949664 [0,1,0,0,1,0|2,0,0]=4 5437 B12R1.253 CC(N)(c1ccccc1)[PH](=O)O Amb27834359 [0,1,0,0,1,0|1,0,0]=3 5438 B12R1.253 CC(O)(C(=O)O)c1ccccc1 Amb33528331 [0,1,0,0,1,0|1,0,0]=3 5439 B12R1.253 CC(O)(C(=O)O)c1ccccn1 Amb18952001 [0,1,0,0,1,0|2,0,0]=4 5440 B12R1.253 CC(O)(C(N)=O)c1ccccc1 Amb4036096 [0,1,0,0,1,0|2,0,0]=4 5441 B12R1.253 C[C@@](Cl)(C(=O)O)c1ccccc1 Amb28118827 [0,1,0,0,1,0|1,0,0]=3 5442 B12R1.253 C[C@@](F)(C(=O)O)c1ccccc1 Amb25279569 [0,1,0,0,1,0|1,0,0]=3 5443 B12R1.253 C[C@@](N)(C(=O)O)c1ccccc1 Amb22225774 [0,1,0,0,1,0|0,0,0]=2 5444 B12R1.253 C[C@@](N)(C(=O)O)c1ccccc1 Amb22747027 [0,1,0,0,1,0|0,0,0]=2 5445 B12R1.253 C[C@@](N)(C(=O)O)c1ccccc1 Amb32662884 [0,1,0,0,1,0|0,0,0]=2 5446 B12R1.253 C[C@@](N)(C(=O)[O-])c1ccccc1 Amb32662882 [0,1,0,0,1,0|0,0,1]=3 5447 B12R1.253 C[C@@](O)(C(=O)O)c1ccccc1 Amb22226510 [0,1,0,0,1,0|1,0,0]=3 5448 B12R1.253 C[C@](F)(C(=O)O)c1ccccc1 Amb25100972 [0,1,0,0,1,0|1,0,0]=3 5449 B12R1.253 C[C@](N)(C(=O)O)c1ccccc1 Amb19929597 [0,1,0,0,1,0|0,0,0]=2 5450 B12R1.253 C[C@](N)(C(=O)O)c1ccccc1 Amb25692685 [0,1,0,0,1,0|0,0,0]=2 5451 B12R1.253 C[C@](N)(C(=O)O)c1cccnc1 Amb27173315 [0,1,0,0,1,0|1,0,0]=3 5452 B12R1.253 C[C@](N)(C(=O)O)c1cnccn1 Amb27222312 [0,1,0,0,1,0|2,0,0]=4 5453 B12R1.253 C[C@](N)(c1ccccc1)[PH](=O)O Amb27975844 [0,1,0,0,1,0|1,0,0]=3 5454 B12R1.253 C[C@](O)(C(=O)O)c1ccccc1 Amb9826883 [0,1,0,0,1,0|1,0,0]=3 5455 B12R1.253 NC(=O)C(Cl)(Cl)c1ccccc1 Amb27628336 [0,1,0,0,1,0|2,0,0]=4 5456 B12R1.253 NC(=O)C(F)(F)c1ccccc1 Amb1104586 [0,1,0,0,1,0|2,0,0]=4 5457 B12R1.253 NC(=O)C(O)(O)c1ccccc1 Amb27490844 [0,1,0,0,1,0|2,0,0]=4 5458 B12R1.253 O=C(Cl)C(F)(F)c1ccccc1 Amb26874459 [0,1,0,0,1,0|2,0,0]=4 5459 B12R1.253 O=C(O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,1,0,0,1,0|1,0,0]=3 5460 B12R1.253 O=C(O)C(F)(Cl)c1ccccc1 Amb24532752 [0,1,0,0,1,0|1,0,0]=3 5461 B12R1.253 O=C(O)C(F)(F)c1ccccc1 Amb1197472 [0,1,0,0,1,0|1,0,0]=3 5462 B12R1.253 O=C(O)C(F)(F)c1ccccn1 Amb10840437 [0,1,0,0,1,0|2,0,0]=4 5463 B12R1.253 O=C(O)C(F)(F)c1ccccn1 Amb20668303 [0,1,0,0,1,0|2,0,0]=4 5464 B12R1.253 O=C(O)C(F)(F)c1cccnc1 Amb18183748 [0,1,0,0,1,0|2,0,0]=4 5465 B12R1.253 O=C(O)C(F)(F)c1ccncc1 Amb23585649 [0,1,0,0,1,0|2,0,0]=4 5466 B12R1.253 O=C(O)C(O)(O)c1ccccc1 Amb25684790 [0,1,0,0,1,0|1,0,0]=3 5467 B12R1.253 O=C(O)[C@](Cl)(Br)c1ccccc1 Amb26880704 [0,1,0,0,1,0|1,0,0]=3 5468 B12R1.478 C=CC(C(=O)O)c1ccccc1 Amb18645652 [0,1,0,0,1,0|1,0,0]=3 5469 B12R1.478 C=CC(C(N)=O)c1ccccc1 Amb25361995 [0,1,0,0,1,0|2,0,0]=4 5470 B12R1.478 CC(=O)C(C#N)c1ccccc1 Amb6315542 [0,1,0,0,1,0|1,0,1]=4 5471 B12R1.478 CC(=O)\C(=C/N)c1ccccc1 Amb17777807 [0,1,0,0,1,0|1,0,1]=4 5472 B12R1.478 CC(=O)\C(=C\N)c1ccccc1 Amb25238332 [0,1,0,0,1,0|1,0,1]=4 5473 B12R1.478 CCC(C(=O)Cl)c1ccccc1 Amb3939962 [0,1,0,0,1,0|2,0,0]=4 5474 B12R1.478 CCC(C(=O)O)c1ccccc1 Amb5559100 [0,1,0,0,1,0|1,0,0]=3 5475 B12R1.478 CCC(C(=O)O)c1ccccn1 Amb25116759 [0,1,0,0,1,0|2,0,0]=4 5476 B12R1.478 CCC(C(=O)O)c1cccnc1 Amb18999434 [0,1,0,0,1,0|2,0,0]=4 5477 B12R1.478 CCC(C(=O)O)c1ccncc1 Amb27654758 [0,1,0,0,1,0|2,0,0]=4 5478 B12R1.478 CCC(C(N)=O)c1ccccc1 Amb3886654 [0,1,0,0,1,0|2,0,0]=4 5479 B12R1.478 CC[C@@H](C(=O)O)c1ccccc1 Amb3939858 [0,1,0,0,1,0|1,0,0]=3 5480 B12R1.478 CC[C@H](C(=O)Cl)c1ccccc1 Amb27804162 [0,1,0,0,1,0|2,0,0]=4 5481 B12R1.478 CC[C@H](C(=O)O)c1ccccc1 Amb3941682 [0,1,0,0,1,0|1,0,0]=3 5482 B12R1.478 CC[C@H](C(C)=O)c1ccccc1 Amb28122453 [0,1,0,0,1,0|2,0,0]=4 5483 B12R1.478 CNC(C(=O)O)c1ccccc1 Amb19346335 [0,1,0,0,1,0|0,0,0]=2 5484 B12R1.478 CNC(C(=O)O)c1ccccc1 Amb9619769 [0,1,0,0,1,0|0,0,0]=2 5485 B12R1.478 CNC(C(=O)O)c1cccnc1 Amb3941274 [0,1,0,0,1,0|1,0,0]=3 5486 B12R1.478 CNC(C(=O)O)c1ncccn1 Amb28400717 [0,1,0,0,1,0|2,0,0]=4 5487 B12R1.478 CNC(C(C)=O)c1ccccc1 Amb28048792 [0,1,0,0,1,0|1,0,0]=3 5488 B12R1.478 CNC(C(N)=O)c1ccccc1 Amb17334616 [0,1,0,0,1,0|1,0,0]=3 5489 B12R1.478 CNC(C(N)=O)c1ccccn1 Amb17334638 [0,1,0,0,1,0|2,0,0]=4 5490 B12R1.478 CNC(C(N)=O)c1cccnc1 Amb17334639 [0,1,0,0,1,0|2,0,0]=4 5491 B12R1.478 CNC(C(N)=O)c1ccncc1 Amb17334640 [0,1,0,0,1,0|2,0,0]=4 5492 B12R1.478 CNC(c1ccccc1)[PH](=O)O Amb27876577 [0,1,0,0,1,0|1,0,0]=3 5493 B12R1.478 CN[C@@H](C(=O)O)c1ccccc1 Amb16183947 [0,1,0,0,1,0|0,0,0]=2 5494 B12R1.478 CN[C@@H](C(=O)O)c1ccccc1 Amb34913188 [0,1,0,0,1,0|0,0,0]=2 5495 B12R1.478 CN[C@@H](C(N)=O)c1ccccc1 Amb27409029 [0,1,0,0,1,0|1,0,0]=3 5496 B12R1.478 CN[C@@H](c1ccccc1)[C@@H](C)O Amb27643322 [0,1,0,0,1,0|1,0,1]=4 5497 B12R1.478 CN[C@H](C(=O)O)c1ccccc1 Amb16183859 [0,1,0,0,1,0|0,0,0]=2 5498 B12R1.478 CN[C@H](C(=O)O)c1ccccc1 Amb33801568 [0,1,0,0,1,0|0,0,0]=2 5499 B12R1.478 COC(C(=O)Cl)c1ccccc1 Amb27178278 [0,1,0,0,1,0|2,0,0]=4 5500 B12R1.478 COC(C(=O)O)c1ccccc1 Amb9729801 [0,1,0,0,1,0|1,0,0]=3 5501 B12R1.478 COC(C(=O)O)c1cccnc1 Amb26452713 [0,1,0,0,1,0|2,0,0]=4 5502 B12R1.478 COC(C(=O)O)c1cccnc1 Amb33483961 [0,1,0,0,1,0|2,0,0]=4 5503 B12R1.478 COC(C(=O)O)c1ccncc1 Amb27233640 [0,1,0,0,1,0|2,0,0]=4 5504 B12R1.478 COC(C(=O)[O-])c1ccccc1 Amb23440840 [0,1,0,0,1,0|1,0,1]=4 5505 B12R1.478 COC(C(=O)[O-])c1ccccc1 Amb4005057 [0,1,0,0,1,0|1,0,1]=4 5506 B12R1.478 COC(C(C)=O)c1ccccc1 Amb33552276 [0,1,0,0,1,0|2,0,0]=4 5507 B12R1.478 CO[C@@H](C(=O)O)c1ccccc1 Amb3940109 [0,1,0,0,1,0|1,0,0]=3 5508 B12R1.478 CO[C@@H](C(C)=O)c1ccccc1 Amb27749805 [0,1,0,0,1,0|2,0,0]=4 5509 B12R1.478 CO[C@H](C(=O)Cl)c1ccccc1 Amb27954592 [0,1,0,0,1,0|2,0,0]=4 5510 B12R1.478 CO[C@H](C(=O)O)c1ccccc1 Amb3939862 [0,1,0,0,1,0|1,0,0]=3 5511 B12R1.478 CS(=O)C(CN)c1ccccc1 Amb27845581 [0,1,0,0,1,0|2,0,0]=4 5512 B12R1.478 CSC(C(=O)O)c1ccccc1 Amb18971615 [0,1,0,0,1,0|1,0,0]=3 5513 B12R1.478 C[C@H](O)[C@@H](CN)c1ccccc1 Amb27647589 [0,1,0,0,1,0|1,0,1]=4 5514 B12R1.478 C\C=C(/C(=O)O)c1ccccc1 Amb2732929 [0,1,0,0,1,0|1,0,1]=4 5515 B12R1.478 N#CC(C(=O)O)c1ccccc1 Amb1783147 [0,1,0,0,1,0|0,0,1]=3 5516 B12R1.478 N#CC(C(=O)O)c1ccccn1 Amb27390431 [0,1,0,0,1,0|1,0,1]=4 5517 B12R1.478 N#CC(C(N)=O)c1ccccc1 Amb18787947 [0,1,0,0,1,0|1,0,1]=4 5518 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [0,1,0,0,1,0|2,0,0]=4 5519 B12R1.478 NC(=O)[C@H](NO)c1ccccc1 Amb27400280 [0,1,0,0,1,0|1,0,0]=3 5520 B12R1.478 NCC(C(=O)Cl)c1ccccc1 Amb27214957 [0,1,0,0,1,0|1,0,0]=3 5521 B12R1.478 NCC(C(=O)O)c1ccccc1 Amb2697387 [0,1,0,0,1,0|0,0,0]=2 5522 B12R1.478 NCC(C(=O)O)c1ccccn1 Amb17400194 [0,1,0,0,1,0|1,0,0]=3 5523 B12R1.478 NCC(C(=O)O)c1cccnc1 Amb2697509 [0,1,0,0,1,0|1,0,0]=3 5524 B12R1.478 NCC(C(=O)O)c1ccncc1 Amb17400195 [0,1,0,0,1,0|1,0,0]=3 5525 B12R1.478 NCC(C(=O)O)c1cnccn1 Amb18827270 [0,1,0,0,1,0|2,0,0]=4 5526 B12R1.478 NCC(C(=O)O)c1cncnc1 Amb27840576 [0,1,0,0,1,0|2,0,0]=4 5527 B12R1.478 NCC(C(=O)O)c1ncccn1 Amb33270727 [0,1,0,0,1,0|2,0,0]=4 5528 B12R1.478 NC[C@@H](C(=O)O)c1ccccc1 Amb22756742 [0,1,0,0,1,0|0,0,0]=2 5529 B12R1.478 NC[C@H](C(=O)O)c1ccccc1 Amb24674068 [0,1,0,0,1,0|0,0,0]=2 5530 B12R1.478 NNC(C(=O)O)c1ccccc1 Amb17400196 [0,1,0,0,1,0|0,0,0]=2 5531 B12R1.478 NNC(C(=O)O)c1ccccn1 Amb17400231 [0,1,0,0,1,0|1,0,0]=3 5532 B12R1.478 NNC(C(=O)O)c1cccnc1 Amb17400232 [0,1,0,0,1,0|1,0,0]=3 5533 B12R1.478 NNC(C(=O)O)c1ccncc1 Amb17400233 [0,1,0,0,1,0|1,0,0]=3 5534 B12R1.478 NOC(C(=O)O)c1ccccc1 Amb27863609 [0,1,0,0,1,0|0,0,0]=2 5535 B12R1.478 N\N=C(/C(=O)O)c1ccccc1 Amb24068345 [0,1,0,0,1,0|0,0,1]=3 5536 B12R1.478 N\N=C(/C(=O)O)c1cccnc1 Amb27478101 [0,1,0,0,1,0|1,0,1]=4 5537 B12R1.478 N\N=C(\C(=O)O)c1ccccc1 Amb25701762 [0,1,0,0,1,0|0,0,1]=3 5538 B12R1.478 N\N=C(\C(=O)O)c1cccnc1 Amb28429575 [0,1,0,0,1,0|1,0,1]=4 5539 B12R1.478 O=C(Cl)C(CO)c1ccccc1 Amb28127023 [0,1,0,0,1,0|2,0,0]=4 5540 B12R1.478 O=C(O)C(CO)c1ccccc1 Amb556054 [0,1,0,0,1,0|1,0,0]=3 5541 B12R1.478 O=C(O)[C@@H](CO)c1ccccc1 Amb25109240 [0,1,0,0,1,0|1,0,0]=3 5542 B12R1.478 O=C(O)[C@@H](NO)c1ccccc1 Amb28396592 [0,1,0,0,1,0|0,0,0]=2 5543 B12R1.478 O=C(O)[C@H](CCl)c1ccccc1 Amb27865518 [0,1,0,0,1,0|1,0,0]=3 5544 B12R1.478 O=C(O)[C@H](CF)c1ccccc1 Amb27231710 [0,1,0,0,1,0|1,0,0]=3 5545 B12R1.478 O=C(O)[C@H](CO)c1ccccc1 Amb27955217 [0,1,0,0,1,0|1,0,0]=3 5546 B12R1.478 O=C(O)\C(=N/O)c1ccccc1 Amb31276902 [0,1,0,0,1,0|0,0,2]=4 5547 B12R1.478 O=C(O)\C(=N\O)c1ccccc1 Amb22230611 [0,1,0,0,1,0|0,0,2]=4 5548 B12R1.478 O=CC(C(=O)O)c1ccccc1 Amb26612719 [0,1,0,0,1,0|1,0,0]=3 5549 B12R1.478 [C-]#[N+]C(C(N)=O)c1ccccc1 Amb27602245 [0,1,0,0,1,0|1,0,1]=4 5550 B12R1.478 [NH3+]CC(C(=O)O)c1ccccc1 Amb22546483 [0,1,0,0,1,0|0,0,1]=3 5551 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb18646373 [0,1,0,0,1,0|1,0,1]=4 5552 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb23399663 [0,1,0,0,1,0|1,0,1]=4 5553 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb27175580 [0,1,0,0,1,0|1,0,1]=4 5554 B12R1.564 CC(C)(O)[C@H](N)c1ccccc1 Amb30874073 [0,1,0,0,1,0|1,0,1]=4 5555 B12R1.564 CC(c1ccccc1)P(=O)(O)O Amb10975962 [0,1,0,0,1,0|2,0,0]=4 5556 B12R1.564 CP(C)(=O)[C@@H](N)c1ccccc1 Amb35788622 [0,1,0,0,1,0|2,0,0]=4 5557 B12R1.564 CP(C)(=O)[C@@H](N)c1ccccc1 Amb35789075 [0,1,0,0,1,0|2,0,0]=4 5558 B12R1.564 CP(C)(=O)[C@H](N)c1ccccc1 Amb35789576 [0,1,0,0,1,0|2,0,0]=4 5559 B12R1.564 CP(C)(=O)[C@H](N)c1ccccc1 Amb35789619 [0,1,0,0,1,0|2,0,0]=4 5560 B12R1.564 NC(c1ccccc1)P(=O)(O)O Amb1148498 [0,1,0,0,1,0|1,0,0]=3 5561 B12R1.564 NC(c1ccccc1)S(=O)(=O)O Amb22472999 [0,1,0,0,1,0|1,0,0]=3 5562 B12R1.564 NC(c1ccccn1)P(=O)(O)O Amb27841425 [0,1,0,0,1,0|2,0,0]=4 5563 B12R1.564 NC(c1ccncc1)P(=O)(O)O Amb24596428 [0,1,0,0,1,0|2,0,0]=4 5564 B12R1.564 N[C@@H](c1ccccc1)P(=O)(O)O Amb26642973 [0,1,0,0,1,0|1,0,0]=3 5565 B12R1.564 N[C@@H](c1ccccc1)P(=O)(O)O Amb35750746 [0,1,0,0,1,0|1,0,0]=3 5566 B12R1.564 N[C@H](c1ccccc1)P(=O)(O)O Amb35751615 [0,1,0,0,1,0|1,0,0]=3 5567 B12R1.564 N[C@H](c1ccccc1)P(=O)(O)O Amb562223 [0,1,0,0,1,0|1,0,0]=3 5568 B12R1.564 O=P(O)(O)C(Br)c1ccccc1 Amb27162338 [0,1,0,0,1,0|2,0,0]=4 5569 B12R1.564 O=P(O)(O)C(O)c1ccccc1 Amb25947469 [0,1,0,0,1,0|2,0,0]=4 5570 B12R1.564 O=P(O)(O)[C@H](O)c1ccccc1 Amb27842095 [0,1,0,0,1,0|2,0,0]=4 5571 B12R1.564 O=S(=O)(O)C(O)c1ccccc1 Amb17594875 [0,1,0,0,1,0|2,0,0]=4 5572 B14R1.337 CC(=O)N[C@@H](C)Cc1ccccc1Cl Amb27863952 [0,1,0,0,0,1|2,0,0]=4 5573 B14R1.337 CC(C)=CC(N)Cc1ccccc1C Amb27773770 [0,1,0,0,0,1|2,0,0]=4 5574 B14R1.337 CC(CC(=O)O)Cc1ccccc1Br Amb32989862 [0,1,0,0,0,1|1,0,0]=3 5575 B14R1.337 CC(CC(=O)O)Cc1ccccc1Cl Amb17241244 [0,1,0,0,0,1|1,0,0]=3 5576 B14R1.337 CC(CC(=O)O)Cc1ccccc1F Amb17236372 [0,1,0,0,0,1|1,0,0]=3 5577 B14R1.337 CC(CC(=O)O)Nc1ccccc1Br Amb9398592 [0,1,0,0,0,1|2,0,0]=4 5578 B14R1.337 CC(CC(=O)O)Nc1ccccc1Cl Amb9398600 [0,1,0,0,0,1|2,0,0]=4 5579 B14R1.337 CC(CC(=O)O)Nc1ccccc1F Amb9398606 [0,1,0,0,0,1|2,0,0]=4 5580 B14R1.337 CC(CC(=O)O)Nc1ccccc1O Amb28458548 [0,1,0,0,0,1|2,0,0]=4 5581 B14R1.337 CC(CC(=O)O)Oc1ccccc1Br Amb9397837 [0,1,0,0,0,1|2,0,0]=4 5582 B14R1.337 CC(CC(=O)O)Oc1ccccc1Cl Amb9397730 [0,1,0,0,0,1|2,0,0]=4 5583 B14R1.337 CC(CC(=O)O)Oc1ccccc1F Amb9397726 [0,1,0,0,0,1|2,0,0]=4 5584 B14R1.337 CN(CC(=O)O)Cc1ccccc1Br Amb9239031 [0,1,0,0,0,1|2,0,0]=4 5585 B14R1.337 CN(CC(=O)O)Cc1ccccc1Cl Amb9239039 [0,1,0,0,0,1|2,0,0]=4 5586 B14R1.337 CN(CC(=O)O)Cc1ccccc1F Amb13948950 [0,1,0,0,0,1|2,0,0]=4 5587 B14R1.337 CN(CC(=O)O)Cc1ccccc1F Amb9239036 [0,1,0,0,0,1|2,0,0]=4 5588 B14R1.337 C\C(=C/C(=O)O)Cc1ccccc1C Amb17234894 [0,1,0,0,0,1|1,0,1]=4 5589 B14R1.337 C\C(=C/C(=O)O)Cc1ccccc1Cl Amb17240730 [0,1,0,0,0,1|1,0,1]=4 5590 B14R1.337 C\C(=C/C(=O)O)Cc1ccccc1F Amb17235881 [0,1,0,0,0,1|1,0,1]=4 5591 B14R1.337 C\C(=C\C(=O)O)Cc1ccccc1C Amb27191532 [0,1,0,0,0,1|1,0,1]=4 5592 B14R1.337 C\C(=C\C(=O)O)Cc1ccccc1Cl Amb27185854 [0,1,0,0,0,1|1,0,1]=4 5593 B14R1.337 Cc1ccccc1CC(C)CC(=O)O Amb17235384 [0,1,0,0,0,1|1,0,0]=3 5594 B14R1.337 Cc1ccccc1CC(N)CC(=O)O Amb17470840 [0,1,0,0,0,1|0,0,0]=2 5595 B14R1.337 Cc1ccccc1CC(O)CC(=O)O Amb17235898 [0,1,0,0,0,1|1,0,0]=3 5596 B14R1.337 Cc1ccccc1CN(C)CC(=O)O Amb9239033 [0,1,0,0,0,1|2,0,0]=4 5597 B14R1.337 Cc1ccccc1C[C@@H](N)CC(=O)O Amb16231753 [0,1,0,0,0,1|0,0,0]=2 5598 B14R1.337 Cc1ccccc1C[C@@H](N)CC(=O)O Amb22747177 [0,1,0,0,0,1|0,0,0]=2 5599 B14R1.337 Cc1ccccc1C[C@H](N)CC(=O)O Amb33726032 [0,1,0,0,0,1|0,0,0]=2 5600 B14R1.337 Cc1ccccc1C[C@H](N)CC(=O)O Amb34151472 [0,1,0,0,0,1|0,0,0]=2 5601 B14R1.337 Cc1ccccc1NC(C)CC(=O)O Amb9398658 [0,1,0,0,0,1|2,0,0]=4 5602 B14R1.337 Cc1ccccc1OC(C)CC(=O)O Amb9397747 [0,1,0,0,0,1|2,0,0]=4 5603 B14R1.337 NC(CC(=O)O)Cc1ccccc1Br Amb17473601 [0,1,0,0,0,1|0,0,0]=2 5604 B14R1.337 NC(CC(=O)O)Cc1ccccc1Cl Amb17471478 [0,1,0,0,0,1|0,0,0]=2 5605 B14R1.337 NC(CC(=O)O)Cc1ccccc1F Amb17470954 [0,1,0,0,0,1|0,0,0]=2 5606 B14R1.337 NC(CC(=O)O)Cc1ccccc1O Amb33624487 [0,1,0,0,0,1|0,0,0]=2 5607 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1Br Amb33832435 [0,1,0,0,0,1|0,0,0]=2 5608 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1Br Amb34903687 [0,1,0,0,0,1|0,0,0]=2 5609 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1Cl Amb16231752 [0,1,0,0,0,1|0,0,0]=2 5610 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1Cl Amb34154652 [0,1,0,0,0,1|0,0,0]=2 5611 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1F Amb19929569 [0,1,0,0,0,1|0,0,0]=2 5612 B14R1.337 N[C@@H](CC(=O)O)Cc1ccccc1F Amb33757815 [0,1,0,0,0,1|0,0,0]=2 5613 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1Br Amb22746341 [0,1,0,0,0,1|0,0,0]=2 5614 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1Br Amb34902225 [0,1,0,0,0,1|0,0,0]=2 5615 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1Cl Amb22746257 [0,1,0,0,0,1|0,0,0]=2 5616 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1Cl Amb34913925 [0,1,0,0,0,1|0,0,0]=2 5617 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1F Amb16231750 [0,1,0,0,0,1|0,0,0]=2 5618 B14R1.337 N[C@H](CC(=O)O)Cc1ccccc1F Amb22747012 [0,1,0,0,0,1|0,0,0]=2 5619 B14R1.337 O=C(O)CC(O)Cc1ccccc1Cl Amb17241781 [0,1,0,0,0,1|1,0,0]=3 5620 B14R1.337 O=C(O)CC(O)Cc1ccccc1F Amb17236718 [0,1,0,0,0,1|1,0,0]=3 5621 B14R1.417 CC(=O)NC(Cl)C(O)c1ccccc1 Amb27413588 [0,1,0,0,0,1|2,0,0]=4 5622 B14R1.417 CC(=O)N[C@@H](C)[C@@H](Cl)c1ccccc1 Amb28286735 [0,1,0,0,0,1|2,0,0]=4 5623 B14R1.417 CC(=O)N[C@@H](C)[C@H](O)c1ccccc1 Amb26646866 [0,1,0,0,0,1|2,0,0]=4 5624 B14R1.417 CC(=O)N[C@H](Cl)[C@H](O)c1ccccc1 Amb28121207 [0,1,0,0,0,1|2,0,0]=4 5625 B14R1.417 CC(CC(=O)O)C(=O)c1ccccc1 Amb17336399 [0,1,0,0,0,1|1,0,1]=4 5626 B14R1.417 CC(CC(=O)O)N(C)c1ccccc1 Amb17336620 [0,1,0,0,0,1|2,0,0]=4 5627 B14R1.417 CC(c1ccccc1)C(N)CC(=O)O Amb2697569 [0,1,0,0,0,1|0,0,0]=2 5628 B14R1.417 CC(c1ccccc1)C(O)CC(=O)O Amb18310720 [0,1,0,0,0,1|1,0,0]=3 5629 B14R1.417 CC(c1ccccc1)N(C)CC(=O)O Amb17336640 [0,1,0,0,0,1|2,0,0]=4 5630 B14R1.417 CC(c1ccccc1)[C@@H](O)CC(=O)O Amb33081838 [0,1,0,0,0,1|1,0,0]=3 5631 B14R1.417 CC(c1ccccc1)[C@H](O)CC(=O)O Amb33081841 [0,1,0,0,0,1|1,0,0]=3 5632 B14R1.417 NC(CC(=O)O)C(=O)c1ccccc1 Amb18627624 [0,1,0,0,0,1|0,0,1]=3 5633 B14R1.417 NC(CC(=O)O)C(O)c1ccccc1 Amb18108613 [0,1,0,0,0,1|0,0,0]=2 5634 B14R1.417 NC(CC(=O)O)C(O)c1ccccn1 Amb18813257 [0,1,0,0,0,1|1,0,0]=3 5635 B14R1.417 NC(CC(=O)O)C(O)c1cccnc1 Amb18813256 [0,1,0,0,0,1|1,0,0]=3 5636 B14R1.417 O=C(O)CC(Br)C(=O)c1ccccc1 Amb1206782 [0,1,0,0,0,1|1,0,1]=4 5637 B14R1.417 O=C(O)CC(Cl)C(=O)c1ccccc1 Amb17339884 [0,1,0,0,0,1|1,0,1]=4 5638 B14R1.425 CC(C(=O)O)N(C)Cc1ccccc1 Amb2616529 [0,1,0,0,0,1|2,0,0]=4 5639 B14R1.425 CC(C(=O)O)N(N)Cc1ccccc1 Amb9777122 [0,1,0,0,0,1|1,0,0]=3 5640 B14R1.425 CN(Cc1ccccc1)C(=O)C(=O)O Amb9303901 [0,1,0,0,0,1|2,0,0]=4 5641 B14R1.425 C[C@@H](C(=O)O)N(C)Cc1ccccc1 Amb26967590 [0,1,0,0,0,1|2,0,0]=4 5642 B14R1.425 C[C@@H](Sc1ccccc1)[C@@H](N)C(=O)O Amb8629274 [0,1,0,0,0,1|2,0,0]=4 5643 B14R1.425 C\C(Cc1ccccc1)=C(\C)C(=O)O Amb27961324 [0,1,0,0,0,1|1,0,1]=4 5644 B14R1.425 NC(=O)C(O)C(N)Cc1ccccc1 Amb32670749 [0,1,0,0,0,1|1,0,0]=3 5645 B14R1.425 NC(=O)C(O)C(N)Cc1ccccc1 Amb32670761 [0,1,0,0,0,1|1,0,0]=3 5646 B14R1.425 NC(C(=O)O)C(O)Cc1ccccc1 Amb33547379 [0,1,0,0,0,1|1,0,0]=3 5647 B14R1.425 NC(Cc1ccccc1)C(O)C(=O)O Amb18652122 [0,1,0,0,0,1|0,0,0]=2 5648 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(=O)O Amb22750622 [0,1,0,0,0,1|0,0,0]=2 5649 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(=O)O Amb22746338 [0,1,0,0,0,1|0,0,0]=2 5650 B14R1.425 N[C@H](Cc1ccccc1)[C@H](O)C(=O)O Amb8631180 [0,1,0,0,0,1|0,0,0]=2 5651 B14R1.425 N[C@H](Cc1ccccc1)[C@H](O)C(=O)O Amb8631360 [0,1,0,0,0,1|0,0,0]=2 5652 B14R1.433 NC(Cc1ccccc1)CS(=O)(=O)F Amb33463768 [0,1,0,0,0,1|1,0,1]=4 5653 B14R1.549 C=CC(Cc1ccccc1)NC(C)=O Amb24096354 [0,1,0,0,0,1|2,0,0]=4 5654 B14R1.549 C=CN(CC(=O)O)Cc1ccccc1 Amb28385556 [0,1,0,0,0,1|2,0,0]=4 5655 B14R1.549 CC(=O)NC(C#N)Cc1ccccc1 Amb24539287 [0,1,0,0,0,1|1,0,1]=4 5656 B14R1.549 CC(=O)N[C@H](C#N)Cc1ccccc1 Amb27592950 [0,1,0,0,0,1|1,0,1]=4 5657 B14R1.549 CC(=O)N[C@H](CCl)Cc1ccccc1 Amb17103592 [0,1,0,0,0,1|2,0,0]=4 5658 B14R1.549 CC(=O)N[C@H](CO)Cc1ccccc1 Amb17102648 [0,1,0,0,0,1|2,0,0]=4 5659 B14R1.549 CCC(CC(=O)O)Cc1ccccc1 Amb31217602 [0,1,0,0,0,1|1,0,0]=3 5660 B14R1.549 CCC(CC(=O)O)Nc1ccccc1 Amb32990255 [0,1,0,0,0,1|2,0,0]=4 5661 B14R1.549 CNC(CC(=O)O)Cc1ccccc1 Amb18629363 [0,1,0,0,0,1|0,0,0]=2 5662 B14R1.549 CNC(CC(=O)O)Cc1ccccc1 Amb32652922 [0,1,0,0,0,1|0,0,0]=2 5663 B14R1.549 N#CC(CC(=O)O)Cc1ccccc1 Amb17336081 [0,1,0,0,0,1|0,0,1]=3 5664 B14R1.549 NCC(CC(=O)O)Cc1ccccc1 Amb32665329 [0,1,0,0,0,1|0,0,0]=2 5665 B14R1.549 NCC(CC(=O)O)Cc1ccccc1 Amb32665330 [0,1,0,0,0,1|0,0,0]=2 5666 B14R1.698 CC(=O)NC(C)Cc1ccc(Br)cc1 Amb10652716 [0,1,0,0,0,1|2,0,0]=4 5667 B14R1.698 CC(=O)NC(C)Cc1ccc(C)cc1 Amb28351475 [0,1,0,0,0,1|2,0,0]=4 5668 B14R1.698 CC(=O)NC(C)Cc1ccc(I)cc1 Amb26525085 [0,1,0,0,0,1|2,0,0]=4 5669 B14R1.698 CC(C)=CC(N)Cc1ccc(Cl)cc1 Amb27388995 [0,1,0,0,0,1|2,0,0]=4 5670 B14R1.698 CC(CC(=O)O)Cc1ccc(Br)cc1 Amb17265523 [0,1,0,0,0,1|1,0,0]=3 5671 B14R1.698 CC(CC(=O)O)Cc1ccc(Cl)cc1 Amb4399433 [0,1,0,0,0,1|1,0,0]=3 5672 B14R1.698 CC(CC(=O)O)Cc1ccc(F)cc1 Amb17236375 [0,1,0,0,0,1|1,0,0]=3 5673 B14R1.698 CC(CC(=O)O)Cc1ccc(O)cc1 Amb17336807 [0,1,0,0,0,1|1,0,0]=3 5674 B14R1.698 CC(CC(=O)O)Nc1ccc(Br)cc1 Amb9398594 [0,1,0,0,0,1|2,0,0]=4 5675 B14R1.698 CC(CC(=O)O)Nc1ccc(Cl)cc1 Amb4007904 [0,1,0,0,0,1|2,0,0]=4 5676 B14R1.698 CC(CC(=O)O)Nc1ccc(F)cc1 Amb9398598 [0,1,0,0,0,1|2,0,0]=4 5677 B14R1.698 CC(CC(=O)O)Oc1ccc(Br)cc1 Amb9397728 [0,1,0,0,0,1|2,0,0]=4 5678 B14R1.698 CC(CC(=O)O)Oc1ccc(Cl)cc1 Amb9397732 [0,1,0,0,0,1|2,0,0]=4 5679 B14R1.698 CC(CC(=O)O)Oc1ccc(F)cc1 Amb9397749 [0,1,0,0,0,1|2,0,0]=4 5680 B14R1.698 CC(CC(=O)O)Sc1ccc(Cl)cc1 Amb3939889 [0,1,0,0,0,1|2,0,0]=4 5681 B14R1.698 CC(CC(=O)O)Sc1ccc(F)cc1 Amb9277788 [0,1,0,0,0,1|2,0,0]=4 5682 B14R1.698 CC(Cc1ccc(Cl)cc1)NC(N)=O Amb22461493 [0,1,0,0,0,1|2,0,0]=4 5683 B14R1.698 CC(Cc1ccc(F)cc1)NC(=O)Cl Amb35625683 [0,1,0,0,0,1|2,0,0]=4 5684 B14R1.698 CN(CC(=O)O)Cc1ccc(Br)cc1 Amb9239037 [0,1,0,0,0,1|2,0,0]=4 5685 B14R1.698 CN(CC(=O)O)Cc1ccc(Cl)cc1 Amb9239038 [0,1,0,0,0,1|2,0,0]=4 5686 B14R1.698 CN(CC(=O)O)Cc1ccc(F)cc1 Amb13948951 [0,1,0,0,0,1|2,0,0]=4 5687 B14R1.698 CN(CC(=O)O)Cc1ccc(F)cc1 Amb7088997 [0,1,0,0,0,1|2,0,0]=4 5688 B14R1.698 C\C(=C/C(=O)O)Cc1ccc(Br)cc1 Amb17264237 [0,1,0,0,0,1|1,0,1]=4 5689 B14R1.698 C\C(=C/C(=O)O)Cc1ccc(C)cc1 Amb17234900 [0,1,0,0,0,1|1,0,1]=4 5690 B14R1.698 C\C(=C/C(=O)O)Cc1ccc(Cl)cc1 Amb17240736 [0,1,0,0,0,1|1,0,1]=4 5691 B14R1.698 C\C(=C/C(=O)O)Cc1ccc(F)cc1 Amb17235884 [0,1,0,0,0,1|1,0,1]=4 5692 B14R1.698 C\C(=C\C(=O)O)Cc1ccc(F)cc1 Amb28289886 [0,1,0,0,0,1|1,0,1]=4 5693 B14R1.698 Cc1ccc(CC(Br)CC(=O)O)cc1 Amb18108429 [0,1,0,0,0,1|1,0,0]=3 5694 B14R1.698 Cc1ccc(CC(C)CC(=O)O)cc1 Amb4007562 [0,1,0,0,0,1|1,0,0]=3 5695 B14R1.698 Cc1ccc(CC(Cl)CC(=O)O)cc1 Amb18627988 [0,1,0,0,0,1|1,0,0]=3 5696 B14R1.698 Cc1ccc(CC(N)CC(=O)O)cc1 Amb2697404 [0,1,0,0,0,1|0,0,0]=2 5697 B14R1.698 Cc1ccc(CC(O)CC(=O)O)cc1 Amb17235900 [0,1,0,0,0,1|1,0,0]=3 5698 B14R1.698 Cc1ccc(CN(C)CC(=O)O)cc1 Amb22587218 [0,1,0,0,0,1|2,0,0]=4 5699 B14R1.698 Cc1ccc(CN(C)CC(=O)O)cc1 Amb6652466 [0,1,0,0,0,1|2,0,0]=4 5700 B14R1.698 Cc1ccc(C[C@@H](N)CC(=O)O)cc1 Amb16231749 [0,1,0,0,0,1|0,0,0]=2 5701 B14R1.698 Cc1ccc(C[C@@H](N)CC(=O)O)cc1 Amb34163822 [0,1,0,0,0,1|0,0,0]=2 5702 B14R1.698 Cc1ccc(C[C@H](N)CC(=O)O)cc1 Amb33726037 [0,1,0,0,0,1|0,0,0]=2 5703 B14R1.698 Cc1ccc(C[C@H](N)CC(=O)O)cc1 Amb34158541 [0,1,0,0,0,1|0,0,0]=2 5704 B14R1.698 Cc1ccc(C\C(Cl)=C\C(=O)O)cc1 Amb27643632 [0,1,0,0,0,1|1,0,1]=4 5705 B14R1.698 Cc1ccc(NC(C)CC(=O)O)cc1 Amb9398652 [0,1,0,0,0,1|2,0,0]=4 5706 B14R1.698 Cc1ccc(OC(C)CC(=O)O)cc1 Amb9397818 [0,1,0,0,0,1|2,0,0]=4 5707 B14R1.698 NC(CC(=O)O)Cc1ccc(Br)cc1 Amb17473597 [0,1,0,0,0,1|0,0,0]=2 5708 B14R1.698 NC(CC(=O)O)Cc1ccc(Cl)cc1 Amb17471486 [0,1,0,0,0,1|0,0,0]=2 5709 B14R1.698 NC(CC(=O)O)Cc1ccc(F)cc1 Amb2697405 [0,1,0,0,0,1|0,0,0]=2 5710 B14R1.698 NC(CC(=O)O)Cc1ccc(I)cc1 Amb33624493 [0,1,0,0,0,1|0,0,0]=2 5711 B14R1.698 NC(CC(=O)O)Cc1ccc(O)cc1 Amb18814153 [0,1,0,0,0,1|0,0,0]=2 5712 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(Br)cc1 Amb33757816 [0,1,0,0,0,1|0,0,0]=2 5713 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(Br)cc1 Amb34903686 [0,1,0,0,0,1|0,0,0]=2 5714 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(Cl)cc1 Amb33725866 [0,1,0,0,0,1|0,0,0]=2 5715 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(Cl)cc1 Amb34912496 [0,1,0,0,0,1|0,0,0]=2 5716 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(F)cc1 Amb17678831 [0,1,0,0,0,1|0,0,0]=2 5717 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(F)cc1 Amb33872113 [0,1,0,0,0,1|0,0,0]=2 5718 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(I)cc1 Amb33726056 [0,1,0,0,0,1|0,0,0]=2 5719 B14R1.698 N[C@@H](CC(=O)O)Cc1ccc(I)cc1 Amb33876778 [0,1,0,0,0,1|0,0,0]=2 5720 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(Br)cc1 Amb16231755 [0,1,0,0,0,1|0,0,0]=2 5721 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(Br)cc1 Amb34153406 [0,1,0,0,0,1|0,0,0]=2 5722 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(Cl)cc1 Amb10603271 [0,1,0,0,0,1|0,0,0]=2 5723 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(Cl)cc1 Amb22745372 [0,1,0,0,0,1|0,0,0]=2 5724 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(F)cc1 Amb16231675 [0,1,0,0,0,1|0,0,0]=2 5725 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(F)cc1 Amb34150776 [0,1,0,0,0,1|0,0,0]=2 5726 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(I)cc1 Amb22746264 [0,1,0,0,0,1|0,0,0]=2 5727 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(I)cc1 Amb31291728 [0,1,0,0,0,1|0,0,0]=2 5728 B14R1.698 N[C@H](CC(=O)O)Cc1ccc(O)cc1 Amb22369425 [0,1,0,0,0,1|0,0,0]=2 5729 B14R1.698 O=C(O)CC(Br)Cc1ccc(Cl)cc1 Amb18628161 [0,1,0,0,0,1|1,0,0]=3 5730 B14R1.698 O=C(O)CC(Br)Cc1ccc(F)cc1 Amb18629098 [0,1,0,0,0,1|1,0,0]=3 5731 B14R1.698 O=C(O)CC(Cl)Cc1ccc(Br)cc1 Amb18111139 [0,1,0,0,0,1|1,0,0]=3 5732 B14R1.698 O=C(O)CC(Cl)Cc1ccc(Cl)cc1 Amb18111140 [0,1,0,0,0,1|1,0,0]=3 5733 B14R1.698 O=C(O)CC(Cl)Cc1ccc(F)cc1 Amb18628471 [0,1,0,0,0,1|1,0,0]=3 5734 B14R1.698 O=C(O)CC(O)Cc1ccc(Br)cc1 Amb17266777 [0,1,0,0,0,1|1,0,0]=3 5735 B14R1.698 O=C(O)CC(O)Cc1ccc(Cl)cc1 Amb17241783 [0,1,0,0,0,1|1,0,0]=3 5736 B14R1.698 O=C(O)CC(O)Cc1ccc(F)cc1 Amb17236719 [0,1,0,0,0,1|1,0,0]=3 5737 B14R1.698 O=C(O)CS(=O)Cc1ccc(Br)cc1 Amb22058852 [0,1,0,0,0,1|2,0,0]=4 5738 B14R1.743 C#CC(=O)NC(C)Cc1ccccc1 Amb35724226 [0,1,0,0,0,1|2,0,0]=4 5739 B14R1.743 CC(Cc1ccccc1)NC(=O)CBr Amb17333679 [0,1,0,0,0,1|2,0,0]=4 5740 B14R1.743 COC(=O)CC(=O)Cc1ccccc1 Amb2689984 [0,1,0,0,0,1|1,0,1]=4 5741 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,1|1,0,0]=3 5742 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,1|1,0,0]=3 5743 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,1|0,0,0]=2 5744 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,1|0,0,0]=2 5745 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719255 [0,1,0,0,0,1|0,0,0]=2 5746 B14R1.743 COC(=O)C[C@@H](N)Cc1ccccc1 Amb32719261 [0,1,0,0,0,1|0,0,0]=2 5747 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719262 [0,1,0,0,0,1|0,0,0]=2 5748 B14R1.743 COC(=O)C[C@H](N)Cc1ccccc1 Amb32719263 [0,1,0,0,0,1|0,0,0]=2 5749 B14R1.743 COC(=O)NC(C)Cc1ccccc1 Amb33552136 [0,1,0,0,0,1|1,0,0]=3 5750 B14R1.743 O=C(CO)NC(=O)Cc1ccccc1 Amb9421519 [0,1,0,0,0,1|1,0,1]=4 5751 B14R1.1485 CC(=O)NC(C)(C)Cc1ccccc1 Amb19517626 [0,1,0,0,0,1|2,0,0]=4 5752 B14R1.1485 CC(C)(CC(=O)O)Cc1ccccc1 Amb17336451 [0,1,0,0,0,1|1,0,0]=3 5753 B14R1.1485 CC(C)(CC(=O)O)Oc1ccccc1 Amb17235912 [0,1,0,0,0,1|2,0,0]=4 5754 B14R1.1485 CC(C)(Cc1ccccc1)NC(=O)Cl Amb35625644 [0,1,0,0,0,1|2,0,0]=4 5755 B14R1.1485 CC(C)(Cc1ccccc1)OC(N)=O Amb24084628 [0,1,0,0,0,1|2,0,0]=4 5756 B14R1.1485 CC(O)(CC(=O)O)Cc1ccccn1 Amb18863974 [0,1,0,0,0,1|2,0,0]=4 5757 B14R1.1485 CC(O)(CC(=O)O)Cc1cccnc1 Amb18863975 [0,1,0,0,0,1|2,0,0]=4 5758 B14R1.1485 CC(O)(CC(=O)O)Cc1ccncc1 Amb18863976 [0,1,0,0,0,1|2,0,0]=4 5759 B14R1.1485 O=C(O)CC(F)(F)Cc1ccccc1 Amb33082114 [0,1,0,0,0,1|1,0,0]=3 5760 B14R1.1485 O=C(O)CS(=O)(=O)Cc1ccccc1 Amb1928151 [0,1,0,0,0,1|2,0,0]=4 5761 B14R1.5978 CC(=O)NC(C)Cc1cccc(S)c1 Amb28047256 [0,1,0,0,0,1|2,0,0]=4 5762 B14R1.5978 CC(C)=CC(N)Cc1cccc(F)c1 Amb28252020 [0,1,0,0,0,1|2,0,0]=4 5763 B14R1.5978 CC(CC(=O)O)Cc1cccc(Br)c1 Amb17265519 [0,1,0,0,0,1|1,0,0]=3 5764 B14R1.5978 CC(CC(=O)O)Cc1cccc(Cl)c1 Amb17241247 [0,1,0,0,0,1|1,0,0]=3 5765 B14R1.5978 CC(CC(=O)O)Cc1cccc(F)c1 Amb19149363 [0,1,0,0,0,1|1,0,0]=3 5766 B14R1.5978 CC(CC(=O)O)Cc1cccc(O)c1 Amb17336809 [0,1,0,0,0,1|1,0,0]=3 5767 B14R1.5978 CC(CC(=O)O)Nc1cccc(Br)c1 Amb9398596 [0,1,0,0,0,1|2,0,0]=4 5768 B14R1.5978 CC(CC(=O)O)Nc1cccc(Cl)c1 Amb9398585 [0,1,0,0,0,1|2,0,0]=4 5769 B14R1.5978 CC(CC(=O)O)Nc1cccc(F)c1 Amb9398587 [0,1,0,0,0,1|2,0,0]=4 5770 B14R1.5978 CC(CC(=O)O)Oc1cccc(Br)c1 Amb9397753 [0,1,0,0,0,1|2,0,0]=4 5771 B14R1.5978 CC(CC(=O)O)Oc1cccc(Cl)c1 Amb9397757 [0,1,0,0,0,1|2,0,0]=4 5772 B14R1.5978 CC(CC(=O)O)Oc1cccc(F)c1 Amb9397764 [0,1,0,0,0,1|2,0,0]=4 5773 B14R1.5978 CC(CC(=O)O)Oc1cccc(O)c1 Amb18813360 [0,1,0,0,0,1|2,0,0]=4 5774 B14R1.5978 CC(Cc1cccc(Cl)c1)NC(N)=O Amb24753672 [0,1,0,0,0,1|2,0,0]=4 5775 B14R1.5978 CN(CC(=O)O)Cc1cccc(Br)c1 Amb9301008 [0,1,0,0,0,1|2,0,0]=4 5776 B14R1.5978 CN(CC(=O)O)Cc1cccc(Cl)c1 Amb9239048 [0,1,0,0,0,1|2,0,0]=4 5777 B14R1.5978 CN(CC(=O)O)Cc1cccc(F)c1 Amb6612442 [0,1,0,0,0,1|2,0,0]=4 5778 B14R1.5978 C\C(=C/C(=O)O)Cc1cccc(Br)c1 Amb17264234 [0,1,0,0,0,1|1,0,1]=4 5779 B14R1.5978 C\C(=C/C(=O)O)Cc1cccc(C)c1 Amb17234897 [0,1,0,0,0,1|1,0,1]=4 5780 B14R1.5978 C\C(=C/C(=O)O)Cc1cccc(Cl)c1 Amb17240733 [0,1,0,0,0,1|1,0,1]=4 5781 B14R1.5978 C\C(=C\C(=O)O)Cc1cccc(F)c1 Amb28289885 [0,1,0,0,0,1|1,0,1]=4 5782 B14R1.5978 Cc1cccc(CC(C)CC(=O)O)c1 Amb615779 [0,1,0,0,0,1|1,0,0]=3 5783 B14R1.5978 Cc1cccc(CC(N)CC(=O)O)c1 Amb17470844 [0,1,0,0,0,1|0,0,0]=2 5784 B14R1.5978 Cc1cccc(CC(O)CC(=O)O)c1 Amb17235899 [0,1,0,0,0,1|1,0,0]=3 5785 B14R1.5978 Cc1cccc(CN(C)CC(=O)O)c1 Amb9301010 [0,1,0,0,0,1|2,0,0]=4 5786 B14R1.5978 Cc1cccc(C[C@@H](N)CC(=O)O)c1 Amb16231754 [0,1,0,0,0,1|0,0,0]=2 5787 B14R1.5978 Cc1cccc(C[C@H](N)CC(=O)O)c1 Amb33726034 [0,1,0,0,0,1|0,0,0]=2 5788 B14R1.5978 Cc1cccc(NC(C)CC(=O)O)c1 Amb9398379 [0,1,0,0,0,1|2,0,0]=4 5789 B14R1.5978 Cc1cccc(OC(C)CC(=O)O)c1 Amb9397745 [0,1,0,0,0,1|2,0,0]=4 5790 B14R1.5978 NC(CC(=O)O)Cc1cccc(Br)c1 Amb17473593 [0,1,0,0,0,1|0,0,0]=2 5791 B14R1.5978 NC(CC(=O)O)Cc1cccc(Cl)c1 Amb17471482 [0,1,0,0,0,1|0,0,0]=2 5792 B14R1.5978 NC(CC(=O)O)Cc1cccc(F)c1 Amb17470961 [0,1,0,0,0,1|0,0,0]=2 5793 B14R1.5978 NC(CC(=O)O)Cc1cccc(O)c1 Amb18814152 [0,1,0,0,0,1|0,0,0]=2 5794 B14R1.5978 N[C@@H](CC(=O)O)Cc1cccc(Cl)c1 Amb33757813 [0,1,0,0,0,1|0,0,0]=2 5795 B14R1.5978 N[C@@H](CC(=O)O)Cc1cccc(F)c1 Amb33813238 [0,1,0,0,0,1|0,0,0]=2 5796 B14R1.5978 N[C@H](CC(=O)O)Cc1cccc(Cl)c1 Amb16231757 [0,1,0,0,0,1|0,0,0]=2 5797 B14R1.5978 N[C@H](CC(=O)O)Cc1cccc(Cl)c1 Amb22747011 [0,1,0,0,0,1|0,0,0]=2 5798 B14R1.5978 N[C@H](CC(=O)O)Cc1cccc(F)c1 Amb16231652 [0,1,0,0,0,1|0,0,0]=2 5799 B14R1.5978 O=C(O)CC(O)Cc1cccc(Br)c1 Amb17266776 [0,1,0,0,0,1|1,0,0]=3 5800 B14R1.5978 O=C(O)CC(O)Cc1cccc(Cl)c1 Amb17241782 [0,1,0,0,0,1|1,0,0]=3 5801 B14R1.161 C=C(CNc1ccccc1C)C(=O)O Amb27183743 [0,1,0,0,0,1|1,0,1]=4 5802 B14R1.161 C=C(CNc1ccccc1I)C(=O)O Amb28044258 [0,1,0,0,0,1|1,0,1]=4 5803 B14R1.161 CC(=O)C(C)SCc1ccccc1C Amb32683000 [0,1,0,0,0,1|2,0,0]=4 5804 B14R1.161 CC(=O)C(C)SCc1ccccc1Cl Amb32682997 [0,1,0,0,0,1|2,0,0]=4 5805 B14R1.161 CC(CCc1ccccc1Br)C(=O)O Amb33242614 [0,1,0,0,0,1|1,0,0]=3 5806 B14R1.161 CC(CCc1ccccc1Cl)C(=O)O Amb17241241 [0,1,0,0,0,1|1,0,0]=3 5807 B14R1.161 CC(CCc1ccccc1F)C(=O)O Amb17236370 [0,1,0,0,0,1|1,0,0]=3 5808 B14R1.161 CC(CCc1ccccc1O)C(=O)O Amb33474659 [0,1,0,0,0,1|1,0,0]=3 5809 B14R1.161 CC(CCc1cccnc1Br)C(=O)O Amb33388134 [0,1,0,0,0,1|2,0,0]=4 5810 B14R1.161 CC(CCc1cccnc1Cl)C(=O)O Amb33257655 [0,1,0,0,0,1|2,0,0]=4 5811 B14R1.161 CC(CCc1cccnc1F)C(=O)O Amb33377140 [0,1,0,0,0,1|2,0,0]=4 5812 B14R1.161 CC(CCc1ccncc1Br)C(=O)O Amb33478367 [0,1,0,0,0,1|2,0,0]=4 5813 B14R1.161 CC(CCc1ccncc1Cl)C(=O)O Amb33052710 [0,1,0,0,0,1|2,0,0]=4 5814 B14R1.161 CC(CCc1ccncc1F)C(=O)O Amb33316816 [0,1,0,0,0,1|2,0,0]=4 5815 B14R1.161 CC(CCc1ncccc1Br)C(=O)O Amb33241227 [0,1,0,0,0,1|2,0,0]=4 5816 B14R1.161 CC(CCc1ncccc1F)C(=O)O Amb33418422 [0,1,0,0,0,1|2,0,0]=4 5817 B14R1.161 CC(CNc1ccccc1Br)C(=O)O Amb9400478 [0,1,0,0,0,1|1,0,0]=3 5818 B14R1.161 CC(CNc1ccccc1Br)C(N)=O Amb8944663 [0,1,0,0,0,1|2,0,0]=4 5819 B14R1.161 CC(CNc1ccccc1Cl)C(=O)O Amb9400486 [0,1,0,0,0,1|1,0,0]=3 5820 B14R1.161 CC(CNc1ccccc1Cl)C(N)=O Amb8944667 [0,1,0,0,0,1|2,0,0]=4 5821 B14R1.161 CC(CNc1ccccc1F)C(=O)O Amb9400490 [0,1,0,0,0,1|1,0,0]=3 5822 B14R1.161 CC(CNc1ccccc1F)C(N)=O Amb8944670 [0,1,0,0,0,1|2,0,0]=4 5823 B14R1.161 CC(CNc1ccccc1I)C(=O)O Amb9400582 [0,1,0,0,0,1|1,0,0]=3 5824 B14R1.161 CC(CNc1ccccc1I)C(N)=O Amb8944727 [0,1,0,0,0,1|2,0,0]=4 5825 B14R1.161 CC(CNc1ccccc1O)C(=O)O Amb2677329 [0,1,0,0,0,1|1,0,0]=3 5826 B14R1.161 CC(CNc1cccnc1Cl)C(=O)O Amb18607785 [0,1,0,0,0,1|2,0,0]=4 5827 B14R1.161 CC(CNc1ccncc1F)C(=O)O Amb30036430 [0,1,0,0,0,1|2,0,0]=4 5828 B14R1.161 CC(COc1ccccc1Br)C(=O)O Amb9399787 [0,1,0,0,0,1|1,0,0]=3 5829 B14R1.161 CC(COc1ccccc1Br)C(N)=O Amb8944785 [0,1,0,0,0,1|2,0,0]=4 5830 B14R1.161 CC(COc1ccccc1Cl)C(=O)O Amb9399498 [0,1,0,0,0,1|1,0,0]=3 5831 B14R1.161 CC(COc1ccccc1Cl)C(N)=O Amb17241549 [0,1,0,0,0,1|2,0,0]=4 5832 B14R1.161 CC(COc1ccccc1F)C(=O)O Amb9399487 [0,1,0,0,0,1|1,0,0]=3 5833 B14R1.161 CC(COc1ccccc1F)C(N)=O Amb17236551 [0,1,0,0,0,1|2,0,0]=4 5834 B14R1.161 CC(NCc1ccccc1Cl)C(=O)O Amb1110092 [0,1,0,0,0,1|1,0,0]=3 5835 B14R1.161 CC(NCc1ccccc1Cl)C(=O)O Amb33545133 [0,1,0,0,0,1|1,0,0]=3 5836 B14R1.161 CC(NCc1ccccc1F)C(=O)O Amb9326928 [0,1,0,0,0,1|1,0,0]=3 5837 B14R1.161 CC(SCc1ccccc1Cl)C(=O)O Amb6260201 [0,1,0,0,0,1|1,0,0]=3 5838 B14R1.161 CC(SCc1ccccc1F)C(=O)O Amb6275185 [0,1,0,0,0,1|1,0,0]=3 5839 B14R1.161 CC(\N=C\c1ccccc1O)C(=O)O Amb26431471 [0,1,0,0,0,1|1,0,1]=4 5840 B14R1.161 C[C@H](\N=C\c1ccccc1O)C(=O)O Amb27262859 [0,1,0,0,0,1|1,0,1]=4 5841 B14R1.161 Cc1ccccc1CCC(C)C(=O)O Amb17235378 [0,1,0,0,0,1|1,0,0]=3 5842 B14R1.161 Cc1ccccc1CCC(N)C(=O)O Amb17470839 [0,1,0,0,0,1|0,0,0]=2 5843 B14R1.161 Cc1ccccc1CC[C@@H](N)C(=O)O Amb34155896 [0,1,0,0,0,1|0,0,0]=2 5844 B14R1.161 Cc1ccccc1CC[C@H](N)C(=O)O Amb34157699 [0,1,0,0,0,1|0,0,0]=2 5845 B14R1.161 Cc1ccccc1CNC(=O)C(=O)O Amb17048336 [0,1,0,0,0,1|1,0,1]=4 5846 B14R1.161 Cc1ccccc1CNC(C)C(=O)O Amb9326977 [0,1,0,0,0,1|1,0,0]=3 5847 B14R1.161 Cc1ccccc1COC(C)C(=O)O Amb28653439 [0,1,0,0,0,1|1,0,0]=3 5848 B14R1.161 Cc1ccccc1CSC(C)C(=O)O Amb6261296 [0,1,0,0,0,1|1,0,0]=3 5849 B14R1.161 Cc1ccccc1NCC(C)C(=O)O Amb9400534 [0,1,0,0,0,1|1,0,0]=3 5850 B14R1.161 Cc1ccccc1NCC(C)C(N)=O Amb8944697 [0,1,0,0,0,1|2,0,0]=4 5851 B14R1.161 Cc1ccccc1NCC(N)C(N)=O Amb27601134 [0,1,0,0,0,1|1,0,0]=3 5852 B14R1.161 Cc1ccccc1OCC(C)C(=O)O Amb9399549 [0,1,0,0,0,1|1,0,0]=3 5853 B14R1.161 Cc1ccccc1OCC(C)C(N)=O Amb17235638 [0,1,0,0,0,1|2,0,0]=4 5854 B14R1.161 Cc1ccccc1OCC(O)C(=O)O Amb6315901 [0,1,0,0,0,1|1,0,0]=3 5855 B14R1.161 Cc1cccnc1CCC(C)C(=O)O Amb33361013 [0,1,0,0,0,1|2,0,0]=4 5856 B14R1.161 Cc1cccnc1NCC(C)C(=O)O Amb18605145 [0,1,0,0,0,1|2,0,0]=4 5857 B14R1.161 Cc1ccncc1CCC(C)C(=O)O Amb33375283 [0,1,0,0,0,1|2,0,0]=4 5858 B14R1.161 Cc1cnccc1CCC(C)C(=O)O Amb33372286 [0,1,0,0,0,1|2,0,0]=4 5859 B14R1.161 Cc1cnccc1NCC(C)C(=O)O Amb27235761 [0,1,0,0,0,1|2,0,0]=4 5860 B14R1.161 Cc1ncccc1CCC(C)C(=O)O Amb32878338 [0,1,0,0,0,1|2,0,0]=4 5861 B14R1.161 NC(=O)C(N)CNc1ccccc1Cl Amb28041765 [0,1,0,0,0,1|1,0,0]=3 5862 B14R1.161 NC(=O)C(O)CNc1ccccc1N Amb28325440 [0,1,0,0,0,1|2,0,0]=4 5863 B14R1.161 NC(CCc1ccccc1Br)C(=O)O Amb17473600 [0,1,0,0,0,1|0,0,0]=2 5864 B14R1.161 NC(CCc1ccccc1Cl)C(=O)O Amb17471477 [0,1,0,0,0,1|0,0,0]=2 5865 B14R1.161 NC(CCc1ccccc1F)C(=O)O Amb17470953 [0,1,0,0,0,1|0,0,0]=2 5866 B14R1.161 NC(CCc1ccccc1O)C(=O)O Amb33802215 [0,1,0,0,0,1|0,0,0]=2 5867 B14R1.161 N[C@@H](CCc1ccccc1Cl)C(=O)O Amb33802149 [0,1,0,0,0,1|0,0,0]=2 5868 B14R1.161 N[C@@H](CCc1ccccc1F)C(=O)O Amb34199376 [0,1,0,0,0,1|0,0,0]=2 5869 B14R1.161 N[C@H](CCc1ccccc1F)C(=O)O Amb34198908 [0,1,0,0,0,1|0,0,0]=2 5870 B14R1.161 Nc1ccccc1\C=C\C(N)C(=O)O Amb27252346 [0,1,0,0,0,1|0,0,1]=3 5871 B14R1.161 O=C(O)C(=O)NCc1ccccc1Cl Amb9303873 [0,1,0,0,0,1|1,0,1]=4 5872 B14R1.161 O=C(O)C(=O)NCc1ccccc1F Amb9303988 [0,1,0,0,0,1|1,0,1]=4 5873 B14R1.415 C=C(CC(=O)c1ccccc1)C(=O)O Amb17594937 [0,1,0,0,0,1|1,0,1]=4 5874 B14R1.415 CC(CC(=O)C(=O)O)c1ccccc1 Amb32952376 [0,1,0,0,0,1|1,0,1]=4 5875 B14R1.415 CC(CC(=O)c1ccccc1)C(=O)O Amb3939945 [0,1,0,0,0,1|1,0,0]=3 5876 B14R1.415 CC(CC(=O)c1ccccn1)C(=O)O Amb17336551 [0,1,0,0,0,1|2,0,0]=4 5877 B14R1.415 CC(CC(=O)c1cccnc1)C(=O)O Amb17235562 [0,1,0,0,0,1|2,0,0]=4 5878 B14R1.415 CC(CC(=O)c1ccncc1)C(=O)O Amb17336556 [0,1,0,0,0,1|2,0,0]=4 5879 B14R1.415 CC(CC(C)c1ccccc1)C(=O)O Amb32954180 [0,1,0,0,0,1|1,0,0]=3 5880 B14R1.415 CC(CC(N)C(=O)O)c1ccccc1 Amb2696732 [0,1,0,0,0,1|0,0,0]=2 5881 B14R1.415 CC(CC(N)C(=O)O)c1ccccc1 Amb31156574 [0,1,0,0,0,1|0,0,0]=2 5882 B14R1.415 CC(CC(O)C(=O)O)c1ccccc1 Amb18324723 [0,1,0,0,0,1|1,0,0]=3 5883 B14R1.415 CC(CN(C)c1ccccc1)C(=O)O Amb17336619 [0,1,0,0,0,1|1,0,0]=3 5884 B14R1.415 CC(CN(C)c1ccccc1)C(N)=O Amb17235455 [0,1,0,0,0,1|2,0,0]=4 5885 B14R1.415 CC(C[C@@H](C)C(=O)O)c1ccccc1 Amb33749393 [0,1,0,0,0,1|1,0,0]=3 5886 B14R1.415 CC(C[C@H](C)C(=O)O)c1ccccc1 Amb33749517 [0,1,0,0,0,1|1,0,0]=3 5887 B14R1.415 CC(NC(=N)c1ccccc1)C(=O)O Amb27596973 [0,1,0,0,0,1|1,0,1]=4 5888 B14R1.415 CC(NC(=O)C(=O)O)c1ccccc1 Amb9303789 [0,1,0,0,0,1|1,0,1]=4 5889 B14R1.415 CC(NC(=O)c1ccccc1)C(=O)O Amb2499734 [0,1,0,0,0,1|1,0,1]=4 5890 B14R1.415 CC(NC(=S)c1ccccc1)C(=O)O Amb2608993 [0,1,0,0,0,1|1,0,1]=4 5891 B14R1.415 CC(NC(C)c1ccccc1)C(=O)O Amb17401788 [0,1,0,0,0,1|1,0,0]=3 5892 B14R1.415 CC(NC(C)c1ccccc1)C(=O)O Amb24271459 [0,1,0,0,0,1|1,0,0]=3 5893 B14R1.415 CC(SC(C)c1ccccc1)C(=O)O Amb17501620 [0,1,0,0,0,1|1,0,0]=3 5894 B14R1.415 CC(\C=C(\F)C(=O)O)c1ccccc1 Amb28143246 [0,1,0,0,0,1|1,0,1]=4 5895 B14R1.415 CN(CC(N)C(=O)O)c1ccccc1 Amb19079990 [0,1,0,0,0,1|0,0,0]=2 5896 B14R1.415 CN(CC(N)C(=O)O)c1ccccc1 Amb33292428 [0,1,0,0,0,1|0,0,0]=2 5897 B14R1.415 C[C@@H](NC(=O)c1ccccc1)C(=O)O Amb3940750 [0,1,0,0,0,1|1,0,1]=4 5898 B14R1.415 C[C@H](NC(=O)c1ccccc1)C(=O)O Amb1206930 [0,1,0,0,0,1|1,0,1]=4 5899 B14R1.415 C\C(=C/C(O)C(=O)O)c1ccccc1 Amb18651099 [0,1,0,0,0,1|1,0,1]=4 5900 B14R1.415 C\C(=C\C(C)c1ccccc1)C(=O)O Amb27824410 [0,1,0,0,0,1|1,0,1]=4 5901 B14R1.415 NC(CC(=O)c1ccccc1)C(=O)O Amb17470829 [0,1,0,0,0,1|0,0,0]=2 5902 B14R1.415 NC(CC(=O)c1ccccc1)C(=O)O Amb6383360 [0,1,0,0,0,1|0,0,0]=2 5903 B14R1.415 NC(CC(O)c1ccccc1)C(=O)O Amb28750788 [0,1,0,0,0,1|0,0,0]=2 5904 B14R1.415 NC(CC(O)c1ccccc1)C(=O)O Amb32686917 [0,1,0,0,0,1|0,0,0]=2 5905 B14R1.415 NC(NC(=O)c1ccccc1)C(=O)O Amb27659493 [0,1,0,0,0,1|0,0,1]=3 5906 B14R1.415 N[C@@H](CC(=O)c1ccccc1)C(=O)O Amb23403688 [0,1,0,0,0,1|0,0,0]=2 5907 B14R1.415 O=C(NC(Cl)C(=O)O)c1ccccc1 Amb27751275 [0,1,0,0,0,1|1,0,1]=4 5908 B14R1.415 O=C(NC(O)C(=O)O)c1ccccc1 Amb2719809 [0,1,0,0,0,1|1,0,1]=4 5909 B14R1.415 O=C(N[C@@H](O)C(=O)O)c1ccccc1 Amb24521905 [0,1,0,0,0,1|1,0,1]=4 5910 B14R1.415 O=C(O)C(=O)CC(=O)c1ccccc1 Amb1102273 [0,1,0,0,0,1|1,0,1]=4 5911 B14R1.679 C=C(CCc1ccc(Br)cc1)C(=O)O Amb33332211 [0,1,0,0,0,1|1,0,1]=4 5912 B14R1.679 C=C(CCc1ccc(F)cc1)C(=O)O Amb33319647 [0,1,0,0,0,1|1,0,1]=4 5913 B14R1.679 C=C(CNc1ccc(C)cc1)C(=O)O Amb28041733 [0,1,0,0,0,1|1,0,1]=4 5914 B14R1.679 C=C(CNc1ccc(Cl)cc1)C(=O)O Amb27628535 [0,1,0,0,0,1|1,0,1]=4 5915 B14R1.679 CC(=O)C(C)CNc1ccc(C)cc1 Amb27231699 [0,1,0,0,0,1|2,0,0]=4 5916 B14R1.679 CC(=O)C(C)SCc1ccc(Cl)cc1 Amb32682998 [0,1,0,0,0,1|2,0,0]=4 5917 B14R1.679 CC(=O)C(C)SCc1ccc(N)cc1 Amb17498400 [0,1,0,0,0,1|2,0,0]=4 5918 B14R1.679 CC(CCc1ccc(Br)cc1)C(=O)O Amb17265518 [0,1,0,0,0,1|1,0,0]=3 5919 B14R1.679 CC(CCc1ccc(Br)cn1)C(=O)O Amb33242780 [0,1,0,0,0,1|2,0,0]=4 5920 B14R1.679 CC(CCc1ccc(Br)nc1)C(=O)O Amb33388894 [0,1,0,0,0,1|2,0,0]=4 5921 B14R1.679 CC(CCc1ccc(Cl)cc1)C(=O)O Amb17241243 [0,1,0,0,0,1|1,0,0]=3 5922 B14R1.679 CC(CCc1ccc(Cl)cn1)C(=O)O Amb33223977 [0,1,0,0,0,1|2,0,0]=4 5923 B14R1.679 CC(CCc1ccc(Cl)nc1)C(=O)O Amb33261667 [0,1,0,0,0,1|2,0,0]=4 5924 B14R1.679 CC(CCc1ccc(F)cc1)C(=O)O Amb17236371 [0,1,0,0,0,1|1,0,0]=3 5925 B14R1.679 CC(CCc1ccc(F)cn1)C(=O)O Amb33315555 [0,1,0,0,0,1|2,0,0]=4 5926 B14R1.679 CC(CCc1ccc(F)nc1)C(=O)O Amb33425139 [0,1,0,0,0,1|2,0,0]=4 5927 B14R1.679 CC(CCc1ccc(O)cc1)C(=O)O Amb17336808 [0,1,0,0,0,1|1,0,0]=3 5928 B14R1.679 CC(CNc1ccc(Br)cc1)C(=O)O Amb9400480 [0,1,0,0,0,1|1,0,0]=3 5929 B14R1.679 CC(CNc1ccc(Br)cc1)C(N)=O Amb8944664 [0,1,0,0,0,1|2,0,0]=4 5930 B14R1.679 CC(CNc1ccc(Cl)cc1)C(=O)O Amb9400472 [0,1,0,0,0,1|1,0,0]=3 5931 B14R1.679 CC(CNc1ccc(Cl)cc1)C(N)=O Amb8944660 [0,1,0,0,0,1|2,0,0]=4 5932 B14R1.679 CC(CNc1ccc(Cl)cn1)C(=O)O Amb18095614 [0,1,0,0,0,1|2,0,0]=4 5933 B14R1.679 CC(CNc1ccc(F)cc1)C(=O)O Amb9400484 [0,1,0,0,0,1|1,0,0]=3 5934 B14R1.679 CC(CNc1ccc(F)cc1)C(N)=O Amb8944666 [0,1,0,0,0,1|2,0,0]=4 5935 B14R1.679 CC(COc1ccc(Br)cc1)C(=O)O Amb9399492 [0,1,0,0,0,1|1,0,0]=3 5936 B14R1.679 CC(COc1ccc(Br)cc1)C(N)=O Amb8944783 [0,1,0,0,0,1|2,0,0]=4 5937 B14R1.679 CC(COc1ccc(Cl)cc1)C(=O)O Amb9399503 [0,1,0,0,0,1|1,0,0]=3 5938 B14R1.679 CC(COc1ccc(Cl)cc1)C(N)=O Amb17241554 [0,1,0,0,0,1|2,0,0]=4 5939 B14R1.679 CC(COc1ccc(F)cc1)C(=O)O Amb9399555 [0,1,0,0,0,1|1,0,0]=3 5940 B14R1.679 CC(COc1ccc(F)cc1)C(N)=O Amb17236557 [0,1,0,0,0,1|2,0,0]=4 5941 B14R1.679 CC(CSc1ccc(Cl)cc1)C(=O)O Amb2725717 [0,1,0,0,0,1|1,0,0]=3 5942 B14R1.679 CC(CSc1ccc(F)cc1)C(=O)O Amb9400061 [0,1,0,0,0,1|1,0,0]=3 5943 B14R1.679 CC(NCc1ccc(Br)cc1)C(=O)O Amb9327074 [0,1,0,0,0,1|1,0,0]=3 5944 B14R1.679 CC(NCc1ccc(Cl)cc1)C(=O)O Amb9326951 [0,1,0,0,0,1|1,0,0]=3 5945 B14R1.679 CC(NCc1ccc(F)cc1)C(=O)O Amb1110539 [0,1,0,0,0,1|1,0,0]=3 5946 B14R1.679 CC(OCc1ccc(F)cc1)C(=O)O Amb32662552 [0,1,0,0,0,1|1,0,0]=3 5947 B14R1.679 CC(SCc1ccc(Br)cc1)C(=O)O Amb43701 [0,1,0,0,0,1|1,0,0]=3 5948 B14R1.679 CC(SCc1ccc(Cl)cc1)C(=O)O Amb2101263 [0,1,0,0,0,1|1,0,0]=3 5949 B14R1.679 CC(SCc1ccc(F)cc1)C(=O)O Amb6263898 [0,1,0,0,0,1|1,0,0]=3 5950 B14R1.679 CC(SCc1ccc(N)cc1)C(=O)O Amb17497539 [0,1,0,0,0,1|1,0,0]=3 5951 B14R1.679 CC(\C=C\c1ccc(F)cc1)C(=O)O Amb33224457 [0,1,0,0,0,1|1,0,1]=4 5952 B14R1.679 C[C@@H](CCc1ccc(F)cc1)C(=O)O Amb33729772 [0,1,0,0,0,1|1,0,0]=3 5953 B14R1.679 C[C@H](CCc1ccc(F)cc1)C(=O)O Amb33729602 [0,1,0,0,0,1|1,0,0]=3 5954 B14R1.679 C[C@H](NCc1ccc(Cl)cc1)C(=O)O Amb32652253 [0,1,0,0,0,1|1,0,0]=3 5955 B14R1.679 C[C@H](\N=C\c1ccc(F)cc1)C(=O)O Amb27477826 [0,1,0,0,0,1|1,0,1]=4 5956 B14R1.679 Cc1ccc(CCC(C)C(=O)O)cc1 Amb17235380 [0,1,0,0,0,1|1,0,0]=3 5957 B14R1.679 Cc1ccc(CCC(C)C(=O)O)cn1 Amb32877418 [0,1,0,0,0,1|2,0,0]=4 5958 B14R1.679 Cc1ccc(CCC(C)C(=O)O)nc1 Amb33200235 [0,1,0,0,0,1|2,0,0]=4 5959 B14R1.679 Cc1ccc(CCC(N)C(=O)O)cc1 Amb17470847 [0,1,0,0,0,1|0,0,0]=2 5960 B14R1.679 Cc1ccc(CC[C@@H](C)C(=O)O)cc1 Amb33726951 [0,1,0,0,0,1|1,0,0]=3 5961 B14R1.679 Cc1ccc(CC[C@@H](N)C(=O)O)cc1 Amb32406295 [0,1,0,0,0,1|0,0,0]=2 5962 B14R1.679 Cc1ccc(CC[C@H](C)C(=O)O)cc1 Amb33729770 [0,1,0,0,0,1|1,0,0]=3 5963 B14R1.679 Cc1ccc(CC[C@H](N)C(=O)O)cc1 Amb33802147 [0,1,0,0,0,1|0,0,0]=2 5964 B14R1.679 Cc1ccc(CNC(=O)C(=O)O)cc1 Amb9304006 [0,1,0,0,0,1|1,0,1]=4 5965 B14R1.679 Cc1ccc(CNC(C)C(=O)O)cc1 Amb9326981 [0,1,0,0,0,1|1,0,0]=3 5966 B14R1.679 Cc1ccc(COC(C)C(=O)O)cc1 Amb28653438 [0,1,0,0,0,1|1,0,0]=3 5967 B14R1.679 Cc1ccc(CSC(C)C(=O)O)cc1 Amb6276784 [0,1,0,0,0,1|1,0,0]=3 5968 B14R1.679 Cc1ccc(NCC(C)C(=O)O)cc1 Amb9400528 [0,1,0,0,0,1|1,0,0]=3 5969 B14R1.679 Cc1ccc(NCC(C)C(=O)O)nc1 Amb18607812 [0,1,0,0,0,1|2,0,0]=4 5970 B14R1.679 Cc1ccc(NCC(C)C(N)=O)cc1 Amb8944694 [0,1,0,0,0,1|2,0,0]=4 5971 B14R1.679 Cc1ccc(NCC(N)C(=O)O)cc1 Amb27601630 [0,1,0,0,0,1|0,0,0]=2 5972 B14R1.679 Cc1ccc(NCC(N)C(N)=O)cc1 Amb27495086 [0,1,0,0,0,1|1,0,0]=3 5973 B14R1.679 Cc1ccc(NNC(C)C(=O)O)cc1 Amb27433892 [0,1,0,0,0,1|2,0,0]=4 5974 B14R1.679 Cc1ccc(OCC(C)C(=O)O)cc1 Amb9399756 [0,1,0,0,0,1|1,0,0]=3 5975 B14R1.679 Cc1ccc(OCC(C)C(N)=O)cc1 Amb17235642 [0,1,0,0,0,1|2,0,0]=4 5976 B14R1.679 NC(=O)C(N)CCc1ccc(Br)cc1 Amb31030968 [0,1,0,0,0,1|1,0,0]=3 5977 B14R1.679 NC(=O)C(N)CNc1ccc(Br)cc1 Amb28142740 [0,1,0,0,0,1|1,0,0]=3 5978 B14R1.679 NC(=O)C(N)CNc1ccc(Cl)cc1 Amb27183745 [0,1,0,0,0,1|1,0,0]=3 5979 B14R1.679 NC(=O)C(N)CNc1ccc(F)cc1 Amb27183819 [0,1,0,0,0,1|1,0,0]=3 5980 B14R1.679 NC(CCc1ccc(Br)cc1)C(=O)O Amb17473596 [0,1,0,0,0,1|0,0,0]=2 5981 B14R1.679 NC(CCc1ccc(Cl)cc1)C(=O)O Amb17471485 [0,1,0,0,0,1|0,0,0]=2 5982 B14R1.679 NC(CCc1ccc(F)cc1)C(=O)O Amb17470957 [0,1,0,0,0,1|0,0,0]=2 5983 B14R1.679 NC(CCc1ccc(O)cc1)C(=O)O Amb24087709 [0,1,0,0,0,1|0,0,0]=2 5984 B14R1.679 NC(CNc1ccc(Cl)cc1)C(=O)O Amb28410204 [0,1,0,0,0,1|0,0,0]=2 5985 B14R1.679 NC(CNc1ccc(F)cc1)C(=O)O Amb27880253 [0,1,0,0,0,1|0,0,0]=2 5986 B14R1.679 NC(CNc1ccc(I)cc1)C(=O)O Amb28192472 [0,1,0,0,0,1|0,0,0]=2 5987 B14R1.679 NC(CNc1ccc(O)cc1)C(=O)O Amb28132751 [0,1,0,0,0,1|0,0,0]=2 5988 B14R1.679 NC(\C=C\c1ccc(F)cc1)C(=O)O Amb33326913 [0,1,0,0,0,1|0,0,1]=3 5989 B14R1.679 N[C@@H](CCc1ccc(Br)cc1)C(=O)O Amb34157847 [0,1,0,0,0,1|0,0,0]=2 5990 B14R1.679 N[C@@H](CCc1ccc(Cl)cc1)C(=O)O Amb33802175 [0,1,0,0,0,1|0,0,0]=2 5991 B14R1.679 N[C@@H](CCc1ccc(F)cc1)C(=O)O Amb33802144 [0,1,0,0,0,1|0,0,0]=2 5992 B14R1.679 N[C@@H](CCc1ccc(O)cc1)C(=O)O Amb2699238 [0,1,0,0,0,1|0,0,0]=2 5993 B14R1.679 N[C@@H](CCc1ccc(O)cc1)C(=O)O Amb8390373 [0,1,0,0,0,1|0,0,0]=2 5994 B14R1.679 N[C@@H](CNc1ccc(O)cc1)C(=O)O Amb27410860 [0,1,0,0,0,1|0,0,0]=2 5995 B14R1.679 N[C@H](CCc1ccc(Br)cc1)C(=O)O Amb34912485 [0,1,0,0,0,1|0,0,0]=2 5996 B14R1.679 N[C@H](CCc1ccc(Cl)cc1)C(=O)O Amb33802148 [0,1,0,0,0,1|0,0,0]=2 5997 B14R1.679 N[C@H](CCc1ccc(F)cc1)C(=O)O Amb33802135 [0,1,0,0,0,1|0,0,0]=2 5998 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(=O)O Amb16183943 [0,1,0,0,0,1|0,0,0]=2 5999 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(=O)O Amb24099406 [0,1,0,0,0,1|0,0,0]=2 6000 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(=O)O Amb33756800 [0,1,0,0,0,1|0,0,0]=2 6001 B14R1.679 Nc1ccc(SCC(N)C(=O)O)cc1 Amb32660855 [0,1,0,0,0,1|0,0,0]=2 6002 B14R1.679 O=C(O)C(=O)CCc1ccc(Br)cc1 Amb18692650 [0,1,0,0,0,1|1,0,1]=4 6003 B14R1.679 O=C(O)C(=O)CCc1ccc(Cl)cc1 Amb17508703 [0,1,0,0,0,1|1,0,1]=4 6004 B14R1.679 O=C(O)C(=O)NCc1ccc(Br)cc1 Amb17415233 [0,1,0,0,0,1|1,0,1]=4 6005 B14R1.679 O=C(O)C(=O)NCc1ccc(Cl)cc1 Amb9303760 [0,1,0,0,0,1|1,0,1]=4 6006 B14R1.679 O=C(O)C(=O)NCc1ccc(F)cc1 Amb9303983 [0,1,0,0,0,1|1,0,1]=4 6007 B14R1.679 O=C(O)C(=O)NCc1ccc(O)cc1 Amb27979421 [0,1,0,0,0,1|1,0,1]=4 6008 B14R1.679 O=C(O)C(O)CCc1ccc(Br)cc1 Amb33332177 [0,1,0,0,0,1|1,0,0]=3 6009 B14R1.679 O=C(O)C(O)CCc1ccc(F)cc1 Amb33474993 [0,1,0,0,0,1|1,0,0]=3 6010 B14R1.679 O=C(O)C(O)CNc1ccc(I)cc1 Amb27602850 [0,1,0,0,0,1|1,0,0]=3 6011 B14R1.679 O=C(O)C(O)CNc1ccc(O)cc1 Amb27401932 [0,1,0,0,0,1|1,0,0]=3 6012 B14R1.679 O=C(O)C(O)\C=C\c1ccc(F)cc1 Amb33326725 [0,1,0,0,0,1|1,0,1]=4 6013 B14R1.679 O=C(O)[C@H](O)\C=C\c1ccc(Cl)cc1 Amb27392209 [0,1,0,0,0,1|1,0,1]=4 6014 B14R1.756 CC(SCc1ccccc1)C(=O)NN Amb6773973 [0,1,0,0,0,1|2,0,0]=4 6015 B14R1.756 CCC(=O)C(C)OCc1ccccc1 Amb25708039 [0,1,0,0,0,1|2,0,0]=4 6016 B14R1.756 CCC(=O)C(C)SCc1ccccc1 Amb32683030 [0,1,0,0,0,1|2,0,0]=4 6017 B14R1.756 CN(CCc1ccccc1)C(=O)CO Amb17401768 [0,1,0,0,0,1|2,0,0]=4 6018 B14R1.756 CNC(=O)C(C)OCc1ccccc1 Amb28340850 [0,1,0,0,0,1|2,0,0]=4 6019 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,1|1,0,0]=3 6020 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,1|1,0,0]=3 6021 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,1|1,0,0]=3 6022 B14R1.756 COC(=O)C(C)NCc1ccccn1 Amb19042488 [0,1,0,0,0,1|2,0,0]=4 6023 B14R1.756 COC(=O)C(C)NCc1cccnc1 Amb19042487 [0,1,0,0,0,1|2,0,0]=4 6024 B14R1.756 COC(=O)C(C)OCc1ccccc1 Amb2699315 [0,1,0,0,0,1|1,0,0]=3 6025 B14R1.756 COC(=O)C(C)\N=C\c1ccccc1 Amb2426902 [0,1,0,0,0,1|1,0,1]=4 6026 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb19042065 [0,1,0,0,0,1|0,0,0]=2 6027 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,1|0,0,0]=2 6028 B14R1.756 COC(=O)C(N)CCc1ccccn1 Amb33736468 [0,1,0,0,0,1|1,0,0]=3 6029 B14R1.756 COC(=O)C(N)CCc1ccncc1 Amb33746371 [0,1,0,0,0,1|1,0,0]=3 6030 B14R1.756 COC(=O)C(N)COc1cccnc1 Amb22643009 [0,1,0,0,0,1|1,0,0]=3 6031 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb22642641 [0,1,0,0,0,1|0,0,0]=2 6032 B14R1.756 COC(=O)C(N)CSc1ccccc1 Amb32662448 [0,1,0,0,0,1|0,0,0]=2 6033 B14R1.756 COC(=O)C(N)CSc1ccccn1 Amb22642645 [0,1,0,0,0,1|1,0,0]=3 6034 B14R1.756 COC(=O)C(N)CSc1ccccn1 Amb32662452 [0,1,0,0,0,1|1,0,0]=3 6035 B14R1.756 COC(=O)C(N)CSc1ncccn1 Amb22642644 [0,1,0,0,0,1|2,0,0]=4 6036 B14R1.756 COC(=O)C(N)CSc1ncccn1 Amb32662451 [0,1,0,0,0,1|2,0,0]=4 6037 B14R1.756 COC(=O)C(N)\C=C\c1ccccc1 Amb33081314 [0,1,0,0,0,1|0,0,1]=3 6038 B14R1.756 COC(=O)C(O)C#Cc1ccccc1 Amb27478725 [0,1,0,0,0,1|1,0,1]=4 6039 B14R1.756 COC(=O)C(O)OCc1ccccc1 Amb28065943 [0,1,0,0,0,1|1,0,0]=3 6040 B14R1.756 COC(=O)C(O)\C=C\c1ccccc1 Amb32952079 [0,1,0,0,0,1|1,0,1]=4 6041 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb16183003 [0,1,0,0,0,1|1,0,0]=3 6042 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,1|1,0,0]=3 6043 B14R1.756 COC(=O)[C@@H](C)OCc1ccccc1 Amb17617220 [0,1,0,0,0,1|1,0,0]=3 6044 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb33738062 [0,1,0,0,0,1|0,0,0]=2 6045 B14R1.756 COC(=O)[C@@H](N)\C=C\c1ccccc1 Amb30647374 [0,1,0,0,0,1|0,0,1]=3 6046 B14R1.756 COC(=O)[C@@H](O)C#Cc1ccccc1 Amb28455648 [0,1,0,0,0,1|1,0,1]=4 6047 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb33757896 [0,1,0,0,0,1|1,0,0]=3 6048 B14R1.756 COC(=O)[C@H](C)NCc1ccccc1 Amb9228619 [0,1,0,0,0,1|1,0,0]=3 6049 B14R1.756 COC(=O)[C@H](N)CCc1ccccc1 Amb33737035 [0,1,0,0,0,1|0,0,0]=2 6050 B14R1.756 COC(=O)\C(N)=C\Nc1ccccc1 Amb28384498 [0,1,0,0,0,1|0,0,2]=4 6051 B14R1.756 C[C@H](OCc1ccccc1)C(=O)CCl Amb27172814 [0,1,0,0,0,1|2,0,0]=4 6052 B14R1.756 C[C@H](OCc1ccccc1)C(=O)NN Amb28129351 [0,1,0,0,0,1|2,0,0]=4 6053 B14R1.756 O=C(NO)C(=O)NCc1ccccc1 Amb27759326 [0,1,0,0,0,1|1,0,1]=4 6054 B14R1.4194 C=CC(NCc1ccccc1)C(=O)O Amb28041744 [0,1,0,0,0,1|1,0,0]=3 6055 B14R1.4194 CCC(CCc1ccccc1)C(=O)O Amb33620704 [0,1,0,0,0,1|1,0,0]=3 6056 B14R1.4194 CCC(NCc1ccccc1)C(=O)O Amb19050997 [0,1,0,0,0,1|1,0,0]=3 6057 B14R1.4194 CCC(NCc1ccccc1)C(C)=O Amb28135303 [0,1,0,0,0,1|2,0,0]=4 6058 B14R1.4194 CCC(SCc1ccccc1)C(=O)O Amb839730 [0,1,0,0,0,1|1,0,0]=3 6059 B14R1.4194 CCC(SCc1ccccc1)C(C)=O Amb32682578 [0,1,0,0,0,1|2,0,0]=4 6060 B14R1.4194 CCC(\C=C\c1ccccc1)C(=O)O Amb32954843 [0,1,0,0,0,1|1,0,1]=4 6061 B14R1.4194 CN[C@@H](CCc1ccccc1)C(=O)O Amb33347471 [0,1,0,0,0,1|0,0,0]=2 6062 B14R1.4194 N#CC(CCc1ccccc1)C(=O)O Amb33140994 [0,1,0,0,0,1|0,0,1]=3 6063 B14R1.4194 N#CC(CCc1ccccc1)C(=O)[O-] Amb26304329 [0,1,0,0,0,1|0,0,2]=4 6064 B14R1.4194 NC(=O)C(CF)NCc1ccccc1 Amb27233646 [0,1,0,0,0,1|2,0,0]=4 6065 B14R1.4194 NCC(NCc1ccccc1)C(=O)O Amb27957278 [0,1,0,0,0,1|0,0,0]=2 6066 B14R1.4194 NCC(\C=C\c1ccccc1)C(=O)O Amb33223798 [0,1,0,0,0,1|0,0,1]=3 6067 B14R1.4194 O=C(O)C(CF)NCc1ccccc1 Amb27196560 [0,1,0,0,0,1|1,0,0]=3 6068 B14R1.4194 O=C(O)C(CO)NCc1ccccc1 Amb17935753 [0,1,0,0,0,1|1,0,0]=3 6069 B14R1.4194 O=C(O)C(CS)NCc1ccccc1 Amb27957868 [0,1,0,0,0,1|1,0,0]=3 6070 B14R1.4194 O=C(O)[C@@H](CO)NCc1ccccc1 Amb17739825 [0,1,0,0,0,1|1,0,0]=3 6071 B14R1.4194 O=C(O)[C@H](CO)NCc1ccccc1 Amb2696451 [0,1,0,0,0,1|1,0,0]=3 6072 B14R1.4194 O=CC(OCc1ccccc1)C(=O)O Amb27600440 [0,1,0,0,0,1|1,0,0]=3 6073 B14R1.5956 C=C(CCc1cccc(Br)c1)C(=O)O Amb33433786 [0,1,0,0,0,1|1,0,1]=4 6074 B14R1.5956 C=C(CNc1cccc(F)c1)C(=O)O Amb28288765 [0,1,0,0,0,1|1,0,1]=4 6075 B14R1.5956 C=C(CNc1cccc(I)c1)C(=O)O Amb27235356 [0,1,0,0,0,1|1,0,1]=4 6076 B14R1.5956 CC(=O)C(C)SCc1cccc(C)c1 Amb32682999 [0,1,0,0,0,1|2,0,0]=4 6077 B14R1.5956 CC(CCc1cc(F)ccn1)C(=O)O Amb33325515 [0,1,0,0,0,1|2,0,0]=4 6078 B14R1.5956 CC(CCc1cccc(Br)c1)C(=O)O Amb17265517 [0,1,0,0,0,1|1,0,0]=3 6079 B14R1.5956 CC(CCc1cccc(Br)n1)C(=O)O Amb33433545 [0,1,0,0,0,1|2,0,0]=4 6080 B14R1.5956 CC(CCc1cccc(Cl)c1)C(=O)O Amb17241242 [0,1,0,0,0,1|1,0,0]=3 6081 B14R1.5956 CC(CCc1cccc(Cl)n1)C(=O)O Amb33222656 [0,1,0,0,0,1|2,0,0]=4 6082 B14R1.5956 CC(CCc1cccc(F)c1)C(=O)O Amb19337858 [0,1,0,0,0,1|1,0,0]=3 6083 B14R1.5956 CC(CCc1cccc(O)c1)C(=O)O Amb17336810 [0,1,0,0,0,1|1,0,0]=3 6084 B14R1.5956 CC(CCc1cncc(Br)c1)C(=O)O Amb33451402 [0,1,0,0,0,1|2,0,0]=4 6085 B14R1.5956 CC(CCc1cncc(F)c1)C(=O)O Amb33195631 [0,1,0,0,0,1|2,0,0]=4 6086 B14R1.5956 CC(CNc1cccc(Br)c1)C(=O)O Amb9400482 [0,1,0,0,0,1|1,0,0]=3 6087 B14R1.5956 CC(CNc1cccc(Br)c1)C(N)=O Amb8944665 [0,1,0,0,0,1|2,0,0]=4 6088 B14R1.5956 CC(CNc1cccc(Cl)c1)C(=O)O Amb9400468 [0,1,0,0,0,1|1,0,0]=3 6089 B14R1.5956 CC(CNc1cccc(Cl)c1)C(N)=O Amb8944658 [0,1,0,0,0,1|2,0,0]=4 6090 B14R1.5956 CC(CNc1cccc(F)c1)C(=O)O Amb9400470 [0,1,0,0,0,1|1,0,0]=3 6091 B14R1.5956 CC(CNc1cccc(F)c1)C(N)=O Amb8944659 [0,1,0,0,0,1|2,0,0]=4 6092 B14R1.5956 CC(CNc1cccc(O)c1)C(=O)O Amb18095613 [0,1,0,0,0,1|1,0,0]=3 6093 B14R1.5956 CC(CNc1cncc(Cl)c1)C(=O)O Amb29864891 [0,1,0,0,0,1|2,0,0]=4 6094 B14R1.5956 CC(COc1cccc(Br)c1)C(=O)O Amb9399565 [0,1,0,0,0,1|1,0,0]=3 6095 B14R1.5956 CC(COc1cccc(Br)c1)C(N)=O Amb8944784 [0,1,0,0,0,1|2,0,0]=4 6096 B14R1.5956 CC(COc1cccc(Cl)c1)C(=O)O Amb9399575 [0,1,0,0,0,1|1,0,0]=3 6097 B14R1.5956 CC(COc1cccc(Cl)c1)C(N)=O Amb17241551 [0,1,0,0,0,1|2,0,0]=4 6098 B14R1.5956 CC(COc1cccc(F)c1)C(=O)O Amb9399595 [0,1,0,0,0,1|1,0,0]=3 6099 B14R1.5956 CC(COc1cccc(F)c1)C(N)=O Amb17236554 [0,1,0,0,0,1|2,0,0]=4 6100 B14R1.5956 CC(NCc1cccc(Br)c1)C(=O)O Amb9327098 [0,1,0,0,0,1|1,0,0]=3 6101 B14R1.5956 CC(NCc1cccc(Cl)c1)C(=O)O Amb1111448 [0,1,0,0,0,1|1,0,0]=3 6102 B14R1.5956 CC(NCc1cccc(F)c1)C(=O)O Amb10199860 [0,1,0,0,0,1|1,0,0]=3 6103 B14R1.5956 CC(NCc1cccc(F)c1)C(=O)O Amb1109690 [0,1,0,0,0,1|1,0,0]=3 6104 B14R1.5956 CC(SCc1cccc(Cl)c1)C(=O)O Amb6261785 [0,1,0,0,0,1|1,0,0]=3 6105 B14R1.5956 CC(SCc1cccc(F)c1)C(=O)O Amb6261908 [0,1,0,0,0,1|1,0,0]=3 6106 B14R1.5956 Cc1cc(CCC(C)C(=O)O)ccn1 Amb32733006 [0,1,0,0,0,1|2,0,0]=4 6107 B14R1.5956 Cc1cccc(CCC(C)C(=O)O)c1 Amb17235379 [0,1,0,0,0,1|1,0,0]=3 6108 B14R1.5956 Cc1cccc(CCC(C)C(=O)O)n1 Amb33200280 [0,1,0,0,0,1|2,0,0]=4 6109 B14R1.5956 Cc1cccc(CCC(N)C(=O)O)c1 Amb17470843 [0,1,0,0,0,1|0,0,0]=2 6110 B14R1.5956 Cc1cccc(CC[C@@H](N)C(=O)O)c1 Amb34912488 [0,1,0,0,0,1|0,0,0]=2 6111 B14R1.5956 Cc1cccc(CC[C@H](N)C(=O)O)c1 Amb34157885 [0,1,0,0,0,1|0,0,0]=2 6112 B14R1.5956 Cc1cccc(CNC(=O)C(=O)O)c1 Amb17048337 [0,1,0,0,0,1|1,0,1]=4 6113 B14R1.5956 Cc1cccc(CNC(C)C(=O)O)c1 Amb9326979 [0,1,0,0,0,1|1,0,0]=3 6114 B14R1.5956 Cc1cccc(COC(C)C(=O)O)c1 Amb32656194 [0,1,0,0,0,1|1,0,0]=3 6115 B14R1.5956 Cc1cccc(NCC(C)C(=O)O)c1 Amb9400294 [0,1,0,0,0,1|1,0,0]=3 6116 B14R1.5956 Cc1cccc(NCC(C)C(N)=O)c1 Amb8944551 [0,1,0,0,0,1|2,0,0]=4 6117 B14R1.5956 Cc1cccc(NCC(N)C(N)=O)c1 Amb28197472 [0,1,0,0,0,1|1,0,0]=3 6118 B14R1.5956 Cc1cccc(NCC(O)C(=O)O)c1 Amb27474206 [0,1,0,0,0,1|1,0,0]=3 6119 B14R1.5956 Cc1cccc(OCC(C)C(=O)O)c1 Amb9399543 [0,1,0,0,0,1|1,0,0]=3 6120 B14R1.5956 Cc1cccc(OCC(C)C(N)=O)c1 Amb17235640 [0,1,0,0,0,1|2,0,0]=4 6121 B14R1.5956 Cc1cccc(\N=N\C(Cl)C(=O)O)c1 Amb27401164 [0,1,0,0,0,1|2,0,0]=4 6122 B14R1.5956 Cc1ccnc(CCC(C)C(=O)O)c1 Amb33226935 [0,1,0,0,0,1|2,0,0]=4 6123 B14R1.5956 Cc1ccnc(NCC(C)C(=O)O)c1 Amb18095591 [0,1,0,0,0,1|2,0,0]=4 6124 B14R1.5956 Cc1cncc(CCC(C)C(=O)O)c1 Amb33317645 [0,1,0,0,0,1|2,0,0]=4 6125 B14R1.5956 NC(=O)C(N)CNc1cccc(Cl)c1 Amb27788968 [0,1,0,0,0,1|1,0,0]=3 6126 B14R1.5956 NC(=O)C(N)CNc1cccc(F)c1 Amb27183707 [0,1,0,0,0,1|1,0,0]=3 6127 B14R1.5956 NC(=O)C(N)CNc1cncc(Cl)c1 Amb29865009 [0,1,0,0,0,1|2,0,0]=4 6128 B14R1.5956 NC(CCc1cccc(Br)c1)C(=O)O Amb17473592 [0,1,0,0,0,1|0,0,0]=2 6129 B14R1.5956 NC(CCc1cccc(Cl)c1)C(=O)O Amb17471481 [0,1,0,0,0,1|0,0,0]=2 6130 B14R1.5956 NC(CCc1cccc(F)c1)C(=O)O Amb17470960 [0,1,0,0,0,1|0,0,0]=2 6131 B14R1.5956 NC(CNc1cccc(I)c1)C(=O)O Amb27183822 [0,1,0,0,0,1|0,0,0]=2 6132 B14R1.5956 NC(CNc1cncc(Cl)c1)C(=O)O Amb29865010 [0,1,0,0,0,1|1,0,0]=3 6133 B14R1.5956 N[C@@H](CCc1cccc(Cl)c1)C(=O)O Amb33802145 [0,1,0,0,0,1|0,0,0]=2 6134 B14R1.5956 N[C@@H](CCc1cccc(F)c1)C(=O)O Amb33802134 [0,1,0,0,0,1|0,0,0]=2 6135 B14R1.5956 N[C@H](CCc1cccc(Br)c1)C(=O)O Amb33869606 [0,1,0,0,0,1|0,0,0]=2 6136 B14R1.5956 N[C@H](CCc1cccc(Cl)c1)C(=O)O Amb33802146 [0,1,0,0,0,1|0,0,0]=2 6137 B14R1.5956 N[C@H](CCc1cccc(F)c1)C(=O)O Amb34912492 [0,1,0,0,0,1|0,0,0]=2 6138 B14R1.5956 O=C(O)C(=O)CCc1cccc(Br)c1 Amb18692651 [0,1,0,0,0,1|1,0,1]=4 6139 B14R1.5956 O=C(O)C(=O)NCc1cccc(Br)c1 Amb17415232 [0,1,0,0,0,1|1,0,1]=4 6140 B14R1.5956 O=C(O)C(=O)NCc1cccc(Cl)c1 Amb17404277 [0,1,0,0,0,1|1,0,1]=4 6141 B14R1.5956 O=C(O)C(O)CCc1cccc(Br)c1 Amb33433812 [0,1,0,0,0,1|1,0,0]=3 6142 B14R1.5956 O=C(O)C(O)CNc1cccc(Br)c1 Amb27951971 [0,1,0,0,0,1|1,0,0]=3 6143 B14R1.5956 O=C(O)C(O)CNc1cccc(I)c1 Amb28197467 [0,1,0,0,0,1|1,0,0]=3 6144 B14R1.5956 O=C(O)C(O)CNc1cncc(Cl)c1 Amb29865012 [0,1,0,0,0,1|2,0,0]=4 6145 B14R1.5956 O=C(O)\C(O)=C\Cc1cccc(Cl)c1 Amb35789539 [0,1,0,0,0,1|1,0,1]=4 6146 B14R1.6395 CC(=O)C(C)(C)CNc1ccccc1 Amb27758330 [0,1,0,0,0,1|2,0,0]=4 6147 B14R1.6395 CC(=O)C(C)(O)COc1ccccc1 Amb35789204 [0,1,0,0,0,1|2,0,0]=4 6148 B14R1.6395 CC(C)(CCc1ccccc1)C(=O)O Amb17235442 [0,1,0,0,0,1|1,0,0]=3 6149 B14R1.6395 CC(C)(CNc1ccccc1)C(=O)O Amb840703 [0,1,0,0,0,1|1,0,0]=3 6150 B14R1.6395 CC(C)(CNc1ccncc1)C(=O)O Amb28347791 [0,1,0,0,0,1|2,0,0]=4 6151 B14R1.6395 CC(C)(COc1ccccc1)C(=O)O Amb5768950 [0,1,0,0,0,1|1,0,0]=3 6152 B14R1.6395 CC(C)(CSc1ccccc1)C(=O)Cl Amb17144253 [0,1,0,0,0,1|2,0,0]=4 6153 B14R1.6395 CC(C)(CSc1ccccc1)C(N)=O Amb17143481 [0,1,0,0,0,1|2,0,0]=4 6154 B14R1.6395 CC(C)(NCc1ccccc1)C(=O)O Amb3976841 [0,1,0,0,0,1|1,0,0]=3 6155 B14R1.6395 CC(C)(NCc1ccccc1)C(N)=O Amb19007435 [0,1,0,0,0,1|2,0,0]=4 6156 B14R1.6395 CC(C)(NCc1ccccn1)C(=O)O Amb3977918 [0,1,0,0,0,1|2,0,0]=4 6157 B14R1.6395 CC(C)(NCc1cccnc1)C(=O)O Amb3977989 [0,1,0,0,0,1|2,0,0]=4 6158 B14R1.6395 CC(C)(NCc1ccncc1)C(=O)O Amb3978061 [0,1,0,0,0,1|2,0,0]=4 6159 B14R1.6395 CC(C)(NNc1ccccc1)C(=O)O Amb27781577 [0,1,0,0,0,1|2,0,0]=4 6160 B14R1.6395 CC(C)(OCc1ccccc1)C(=O)O Amb19014785 [0,1,0,0,0,1|1,0,0]=3 6161 B14R1.6395 CC(C)(SCc1ccccc1)C(=O)O Amb17501463 [0,1,0,0,0,1|1,0,0]=3 6162 B14R1.6395 CC(C)(\C=C\c1ccccc1)C(=O)O Amb33082318 [0,1,0,0,0,1|1,0,1]=4 6163 B14R1.6395 CC(N)(CCc1ccccc1)C(=O)O Amb33549006 [0,1,0,0,0,1|0,0,0]=2 6164 B14R1.6395 CC(N)(CCc1ccccc1)C(=O)O Amb4134851 [0,1,0,0,0,1|0,0,0]=2 6165 B14R1.6395 CC(N)(COc1ccccc1)C(=O)O Amb19042938 [0,1,0,0,0,1|0,0,0]=2 6166 B14R1.6395 CC(N)(COc1ccccc1)C(=O)O Amb33309605 [0,1,0,0,0,1|0,0,0]=2 6167 B14R1.6395 CC(N)(COc1ccccc1)C(N)=O Amb19042514 [0,1,0,0,0,1|1,0,0]=3 6168 B14R1.6395 CC(N)(\C=C\c1ccccc1)C(N)=O Amb27232702 [0,1,0,0,0,1|1,0,1]=4 6169 B14R1.6395 CC(O)(CCc1ccccc1)C(=O)O Amb19011221 [0,1,0,0,0,1|1,0,0]=3 6170 B14R1.6395 O=C(O)C(F)(F)CCc1ccccc1 Amb32954091 [0,1,0,0,0,1|1,0,0]=3 6171 B14R1.6395 O=C(O)C(F)(F)CCc1ccccn1 Amb33170790 [0,1,0,0,0,1|2,0,0]=4 6172 B14R1.6395 O=C(O)C(F)(F)CCc1cccnc1 Amb33170787 [0,1,0,0,0,1|2,0,0]=4 6173 B14R1.6395 O=C(O)C(F)(F)CCc1ccncc1 Amb33170791 [0,1,0,0,0,1|2,0,0]=4 6174 B14R1.6395 O=C(O)C(F)(F)CNc1ccccc1 Amb26527131 [0,1,0,0,0,1|1,0,0]=3 6175 B14R1.6395 O=C(O)C(F)(F)COc1ccccc1 Amb33169260 [0,1,0,0,0,1|1,0,0]=3 6176 B14R1.6395 O=C(O)C(F)(F)COc1cccnc1 Amb33169261 [0,1,0,0,0,1|2,0,0]=4 6177 B14R1.6395 O=C(O)C(F)(F)CSc1ccccc1 Amb33171184 [0,1,0,0,0,1|1,0,0]=3 6178 B14R1.6395 O=C(O)C(F)(F)CSc1ccccn1 Amb33171185 [0,1,0,0,0,1|2,0,0]=4 6179 B14R1.6395 O=C(O)C(F)(F)CSc1ccncc1 Amb33171186 [0,1,0,0,0,1|2,0,0]=4 6180 B14R1.6395 O=C(O)C(F)(F)\C=C\c1ccccc1 Amb32953287 [0,1,0,0,0,1|1,0,1]=4 6181 B14R1.328 CC(OC1=CC=CC=CC1=O)C(=O)O Amb27637732 [0,1,0,0,0,1|2,0,0]=4 6182 B14R1.3 C#Cc1ccc(CC(=O)C(=O)O)cc1 Amb32877901 [0,2,0,0,0,0|1,0,1]=4 6183 B14R1.3 C#Cc1ccc(CC(C)C(=O)O)cc1 Amb32877914 [0,2,0,0,0,0|1,0,0]=3 6184 B14R1.3 C#Cc1ccc(CC(N)C(=O)O)cc1 Amb25828354 [0,2,0,0,0,0|0,0,0]=2 6185 B14R1.3 C#Cc1ccc(CC(O)C(=O)O)cc1 Amb32877887 [0,2,0,0,0,0|1,0,0]=3 6186 B14R1.3 C#Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb25114223 [0,2,0,0,0,0|0,0,0]=2 6187 B14R1.3 C#Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb33802273 [0,2,0,0,0,0|0,0,0]=2 6188 B14R1.3 C=Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb33802005 [0,2,0,0,0,0|0,0,0]=2 6189 B14R1.3 CC(Cc1ccc(C#N)cc1)C(=O)O Amb17605814 [0,2,0,0,0,0|1,0,0]=3 6190 B14R1.3 CC(Oc1ccc(C#N)cc1)C(=O)O Amb9702375 [0,2,0,0,0,0|2,0,0]=4 6191 B14R1.3 CC(Oc1ccc(C=O)cc1)C(=O)O Amb1786444 [0,2,0,0,0,0|2,0,0]=4 6192 B14R1.3 CC(Oc1ccc(CN)cc1)C(=O)O Amb17127290 [0,2,0,0,0,0|2,0,0]=4 6193 B14R1.3 CC(Sc1ccc(C#N)cc1)C(=O)O Amb9742166 [0,2,0,0,0,0|2,0,0]=4 6194 B14R1.3 CCc1ccc(CC(=O)C(=O)O)cc1 Amb1129594 [0,2,0,0,0,0|1,0,1]=4 6195 B14R1.3 CCc1ccc(CC(Br)C(C)=O)cc1 Amb18073266 [0,2,0,0,0,0|2,0,0]=4 6196 B14R1.3 CCc1ccc(CC(C)C(=O)O)cc1 Amb5744015 [0,2,0,0,0,0|1,0,0]=3 6197 B14R1.3 CCc1ccc(CC(C)C(C)=O)cc1 Amb17234962 [0,2,0,0,0,0|2,0,0]=4 6198 B14R1.3 CCc1ccc(CC(Cl)C(=O)O)cc1 Amb17204445 [0,2,0,0,0,0|1,0,0]=3 6199 B14R1.3 CCc1ccc(CC(Cl)C(C)=O)cc1 Amb17204433 [0,2,0,0,0,0|2,0,0]=4 6200 B14R1.3 CCc1ccc(CC(Cl)C(N)=O)cc1 Amb17204439 [0,2,0,0,0,0|2,0,0]=4 6201 B14R1.3 CCc1ccc(CC(N)C(=O)O)cc1 Amb3788507 [0,2,0,0,0,0|0,0,0]=2 6202 B14R1.3 CCc1ccc(CC(O)C(=O)O)cc1 Amb17139447 [0,2,0,0,0,0|1,0,0]=3 6203 B14R1.3 CCc1ccc(C[C@@H](C)C(=O)O)cc1 Amb10844173 [0,2,0,0,0,0|1,0,0]=3 6204 B14R1.3 CCc1ccc(C[C@@H](N)C(=O)O)cc1 Amb19061740 [0,2,0,0,0,0|0,0,0]=2 6205 B14R1.3 CCc1ccc(C[C@H](C)C(=O)O)cc1 Amb10844174 [0,2,0,0,0,0|1,0,0]=3 6206 B14R1.3 CCc1ccc(C[C@H](N)C(=O)O)cc1 Amb24087706 [0,2,0,0,0,0|0,0,0]=2 6207 B14R1.3 CCc1ccc(NC(C)C(=O)O)cc1 Amb17401790 [0,2,0,0,0,0|2,0,0]=4 6208 B14R1.3 CCc1ccc(OC(C)C(=O)O)cc1 Amb9702561 [0,2,0,0,0,0|2,0,0]=4 6209 B14R1.3 CCc1ccc(SC(C)C(=O)O)cc1 Amb17083274 [0,2,0,0,0,0|2,0,0]=4 6210 B14R1.3 CCc1ccc(\C=C(\N)C(=O)O)cc1 Amb27462921 [0,2,0,0,0,0|0,0,2]=4 6211 B14R1.3 CNc1ccc(C[C@@H](N)C(=O)O)cc1 Amb24499178 [0,2,0,0,0,0|0,0,0]=2 6212 B14R1.3 CNc1ccc(OC(C)C(=O)O)cc1 Amb19063330 [0,2,0,0,0,0|2,0,0]=4 6213 B14R1.3 COc1ccc(CC(=O)C(=O)O)cc1 Amb1134810 [0,2,0,0,0,0|1,0,1]=4 6214 B14R1.3 COc1ccc(CC(Br)C(C)=O)cc1 Amb17507791 [0,2,0,0,0,0|2,0,0]=4 6215 B14R1.3 COc1ccc(CC(C)C(=O)O)cc1 Amb5744018 [0,2,0,0,0,0|1,0,0]=3 6216 B14R1.3 COc1ccc(CC(C)C(=O)O)cn1 Amb33449135 [0,2,0,0,0,0|2,0,0]=4 6217 B14R1.3 COc1ccc(CC(C)C(=O)O)nc1 Amb33314917 [0,2,0,0,0,0|2,0,0]=4 6218 B14R1.3 COc1ccc(CC(C)C(C)=O)cc1 Amb17235392 [0,2,0,0,0,0|2,0,0]=4 6219 B14R1.3 COc1ccc(CC(Cl)C(=O)O)cc1 Amb17204461 [0,2,0,0,0,0|1,0,0]=3 6220 B14R1.3 COc1ccc(CC(Cl)C(C)=O)cc1 Amb17204450 [0,2,0,0,0,0|2,0,0]=4 6221 B14R1.3 COc1ccc(CC(Cl)C(N)=O)cc1 Amb17204455 [0,2,0,0,0,0|2,0,0]=4 6222 B14R1.3 COc1ccc(CC(N)C(=O)O)cc1 Amb3788570 [0,2,0,0,0,0|0,0,0]=2 6223 B14R1.3 COc1ccc(CC(N)C(=O)O)cn1 Amb33359072 [0,2,0,0,0,0|1,0,0]=3 6224 B14R1.3 COc1ccc(CC(N)C(=O)O)nc1 Amb32954098 [0,2,0,0,0,0|1,0,0]=3 6225 B14R1.3 COc1ccc(CC(O)C(=O)O)cc1 Amb17139589 [0,2,0,0,0,0|1,0,0]=3 6226 B14R1.3 COc1ccc(CC(O)C(=O)O)cn1 Amb33196151 [0,2,0,0,0,0|2,0,0]=4 6227 B14R1.3 COc1ccc(CC(O)C(=O)O)nc1 Amb33314890 [0,2,0,0,0,0|2,0,0]=4 6228 B14R1.3 COc1ccc(CC(S)C(=O)O)cc1 Amb19003575 [0,2,0,0,0,0|1,0,0]=3 6229 B14R1.3 COc1ccc(C[C@@H](C)C(=O)O)cc1 Amb10844211 [0,2,0,0,0,0|1,0,0]=3 6230 B14R1.3 COc1ccc(C[C@@H](C)C(=O)O)cn1 Amb33728219 [0,2,0,0,0,0|2,0,0]=4 6231 B14R1.3 COc1ccc(C[C@@H](N)C(=O)O)cc1 Amb20241652 [0,2,0,0,0,0|0,0,0]=2 6232 B14R1.3 COc1ccc(C[C@@H](N)C(=O)O)cc1 Amb8397023 [0,2,0,0,0,0|0,0,0]=2 6233 B14R1.3 COc1ccc(C[C@H](C)C(=O)O)cc1 Amb10844212 [0,2,0,0,0,0|1,0,0]=3 6234 B14R1.3 COc1ccc(C[C@H](C)C(=O)O)cn1 Amb33727892 [0,2,0,0,0,0|2,0,0]=4 6235 B14R1.3 COc1ccc(C[C@H](N)C(=O)O)cc1 Amb3941498 [0,2,0,0,0,0|0,0,0]=2 6236 B14R1.3 COc1ccc(NC(C)C(=O)O)cc1 Amb840553 [0,2,0,0,0,0|2,0,0]=4 6237 B14R1.3 COc1ccc(N[C@@H](C)C(=O)O)cc1 Amb28396609 [0,2,0,0,0,0|2,0,0]=4 6238 B14R1.3 COc1ccc(OC(C)C(=O)O)cc1 Amb6336456 [0,2,0,0,0,0|2,0,0]=4 6239 B14R1.3 COc1ccc(SC(C)C(=O)O)cc1 Amb9709157 [0,2,0,0,0,0|2,0,0]=4 6240 B14R1.3 COc1ccc(\C=C(\N)C(=O)O)cc1 Amb27863595 [0,2,0,0,0,0|0,0,2]=4 6241 B14R1.3 CSc1ccc(CC(=O)C(=O)O)cc1 Amb9303748 [0,2,0,0,0,0|1,0,1]=4 6242 B14R1.3 CSc1ccc(CC(C)C(=O)O)cc1 Amb33474778 [0,2,0,0,0,0|1,0,0]=3 6243 B14R1.3 CSc1ccc(CC(C)C(C)=O)cc1 Amb18865884 [0,2,0,0,0,0|2,0,0]=4 6244 B14R1.3 CSc1ccc(CC(N)C(=O)O)cc1 Amb13951673 [0,2,0,0,0,0|0,0,0]=2 6245 B14R1.3 CSc1ccc(CC(N)C(=O)O)cc1 Amb3789104 [0,2,0,0,0,0|0,0,0]=2 6246 B14R1.3 CSc1ccc(CC(O)C(=O)O)cc1 Amb33353203 [0,2,0,0,0,0|1,0,0]=3 6247 B14R1.3 CSc1ccc(C[C@H](N)C(=O)O)cc1 Amb35825311 [0,2,0,0,0,0|0,0,0]=2 6248 B14R1.3 CSc1ccc(OC(C)C(=O)O)cc1 Amb19374820 [0,2,0,0,0,0|2,0,0]=4 6249 B14R1.3 N#Cc1ccc(CC(=O)C(=O)O)cc1 Amb1139062 [0,2,0,0,0,0|1,0,1]=4 6250 B14R1.3 N#Cc1ccc(CC(Br)C(N)=O)cc1 Amb27855783 [0,2,0,0,0,0|2,0,0]=4 6251 B14R1.3 N#Cc1ccc(CC(N)C(=O)O)cc1 Amb22002699 [0,2,0,0,0,0|0,0,0]=2 6252 B14R1.3 N#Cc1ccc(CC(N)C(=O)O)cn1 Amb31031006 [0,2,0,0,0,0|1,0,0]=3 6253 B14R1.3 N#Cc1ccc(CC(N)C(N)=O)cc1 Amb28123743 [0,2,0,0,0,0|1,0,0]=3 6254 B14R1.3 N#Cc1ccc(CC(O)C(=O)O)cc1 Amb33353282 [0,2,0,0,0,0|1,0,0]=3 6255 B14R1.3 N#Cc1ccc(C[C@@H](N)C(=O)O)cc1 Amb2694719 [0,2,0,0,0,0|0,0,0]=2 6256 B14R1.3 N#Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb22746029 [0,2,0,0,0,0|0,0,0]=2 6257 B14R1.3 N#Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb2694720 [0,2,0,0,0,0|0,0,0]=2 6258 B14R1.3 N#Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb24446739 [0,2,0,0,0,0|1,0,0]=3 6259 B14R1.3 N#Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb35752640 [0,2,0,0,0,0|1,0,0]=3 6260 B14R1.3 N#Cc1ccc(C[C@H](N)C(=O)O)nc1 Amb27630612 [0,2,0,0,0,0|1,0,0]=3 6261 B14R1.3 N#Cc1ccc(C[C@H](N)C(N)=O)cc1 Amb27665369 [0,2,0,0,0,0|1,0,0]=3 6262 B14R1.3 NCc1ccc(CC(N)C(=O)O)cc1 Amb31031103 [0,2,0,0,0,0|0,0,0]=2 6263 B14R1.3 NCc1ccc(C[C@H](N)C(=O)O)cc1 Amb8397029 [0,2,0,0,0,0|0,0,0]=2 6264 B14R1.132 C=C(C(=O)O)C(C)c1ccc(F)cc1 Amb24634260 [0,2,0,0,0,0|1,0,1]=4 6265 B14R1.132 C=C(C(=O)O)C(O)c1ccc(C)cc1 Amb26405977 [0,2,0,0,0,0|1,0,1]=4 6266 B14R1.132 C=C(C(=O)O)C(O)c1ccc(Cl)cc1 Amb27198760 [0,2,0,0,0,0|1,0,1]=4 6267 B14R1.132 C=C(C(=O)O)C(O)c1ccc(F)cc1 Amb25181604 [0,2,0,0,0,0|1,0,1]=4 6268 B14R1.132 C=C(C(=O)O)[C@@H](N)c1ccc(F)cc1 Amb27257860 [0,2,0,0,0,0|1,0,1]=4 6269 B14R1.132 C=C(C(=O)O)[C@H](O)c1ccc(F)cc1 Amb27402001 [0,2,0,0,0,0|1,0,1]=4 6270 B14R1.132 CC(=O)C(Br)C(Br)c1ccc(Cl)cc1 Amb2433255 [0,2,0,0,0,0|2,0,0]=4 6271 B14R1.132 CC(=O)C(Br)C(C)c1ccc(Cl)cc1 Amb27412152 [0,2,0,0,0,0|2,0,0]=4 6272 B14R1.132 CC(=O)C(Br)C(C)c1ccc(I)cc1 Amb28186707 [0,2,0,0,0,0|2,0,0]=4 6273 B14R1.132 CC(=O)C(C)C(O)c1ccc(C)cc1 Amb27198095 [0,2,0,0,0,0|2,0,0]=4 6274 B14R1.132 CC(=O)[C@@H](O)[C@H](O)c1ccc(F)cc1 Amb27835870 [0,2,0,0,0,0|2,0,0]=4 6275 B14R1.132 CC(=O)[C@H](C)[C@H](O)c1ccc(C)cc1 Amb27457655 [0,2,0,0,0,0|2,0,0]=4 6276 B14R1.132 CC(C(=O)C(=O)O)c1ccc(F)cc1 Amb33274566 [0,2,0,0,0,0|1,0,1]=4 6277 B14R1.132 CC(C(=O)O)C(C)c1ccc(Br)cn1 Amb35669518 [0,2,0,0,0,0|2,0,0]=4 6278 B14R1.132 CC(C(=O)O)C(C)c1ccc(Cl)cn1 Amb35669515 [0,2,0,0,0,0|2,0,0]=4 6279 B14R1.132 CC(C(=O)O)C(C)c1ccc(F)cc1 Amb18813112 [0,2,0,0,0,0|1,0,0]=3 6280 B14R1.132 CC(C(=O)O)C(C)c1ccc(N)cc1 Amb27957873 [0,2,0,0,0,0|1,0,0]=3 6281 B14R1.132 CC(C(=O)O)C(N)c1ccc(Br)cc1 Amb17473595 [0,2,0,0,0,0|1,0,0]=3 6282 B14R1.132 CC(C(=O)O)C(N)c1ccc(Br)cc1 Amb28750793 [0,2,0,0,0,0|1,0,0]=3 6283 B14R1.132 CC(C(=O)O)C(N)c1ccc(Cl)cc1 Amb17471484 [0,2,0,0,0,0|1,0,0]=3 6284 B14R1.132 CC(C(=O)O)C(N)c1ccc(O)cc1 Amb27748244 [0,2,0,0,0,0|1,0,0]=3 6285 B14R1.132 CC(C(=O)O)C(O)c1ccc(F)cc1 Amb18990625 [0,2,0,0,0,0|1,0,0]=3 6286 B14R1.132 CC(C(=O)O)N(C)c1ccc(Br)cc1 Amb22967142 [0,2,0,0,0,0|2,0,0]=4 6287 B14R1.132 CC(C(=O)O)N(C)c1ccc(F)cc1 Amb22967001 [0,2,0,0,0,0|2,0,0]=4 6288 B14R1.132 CC(C(=O)O)N(C)c1ccc(O)cc1 Amb5761076 [0,2,0,0,0,0|2,0,0]=4 6289 B14R1.132 CC(C(=O)O)S(=O)c1ccc(Br)cc1 Amb27797088 [0,2,0,0,0,0|2,0,0]=4 6290 B14R1.132 CC(C(=O)O)S(=O)c1ccc(F)cc1 Amb18292849 [0,2,0,0,0,0|2,0,0]=4 6291 B14R1.132 CC(C(=S)C(=O)O)c1ccc(Cl)cc1 Amb27633853 [0,2,0,0,0,0|1,0,1]=4 6292 B14R1.132 CC(c1ccc(Br)cn1)C(F)C(=O)O Amb35669519 [0,2,0,0,0,0|2,0,0]=4 6293 B14R1.132 CC(c1ccc(Br)cn1)C(N)C(=O)O Amb35663289 [0,2,0,0,0,0|1,0,0]=3 6294 B14R1.132 CC(c1ccc(Cl)cc1)C(F)C(=O)O Amb27235099 [0,2,0,0,0,0|1,0,0]=3 6295 B14R1.132 CC(c1ccc(Cl)cn1)C(F)C(=O)O Amb35669516 [0,2,0,0,0,0|2,0,0]=4 6296 B14R1.132 CC(c1ccc(Cl)cn1)C(N)C(=O)O Amb35663238 [0,2,0,0,0,0|1,0,0]=3 6297 B14R1.132 CC(c1ccc(F)cc1)C(N)C(=O)O Amb27956030 [0,2,0,0,0,0|0,0,0]=2 6298 B14R1.132 CC(c1ccc(F)cc1)C(O)C(=O)O Amb26357793 [0,2,0,0,0,0|1,0,0]=3 6299 B14R1.132 CC(c1ccc(F)cc1)[C@@H](C)C(=O)O Amb33729609 [0,2,0,0,0,0|1,0,0]=3 6300 B14R1.132 CC(c1ccc(F)cc1)[C@H](C)C(=O)O Amb33744372 [0,2,0,0,0,0|1,0,0]=3 6301 B14R1.132 CC(c1ccc(F)cn1)C(F)C(=O)O Amb27164984 [0,2,0,0,0,0|2,0,0]=4 6302 B14R1.132 CC(c1ccc(F)cn1)C(N)C(=O)O Amb35663179 [0,2,0,0,0,0|1,0,0]=3 6303 B14R1.132 CC(c1ccc(I)cc1)C(N)C(=O)O Amb30040032 [0,2,0,0,0,0|0,0,0]=2 6304 B14R1.132 CC(c1ccc(N)cc1)C(N)C(=O)O Amb18651901 [0,2,0,0,0,0|0,0,0]=2 6305 B14R1.132 CC(c1ccc(O)cc1)C(N)C(=O)O Amb4025751 [0,2,0,0,0,0|0,0,0]=2 6306 B14R1.132 C[C@@H](C(=O)O)[C@@H](O)c1ccc(Cl)cc1 Amb27169488 [0,2,0,0,0,0|1,0,0]=3 6307 B14R1.132 C[C@@H](c1ccc(F)cc1)[C@H](N)C(=O)O Amb27983677 [0,2,0,0,0,0|0,0,0]=2 6308 B14R1.132 C[C@@H](c1ccc(O)cc1)[C@@H](N)C(=O)O Amb27232964 [0,2,0,0,0,0|0,0,0]=2 6309 B14R1.132 C[C@H](c1ccc(N)cc1)[C@@H](C)C(=O)O Amb27233596 [0,2,0,0,0,0|1,0,0]=3 6310 B14R1.132 Cc1ccc(C(C)C(C)C(=O)O)cc1 Amb18190563 [0,2,0,0,0,0|1,0,0]=3 6311 B14R1.132 Cc1ccc(C(C)C(C)C(=O)O)cn1 Amb28289926 [0,2,0,0,0,0|2,0,0]=4 6312 B14R1.132 Cc1ccc(C(C)C(C)C(N)=O)cc1 Amb27425507 [0,2,0,0,0,0|2,0,0]=4 6313 B14R1.132 Cc1ccc(C(C)C(O)C(=O)O)cc1 Amb19149343 [0,2,0,0,0,0|1,0,0]=3 6314 B14R1.132 Cc1ccc(C(C)[C@@H](C)C(=O)O)cc1 Amb33738124 [0,2,0,0,0,0|1,0,0]=3 6315 B14R1.132 Cc1ccc(C(C)[C@H](C)C(=O)O)cc1 Amb33728362 [0,2,0,0,0,0|1,0,0]=3 6316 B14R1.132 Cc1ccc(C(N)C(C)C(=O)O)cc1 Amb17470846 [0,2,0,0,0,0|1,0,0]=3 6317 B14R1.132 Cc1ccc(C(N)C(F)C(=O)O)cc1 Amb27950923 [0,2,0,0,0,0|1,0,0]=3 6318 B14R1.132 Cc1ccc(C(N)C(O)C(=O)O)cc1 Amb27237505 [0,2,0,0,0,0|1,0,0]=3 6319 B14R1.132 Cc1ccc(C(O)C(C)C(=O)O)cc1 Amb3194333 [0,2,0,0,0,0|1,0,0]=3 6320 B14R1.132 Cc1ccc(C(O)C(N)C(=O)O)cc1 Amb25232569 [0,2,0,0,0,0|0,0,0]=2 6321 B14R1.132 Cc1ccc(C(O)C(N)C(=O)O)cn1 Amb27162946 [0,2,0,0,0,0|1,0,0]=3 6322 B14R1.132 Cc1ccc(C(O)C(N)C(=O)O)nc1 Amb25133208 [0,2,0,0,0,0|1,0,0]=3 6323 B14R1.132 Cc1ccc(C(O)C(N)C(N)=O)cc1 Amb27955211 [0,2,0,0,0,0|1,0,0]=3 6324 B14R1.132 Cc1ccc(S(=O)C(C)C(=O)O)cc1 Amb18293857 [0,2,0,0,0,0|2,0,0]=4 6325 B14R1.132 Cc1ccc([C@@H](C)[C@H](N)C(=O)O)cc1 Amb27592214 [0,2,0,0,0,0|0,0,0]=2 6326 B14R1.132 Cc1ccc([C@H](N)C(F)C(=O)O)cc1 Amb27585625 [0,2,0,0,0,0|1,0,0]=3 6327 B14R1.132 Cc1ccc([C@H](N)[C@@H](O)C(=O)O)cc1 Amb27249546 [0,2,0,0,0,0|1,0,0]=3 6328 B14R1.132 Cc1ccc([C@H](N)[C@H](O)C(=O)O)cc1 Amb25282340 [0,2,0,0,0,0|1,0,0]=3 6329 B14R1.132 Cc1cnc(C(O)C(N)C(=O)O)cn1 Amb33374373 [0,2,0,0,0,0|2,0,0]=4 6330 B14R1.132 NC(C(=O)O)C(O)c1ccc(Br)cc1 Amb18692059 [0,2,0,0,0,0|0,0,0]=2 6331 B14R1.132 NC(C(=O)O)C(O)c1ccc(Br)cn1 Amb25126511 [0,2,0,0,0,0|1,0,0]=3 6332 B14R1.132 NC(C(=O)O)C(O)c1ccc(Br)nc1 Amb33388026 [0,2,0,0,0,0|1,0,0]=3 6333 B14R1.132 NC(C(=O)O)C(O)c1ccc(Cl)cc1 Amb18657878 [0,2,0,0,0,0|0,0,0]=2 6334 B14R1.132 NC(C(=O)O)C(O)c1ccc(Cl)nc1 Amb33261547 [0,2,0,0,0,0|1,0,0]=3 6335 B14R1.132 NC(C(=O)O)C(O)c1ccc(F)cc1 Amb17846423 [0,2,0,0,0,0|0,0,0]=2 6336 B14R1.132 NC(C(=O)O)C(O)c1ccc(F)cn1 Amb33317388 [0,2,0,0,0,0|1,0,0]=3 6337 B14R1.132 NC(C(=O)O)C(O)c1ccc(F)nc1 Amb33426220 [0,2,0,0,0,0|1,0,0]=3 6338 B14R1.132 NC(C(=O)O)C(O)c1ccc(O)cc1 Amb18652543 [0,2,0,0,0,0|0,0,0]=2 6339 B14R1.132 NC(C(=O)O)C(O)c1ncc(Br)cn1 Amb33334763 [0,2,0,0,0,0|2,0,0]=4 6340 B14R1.132 NC(c1ccc(Br)cc1)C(O)C(=O)O Amb27963738 [0,2,0,0,0,0|1,0,0]=3 6341 B14R1.132 NC(c1ccc(F)nc1)C(O)C(=O)O Amb27620353 [0,2,0,0,0,0|2,0,0]=4 6342 B14R1.132 NC(c1ccc(O)cc1)C(O)C(=O)O Amb27182848 [0,2,0,0,0,0|1,0,0]=3 6343 B14R1.132 N[C@@H](C(=O)O)C(O)c1ccc(Cl)cc1 Amb28247140 [0,2,0,0,0,0|0,0,0]=2 6344 B14R1.132 N[C@@H](C(=O)O)[C@H](O)c1ccc(F)cc1 Amb27955830 [0,2,0,0,0,0|0,0,0]=2 6345 B14R1.132 N[C@@H](c1ccc(Br)cn1)[C@@H](O)C(=O)O Amb27669979 [0,2,0,0,0,0|2,0,0]=4 6346 B14R1.132 N[C@@H](c1ccc(F)cc1)[C@H](O)C(=O)O Amb28289941 [0,2,0,0,0,0|1,0,0]=3 6347 B14R1.132 N[C@@H](c1ccc(I)cc1)[C@@H](O)C(=O)O Amb27182651 [0,2,0,0,0,0|1,0,0]=3 6348 B14R1.132 N[C@H](C(=O)O)C(O)c1ccc(Cl)cc1 Amb27957871 [0,2,0,0,0,0|0,0,0]=2 6349 B14R1.132 N[C@H](C(=O)O)[C@@H](O)c1ccc(Cl)cc1 Amb23603668 [0,2,0,0,0,0|0,0,0]=2 6350 B14R1.132 N[C@H](C(=O)O)[C@@H](O)c1ccc(O)cc1 Amb28119933 [0,2,0,0,0,0|0,0,0]=2 6351 B14R1.132 N[C@H](C(=O)O)[C@H](O)c1ccc(Br)cc1 Amb27977978 [0,2,0,0,0,0|0,0,0]=2 6352 B14R1.132 N[C@H](C(=O)O)[C@H](O)c1ccc(F)cc1 Amb27878697 [0,2,0,0,0,0|0,0,0]=2 6353 B14R1.132 N[C@H](c1ccc(Br)cn1)[C@H](O)C(=O)O Amb28368679 [0,2,0,0,0,0|2,0,0]=4 6354 B14R1.132 N[C@H](c1ccc(Br)nc1)[C@H](O)C(=O)O Amb28323626 [0,2,0,0,0,0|2,0,0]=4 6355 B14R1.132 N[C@H](c1ccc(Cl)cc1)[C@H](O)C(=O)O Amb27965863 [0,2,0,0,0,0|1,0,0]=3 6356 B14R1.132 N[C@H](c1ccc(F)nc1)[C@H](O)C(=O)O Amb27193514 [0,2,0,0,0,0|2,0,0]=4 6357 B14R1.132 Nc1ccc([C@@H](N)[C@H](N)C(=O)O)cc1 Amb28184190 [0,2,0,0,0,0|0,0,0]=2 6358 B14R1.132 Nc1ccc([C@@H](O)[C@H](N)C(=O)O)cc1 Amb27401912 [0,2,0,0,0,0|0,0,0]=2 6359 B14R1.132 Nc1ccc([C@H](N)[C@@H](O)C(=O)O)cc1 Amb27273412 [0,2,0,0,0,0|1,0,0]=3 6360 B14R1.132 O=C(O)C(=O)C(Br)c1ccc(F)cc1 Amb25055628 [0,2,0,0,0,0|1,0,1]=4 6361 B14R1.132 O=C(O)C(=O)C(F)c1ccc(F)cc1 Amb27166090 [0,2,0,0,0,0|1,0,1]=4 6362 B14R1.132 O=C(O)C(O)C(O)c1ccc(F)cc1 Amb28408804 [0,2,0,0,0,0|1,0,0]=3 6363 B14R1.134 CCC(=O)C(C)Cc1ccc(Br)cc1 Amb17264258 [0,2,0,0,0,0|2,0,0]=4 6364 B14R1.134 CCC(=O)C(C)Cc1ccc(C)cc1 Amb17234961 [0,2,0,0,0,0|2,0,0]=4 6365 B14R1.134 CCC(=O)C(C)Cc1ccc(Cl)cc1 Amb17240774 [0,2,0,0,0,0|2,0,0]=4 6366 B14R1.134 CCC(=O)C(C)Cc1ccc(F)cc1 Amb17235958 [0,2,0,0,0,0|2,0,0]=4 6367 B14R1.134 CN(Cc1ccc(Br)cc1)C(=O)CO Amb17415251 [0,2,0,0,0,0|2,0,0]=4 6368 B14R1.134 CN(Cc1ccc(Cl)cc1)C(=O)CO Amb17404296 [0,2,0,0,0,0|2,0,0]=4 6369 B14R1.134 CN(Cc1ccc(F)cc1)C(=O)CO Amb1110198 [0,2,0,0,0,0|2,0,0]=4 6370 B14R1.134 CNC(=O)C(Cl)Cc1ccc(N)cc1 Amb27206429 [0,2,0,0,0,0|2,0,0]=4 6371 B14R1.134 CNC(=O)C(N)Cc1ccc(C)cc1 Amb27818129 [0,2,0,0,0,0|1,0,0]=3 6372 B14R1.134 CNC(=O)C(N)Cc1ccc(N)cc1 Amb28198097 [0,2,0,0,0,0|1,0,0]=3 6373 B14R1.134 CNC(=O)C(N)Cc1ccc(O)cc1 Amb18972760 [0,2,0,0,0,0|1,0,0]=3 6374 B14R1.134 CNC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb27193478 [0,2,0,0,0,0|1,0,0]=3 6375 B14R1.134 COC(=O)C(=O)Cc1ccc(Br)cc1 Amb17162561 [0,2,0,0,0,0|1,0,1]=4 6376 B14R1.134 COC(=O)C(=O)Cc1ccc(C)cc1 Amb17139342 [0,2,0,0,0,0|1,0,1]=4 6377 B14R1.134 COC(=O)C(=O)Cc1ccc(Cl)cc1 Amb17140710 [0,2,0,0,0,0|1,0,1]=4 6378 B14R1.134 COC(=O)C(=O)Cc1ccc(F)cc1 Amb17139585 [0,2,0,0,0,0|1,0,1]=4 6379 B14R1.134 COC(=O)C(Br)Cc1ccc(Br)cc1 Amb7092620 [0,2,0,0,0,0|1,0,0]=3 6380 B14R1.134 COC(=O)C(Br)Cc1ccc(C)cc1 Amb7092616 [0,2,0,0,0,0|1,0,0]=3 6381 B14R1.134 COC(=O)C(Br)Cc1ccc(Cl)cc1 Amb7092619 [0,2,0,0,0,0|1,0,0]=3 6382 B14R1.134 COC(=O)C(Br)Cc1ccc(F)cc1 Amb7092618 [0,2,0,0,0,0|1,0,0]=3 6383 B14R1.134 COC(=O)C(C)Cc1ccc(C)cc1 Amb17844107 [0,2,0,0,0,0|1,0,0]=3 6384 B14R1.134 COC(=O)C(C)Cc1ccc(N)cc1 Amb32990220 [0,2,0,0,0,0|1,0,0]=3 6385 B14R1.134 COC(=O)C(C)Nc1ccc(C)cc1 Amb4137937 [0,2,0,0,0,0|2,0,0]=4 6386 B14R1.134 COC(=O)C(C)Nc1ccc(Cl)cc1 Amb19018827 [0,2,0,0,0,0|2,0,0]=4 6387 B14R1.134 COC(=O)C(C)Nc1ccc(F)cc1 Amb18307969 [0,2,0,0,0,0|2,0,0]=4 6388 B14R1.134 COC(=O)C(C)Nc1ccc(N)cc1 Amb19017407 [0,2,0,0,0,0|2,0,0]=4 6389 B14R1.134 COC(=O)C(C)Oc1ccc(Br)cc1 Amb6547342 [0,2,0,0,0,0|2,0,0]=4 6390 B14R1.134 COC(=O)C(C)Oc1ccc(F)cc1 Amb6550314 [0,2,0,0,0,0|2,0,0]=4 6391 B14R1.134 COC(=O)C(C)Oc1ccc(N)cc1 Amb17109999 [0,2,0,0,0,0|2,0,0]=4 6392 B14R1.134 COC(=O)C(C)Oc1ccc(O)cc1 Amb2423203 [0,2,0,0,0,0|2,0,0]=4 6393 B14R1.134 COC(=O)C(C)Sc1ccc(N)cc1 Amb33747225 [0,2,0,0,0,0|2,0,0]=4 6394 B14R1.134 COC(=O)C(Cl)Cc1ccc(Br)cc1 Amb17204951 [0,2,0,0,0,0|1,0,0]=3 6395 B14R1.134 COC(=O)C(Cl)Cc1ccc(C)cc1 Amb17204448 [0,2,0,0,0,0|1,0,0]=3 6396 B14R1.134 COC(=O)C(Cl)Cc1ccc(Cl)cc1 Amb17204593 [0,2,0,0,0,0|1,0,0]=3 6397 B14R1.134 COC(=O)C(Cl)Cc1ccc(F)cc1 Amb17204463 [0,2,0,0,0,0|1,0,0]=3 6398 B14R1.134 COC(=O)C(N)Cc1ccc(Br)cc1 Amb17415249 [0,2,0,0,0,0|0,0,0]=2 6399 B14R1.134 COC(=O)C(N)Cc1ccc(C)cc1 Amb17401774 [0,2,0,0,0,0|0,0,0]=2 6400 B14R1.134 COC(=O)C(N)Cc1ccc(Cl)cc1 Amb2228449 [0,2,0,0,0,0|0,0,0]=2 6401 B14R1.134 COC(=O)C(N)Cc1ccc(Cl)nc1 Amb35746151 [0,2,0,0,0,0|1,0,0]=3 6402 B14R1.134 COC(=O)C(N)Cc1ccc(Cl)nc1 Amb35748881 [0,2,0,0,0,0|1,0,0]=3 6403 B14R1.134 COC(=O)C(N)Cc1ccc(F)cc1 Amb17402183 [0,2,0,0,0,0|0,0,0]=2 6404 B14R1.134 COC(=O)C(N)Cc1ccc(F)cc1 Amb28468150 [0,2,0,0,0,0|0,0,0]=2 6405 B14R1.134 COC(=O)C(N)Cc1ccc(O)cc1 Amb1210958 [0,2,0,0,0,0|0,0,0]=2 6406 B14R1.134 COC(=O)C(N)Cc1ccc(O)cc1 Amb2722655 [0,2,0,0,0,0|0,0,0]=2 6407 B14R1.134 COC(=O)C(O)Cc1ccc(Br)cc1 Amb17163100 [0,2,0,0,0,0|1,0,0]=3 6408 B14R1.134 COC(=O)C(O)Cc1ccc(Br)cn1 Amb33450914 [0,2,0,0,0,0|2,0,0]=4 6409 B14R1.134 COC(=O)C(O)Cc1ccc(Br)nc1 Amb33388401 [0,2,0,0,0,0|2,0,0]=4 6410 B14R1.134 COC(=O)C(O)Cc1ccc(C)cc1 Amb17139450 [0,2,0,0,0,0|1,0,0]=3 6411 B14R1.134 COC(=O)C(O)Cc1ccc(C)cn1 Amb33198387 [0,2,0,0,0,0|2,0,0]=4 6412 B14R1.134 COC(=O)C(O)Cc1ccc(C)nc1 Amb32877452 [0,2,0,0,0,0|2,0,0]=4 6413 B14R1.134 COC(=O)C(O)Cc1ccc(Cl)cc1 Amb17140888 [0,2,0,0,0,0|1,0,0]=3 6414 B14R1.134 COC(=O)C(O)Cc1ccc(Cl)cn1 Amb33058822 [0,2,0,0,0,0|2,0,0]=4 6415 B14R1.134 COC(=O)C(O)Cc1ccc(Cl)nc1 Amb33261683 [0,2,0,0,0,0|2,0,0]=4 6416 B14R1.134 COC(=O)C(O)Cc1ccc(F)cc1 Amb17139694 [0,2,0,0,0,0|1,0,0]=3 6417 B14R1.134 COC(=O)C(O)Cc1ccc(F)cn1 Amb33315589 [0,2,0,0,0,0|2,0,0]=4 6418 B14R1.134 COC(=O)C(O)Cc1ccc(F)nc1 Amb33425806 [0,2,0,0,0,0|2,0,0]=4 6419 B14R1.134 COC(=O)C(O)Cc1ccc(O)cc1 Amb18652328 [0,2,0,0,0,0|1,0,0]=3 6420 B14R1.134 COC(=O)C(S)Cc1ccc(C)cc1 Amb33204510 [0,2,0,0,0,0|1,0,0]=3 6421 B14R1.134 COC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb22492774 [0,2,0,0,0,0|0,0,1]=3 6422 B14R1.134 COC(=O)N(C)Cc1ccc(N)cc1 Amb9317713 [0,2,0,0,0,0|2,0,0]=4 6423 B14R1.134 COC(=O)[C@@H](C)Nc1ccc(Cl)cc1 Amb27401161 [0,2,0,0,0,0|2,0,0]=4 6424 B14R1.134 COC(=O)[C@@H](C)Oc1ccc(O)cc1 Amb3939257 [0,2,0,0,0,0|2,0,0]=4 6425 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Br)cc1 Amb33623634 [0,2,0,0,0,0|0,0,0]=2 6426 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Br)cc1 Amb6295882 [0,2,0,0,0,0|0,0,0]=2 6427 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Br)cn1 Amb30633806 [0,2,0,0,0,0|1,0,0]=3 6428 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(C)cn1 Amb33802009 [0,2,0,0,0,0|1,0,0]=3 6429 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(C)cn1 Amb33872494 [0,2,0,0,0,0|1,0,0]=3 6430 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb33804277 [0,2,0,0,0,0|0,0,0]=2 6431 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb6295875 [0,2,0,0,0,0|0,0,0]=2 6432 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)cn1 Amb23440404 [0,2,0,0,0,0|1,0,0]=3 6433 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb22745758 [0,2,0,0,0,0|0,0,0]=2 6434 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb32684473 [0,2,0,0,0,0|0,0,0]=2 6435 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(I)cc1 Amb22226738 [0,2,0,0,0,0|0,0,0]=2 6436 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb2719689 [0,2,0,0,0,0|0,0,0]=2 6437 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb6364885 [0,2,0,0,0,0|0,0,0]=2 6438 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(F)cc1 Amb22747622 [0,2,0,0,0,0|1,0,0]=3 6439 B14R1.134 COC(=O)[C@H](C)Nc1ccc(C)cc1 Amb28400008 [0,2,0,0,0,0|2,0,0]=4 6440 B14R1.134 COC(=O)[C@H](C)Nc1ccc(Cl)cc1 Amb27873427 [0,2,0,0,0,0|2,0,0]=4 6441 B14R1.134 COC(=O)[C@H](C)Oc1ccc(O)cc1 Amb9826049 [0,2,0,0,0,0|2,0,0]=4 6442 B14R1.134 COC(=O)[C@H](N)Cc1ccc(Br)cc1 Amb33748949 [0,2,0,0,0,0|0,0,0]=2 6443 B14R1.134 COC(=O)[C@H](N)Cc1ccc(Cl)cc1 Amb6295877 [0,2,0,0,0,0|0,0,0]=2 6444 B14R1.134 COC(=O)[C@H](N)Cc1ccc(F)cc1 Amb2698796 [0,2,0,0,0,0|0,0,0]=2 6445 B14R1.134 COC(=O)[C@H](N)Cc1ccc(F)cc1 Amb4478178 [0,2,0,0,0,0|0,0,0]=2 6446 B14R1.134 COC(=O)[C@H](N)Cc1ccc(N)cc1 Amb8385957 [0,2,0,0,0,0|0,0,0]=2 6447 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb19944299 [0,2,0,0,0,0|0,0,0]=2 6448 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb33804816 [0,2,0,0,0,0|0,0,0]=2 6449 B14R1.134 COC(=O)[C@H](O)Cc1ccc(F)cc1 Amb17935903 [0,2,0,0,0,0|1,0,0]=3 6450 B14R1.134 Cc1ccc(CN(C)C(=O)CO)cc1 Amb1110323 [0,2,0,0,0,0|2,0,0]=4 6451 B14R1.134 NC(Cc1ccc(Cl)cc1)C(=O)NO Amb27166508 [0,2,0,0,0,0|0,0,0]=2 6452 B14R1.134 NC(Cc1ccc(O)cc1)C(=O)NO Amb22451358 [0,2,0,0,0,0|0,0,0]=2 6453 B14R1.134 NNC(=O)C(N)Cc1ccc(O)cc1 Amb26456266 [0,2,0,0,0,0|1,0,0]=3 6454 B14R1.134 NNC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb8386405 [0,2,0,0,0,0|1,0,0]=3 6455 B14R1.134 N[C@@H](Cc1ccc(Br)cc1)C(=O)NO Amb27189963 [0,2,0,0,0,0|0,0,0]=2 6456 B14R1.134 N[C@@H](Cc1ccc(Cl)cc1)C(=O)NO Amb27166565 [0,2,0,0,0,0|0,0,0]=2 6457 B14R1.134 N[C@@H](Cc1ccc(F)cc1)C(=O)NO Amb27644108 [0,2,0,0,0,0|0,0,0]=2 6458 B14R1.134 O=C(NO)C(O)Cc1ccc(O)cc1 Amb28409168 [0,2,0,0,0,0|1,0,0]=3 6459 B14R1.536 C=C=C(Cc1ccc(C)cc1)C(=O)O Amb27444613 [0,2,0,0,0,0|1,0,1]=4 6460 B14R1.536 C=C=C(Cc1ccc(Cl)cc1)C(=O)O Amb27390162 [0,2,0,0,0,0|1,0,1]=4 6461 B14R1.536 CCC(Cc1ccc(Br)cc1)C(=O)O Amb17605818 [0,2,0,0,0,0|1,0,0]=3 6462 B14R1.536 CCC(Cc1ccc(Br)cc1)C(C)=O Amb17264257 [0,2,0,0,0,0|2,0,0]=4 6463 B14R1.536 CCC(Cc1ccc(C)cc1)C(=O)O Amb5744039 [0,2,0,0,0,0|1,0,0]=3 6464 B14R1.536 CCC(Cc1ccc(C)cc1)C(C)=O Amb17234960 [0,2,0,0,0,0|2,0,0]=4 6465 B14R1.536 CCC(Cc1ccc(Cl)cc1)C(=O)O Amb5744048 [0,2,0,0,0,0|1,0,0]=3 6466 B14R1.536 CCC(Cc1ccc(Cl)cc1)C(C)=O Amb17240773 [0,2,0,0,0,0|2,0,0]=4 6467 B14R1.536 CCC(Cc1ccc(F)cc1)C(=O)O Amb5744041 [0,2,0,0,0,0|1,0,0]=3 6468 B14R1.536 CCC(Cc1ccc(F)cc1)C(C)=O Amb17235957 [0,2,0,0,0,0|2,0,0]=4 6469 B14R1.536 CCC(Cc1ccc(N)cc1)C(=O)O Amb26304334 [0,2,0,0,0,0|1,0,0]=3 6470 B14R1.536 CCC(Nc1ccc(Br)cc1)C(=O)O Amb840609 [0,2,0,0,0,0|2,0,0]=4 6471 B14R1.536 CCC(Nc1ccc(C)cc1)C(=O)O Amb840593 [0,2,0,0,0,0|2,0,0]=4 6472 B14R1.536 CCC(Nc1ccc(F)cc1)C(=O)O Amb840603 [0,2,0,0,0,0|2,0,0]=4 6473 B14R1.536 CCC(Nc1ccc(I)cc1)C(=O)O Amb27181654 [0,2,0,0,0,0|2,0,0]=4 6474 B14R1.536 CCC(Oc1ccc(Br)cc1)C(=O)O Amb9702092 [0,2,0,0,0,0|2,0,0]=4 6475 B14R1.536 CCC(Oc1ccc(C)cc1)C(=O)O Amb9702342 [0,2,0,0,0,0|2,0,0]=4 6476 B14R1.536 CCC(Oc1ccc(Cl)cc1)C(=O)O Amb9702340 [0,2,0,0,0,0|2,0,0]=4 6477 B14R1.536 CCC(Oc1ccc(F)cc1)C(=O)O Amb9702343 [0,2,0,0,0,0|2,0,0]=4 6478 B14R1.536 CCC(Oc1ccc(I)cc1)C(=O)O Amb9233642 [0,2,0,0,0,0|2,0,0]=4 6479 B14R1.536 CCC(Oc1ccc(N)cc1)C(=O)O Amb839767 [0,2,0,0,0,0|2,0,0]=4 6480 B14R1.536 CCC(Sc1ccc(Cl)cc1)C(=O)O Amb9702124 [0,2,0,0,0,0|2,0,0]=4 6481 B14R1.536 CC[C@H](Nc1ccc(Cl)cc1)C(=O)O Amb27830068 [0,2,0,0,0,0|2,0,0]=4 6482 B14R1.536 CNC(Cc1ccc(O)cc1)C(=O)O Amb18652099 [0,2,0,0,0,0|0,0,0]=2 6483 B14R1.536 CN[C@@H](Cc1ccc(O)cc1)C(=O)O Amb17617887 [0,2,0,0,0,0|0,0,0]=2 6484 B14R1.536 CN[C@@H](Cc1ccc(O)cc1)C(=O)O Amb33802229 [0,2,0,0,0,0|0,0,0]=2 6485 B14R1.536 CN[C@H](Cc1ccc(O)cc1)C(=O)O Amb33952003 [0,2,0,0,0,0|0,0,0]=2 6486 B14R1.536 COC(Cc1ccc(Br)cc1)C(=O)O Amb23321116 [0,2,0,0,0,0|1,0,0]=3 6487 B14R1.536 COC(Cc1ccc(Br)cn1)C(=O)O Amb33477418 [0,2,0,0,0,0|2,0,0]=4 6488 B14R1.536 COC(Cc1ccc(Br)nc1)C(=O)O Amb33388413 [0,2,0,0,0,0|2,0,0]=4 6489 B14R1.536 COC(Cc1ccc(C)cc1)C(=O)O Amb23320726 [0,2,0,0,0,0|1,0,0]=3 6490 B14R1.536 COC(Cc1ccc(C)cn1)C(=O)O Amb33198380 [0,2,0,0,0,0|2,0,0]=4 6491 B14R1.536 COC(Cc1ccc(C)nc1)C(=O)O Amb32877447 [0,2,0,0,0,0|2,0,0]=4 6492 B14R1.536 COC(Cc1ccc(Cl)cc1)C(=O)O Amb16233253 [0,2,0,0,0,0|1,0,0]=3 6493 B14R1.536 COC(Cc1ccc(Cl)cn1)C(=O)O Amb33058531 [0,2,0,0,0,0|2,0,0]=4 6494 B14R1.536 COC(Cc1ccc(Cl)nc1)C(=O)O Amb33261595 [0,2,0,0,0,0|2,0,0]=4 6495 B14R1.536 COC(Cc1ccc(F)cc1)C(=O)O Amb23320970 [0,2,0,0,0,0|1,0,0]=3 6496 B14R1.536 COC(Cc1ccc(F)cn1)C(=O)O Amb33315583 [0,2,0,0,0,0|2,0,0]=4 6497 B14R1.536 COC(Cc1ccc(F)nc1)C(=O)O Amb33425505 [0,2,0,0,0,0|2,0,0]=4 6498 B14R1.536 COC(Cc1ccc(O)cc1)C(=O)O Amb32953565 [0,2,0,0,0,0|1,0,0]=3 6499 B14R1.536 Cc1ccc(CC(C#N)C(=O)O)cc1 Amb17090112 [0,2,0,0,0,0|0,0,1]=3 6500 B14R1.536 Cc1ccc(CC(C#N)C(=O)O)cn1 Amb29875741 [0,2,0,0,0,0|1,0,1]=4 6501 B14R1.536 Cc1ccc(CC(C#N)C(N)=O)cc1 Amb24525160 [0,2,0,0,0,0|1,0,1]=4 6502 B14R1.536 Cc1ccc(CC(CN)C(=O)O)cc1 Amb2697413 [0,2,0,0,0,0|0,0,0]=2 6503 B14R1.536 Cc1ccc(CC(CN)C(=O)O)cc1 Amb33550231 [0,2,0,0,0,0|0,0,0]=2 6504 B14R1.536 Cc1ccc(NC(CN)C(=O)O)cc1 Amb27623771 [0,2,0,0,0,0|1,0,0]=3 6505 B14R1.536 N#CC(Cc1ccc(Br)cc1)C(=O)O Amb8631522 [0,2,0,0,0,0|0,0,1]=3 6506 B14R1.536 N#CC(Cc1ccc(Br)cn1)C(=O)O Amb35584194 [0,2,0,0,0,0|1,0,1]=4 6507 B14R1.536 N#CC(Cc1ccc(Cl)cc1)C(=O)O Amb17090120 [0,2,0,0,0,0|0,0,1]=3 6508 B14R1.536 N#CC(Cc1ccc(Cl)cc1)C(N)=O Amb18656362 [0,2,0,0,0,0|1,0,1]=4 6509 B14R1.536 N#CC(Cc1ccc(Cl)nc1)C(=O)O Amb35584188 [0,2,0,0,0,0|1,0,1]=4 6510 B14R1.536 N#CC(Cc1ccc(F)cc1)C(=O)O Amb17090114 [0,2,0,0,0,0|0,0,1]=3 6511 B14R1.536 N#CC(Cc1ccc(I)cc1)C(=O)O Amb35584197 [0,2,0,0,0,0|0,0,1]=3 6512 B14R1.536 N#CC(Cc1ccc(O)cc1)C(=O)O Amb17090135 [0,2,0,0,0,0|0,0,1]=3 6513 B14R1.536 NCC(Cc1ccc(Br)cc1)C(=O)O Amb8631345 [0,2,0,0,0,0|0,0,0]=2 6514 B14R1.536 NCC(Cc1ccc(Cl)cc1)C(=O)O Amb19321135 [0,2,0,0,0,0|0,0,0]=2 6515 B14R1.536 NCC(Cc1ccc(Cl)cc1)C(=O)O Amb5744260 [0,2,0,0,0,0|0,0,0]=2 6516 B14R1.536 NCC(Cc1ccc(Cl)cc1)C(N)=O Amb21837690 [0,2,0,0,0,0|1,0,0]=3 6517 B14R1.536 NCC(Cc1ccc(F)cc1)C(=O)O Amb35748891 [0,2,0,0,0,0|0,0,0]=2 6518 B14R1.536 NCC(Cc1ccc(F)cc1)C(=O)O Amb5744254 [0,2,0,0,0,0|0,0,0]=2 6519 B14R1.536 NCC(Cc1ccc(F)cc1)C(N)=O Amb7800986 [0,2,0,0,0,0|1,0,0]=3 6520 B14R1.536 NCC(Nc1ccc(Cl)cc1)C(=O)O Amb27795414 [0,2,0,0,0,0|1,0,0]=3 6521 B14R1.536 NCC(Oc1ccc(Br)cc1)C(=O)O Amb33802914 [0,2,0,0,0,0|1,0,0]=3 6522 B14R1.536 NCC(Oc1ccc(F)cc1)C(=O)O Amb22059585 [0,2,0,0,0,0|1,0,0]=3 6523 B14R1.536 NCC(Oc1ccc(F)cc1)C(=O)O Amb33550344 [0,2,0,0,0,0|1,0,0]=3 6524 B14R1.536 O=C(O)\C(Cc1ccc(Br)cc1)=N/O Amb33042417 [0,2,0,0,0,0|0,0,2]=4 6525 B14R1.536 O=C(O)\C(Cc1ccc(Cl)cc1)=N/O Amb23603648 [0,2,0,0,0,0|0,0,2]=4 6526 B14R1.536 O=C(O)\C(Cc1ccc(F)cc1)=N/O Amb23603649 [0,2,0,0,0,0|0,0,2]=4 6527 B14R1.686 C=C(C)C(N)Cc1ccc(Cl)c(Cl)c1 Amb27595910 [0,2,0,0,0,0|2,0,0]=4 6528 B14R1.686 C=C(C)C(N)Cc1ccc(F)c(F)c1 Amb27214541 [0,2,0,0,0,0|2,0,0]=4 6529 B14R1.686 CC(=O)C(Br)Cc1ccc(C)c(Br)c1 Amb27761025 [0,2,0,0,0,0|2,0,0]=4 6530 B14R1.686 CC(=O)C(Br)Cc1ccc(C)c(C)c1 Amb18073361 [0,2,0,0,0,0|2,0,0]=4 6531 B14R1.686 CC(=O)C(Br)Cc1ccc(C)c(Cl)c1 Amb18077840 [0,2,0,0,0,0|2,0,0]=4 6532 B14R1.686 CC(=O)C(Br)Cc1ccc(F)c(C)c1 Amb27865239 [0,2,0,0,0,0|2,0,0]=4 6533 B14R1.686 CC(=O)C(Br)Cc1ccc(F)c(Cl)c1 Amb18079658 [0,2,0,0,0,0|2,0,0]=4 6534 B14R1.686 CC(=O)C(Br)Cc1ccc(F)c(F)c1 Amb18590643 [0,2,0,0,0,0|2,0,0]=4 6535 B14R1.686 CC(=O)C(C)Cc1ccc(Cl)c(C)c1 Amb33253042 [0,2,0,0,0,0|2,0,0]=4 6536 B14R1.686 CC(=O)C(C)Cc1ccc(Cl)c(Cl)c1 Amb17249289 [0,2,0,0,0,0|2,0,0]=4 6537 B14R1.686 CC(=O)C(C)Cc1ccc(F)c(C)c1 Amb18863906 [0,2,0,0,0,0|2,0,0]=4 6538 B14R1.686 CC(=O)C(C)Cc1ccc(F)c(Cl)c1 Amb18866565 [0,2,0,0,0,0|2,0,0]=4 6539 B14R1.686 CC(=O)C(C)Cc1ccc(F)c(F)c1 Amb18864140 [0,2,0,0,0,0|2,0,0]=4 6540 B14R1.686 CC(=O)C(Cl)Cc1ccc(Br)c(C)c1 Amb17204930 [0,2,0,0,0,0|2,0,0]=4 6541 B14R1.686 CC(=O)C(Cl)Cc1ccc(C)c(Br)c1 Amb17204927 [0,2,0,0,0,0|2,0,0]=4 6542 B14R1.686 CC(=O)C(Cl)Cc1ccc(C)c(C)c1 Amb17204430 [0,2,0,0,0,0|2,0,0]=4 6543 B14R1.686 CC(=O)C(Cl)Cc1ccc(C)c(Cl)c1 Amb17204557 [0,2,0,0,0,0|2,0,0]=4 6544 B14R1.686 CC(=O)C(Cl)Cc1ccc(Cl)c(Cl)c1 Amb17204742 [0,2,0,0,0,0|2,0,0]=4 6545 B14R1.686 CC(=O)C(Cl)Cc1ccc(F)c(Cl)c1 Amb17204610 [0,2,0,0,0,0|2,0,0]=4 6546 B14R1.686 CC(=O)C(Cl)Cc1ccc(F)c(F)c1 Amb17204489 [0,2,0,0,0,0|2,0,0]=4 6547 B14R1.686 CC(=O)C(N)Cc1ccc(Br)c(C)c1 Amb27755284 [0,2,0,0,0,0|1,0,0]=3 6548 B14R1.686 CC(=O)C(N)Cc1ccc(C)c(Br)c1 Amb25722250 [0,2,0,0,0,0|1,0,0]=3 6549 B14R1.686 CC(=O)C(N)Cc1ccc(C)c(Cl)c1 Amb24534876 [0,2,0,0,0,0|1,0,0]=3 6550 B14R1.686 CC(=O)C(N)Cc1ccc(Cl)c(Cl)c1 Amb24705585 [0,2,0,0,0,0|1,0,0]=3 6551 B14R1.686 CC(=O)C(N)Cc1ccc(F)c(Cl)c1 Amb25041795 [0,2,0,0,0,0|1,0,0]=3 6552 B14R1.686 CC(=O)C(N)Cc1ccc(F)c(F)c1 Amb25781802 [0,2,0,0,0,0|1,0,0]=3 6553 B14R1.686 CC(Cc1ccc(Br)c(Cl)c1)C(=O)O Amb25864504 [0,2,0,0,0,0|1,0,0]=3 6554 B14R1.686 CC(Cc1ccc(Br)c(F)c1)C(=O)O Amb24733936 [0,2,0,0,0,0|1,0,0]=3 6555 B14R1.686 CC(Cc1ccc(Br)c(O)c1)C(=O)O Amb24593252 [0,2,0,0,0,0|1,0,0]=3 6556 B14R1.686 CC(Cc1ccc(Cl)c(Br)c1)C(=O)O Amb26632873 [0,2,0,0,0,0|1,0,0]=3 6557 B14R1.686 CC(Cc1ccc(Cl)c(Cl)c1)C(=O)O Amb17605797 [0,2,0,0,0,0|1,0,0]=3 6558 B14R1.686 CC(Cc1ccc(Cl)c(F)c1)C(=O)O Amb28292035 [0,2,0,0,0,0|1,0,0]=3 6559 B14R1.686 CC(Cc1ccc(Cl)c(O)c1)C(=O)O Amb25854276 [0,2,0,0,0,0|1,0,0]=3 6560 B14R1.686 CC(Cc1ccc(F)c(Br)c1)C(=O)O Amb20629131 [0,2,0,0,0,0|1,0,0]=3 6561 B14R1.686 CC(Cc1ccc(F)c(Cl)c1)C(=O)O Amb28453814 [0,2,0,0,0,0|1,0,0]=3 6562 B14R1.686 CC(Cc1ccc(F)c(F)c1)C(=O)O Amb28282154 [0,2,0,0,0,0|1,0,0]=3 6563 B14R1.686 CC(Cc1ccc(F)c(O)c1)C(=O)O Amb25084258 [0,2,0,0,0,0|1,0,0]=3 6564 B14R1.686 CC(Cc1ccc(O)c(Br)c1)C(=O)O Amb33389518 [0,2,0,0,0,0|1,0,0]=3 6565 B14R1.686 CC(Cc1ccc(O)c(Cl)c1)C(=O)O Amb28058702 [0,2,0,0,0,0|1,0,0]=3 6566 B14R1.686 CC(Cc1ccc(O)c(F)c1)C(=O)O Amb10844160 [0,2,0,0,0,0|1,0,0]=3 6567 B14R1.686 CC(Cc1ccc(O)c(O)c1)C(=O)O Amb6298640 [0,2,0,0,0,0|1,0,0]=3 6568 B14R1.686 CC(Cc1cnc(Cl)c(Cl)c1)C(=O)O Amb33413596 [0,2,0,0,0,0|2,0,0]=4 6569 B14R1.686 CC(NC1=CC(=O)C(=O)C=C1)C(=O)O Amb27605250 [0,2,0,0,0,0|2,0,0]=4 6570 B14R1.686 CC(Nc1ccc(Br)c(I)c1)C(=O)O Amb27166952 [0,2,0,0,0,0|2,0,0]=4 6571 B14R1.686 CC(Nc1ccc(Cl)c(Cl)c1)C(=O)O Amb840573 [0,2,0,0,0,0|2,0,0]=4 6572 B14R1.686 CC(Nc1ccc(F)c(Cl)c1)C(=O)O Amb840580 [0,2,0,0,0,0|2,0,0]=4 6573 B14R1.686 CC(Nc1ccc(F)c(F)c1)C(=O)O Amb17402395 [0,2,0,0,0,0|2,0,0]=4 6574 B14R1.686 CC(Nc1ccc(O)c(Cl)c1)C(=O)O Amb27606192 [0,2,0,0,0,0|2,0,0]=4 6575 B14R1.686 CC(Nc1ccc(O)c(F)c1)C(=O)O Amb27405654 [0,2,0,0,0,0|2,0,0]=4 6576 B14R1.686 CC(Oc1ccc(Br)c(Cl)c1)C(=O)O Amb27650722 [0,2,0,0,0,0|2,0,0]=4 6577 B14R1.686 CC(Oc1ccc(Cl)c(Cl)c1)C(=O)O Amb33536646 [0,2,0,0,0,0|2,0,0]=4 6578 B14R1.686 CC(Oc1ccc(Cl)c(F)c1)C(=O)O Amb27596492 [0,2,0,0,0,0|2,0,0]=4 6579 B14R1.686 CC(Oc1ccc(F)c(Cl)c1)C(=O)O Amb1111292 [0,2,0,0,0,0|2,0,0]=4 6580 B14R1.686 CC(Oc1ccc(F)c(F)c1)C(=O)O Amb33536747 [0,2,0,0,0,0|2,0,0]=4 6581 B14R1.686 CC(Oc1ccc(S)c(Cl)c1)C(=O)O Amb27806715 [0,2,0,0,0,0|2,0,0]=4 6582 B14R1.686 CC(Oc1ccc(S)c(F)c1)C(=O)O Amb27983463 [0,2,0,0,0,0|2,0,0]=4 6583 B14R1.686 CC(Sc1ccc(Cl)c(Cl)c1)C(=O)O Amb5764596 [0,2,0,0,0,0|2,0,0]=4 6584 B14R1.686 CC1=CN(CC(N)C(N)=O)C=CC1=O Amb27642206 [0,2,0,0,0,0|2,0,0]=4 6585 B14R1.686 CN1C=C(CC(N)C(=O)O)C=CC1=O Amb26329935 [0,2,0,0,0,0|1,0,0]=3 6586 B14R1.686 CN1C=C(C[C@H](N)C(=O)O)C=CC1=O Amb27405878 [0,2,0,0,0,0|1,0,0]=3 6587 B14R1.686 C[C@@H](Oc1ccc(Br)c(Cl)c1)C(=O)O Amb27984182 [0,2,0,0,0,0|2,0,0]=4 6588 B14R1.686 C[C@@H](Oc1ccc(Cl)c(F)c1)C(=O)O Amb27971470 [0,2,0,0,0,0|2,0,0]=4 6589 B14R1.686 C[C@@H](Oc1ccc(F)c(Br)c1)C(=O)O Amb28289847 [0,2,0,0,0,0|2,0,0]=4 6590 B14R1.686 C[C@@H](Oc1ccc(F)c(Cl)c1)C(=O)O Amb28191245 [0,2,0,0,0,0|2,0,0]=4 6591 B14R1.686 C[C@@H](Oc1ccc(F)c(F)c1)C(=O)O Amb28198308 [0,2,0,0,0,0|2,0,0]=4 6592 B14R1.686 C[C@H](Oc1ccc(Br)c(Cl)c1)C(=O)O Amb28137316 [0,2,0,0,0,0|2,0,0]=4 6593 B14R1.686 Cc1cc(CC(=O)C(=O)O)ccc1Br Amb25054918 [0,2,0,0,0,0|1,0,1]=4 6594 B14R1.686 Cc1cc(CC(=O)C(=O)O)ccc1Cl Amb33252607 [0,2,0,0,0,0|1,0,1]=4 6595 B14R1.686 Cc1cc(CC(=O)C(=O)O)ccc1F Amb18295687 [0,2,0,0,0,0|1,0,1]=4 6596 B14R1.686 Cc1cc(CC(=O)C(=O)O)ccc1O Amb27634926 [0,2,0,0,0,0|1,0,1]=4 6597 B14R1.686 Cc1cc(CC(Br)C(N)=O)ccc1Br Amb27648642 [0,2,0,0,0,0|2,0,0]=4 6598 B14R1.686 Cc1cc(CC(C)C(=O)O)ccc1Br Amb27486235 [0,2,0,0,0,0|1,0,0]=3 6599 B14R1.686 Cc1cc(CC(C)C(=O)O)ccc1Cl Amb26970173 [0,2,0,0,0,0|1,0,0]=3 6600 B14R1.686 Cc1cc(CC(C)C(=O)O)ccc1F Amb25807813 [0,2,0,0,0,0|1,0,0]=3 6601 B14R1.686 Cc1cc(CC(C)C(=O)O)ccc1O Amb25028881 [0,2,0,0,0,0|1,0,0]=3 6602 B14R1.686 Cc1cc(CC(C)C(=O)O)cnc1Cl Amb33058192 [0,2,0,0,0,0|2,0,0]=4 6603 B14R1.686 Cc1cc(CC(Cl)C(=O)O)ccc1Br Amb17204950 [0,2,0,0,0,0|1,0,0]=3 6604 B14R1.686 Cc1cc(CC(Cl)C(N)=O)ccc1Br Amb17204939 [0,2,0,0,0,0|2,0,0]=4 6605 B14R1.686 Cc1cc(CC(F)C(=O)O)ccc1Br Amb27880025 [0,2,0,0,0,0|1,0,0]=3 6606 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1Br Amb25905944 [0,2,0,0,0,0|0,0,0]=2 6607 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1Cl Amb22043837 [0,2,0,0,0,0|0,0,0]=2 6608 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1F Amb18300563 [0,2,0,0,0,0|0,0,0]=2 6609 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1I Amb27778554 [0,2,0,0,0,0|0,0,0]=2 6610 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1N Amb27202735 [0,2,0,0,0,0|0,0,0]=2 6611 B14R1.686 Cc1cc(CC(N)C(=O)O)ccc1O Amb27748360 [0,2,0,0,0,0|0,0,0]=2 6612 B14R1.686 Cc1cc(CC(N)C(=O)O)cnc1Cl Amb25324072 [0,2,0,0,0,0|1,0,0]=3 6613 B14R1.686 Cc1cc(CC(N)C(=O)O)ncc1Br Amb27866459 [0,2,0,0,0,0|1,0,0]=3 6614 B14R1.686 Cc1cc(CC(N)C(N)=O)ccc1Cl Amb33252739 [0,2,0,0,0,0|1,0,0]=3 6615 B14R1.686 Cc1cc(CC(O)C(=O)O)ccc1Br Amb33353329 [0,2,0,0,0,0|1,0,0]=3 6616 B14R1.686 Cc1cc(CC(O)C(=O)O)ccc1Cl Amb33252683 [0,2,0,0,0,0|1,0,0]=3 6617 B14R1.686 Cc1cc(CC(O)C(=O)O)ccc1F Amb33353418 [0,2,0,0,0,0|1,0,0]=3 6618 B14R1.686 Cc1cc(CC(O)C(=O)O)cnc1Cl Amb33485377 [0,2,0,0,0,0|2,0,0]=4 6619 B14R1.686 Cc1cc(C[C@@H](N)C(=O)O)ccc1Cl Amb26895842 [0,2,0,0,0,0|0,0,0]=2 6620 B14R1.686 Cc1cc(C[C@@H](N)C(=O)O)ncc1Br Amb27181900 [0,2,0,0,0,0|1,0,0]=3 6621 B14R1.686 Cc1cc(C[C@H](N)C(=O)O)ccc1Br Amb27623289 [0,2,0,0,0,0|0,0,0]=2 6622 B14R1.686 Cc1cc(C[C@H](N)C(=O)O)ccc1Cl Amb27419630 [0,2,0,0,0,0|0,0,0]=2 6623 B14R1.686 Cc1cc(C[C@H](N)C(=O)O)ccc1F Amb27402785 [0,2,0,0,0,0|0,0,0]=2 6624 B14R1.686 Cc1cc(C[C@H](N)C(=O)O)ccc1I Amb27611992 [0,2,0,0,0,0|0,0,0]=2 6625 B14R1.686 Cc1cc(C[C@H](N)C(=O)O)ccc1O Amb24655787 [0,2,0,0,0,0|0,0,0]=2 6626 B14R1.686 Cc1cc(NC(C)C(=O)O)ccc1Br Amb17415255 [0,2,0,0,0,0|2,0,0]=4 6627 B14R1.686 Cc1cc(NC(C)C(=O)O)ccc1F Amb18998952 [0,2,0,0,0,0|2,0,0]=4 6628 B14R1.686 Cc1cc(OC(C)C(=O)O)ccc1Br Amb5770426 [0,2,0,0,0,0|2,0,0]=4 6629 B14R1.686 Cc1cc(OC(C)C(=O)O)ccc1Cl Amb9705909 [0,2,0,0,0,0|2,0,0]=4 6630 B14R1.686 Cc1cc(OC(C)C(=O)O)ccc1N Amb18301893 [0,2,0,0,0,0|2,0,0]=4 6631 B14R1.686 Cc1cc(O[C@H](C)C(=O)O)ccc1Br Amb27857033 [0,2,0,0,0,0|2,0,0]=4 6632 B14R1.686 Cc1cc(O[C@H](C)C(=O)O)ccc1F Amb27171732 [0,2,0,0,0,0|2,0,0]=4 6633 B14R1.686 Cc1cc(SC(C)C(=O)O)ccc1Cl Amb17083290 [0,2,0,0,0,0|2,0,0]=4 6634 B14R1.686 Cc1cc(SC(C)C(=O)O)ccc1F Amb17083277 [0,2,0,0,0,0|2,0,0]=4 6635 B14R1.686 Cc1cc(SC(C)C(=O)O)ccc1N Amb28290018 [0,2,0,0,0,0|2,0,0]=4 6636 B14R1.686 Cc1cc(SC(F)C(=O)O)ccc1N Amb27201193 [0,2,0,0,0,0|2,0,0]=4 6637 B14R1.686 Cc1ccc(CC(=O)C(=O)O)cc1Br Amb25692628 [0,2,0,0,0,0|1,0,1]=4 6638 B14R1.686 Cc1ccc(CC(=O)C(=O)O)cc1C Amb9618615 [0,2,0,0,0,0|1,0,1]=4 6639 B14R1.686 Cc1ccc(CC(=O)C(=O)O)cc1Cl Amb26850957 [0,2,0,0,0,0|1,0,1]=4 6640 B14R1.686 Cc1ccc(CC(=O)C(=O)O)cc1F Amb26961516 [0,2,0,0,0,0|1,0,1]=4 6641 B14R1.686 Cc1ccc(CC(=O)C(=O)O)cc1O Amb33312038 [0,2,0,0,0,0|1,0,1]=4 6642 B14R1.686 Cc1ccc(CC(Br)C(=O)O)cc1C Amb23320609 [0,2,0,0,0,0|1,0,0]=3 6643 B14R1.686 Cc1ccc(CC(Br)C(=O)O)cc1Cl Amb23320628 [0,2,0,0,0,0|1,0,0]=3 6644 B14R1.686 Cc1ccc(CC(Br)C(N)=O)cc1C Amb28364562 [0,2,0,0,0,0|2,0,0]=4 6645 B14R1.686 Cc1ccc(CC(Br)C(N)=O)cc1Cl Amb27600315 [0,2,0,0,0,0|2,0,0]=4 6646 B14R1.686 Cc1ccc(CC(Br)C(N)=O)cc1F Amb28124166 [0,2,0,0,0,0|2,0,0]=4 6647 B14R1.686 Cc1ccc(CC(Br)C(N)=O)cc1I Amb28325385 [0,2,0,0,0,0|2,0,0]=4 6648 B14R1.686 Cc1ccc(CC(C)C(=O)O)cc1Br Amb25916023 [0,2,0,0,0,0|1,0,0]=3 6649 B14R1.686 Cc1ccc(CC(C)C(=O)O)cc1C Amb17605829 [0,2,0,0,0,0|1,0,0]=3 6650 B14R1.686 Cc1ccc(CC(C)C(=O)O)cc1Cl Amb25827789 [0,2,0,0,0,0|1,0,0]=3 6651 B14R1.686 Cc1ccc(CC(C)C(=O)O)cc1F Amb27456891 [0,2,0,0,0,0|1,0,0]=3 6652 B14R1.686 Cc1ccc(CC(C)C(=O)O)cc1O Amb28138405 [0,2,0,0,0,0|1,0,0]=3 6653 B14R1.686 Cc1ccc(CC(Cl)C(=O)O)cc1Br Amb17204947 [0,2,0,0,0,0|1,0,0]=3 6654 B14R1.686 Cc1ccc(CC(Cl)C(=O)O)cc1C Amb17204442 [0,2,0,0,0,0|1,0,0]=3 6655 B14R1.686 Cc1ccc(CC(Cl)C(=O)O)cc1Cl Amb17204588 [0,2,0,0,0,0|1,0,0]=3 6656 B14R1.686 Cc1ccc(CC(Cl)C(N)=O)cc1Br Amb17204936 [0,2,0,0,0,0|2,0,0]=4 6657 B14R1.686 Cc1ccc(CC(Cl)C(N)=O)cc1C Amb17204436 [0,2,0,0,0,0|2,0,0]=4 6658 B14R1.686 Cc1ccc(CC(Cl)C(N)=O)cc1Cl Amb17204561 [0,2,0,0,0,0|2,0,0]=4 6659 B14R1.686 Cc1ccc(CC(Cl)C(N)=O)cc1I Amb28325384 [0,2,0,0,0,0|2,0,0]=4 6660 B14R1.686 Cc1ccc(CC(F)C(=O)O)cc1Br Amb27855707 [0,2,0,0,0,0|1,0,0]=3 6661 B14R1.686 Cc1ccc(CC(F)C(=O)O)cc1C Amb28388230 [0,2,0,0,0,0|1,0,0]=3 6662 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1Br Amb27950726 [0,2,0,0,0,0|0,0,0]=2 6663 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1C Amb28600466 [0,2,0,0,0,0|0,0,0]=2 6664 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1C Amb9618621 [0,2,0,0,0,0|0,0,0]=2 6665 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1Cl Amb24756671 [0,2,0,0,0,0|0,0,0]=2 6666 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1F Amb22047660 [0,2,0,0,0,0|0,0,0]=2 6667 B14R1.686 Cc1ccc(CC(N)C(=O)O)cc1O Amb25840843 [0,2,0,0,0,0|0,0,0]=2 6668 B14R1.686 Cc1ccc(CC(N)C(N)=O)cc1Br Amb28421814 [0,2,0,0,0,0|1,0,0]=3 6669 B14R1.686 Cc1ccc(CC(O)C(=O)O)cc1Br Amb24339477 [0,2,0,0,0,0|1,0,0]=3 6670 B14R1.686 Cc1ccc(CC(O)C(=O)O)cc1C Amb24726250 [0,2,0,0,0,0|1,0,0]=3 6671 B14R1.686 Cc1ccc(CC(O)C(=O)O)cc1Cl Amb24456663 [0,2,0,0,0,0|1,0,0]=3 6672 B14R1.686 Cc1ccc(CC(O)C(=O)O)cc1F Amb33353474 [0,2,0,0,0,0|1,0,0]=3 6673 B14R1.686 Cc1ccc(CC(O)C(=O)O)cc1O Amb33310512 [0,2,0,0,0,0|1,0,0]=3 6674 B14R1.686 Cc1ccc(CC(S)C(=O)O)cc1C Amb423626 [0,2,0,0,0,0|1,0,0]=3 6675 B14R1.686 Cc1ccc(C[C@H](N)C(=O)O)cc1C Amb16231648 [0,2,0,0,0,0|0,0,0]=2 6676 B14R1.686 Cc1ccc(NC(C)C(=O)O)cc1Br Amb17415253 [0,2,0,0,0,0|2,0,0]=4 6677 B14R1.686 Cc1ccc(NC(C)C(=O)O)cc1C Amb840572 [0,2,0,0,0,0|2,0,0]=4 6678 B14R1.686 Cc1ccc(NC(C)C(=O)O)cc1Cl Amb17404302 [0,2,0,0,0,0|2,0,0]=4 6679 B14R1.686 Cc1ccc(NC(C)C(=O)O)cc1F Amb18981765 [0,2,0,0,0,0|2,0,0]=4 6680 B14R1.686 Cc1ccc(OC(C)C(=O)O)cc1C Amb9702605 [0,2,0,0,0,0|2,0,0]=4 6681 B14R1.686 Cc1ccc(OC(C)C(=O)O)cc1Cl Amb6550984 [0,2,0,0,0,0|2,0,0]=4 6682 B14R1.686 Cc1ccc(OC(F)C(=O)O)cc1Br Amb27421656 [0,2,0,0,0,0|2,0,0]=4 6683 B14R1.686 Cc1ccc(O[C@@H](C)C(=O)O)cc1C Amb28454561 [0,2,0,0,0,0|2,0,0]=4 6684 B14R1.686 Cc1ccc(O[C@H](C)C(=O)O)cc1Br Amb28062355 [0,2,0,0,0,0|2,0,0]=4 6685 B14R1.686 Cc1ccc(O[C@H](C)C(=O)O)cc1C Amb27425522 [0,2,0,0,0,0|2,0,0]=4 6686 B14R1.686 Cc1ccc(SC(C)C(=O)O)cc1C Amb1119990 [0,2,0,0,0,0|2,0,0]=4 6687 B14R1.686 Cc1ccc(\C=C(\N)C(=O)O)cc1C Amb27394333 [0,2,0,0,0,0|0,0,2]=4 6688 B14R1.686 Cc1nc(CC(N)C(=O)O)ccc1Br Amb27419542 [0,2,0,0,0,0|1,0,0]=3 6689 B14R1.686 N=C1C=C(CC(N)C(=O)O)C=CC1=O Amb28040992 [0,2,0,0,0,0|0,0,0]=2 6690 B14R1.686 NC(=O)C(Br)Cc1ccc(Cl)c(Cl)c1 Amb27474464 [0,2,0,0,0,0|2,0,0]=4 6691 B14R1.686 NC(=O)C(Br)Cc1ccc(I)c(Br)c1 Amb27958258 [0,2,0,0,0,0|2,0,0]=4 6692 B14R1.686 NC(=O)C(Cl)Cc1ccc(Cl)c(Br)c1 Amb28207834 [0,2,0,0,0,0|2,0,0]=4 6693 B14R1.686 NC(=O)C(Cl)Cc1ccc(Cl)c(Cl)c1 Amb17204749 [0,2,0,0,0,0|2,0,0]=4 6694 B14R1.686 NC(=O)C(Cl)Cc1ccc(F)c(Cl)c1 Amb17204613 [0,2,0,0,0,0|2,0,0]=4 6695 B14R1.686 NC(=O)C(Cl)Cc1ccc(F)c(F)c1 Amb17204498 [0,2,0,0,0,0|2,0,0]=4 6696 B14R1.686 NC(=O)C(O)Cc1ccc(O)c(O)c1 Amb27166003 [0,2,0,0,0,0|2,0,0]=4 6697 B14R1.686 NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 Amb19053055 [0,2,0,0,0,0|1,0,0]=3 6698 B14R1.686 NC(=O)[C@@H](N)Cc1ccc(O)c(O)c1 Amb34149667 [0,2,0,0,0,0|1,0,0]=3 6699 B14R1.686 NC(=O)[C@H](O)Cc1ccc(O)c(O)c1 Amb28119242 [0,2,0,0,0,0|2,0,0]=4 6700 B14R1.686 NC(CC1=CC(=O)N(O)C=C1)C(=O)O Amb27392385 [0,2,0,0,0,0|1,0,0]=3 6701 B14R1.686 NC(Cc1cc(Br)c(O)cn1)C(=O)O Amb32757502 [0,2,0,0,0,0|1,0,0]=3 6702 B14R1.686 NC(Cc1cc(Br)c(O)cn1)C(=O)O Amb32757503 [0,2,0,0,0,0|1,0,0]=3 6703 B14R1.686 NC(Cc1ccc(Br)c(Br)c1)C(=O)O Amb3803502 [0,2,0,0,0,0|0,0,0]=2 6704 B14R1.686 NC(Cc1ccc(Br)c(Cl)c1)C(=O)O Amb27187146 [0,2,0,0,0,0|0,0,0]=2 6705 B14R1.686 NC(Cc1ccc(Br)c(F)c1)C(=O)O Amb27200293 [0,2,0,0,0,0|0,0,0]=2 6706 B14R1.686 NC(Cc1ccc(Br)c(I)c1)C(=O)O Amb28132605 [0,2,0,0,0,0|0,0,0]=2 6707 B14R1.686 NC(Cc1ccc(Cl)c(Br)c1)C(=O)O Amb27814369 [0,2,0,0,0,0|0,0,0]=2 6708 B14R1.686 NC(Cc1ccc(Cl)c(Cl)c1)C(=O)O Amb33532661 [0,2,0,0,0,0|0,0,0]=2 6709 B14R1.686 NC(Cc1ccc(Cl)c(F)c1)C(=O)O Amb18300562 [0,2,0,0,0,0|0,0,0]=2 6710 B14R1.686 NC(Cc1ccc(F)c(Br)c1)C(=O)O Amb6260292 [0,2,0,0,0,0|0,0,0]=2 6711 B14R1.686 NC(Cc1ccc(F)c(Cl)c1)C(=O)O Amb18226045 [0,2,0,0,0,0|0,0,0]=2 6712 B14R1.686 NC(Cc1ccc(F)c(F)c1)C(=O)O Amb9723789 [0,2,0,0,0,0|0,0,0]=2 6713 B14R1.686 NC(Cc1ccc(F)c(O)c1)C(=O)O Amb24117508 [0,2,0,0,0,0|0,0,0]=2 6714 B14R1.686 NC(Cc1ccc(F)c(O)c1)C(=O)O Amb24671256 [0,2,0,0,0,0|0,0,0]=2 6715 B14R1.686 NC(Cc1ccc(O)c(Br)c1)C(=O)O Amb20243421 [0,2,0,0,0,0|0,0,0]=2 6716 B14R1.686 NC(Cc1ccc(O)c(Cl)c1)C(=O)O Amb9809976 [0,2,0,0,0,0|0,0,0]=2 6717 B14R1.686 NC(Cc1ccc(O)c(Cl)n1)C(=O)O Amb27957920 [0,2,0,0,0,0|1,0,0]=3 6718 B14R1.686 NC(Cc1ccc(O)c(F)c1)C(=O)O Amb543070 [0,2,0,0,0,0|0,0,0]=2 6719 B14R1.686 NC(Cc1ccc(O)c(O)c1)C(=O)O Amb1216479 [0,2,0,0,0,0|0,0,0]=2 6720 B14R1.686 NC(Cc1ccc(O)c(S)c1)C(=O)O Amb27237544 [0,2,0,0,0,0|0,0,0]=2 6721 B14R1.686 NC(Cc1cnc(Br)c(Br)c1)C(=O)O Amb25940659 [0,2,0,0,0,0|1,0,0]=3 6722 B14R1.686 NC(Cc1cnc(Br)c(Br)c1)C(=O)O Amb35750230 [0,2,0,0,0,0|1,0,0]=3 6723 B14R1.686 NC(Cc1cnc(Cl)c(Cl)c1)C(=O)O Amb27419582 [0,2,0,0,0,0|1,0,0]=3 6724 B14R1.686 NC(Cc1cnc(Cl)c(Cl)c1)C(=O)O Amb33734659 [0,2,0,0,0,0|1,0,0]=3 6725 B14R1.686 N[C@@H](CN1C=CC(=O)C(O)=C1)C(=O)O Amb18511712 [0,2,0,0,0,0|1,0,0]=3 6726 B14R1.686 N[C@@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O Amb8397013 [0,2,0,0,0,0|0,0,0]=2 6727 B14R1.686 N[C@@H](Cc1ccc(F)c(Br)c1)C(=O)O Amb27771071 [0,2,0,0,0,0|0,0,0]=2 6728 B14R1.686 N[C@@H](Cc1ccc(F)c(Cl)c1)C(=O)O Amb25194777 [0,2,0,0,0,0|0,0,0]=2 6729 B14R1.686 N[C@@H](Cc1ccc(F)c(F)c1)C(=O)O Amb6295895 [0,2,0,0,0,0|0,0,0]=2 6730 B14R1.686 N[C@@H](Cc1ccc(F)c(O)c1)C(=O)O Amb26603761 [0,2,0,0,0,0|0,0,0]=2 6731 B14R1.686 N[C@@H](Cc1ccc(I)c(Cl)c1)C(=O)O Amb27794594 [0,2,0,0,0,0|0,0,0]=2 6732 B14R1.686 N[C@@H](Cc1ccc(O)c(Br)c1)C(=O)O Amb22229234 [0,2,0,0,0,0|0,0,0]=2 6733 B14R1.686 N[C@@H](Cc1ccc(O)c(Cl)c1)C(=O)O Amb16233351 [0,2,0,0,0,0|0,0,0]=2 6734 B14R1.686 N[C@@H](Cc1ccc(O)c(Cl)c1)C(=O)O Amb3941674 [0,2,0,0,0,0|0,0,0]=2 6735 B14R1.686 N[C@@H](Cc1ccc(O)c(F)c1)C(=O)O Amb9825637 [0,2,0,0,0,0|0,0,0]=2 6736 B14R1.686 N[C@@H](Cc1ccc(O)c(I)c1)C(=O)O Amb8513194 [0,2,0,0,0,0|0,0,0]=2 6737 B14R1.686 N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O Amb25671225 [0,2,0,0,0,0|0,0,0]=2 6738 B14R1.686 N[C@@H](Cc1ccc(O)c(O)c1)C(=O)O Amb536112 [0,2,0,0,0,0|0,0,0]=2 6739 B14R1.686 N[C@@H](Cc1cnc(Br)c(Br)c1)C(=O)O Amb27877691 [0,2,0,0,0,0|1,0,0]=3 6740 B14R1.686 N[C@@H](Cc1cnc(Cl)c(Br)c1)C(=O)O Amb27482641 [0,2,0,0,0,0|1,0,0]=3 6741 B14R1.686 N[C@@H](Cc1cnc(F)c(F)c1)C(=O)O Amb28042861 [0,2,0,0,0,0|1,0,0]=3 6742 B14R1.686 N[C@@H](\C=C1\C=CC(=O)C(O)=C1)C(=O)O Amb27776906 [0,2,0,0,0,0|0,0,1]=3 6743 B14R1.686 N[C@H](Cc1ccc(Br)c(F)c1)C(=O)O Amb27462063 [0,2,0,0,0,0|0,0,0]=2 6744 B14R1.686 N[C@H](Cc1ccc(Cl)c(Cl)c1)C(=O)O Amb8397014 [0,2,0,0,0,0|0,0,0]=2 6745 B14R1.686 N[C@H](Cc1ccc(Cl)c(I)c1)C(=O)O Amb27876669 [0,2,0,0,0,0|0,0,0]=2 6746 B14R1.686 N[C@H](Cc1ccc(F)c(Br)c1)C(=O)O Amb28350659 [0,2,0,0,0,0|0,0,0]=2 6747 B14R1.686 N[C@H](Cc1ccc(F)c(Cl)c1)C(=O)O Amb27619142 [0,2,0,0,0,0|0,0,0]=2 6748 B14R1.686 N[C@H](Cc1ccc(F)c(F)c1)C(=O)O Amb8396990 [0,2,0,0,0,0|0,0,0]=2 6749 B14R1.686 N[C@H](Cc1ccc(F)c(I)c1)C(=O)O Amb27947510 [0,2,0,0,0,0|0,0,0]=2 6750 B14R1.686 N[C@H](Cc1ccc(F)c(O)c1)C(=O)O Amb28397861 [0,2,0,0,0,0|0,0,0]=2 6751 B14R1.686 N[C@H](Cc1ccc(O)c(Br)c1)C(=O)O Amb22229233 [0,2,0,0,0,0|0,0,0]=2 6752 B14R1.686 N[C@H](Cc1ccc(O)c(Cl)c1)C(=O)O Amb16231682 [0,2,0,0,0,0|0,0,0]=2 6753 B14R1.686 N[C@H](Cc1ccc(O)c(F)c1)C(=O)O Amb10839960 [0,2,0,0,0,0|0,0,0]=2 6754 B14R1.686 N[C@H](Cc1ccc(O)c(I)c1)C(=O)O Amb10072403 [0,2,0,0,0,0|0,0,0]=2 6755 B14R1.686 N[C@H](Cc1ccc(O)c(O)c1)C(=O)O Amb17613565 [0,2,0,0,0,0|0,0,0]=2 6756 B14R1.686 N\C(=C\c1ccc(F)c(Cl)c1)C(=O)O Amb29877699 [0,2,0,0,0,0|0,0,2]=4 6757 B14R1.686 N\C(=C\c1ccc(O)c(O)c1)C(=O)O Amb27597157 [0,2,0,0,0,0|0,0,2]=4 6758 B14R1.686 Nc1cc(CC(N)C(=O)O)ccc1Br Amb27780638 [0,2,0,0,0,0|0,0,0]=2 6759 B14R1.686 Nc1cc(CC(N)C(=O)O)ccc1O Amb8390371 [0,2,0,0,0,0|0,0,0]=2 6760 B14R1.686 Nc1cc(CC(N)C(=O)O)cnc1F Amb27831911 [0,2,0,0,0,0|1,0,0]=3 6761 B14R1.686 Nc1cc(C[C@@H](N)C(=O)O)ccc1O Amb10072243 [0,2,0,0,0,0|0,0,0]=2 6762 B14R1.686 Nc1cc(C[C@@H](N)C(=O)O)ccc1O Amb22750576 [0,2,0,0,0,0|0,0,0]=2 6763 B14R1.686 Nc1cc(C[C@@H](N)C(=O)O)ccc1O Amb31206985 [0,2,0,0,0,0|0,0,0]=2 6764 B14R1.686 Nc1cc(C[C@@H](N)C(=O)O)cnc1N Amb27748308 [0,2,0,0,0,0|1,0,0]=3 6765 B14R1.686 Nc1cc(C[C@H](N)C(=O)O)ccc1Cl Amb28239608 [0,2,0,0,0,0|0,0,0]=2 6766 B14R1.686 Nc1cc(C[C@H](N)C(=O)O)ccc1F Amb27748315 [0,2,0,0,0,0|0,0,0]=2 6767 B14R1.686 Nc1cc(C[C@H](N)C(=O)O)ccc1O Amb16231672 [0,2,0,0,0,0|0,0,0]=2 6768 B14R1.686 Nc1cc(C[C@H](N)C(=O)O)ccc1O Amb3941700 [0,2,0,0,0,0|0,0,0]=2 6769 B14R1.686 Nc1cc(C[C@H](N)C(=O)O)cnc1F Amb27468652 [0,2,0,0,0,0|1,0,0]=3 6770 B14R1.686 Nc1ccc(CC(N)C(=O)O)cc1Cl Amb27487313 [0,2,0,0,0,0|0,0,0]=2 6771 B14R1.686 Nc1ccc(CC(N)C(=O)O)cc1O Amb22054329 [0,2,0,0,0,0|0,0,0]=2 6772 B14R1.686 Nc1ccc(C[C@@H](N)C(=O)O)cc1Cl Amb27978972 [0,2,0,0,0,0|0,0,0]=2 6773 B14R1.686 Nc1ccc(C[C@@H](N)C(=O)O)cc1F Amb27748146 [0,2,0,0,0,0|0,0,0]=2 6774 B14R1.686 Nc1ccc(SC(F)C(=O)O)cc1Cl Amb27232331 [0,2,0,0,0,0|2,0,0]=4 6775 B14R1.686 Nc1ncc(C[C@H](N)C(=O)O)cc1I Amb27393079 [0,2,0,0,0,0|1,0,0]=3 6776 B14R1.686 O=C(O)C(=O)Cc1ccc(Br)c(Br)c1 Amb25860889 [0,2,0,0,0,0|1,0,1]=4 6777 B14R1.686 O=C(O)C(=O)Cc1ccc(Br)c(Cl)c1 Amb25220059 [0,2,0,0,0,0|1,0,1]=4 6778 B14R1.686 O=C(O)C(=O)Cc1ccc(Br)c(F)c1 Amb24591367 [0,2,0,0,0,0|1,0,1]=4 6779 B14R1.686 O=C(O)C(=O)Cc1ccc(Cl)c(Br)c1 Amb25134658 [0,2,0,0,0,0|1,0,1]=4 6780 B14R1.686 O=C(O)C(=O)Cc1ccc(Cl)c(Cl)c1 Amb1126045 [0,2,0,0,0,0|1,0,1]=4 6781 B14R1.686 O=C(O)C(=O)Cc1ccc(Cl)c(F)c1 Amb18980641 [0,2,0,0,0,0|1,0,1]=4 6782 B14R1.686 O=C(O)C(=O)Cc1ccc(F)c(Br)c1 Amb1133011 [0,2,0,0,0,0|1,0,1]=4 6783 B14R1.686 O=C(O)C(=O)Cc1ccc(F)c(Cl)c1 Amb24462337 [0,2,0,0,0,0|1,0,1]=4 6784 B14R1.686 O=C(O)C(=O)Cc1ccc(F)c(F)c1 Amb1138787 [0,2,0,0,0,0|1,0,1]=4 6785 B14R1.686 O=C(O)C(=O)Cc1ccc(O)c(Br)c1 Amb27762918 [0,2,0,0,0,0|1,0,1]=4 6786 B14R1.686 O=C(O)C(=O)Cc1ccc(O)c(Cl)c1 Amb18980953 [0,2,0,0,0,0|1,0,1]=4 6787 B14R1.686 O=C(O)C(=O)Cc1ccc(O)c(F)c1 Amb24655684 [0,2,0,0,0,0|1,0,1]=4 6788 B14R1.686 O=C(O)C(=O)Cc1ccc(O)c(O)c1 Amb1127083 [0,2,0,0,0,0|1,0,1]=4 6789 B14R1.686 O=C(O)C(=S)Cc1ccc(O)c(O)c1 Amb27789565 [0,2,0,0,0,0|1,0,1]=4 6790 B14R1.686 O=C(O)C(Br)Cc1ccc(Cl)c(Cl)c1 Amb10576762 [0,2,0,0,0,0|1,0,0]=3 6791 B14R1.686 O=C(O)C(Br)Cc1ccc(F)c(Cl)c1 Amb26934988 [0,2,0,0,0,0|1,0,0]=3 6792 B14R1.686 O=C(O)C(Br)Cc1ccc(F)c(F)c1 Amb25854960 [0,2,0,0,0,0|1,0,0]=3 6793 B14R1.686 O=C(O)C(Cl)Cc1ccc(Cl)c(Cl)c1 Amb17204773 [0,2,0,0,0,0|1,0,0]=3 6794 B14R1.686 O=C(O)C(Cl)Cc1ccc(F)c(Cl)c1 Amb17204626 [0,2,0,0,0,0|1,0,0]=3 6795 B14R1.686 O=C(O)C(Cl)Cc1ccc(F)c(F)c1 Amb17204501 [0,2,0,0,0,0|1,0,0]=3 6796 B14R1.686 O=C(O)C(F)Cc1ccc(Br)c(Br)c1 Amb27621221 [0,2,0,0,0,0|1,0,0]=3 6797 B14R1.686 O=C(O)C(F)Cc1ccc(Br)c(Cl)c1 Amb27206739 [0,2,0,0,0,0|1,0,0]=3 6798 B14R1.686 O=C(O)C(F)Cc1ccc(F)c(F)c1 Amb28388231 [0,2,0,0,0,0|1,0,0]=3 6799 B14R1.686 O=C(O)C(F)Cc1ccc(O)c(Cl)c1 Amb28068254 [0,2,0,0,0,0|1,0,0]=3 6800 B14R1.686 O=C(O)C(F)Cc1ccc(O)c(O)c1 Amb25790634 [0,2,0,0,0,0|1,0,0]=3 6801 B14R1.686 O=C(O)C(F)Oc1ccc(Cl)c(F)c1 Amb24442658 [0,2,0,0,0,0|2,0,0]=4 6802 B14R1.686 O=C(O)C(F)Oc1ccc(F)c(Br)c1 Amb27792645 [0,2,0,0,0,0|2,0,0]=4 6803 B14R1.686 O=C(O)C(F)Sc1ccc(F)c(Cl)c1 Amb27871185 [0,2,0,0,0,0|2,0,0]=4 6804 B14R1.686 O=C(O)C(F)Sc1ccc(F)c(F)c1 Amb27948378 [0,2,0,0,0,0|2,0,0]=4 6805 B14R1.686 O=C(O)C(O)Cc1ccc(Br)c(Br)c1 Amb33353493 [0,2,0,0,0,0|1,0,0]=3 6806 B14R1.686 O=C(O)C(O)Cc1ccc(Br)c(Cl)c1 Amb33353437 [0,2,0,0,0,0|1,0,0]=3 6807 B14R1.686 O=C(O)C(O)Cc1ccc(Br)c(F)c1 Amb33353378 [0,2,0,0,0,0|1,0,0]=3 6808 B14R1.686 O=C(O)C(O)Cc1ccc(Cl)c(Br)c1 Amb33353397 [0,2,0,0,0,0|1,0,0]=3 6809 B14R1.686 O=C(O)C(O)Cc1ccc(Cl)c(Cl)c1 Amb24094048 [0,2,0,0,0,0|1,0,0]=3 6810 B14R1.686 O=C(O)C(O)Cc1ccc(Cl)c(F)c1 Amb28136529 [0,2,0,0,0,0|1,0,0]=3 6811 B14R1.686 O=C(O)C(O)Cc1ccc(F)c(Br)c1 Amb24570493 [0,2,0,0,0,0|1,0,0]=3 6812 B14R1.686 O=C(O)C(O)Cc1ccc(F)c(Cl)c1 Amb28369947 [0,2,0,0,0,0|1,0,0]=3 6813 B14R1.686 O=C(O)C(O)Cc1ccc(F)c(F)c1 Amb25059600 [0,2,0,0,0,0|1,0,0]=3 6814 B14R1.686 O=C(O)C(O)Cc1ccc(O)c(Br)c1 Amb33388544 [0,2,0,0,0,0|1,0,0]=3 6815 B14R1.686 O=C(O)C(O)Cc1ccc(O)c(Cl)c1 Amb27166154 [0,2,0,0,0,0|1,0,0]=3 6816 B14R1.686 O=C(O)C(O)Cc1ccc(O)c(F)c1 Amb25220163 [0,2,0,0,0,0|1,0,0]=3 6817 B14R1.686 O=C(O)C(O)Cc1ccc(O)c(O)c1 Amb8401808 [0,2,0,0,0,0|1,0,0]=3 6818 B14R1.686 O=C(O)C(O)Cc1cnc(Cl)c(Cl)c1 Amb33413641 [0,2,0,0,0,0|2,0,0]=4 6819 B14R1.686 O=C(O)C(S)Cc1ccc(O)c(O)c1 Amb27463306 [0,2,0,0,0,0|1,0,0]=3 6820 B14R1.686 O=C(O)[C@@H](O)Cc1ccc(O)c(O)c1 Amb22747075 [0,2,0,0,0,0|1,0,0]=3 6821 B14R1.686 O=C(O)[C@H](O)Cc1ccc(O)c(O)c1 Amb24629166 [0,2,0,0,0,0|1,0,0]=3 6822 B14R1.700 CC(C)(O)C(N)Cc1ccc(Cl)cc1 Amb27236861 [0,2,0,0,0,0|1,0,1]=4 6823 B14R1.700 CC(C)(O)C(N)Cc1ccc(F)cc1 Amb18812260 [0,2,0,0,0,0|1,0,1]=4 6824 B14R1.700 CC(C)(O)C(N)Cc1ccc(F)cc1 Amb33338814 [0,2,0,0,0,0|1,0,1]=4 6825 B14R1.700 N[C@@H](Cc1ccc(O)cc1)P(=O)(O)O Amb27166083 [0,2,0,0,0,0|1,0,0]=3 6826 B14R1.700 N[C@H](Cc1ccc(O)cc1)P(=O)(O)O Amb28292730 [0,2,0,0,0,0|1,0,0]=3 6827 B14R1.6049 C=C(C)C(N)Cc1ccc(Br)cc1F Amb35681976 [0,2,0,0,0,0|2,0,0]=4 6828 B14R1.6049 C=C(C)C(N)Cc1ccc(F)cc1F Amb28313254 [0,2,0,0,0,0|2,0,0]=4 6829 B14R1.6049 CC(=O)C(Br)Cc1ccc(C)cc1Br Amb27833167 [0,2,0,0,0,0|2,0,0]=4 6830 B14R1.6049 CC(=O)C(Br)Cc1ccc(C)cc1C Amb18585221 [0,2,0,0,0,0|2,0,0]=4 6831 B14R1.6049 CC(=O)C(Br)Cc1ccc(C)cc1F Amb28398431 [0,2,0,0,0,0|2,0,0]=4 6832 B14R1.6049 CC(=O)C(Br)Cc1ccc(Cl)cc1C Amb18077770 [0,2,0,0,0,0|2,0,0]=4 6833 B14R1.6049 CC(=O)C(Br)Cc1ccc(Cl)cc1F Amb26008691 [0,2,0,0,0,0|2,0,0]=4 6834 B14R1.6049 CC(=O)C(Br)Cc1ccc(F)cc1F Amb33530416 [0,2,0,0,0,0|2,0,0]=4 6835 B14R1.6049 CC(=O)C(Br)Cc1ccc(F)cc1I Amb28314747 [0,2,0,0,0,0|2,0,0]=4 6836 B14R1.6049 CC(=O)C(Br)Cc1ccc(I)cc1F Amb29877322 [0,2,0,0,0,0|2,0,0]=4 6837 B14R1.6049 CC(=O)C(C)Cc1ccc(Br)cc1F Amb27238138 [0,2,0,0,0,0|2,0,0]=4 6838 B14R1.6049 CC(=O)C(C)Cc1ccc(C)cc1C Amb17234967 [0,2,0,0,0,0|2,0,0]=4 6839 B14R1.6049 CC(=O)C(C)Cc1ccc(Cl)cc1Cl Amb17249288 [0,2,0,0,0,0|2,0,0]=4 6840 B14R1.6049 CC(=O)C(Cl)Cc1ccc(Br)cc1C Amb17204929 [0,2,0,0,0,0|2,0,0]=4 6841 B14R1.6049 CC(=O)C(Cl)Cc1ccc(C)cc1Br Amb17204928 [0,2,0,0,0,0|2,0,0]=4 6842 B14R1.6049 CC(=O)C(Cl)Cc1ccc(C)cc1C Amb17204428 [0,2,0,0,0,0|2,0,0]=4 6843 B14R1.6049 CC(=O)C(Cl)Cc1ccc(Cl)cc1C Amb17204556 [0,2,0,0,0,0|2,0,0]=4 6844 B14R1.6049 CC(=O)C(Cl)Cc1ccc(Cl)cc1Cl Amb17204743 [0,2,0,0,0,0|2,0,0]=4 6845 B14R1.6049 CC(=O)C(Cl)Cc1ccc(F)cc1F Amb17204488 [0,2,0,0,0,0|2,0,0]=4 6846 B14R1.6049 CC(=O)C(N)Cc1ccc(Br)cc1C Amb25084294 [0,2,0,0,0,0|1,0,0]=3 6847 B14R1.6049 CC(=O)C(N)Cc1ccc(Cl)cc1C Amb24507511 [0,2,0,0,0,0|1,0,0]=3 6848 B14R1.6049 CC(=O)C(N)Cc1ccc(Cl)cc1Cl Amb26357598 [0,2,0,0,0,0|1,0,0]=3 6849 B14R1.6049 CC(=O)C(N)Cc1ccc(F)cc1F Amb25689019 [0,2,0,0,0,0|1,0,0]=3 6850 B14R1.6049 CC(Cc1ccc(Br)cc1Cl)C(=O)O Amb26029246 [0,2,0,0,0,0|1,0,0]=3 6851 B14R1.6049 CC(Cc1ccc(Br)cc1F)C(=O)O Amb27769812 [0,2,0,0,0,0|1,0,0]=3 6852 B14R1.6049 CC(Cc1ccc(Br)cc1O)C(=O)O Amb33389520 [0,2,0,0,0,0|1,0,0]=3 6853 B14R1.6049 CC(Cc1ccc(Cl)cc1Br)C(=O)O Amb25028936 [0,2,0,0,0,0|1,0,0]=3 6854 B14R1.6049 CC(Cc1ccc(Cl)cc1Cl)C(=O)O Amb17605799 [0,2,0,0,0,0|1,0,0]=3 6855 B14R1.6049 CC(Cc1ccc(Cl)cc1F)C(=O)O Amb24463169 [0,2,0,0,0,0|1,0,0]=3 6856 B14R1.6049 CC(Cc1ccc(Cl)cc1O)C(=O)O Amb33259793 [0,2,0,0,0,0|1,0,0]=3 6857 B14R1.6049 CC(Cc1ccc(F)cc1Br)C(=O)O Amb24502990 [0,2,0,0,0,0|1,0,0]=3 6858 B14R1.6049 CC(Cc1ccc(F)cc1Cl)C(=O)O Amb25849479 [0,2,0,0,0,0|1,0,0]=3 6859 B14R1.6049 CC(Cc1ccc(F)cc1F)C(=O)O Amb17605827 [0,2,0,0,0,0|1,0,0]=3 6860 B14R1.6049 CC(Cc1ccc(O)cc1Cl)C(=O)O Amb33057324 [0,2,0,0,0,0|1,0,0]=3 6861 B14R1.6049 CC(Cc1ccc(O)cc1F)C(=O)O Amb33358197 [0,2,0,0,0,0|1,0,0]=3 6862 B14R1.6049 CC(Cc1ccc(O)cc1O)C(=O)O Amb33340469 [0,2,0,0,0,0|1,0,0]=3 6863 B14R1.6049 CC(Cc1cnc(Cl)cc1Cl)C(=O)O Amb26967413 [0,2,0,0,0,0|2,0,0]=4 6864 B14R1.6049 CC(Cc1ncc(Br)cc1Br)C(=O)O Amb27845254 [0,2,0,0,0,0|2,0,0]=4 6865 B14R1.6049 CC(Nc1ccc(Br)cc1Br)C(=O)O Amb28461385 [0,2,0,0,0,0|2,0,0]=4 6866 B14R1.6049 CC(Nc1ccc(Cl)cc1Br)C(=O)O Amb27490466 [0,2,0,0,0,0|2,0,0]=4 6867 B14R1.6049 CC(Nc1ccc(Cl)cc1Cl)C(=O)O Amb18039871 [0,2,0,0,0,0|2,0,0]=4 6868 B14R1.6049 CC(Nc1ccc(Cl)cc1F)C(=O)O Amb18999364 [0,2,0,0,0,0|2,0,0]=4 6869 B14R1.6049 CC(Nc1ccc(F)cc1Br)C(=O)O Amb27232423 [0,2,0,0,0,0|2,0,0]=4 6870 B14R1.6049 CC(Nc1ccc(F)cc1F)C(=O)O Amb17402393 [0,2,0,0,0,0|2,0,0]=4 6871 B14R1.6049 CC(Nc1ccc(F)cc1I)C(=O)O Amb27808368 [0,2,0,0,0,0|2,0,0]=4 6872 B14R1.6049 CC(Nc1ccc(I)cc1F)C(=O)O Amb35736207 [0,2,0,0,0,0|2,0,0]=4 6873 B14R1.6049 CC(Nc1ccc(O)cc1Cl)C(=O)O Amb35735306 [0,2,0,0,0,0|2,0,0]=4 6874 B14R1.6049 CC(Oc1ccc(Br)cc1Br)C(=O)O Amb1114877 [0,2,0,0,0,0|2,0,0]=4 6875 B14R1.6049 CC(Oc1ccc(Br)cc1Cl)C(=O)O Amb6549411 [0,2,0,0,0,0|2,0,0]=4 6876 B14R1.6049 CC(Oc1ccc(Br)cc1F)C(=O)O Amb1109857 [0,2,0,0,0,0|2,0,0]=4 6877 B14R1.6049 CC(Oc1ccc(Br)cc1N)C(=O)O Amb27747133 [0,2,0,0,0,0|2,0,0]=4 6878 B14R1.6049 CC(Oc1ccc(Cl)cc1Br)C(=O)O Amb6336768 [0,2,0,0,0,0|2,0,0]=4 6879 B14R1.6049 CC(Oc1ccc(Cl)cc1Cl)C(=O)O Amb9702403 [0,2,0,0,0,0|2,0,0]=4 6880 B14R1.6049 CC(Oc1ccc(F)cc1Br)C(=O)O Amb1140649 [0,2,0,0,0,0|2,0,0]=4 6881 B14R1.6049 CC(Oc1ccc(F)cc1Cl)C(=O)O Amb9702368 [0,2,0,0,0,0|2,0,0]=4 6882 B14R1.6049 CC(Oc1ccc(F)cc1F)C(=O)O Amb9702311 [0,2,0,0,0,0|2,0,0]=4 6883 B14R1.6049 CC(Oc1ccc(N)cc1F)C(=O)O Amb19001360 [0,2,0,0,0,0|2,0,0]=4 6884 B14R1.6049 CC(Sc1ccc(Cl)cc1Cl)C(=O)O Amb5764490 [0,2,0,0,0,0|2,0,0]=4 6885 B14R1.6049 CC1=CC(=O)N(CC(N)C(N)=O)C=C1 Amb28319753 [0,2,0,0,0,0|2,0,0]=4 6886 B14R1.6049 C[C@@H](Cc1ccc(F)cc1F)C(=O)O Amb33749078 [0,2,0,0,0,0|1,0,0]=3 6887 B14R1.6049 C[C@@H](Oc1ccc(Br)cc1Br)C(=O)O Amb27183713 [0,2,0,0,0,0|2,0,0]=4 6888 B14R1.6049 C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)O Amb22348379 [0,2,0,0,0,0|2,0,0]=4 6889 B14R1.6049 C[C@H](Cc1ccc(F)cc1F)C(=O)O Amb33727259 [0,2,0,0,0,0|1,0,0]=3 6890 B14R1.6049 C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)O Amb25067445 [0,2,0,0,0,0|2,0,0]=4 6891 B14R1.6049 C[C@H](Oc1ccc(F)cc1Cl)C(=O)O Amb27183716 [0,2,0,0,0,0|2,0,0]=4 6892 B14R1.6049 Cc1cc(Br)ccc1CC(=O)C(=O)O Amb27192097 [0,2,0,0,0,0|1,0,1]=4 6893 B14R1.6049 Cc1cc(Br)ccc1CC(Br)C(N)=O Amb28409455 [0,2,0,0,0,0|2,0,0]=4 6894 B14R1.6049 Cc1cc(Br)ccc1CC(C)C(=O)O Amb26383760 [0,2,0,0,0,0|1,0,0]=3 6895 B14R1.6049 Cc1cc(Br)ccc1CC(Cl)C(=O)O Amb17204949 [0,2,0,0,0,0|1,0,0]=3 6896 B14R1.6049 Cc1cc(Br)ccc1CC(Cl)C(N)=O Amb17204938 [0,2,0,0,0,0|2,0,0]=4 6897 B14R1.6049 Cc1cc(Br)ccc1CC(N)C(=O)O Amb26904630 [0,2,0,0,0,0|0,0,0]=2 6898 B14R1.6049 Cc1cc(Br)ccc1CC(O)C(=O)O Amb33353416 [0,2,0,0,0,0|1,0,0]=3 6899 B14R1.6049 Cc1cc(Br)ccc1C[C@@H](N)C(=O)O Amb27606413 [0,2,0,0,0,0|0,0,0]=2 6900 B14R1.6049 Cc1cc(Br)ccc1NC(C)C(=O)O Amb17415254 [0,2,0,0,0,0|2,0,0]=4 6901 B14R1.6049 Cc1cc(Br)ccc1OC(C)C(=O)O Amb5763689 [0,2,0,0,0,0|2,0,0]=4 6902 B14R1.6049 Cc1cc(Br)ccc1OC(F)C(=O)O Amb27866177 [0,2,0,0,0,0|2,0,0]=4 6903 B14R1.6049 Cc1cc(Br)cnc1CC(N)C(=O)O Amb27393836 [0,2,0,0,0,0|1,0,0]=3 6904 B14R1.6049 Cc1cc(Br)cnc1C[C@@H](N)C(=O)O Amb27253056 [0,2,0,0,0,0|1,0,0]=3 6905 B14R1.6049 Cc1cc(Cl)ccc1CC(=O)C(=O)O Amb25028752 [0,2,0,0,0,0|1,0,1]=4 6906 B14R1.6049 Cc1cc(Cl)ccc1CC(Br)C(=O)O Amb23320626 [0,2,0,0,0,0|1,0,0]=3 6907 B14R1.6049 Cc1cc(Cl)ccc1CC(Br)C(N)=O Amb28409411 [0,2,0,0,0,0|2,0,0]=4 6908 B14R1.6049 Cc1cc(Cl)ccc1CC(C)C(=O)O Amb26029953 [0,2,0,0,0,0|1,0,0]=3 6909 B14R1.6049 Cc1cc(Cl)ccc1CC(Cl)C(=O)O Amb17204587 [0,2,0,0,0,0|1,0,0]=3 6910 B14R1.6049 Cc1cc(Cl)ccc1CC(Cl)C(N)=O Amb17204560 [0,2,0,0,0,0|2,0,0]=4 6911 B14R1.6049 Cc1cc(Cl)ccc1CC(F)C(=O)O Amb27436281 [0,2,0,0,0,0|1,0,0]=3 6912 B14R1.6049 Cc1cc(Cl)ccc1CC(N)C(=O)O Amb25732389 [0,2,0,0,0,0|0,0,0]=2 6913 B14R1.6049 Cc1cc(Cl)ccc1CC(O)C(=O)O Amb33353236 [0,2,0,0,0,0|1,0,0]=3 6914 B14R1.6049 Cc1cc(Cl)ccc1C[C@@H](C)C(=O)O Amb27463378 [0,2,0,0,0,0|1,0,0]=3 6915 B14R1.6049 Cc1cc(Cl)ccc1C[C@@H](N)C(=O)O Amb26345300 [0,2,0,0,0,0|0,0,0]=2 6916 B14R1.6049 Cc1cc(Cl)ccc1C[C@H](N)C(=O)O Amb28240490 [0,2,0,0,0,0|0,0,0]=2 6917 B14R1.6049 Cc1cc(Cl)ccc1NC(C)C(=O)O Amb17404301 [0,2,0,0,0,0|2,0,0]=4 6918 B14R1.6049 Cc1cc(Cl)ccc1OC(C)C(=O)O Amb1885033 [0,2,0,0,0,0|2,0,0]=4 6919 B14R1.6049 Cc1cc(Cl)ccc1O[C@@H](C)C(=O)O Amb22747827 [0,2,0,0,0,0|2,0,0]=4 6920 B14R1.6049 Cc1cc(Cl)ccc1O[C@H](C)C(=O)O Amb22350595 [0,2,0,0,0,0|2,0,0]=4 6921 B14R1.6049 Cc1cc(F)ccc1CC(=O)C(=O)O Amb18986590 [0,2,0,0,0,0|1,0,1]=4 6922 B14R1.6049 Cc1cc(F)ccc1CC(Br)C(N)=O Amb27786179 [0,2,0,0,0,0|2,0,0]=4 6923 B14R1.6049 Cc1cc(F)ccc1CC(C)C(=O)O Amb27197295 [0,2,0,0,0,0|1,0,0]=3 6924 B14R1.6049 Cc1cc(F)ccc1CC(F)C(=O)O Amb28120290 [0,2,0,0,0,0|1,0,0]=3 6925 B14R1.6049 Cc1cc(F)ccc1CC(N)C(=O)O Amb18995883 [0,2,0,0,0,0|0,0,0]=2 6926 B14R1.6049 Cc1cc(F)ccc1CC(O)C(=O)O Amb27599778 [0,2,0,0,0,0|1,0,0]=3 6927 B14R1.6049 Cc1cc(F)ccc1C[C@@H](N)C(=O)O Amb18325206 [0,2,0,0,0,0|0,0,0]=2 6928 B14R1.6049 Cc1cc(F)ccc1C[C@H](N)C(=O)O Amb25309017 [0,2,0,0,0,0|0,0,0]=2 6929 B14R1.6049 Cc1cc(F)ccc1NC(C)C(=O)O Amb18999361 [0,2,0,0,0,0|2,0,0]=4 6930 B14R1.6049 Cc1cc(F)ccc1O[C@H](C)C(=O)O Amb28348875 [0,2,0,0,0,0|2,0,0]=4 6931 B14R1.6049 Cc1cc(F)ccc1SC(C)C(=O)O Amb17083278 [0,2,0,0,0,0|2,0,0]=4 6932 B14R1.6049 Cc1cc(F)ccc1\C=C(\N)C(=O)O Amb28079367 [0,2,0,0,0,0|0,0,2]=4 6933 B14R1.6049 Cc1cc(I)ccc1CC(N)C(=O)O Amb27446523 [0,2,0,0,0,0|0,0,0]=2 6934 B14R1.6049 Cc1cc(I)ccc1C[C@@H](N)C(=O)O Amb27748021 [0,2,0,0,0,0|0,0,0]=2 6935 B14R1.6049 Cc1cc(N)ccc1OC(C)C(=O)O Amb27403995 [0,2,0,0,0,0|2,0,0]=4 6936 B14R1.6049 Cc1cc(N)ccc1SC(C)C(=O)O Amb18291279 [0,2,0,0,0,0|2,0,0]=4 6937 B14R1.6049 Cc1cc(N)ncc1C[C@@H](N)C(=O)O Amb27259159 [0,2,0,0,0,0|1,0,0]=3 6938 B14R1.6049 Cc1cc(N)ncc1C[C@H](N)C(=O)O Amb27413100 [0,2,0,0,0,0|1,0,0]=3 6939 B14R1.6049 Cc1cc(O)ccc1CC(N)C(=O)O Amb554936 [0,2,0,0,0,0|0,0,0]=2 6940 B14R1.6049 Cc1cc(S)ccc1OC(C)C(=O)O Amb18771867 [0,2,0,0,0,0|2,0,0]=4 6941 B14R1.6049 Cc1ccc(CC(=O)C(=O)O)c(Br)c1 Amb26878686 [0,2,0,0,0,0|1,0,1]=4 6942 B14R1.6049 Cc1ccc(CC(=O)C(=O)O)c(C)c1 Amb1125553 [0,2,0,0,0,0|1,0,1]=4 6943 B14R1.6049 Cc1ccc(CC(=O)C(=O)O)c(Cl)c1 Amb28073131 [0,2,0,0,0,0|1,0,1]=4 6944 B14R1.6049 Cc1ccc(CC(=O)C(=O)O)c(F)c1 Amb33324370 [0,2,0,0,0,0|1,0,1]=4 6945 B14R1.6049 Cc1ccc(CC(=O)C(=O)O)c(O)c1 Amb33426660 [0,2,0,0,0,0|1,0,1]=4 6946 B14R1.6049 Cc1ccc(CC(Br)C(=O)O)c(C)c1 Amb23320605 [0,2,0,0,0,0|1,0,0]=3 6947 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(Br)c1 Amb28280844 [0,2,0,0,0,0|1,0,0]=3 6948 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(C)c1 Amb24498055 [0,2,0,0,0,0|1,0,0]=3 6949 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(Cl)c1 Amb25251901 [0,2,0,0,0,0|1,0,0]=3 6950 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(Cl)n1 Amb33259858 [0,2,0,0,0,0|2,0,0]=4 6951 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(F)c1 Amb26970189 [0,2,0,0,0,0|1,0,0]=3 6952 B14R1.6049 Cc1ccc(CC(C)C(=O)O)c(O)c1 Amb33426665 [0,2,0,0,0,0|1,0,0]=3 6953 B14R1.6049 Cc1ccc(CC(Cl)C(=O)O)c(Br)c1 Amb17204948 [0,2,0,0,0,0|1,0,0]=3 6954 B14R1.6049 Cc1ccc(CC(Cl)C(=O)O)c(C)c1 Amb17204440 [0,2,0,0,0,0|1,0,0]=3 6955 B14R1.6049 Cc1ccc(CC(Cl)C(N)=O)c(Br)c1 Amb17204937 [0,2,0,0,0,0|2,0,0]=4 6956 B14R1.6049 Cc1ccc(CC(Cl)C(N)=O)c(C)c1 Amb17204434 [0,2,0,0,0,0|2,0,0]=4 6957 B14R1.6049 Cc1ccc(CC(Cl)C(N)=O)c(Cl)c1 Amb27465410 [0,2,0,0,0,0|2,0,0]=4 6958 B14R1.6049 Cc1ccc(CC(F)C(=O)O)c(Cl)c1 Amb30012813 [0,2,0,0,0,0|1,0,0]=3 6959 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(Br)c1 Amb24399395 [0,2,0,0,0,0|0,0,0]=2 6960 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(C)c1 Amb3788506 [0,2,0,0,0,0|0,0,0]=2 6961 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(Cl)c1 Amb25744040 [0,2,0,0,0,0|0,0,0]=2 6962 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(Cl)n1 Amb25970913 [0,2,0,0,0,0|1,0,0]=3 6963 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(F)c1 Amb22043806 [0,2,0,0,0,0|0,0,0]=2 6964 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(N)c1 Amb27391200 [0,2,0,0,0,0|0,0,0]=2 6965 B14R1.6049 Cc1ccc(CC(N)C(=O)O)c(O)c1 Amb4020996 [0,2,0,0,0,0|0,0,0]=2 6966 B14R1.6049 Cc1ccc(CC(N)C(N)=O)c(Cl)c1 Amb27811620 [0,2,0,0,0,0|1,0,0]=3 6967 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(Br)c1 Amb33353495 [0,2,0,0,0,0|1,0,0]=3 6968 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(C)c1 Amb33353398 [0,2,0,0,0,0|1,0,0]=3 6969 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(Cl)c1 Amb25989899 [0,2,0,0,0,0|1,0,0]=3 6970 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(Cl)n1 Amb33259871 [0,2,0,0,0,0|2,0,0]=4 6971 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(F)c1 Amb33353186 [0,2,0,0,0,0|1,0,0]=3 6972 B14R1.6049 Cc1ccc(CC(O)C(=O)O)c(O)c1 Amb33426371 [0,2,0,0,0,0|1,0,0]=3 6973 B14R1.6049 Cc1ccc(C[C@@H](C)C(=O)O)c(C)c1 Amb33739402 [0,2,0,0,0,0|1,0,0]=3 6974 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(Br)c1 Amb27263839 [0,2,0,0,0,0|0,0,0]=2 6975 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(C)c1 Amb8397011 [0,2,0,0,0,0|0,0,0]=2 6976 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(Cl)c1 Amb24452116 [0,2,0,0,0,0|0,0,0]=2 6977 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(Cl)n1 Amb27259348 [0,2,0,0,0,0|1,0,0]=3 6978 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(F)c1 Amb27202743 [0,2,0,0,0,0|0,0,0]=2 6979 B14R1.6049 Cc1ccc(C[C@@H](N)C(=O)O)c(O)c1 Amb27626043 [0,2,0,0,0,0|0,0,0]=2 6980 B14R1.6049 Cc1ccc(C[C@H](C)C(=O)O)c(C)c1 Amb33744358 [0,2,0,0,0,0|1,0,0]=3 6981 B14R1.6049 Cc1ccc(C[C@H](N)C(=O)O)c(C)c1 Amb8397012 [0,2,0,0,0,0|0,0,0]=2 6982 B14R1.6049 Cc1ccc(C[C@H](N)C(=O)O)c(C)n1 Amb28341721 [0,2,0,0,0,0|1,0,0]=3 6983 B14R1.6049 Cc1ccc(C[C@H](N)C(=O)O)c(F)c1 Amb24617556 [0,2,0,0,0,0|0,0,0]=2 6984 B14R1.6049 Cc1ccc(NC(C)C(=O)O)c(Br)c1 Amb840577 [0,2,0,0,0,0|2,0,0]=4 6985 B14R1.6049 Cc1ccc(NC(C)C(=O)O)c(C)c1 Amb840569 [0,2,0,0,0,0|2,0,0]=4 6986 B14R1.6049 Cc1ccc(NC(C)C(=O)O)c(F)c1 Amb18981766 [0,2,0,0,0,0|2,0,0]=4 6987 B14R1.6049 Cc1ccc(OC(C)C(=O)O)c(Br)c1 Amb9703950 [0,2,0,0,0,0|2,0,0]=4 6988 B14R1.6049 Cc1ccc(OC(C)C(=O)O)c(C)c1 Amb9702587 [0,2,0,0,0,0|2,0,0]=4 6989 B14R1.6049 Cc1ccc(OC(F)C(=O)O)c(Br)c1 Amb28123053 [0,2,0,0,0,0|2,0,0]=4 6990 B14R1.6049 Cc1ccc(OC(F)C(=O)O)c(C)c1 Amb28430665 [0,2,0,0,0,0|2,0,0]=4 6991 B14R1.6049 Cc1ccc(OC(F)C(=O)O)c(Cl)c1 Amb27488894 [0,2,0,0,0,0|2,0,0]=4 6992 B14R1.6049 Cc1ccc(O[C@H](C)C(=O)O)c(Br)c1 Amb28454562 [0,2,0,0,0,0|2,0,0]=4 6993 B14R1.6049 Cc1ccc(SC(C)C(=O)O)c(C)c1 Amb1118227 [0,2,0,0,0,0|2,0,0]=4 6994 B14R1.6049 Cc1cnc(CC(N)C(=O)O)c(Br)c1 Amb27393123 [0,2,0,0,0,0|1,0,0]=3 6995 B14R1.6049 Cc1cnc(C[C@@H](N)C(=O)O)c(Br)c1 Amb27394214 [0,2,0,0,0,0|1,0,0]=3 6996 B14R1.6049 Cc1nc(F)ccc1C[C@H](N)C(=O)O Amb27748142 [0,2,0,0,0,0|1,0,0]=3 6997 B14R1.6049 Cc1nc(N)ccc1C[C@@H](N)C(=O)O Amb28423377 [0,2,0,0,0,0|1,0,0]=3 6998 B14R1.6049 NC(=O)C(Br)Cc1ccc(Cl)cc1I Amb27245672 [0,2,0,0,0,0|2,0,0]=4 6999 B14R1.6049 NC(=O)C(Br)Cc1ccc(I)cc1Br Amb27245627 [0,2,0,0,0,0|2,0,0]=4 7000 B14R1.6049 NC(=O)C(Br)Cc1ccc(I)cc1F Amb29877317 [0,2,0,0,0,0|2,0,0]=4 7001 B14R1.6049 NC(=O)C(Cl)Cc1ccc(Br)cc1F Amb27808131 [0,2,0,0,0,0|2,0,0]=4 7002 B14R1.6049 NC(=O)C(Cl)Cc1ccc(Cl)cc1Cl Amb17204750 [0,2,0,0,0,0|2,0,0]=4 7003 B14R1.6049 NC(=O)C(Cl)Cc1ccc(F)cc1Br Amb27656965 [0,2,0,0,0,0|2,0,0]=4 7004 B14R1.6049 NC(=O)C(Cl)Cc1ccc(F)cc1Cl Amb27167207 [0,2,0,0,0,0|2,0,0]=4 7005 B14R1.6049 NC(=O)C(Cl)Cc1ccc(F)cc1F Amb17204497 [0,2,0,0,0,0|2,0,0]=4 7006 B14R1.6049 NC(=O)C(Cl)Cc1ccc(F)cc1I Amb28206698 [0,2,0,0,0,0|2,0,0]=4 7007 B14R1.6049 NC(=O)C(Cl)Cc1ccc(I)cc1Br Amb27834086 [0,2,0,0,0,0|2,0,0]=4 7008 B14R1.6049 NC(=O)C(Cl)Cc1ccc(I)cc1F Amb29877324 [0,2,0,0,0,0|2,0,0]=4 7009 B14R1.6049 NC(=O)C(N)Cc1ccc(Br)cc1F Amb27755691 [0,2,0,0,0,0|1,0,0]=3 7010 B14R1.6049 NC(CN1C=CC(=O)NC1=O)C(=O)O Amb18652980 [0,2,0,0,0,0|2,0,0]=4 7011 B14R1.6049 NC(CN1C=CC(=O)NC1=O)C(=O)O Amb22587980 [0,2,0,0,0,0|2,0,0]=4 7012 B14R1.6049 NC(Cc1ccc(Br)cc1Cl)C(=O)O Amb26619596 [0,2,0,0,0,0|0,0,0]=2 7013 B14R1.6049 NC(Cc1ccc(Br)cc1F)C(=O)O Amb9025220 [0,2,0,0,0,0|0,0,0]=2 7014 B14R1.6049 NC(Cc1ccc(Br)cc1O)C(=O)O Amb27459732 [0,2,0,0,0,0|0,0,0]=2 7015 B14R1.6049 NC(Cc1ccc(Cl)cc1Br)C(=O)O Amb25376983 [0,2,0,0,0,0|0,0,0]=2 7016 B14R1.6049 NC(Cc1ccc(Cl)cc1Cl)C(=O)O Amb3790206 [0,2,0,0,0,0|0,0,0]=2 7017 B14R1.6049 NC(Cc1ccc(Cl)cc1F)C(=O)O Amb22738201 [0,2,0,0,0,0|0,0,0]=2 7018 B14R1.6049 NC(Cc1ccc(Cl)cc1O)C(=O)O Amb25790444 [0,2,0,0,0,0|0,0,0]=2 7019 B14R1.6049 NC(Cc1ccc(Cl)nc1Cl)C(=O)O Amb18135670 [0,2,0,0,0,0|1,0,0]=3 7020 B14R1.6049 NC(Cc1ccc(F)cc1Br)C(=O)O Amb6272527 [0,2,0,0,0,0|0,0,0]=2 7021 B14R1.6049 NC(Cc1ccc(F)cc1Cl)C(=O)O Amb6270631 [0,2,0,0,0,0|0,0,0]=2 7022 B14R1.6049 NC(Cc1ccc(F)cc1F)C(=O)O Amb2687230 [0,2,0,0,0,0|0,0,0]=2 7023 B14R1.6049 NC(Cc1ccc(F)cc1O)C(=O)O Amb27404634 [0,2,0,0,0,0|0,0,0]=2 7024 B14R1.6049 NC(Cc1ccc(F)nc1F)C(=O)O Amb27790900 [0,2,0,0,0,0|1,0,0]=3 7025 B14R1.6049 NC(Cc1ccc(I)cc1Cl)C(=O)O Amb27387851 [0,2,0,0,0,0|0,0,0]=2 7026 B14R1.6049 NC(Cc1ccc(O)cc1Cl)C(=O)O Amb27419673 [0,2,0,0,0,0|0,0,0]=2 7027 B14R1.6049 NC(Cc1ccc(O)cc1F)C(=O)O Amb2697464 [0,2,0,0,0,0|0,0,0]=2 7028 B14R1.6049 NC(Cc1ccc(O)cc1I)C(=O)O Amb26926297 [0,2,0,0,0,0|0,0,0]=2 7029 B14R1.6049 NC(Cc1ccc(O)cc1O)C(=O)O Amb4090206 [0,2,0,0,0,0|0,0,0]=2 7030 B14R1.6049 NC(Cc1ccc(O)nc1Cl)C(=O)O Amb27402689 [0,2,0,0,0,0|1,0,0]=3 7031 B14R1.6049 NC(Cc1cnc(Cl)cc1Cl)C(=O)O Amb26978343 [0,2,0,0,0,0|1,0,0]=3 7032 B14R1.6049 NC(Cc1ncc(Br)cc1Br)C(=O)O Amb27425557 [0,2,0,0,0,0|1,0,0]=3 7033 B14R1.6049 NC(Cc1ncc(Br)cc1F)C(=O)O Amb27182004 [0,2,0,0,0,0|1,0,0]=3 7034 B14R1.6049 NC(Cc1ncc(Cl)cc1Br)C(=O)O Amb27586719 [0,2,0,0,0,0|1,0,0]=3 7035 B14R1.6049 NC(Cc1ncc(Cl)cc1Cl)C(=O)O Amb25999542 [0,2,0,0,0,0|1,0,0]=3 7036 B14R1.6049 NC(Cc1ncc(F)cc1F)C(=O)O Amb27597521 [0,2,0,0,0,0|1,0,0]=3 7037 B14R1.6049 NC1=NC(=O)N(C[C@H](N)C(=O)O)C=C1 Amb27758619 [0,2,0,0,0,0|2,0,0]=4 7038 B14R1.6049 NC1=NC(=O)NC=C1CC(N)C(=O)O Amb24398609 [0,2,0,0,0,0|2,0,0]=4 7039 B14R1.6049 NC1=NC=C(CC(N)C(=O)O)C(=O)N1 Amb25199976 [0,2,0,0,0,0|2,0,0]=4 7040 B14R1.6049 NC1=NC=C(CC(N)C(=O)O)C(=O)N1 Amb35789172 [0,2,0,0,0,0|2,0,0]=4 7041 B14R1.6049 N[C@@H](CN1C=CC(=O)NC1=O)C(=O)O Amb19893387 [0,2,0,0,0,0|2,0,0]=4 7042 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1Cl)C(=O)O Amb25103196 [0,2,0,0,0,0|0,0,0]=2 7043 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1F)C(=O)O Amb25957298 [0,2,0,0,0,0|0,0,0]=2 7044 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1O)C(=O)O Amb27871490 [0,2,0,0,0,0|0,0,0]=2 7045 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)O Amb8397016 [0,2,0,0,0,0|0,0,0]=2 7046 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1I)C(=O)O Amb27493059 [0,2,0,0,0,0|0,0,0]=2 7047 B14R1.6049 N[C@@H](Cc1ccc(F)cc1Cl)C(=O)O Amb25766645 [0,2,0,0,0,0|0,0,0]=2 7048 B14R1.6049 N[C@@H](Cc1ccc(F)cc1F)C(=O)O Amb6295854 [0,2,0,0,0,0|0,0,0]=2 7049 B14R1.6049 N[C@@H](Cc1ccc(F)nc1F)C(=O)O Amb26420913 [0,2,0,0,0,0|1,0,0]=3 7050 B14R1.6049 N[C@@H](Cc1ccc(O)cc1Cl)C(=O)O Amb22746045 [0,2,0,0,0,0|0,0,0]=2 7051 B14R1.6049 N[C@@H](Cc1ccc(O)cc1F)C(=O)O Amb10845772 [0,2,0,0,0,0|0,0,0]=2 7052 B14R1.6049 N[C@@H](Cc1ccc(O)cc1O)C(=O)O Amb22228337 [0,2,0,0,0,0|0,0,0]=2 7053 B14R1.6049 N[C@@H](Cc1ncc(Br)cc1Cl)C(=O)O Amb27957183 [0,2,0,0,0,0|1,0,0]=3 7054 B14R1.6049 N[C@@H](Cc1ncc(Cl)cc1Br)C(=O)O Amb27876633 [0,2,0,0,0,0|1,0,0]=3 7055 B14R1.6049 N[C@H](Cc1ccc(Br)cc1Cl)C(=O)O Amb28241076 [0,2,0,0,0,0|0,0,0]=2 7056 B14R1.6049 N[C@H](Cc1ccc(Br)cc1F)C(=O)O Amb27771158 [0,2,0,0,0,0|0,0,0]=2 7057 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1Br)C(=O)O Amb28254265 [0,2,0,0,0,0|0,0,0]=2 7058 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1Cl)C(=O)O Amb8397015 [0,2,0,0,0,0|0,0,0]=2 7059 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1F)C(=O)O Amb26312658 [0,2,0,0,0,0|0,0,0]=2 7060 B14R1.6049 N[C@H](Cc1ccc(F)cc1Cl)C(=O)O Amb25972957 [0,2,0,0,0,0|0,0,0]=2 7061 B14R1.6049 N[C@H](Cc1ccc(F)cc1F)C(=O)O Amb16231883 [0,2,0,0,0,0|0,0,0]=2 7062 B14R1.6049 N[C@H](Cc1ccc(I)cc1F)C(=O)O Amb27265650 [0,2,0,0,0,0|0,0,0]=2 7063 B14R1.6049 N[C@H](Cc1ncc(Br)cc1Br)C(=O)O Amb27611990 [0,2,0,0,0,0|1,0,0]=3 7064 B14R1.6049 N[C@H](Cc1ncc(F)cc1F)C(=O)O Amb27230018 [0,2,0,0,0,0|1,0,0]=3 7065 B14R1.6049 N\C(=C\c1ccc(Cl)cc1Cl)C(=O)O Amb27244420 [0,2,0,0,0,0|0,0,2]=4 7066 B14R1.6049 Nc1cc(Cl)ccc1CC(N)C(=O)O Amb18657750 [0,2,0,0,0,0|0,0,0]=2 7067 B14R1.6049 Nc1cc(Cl)cnc1C[C@@H](N)C(=O)O Amb27773245 [0,2,0,0,0,0|1,0,0]=3 7068 B14R1.6049 Nc1cc(Cl)cnc1C[C@H](N)C(=O)O Amb27663952 [0,2,0,0,0,0|1,0,0]=3 7069 B14R1.6049 Nc1cc(O)ccc1CC(N)C(=O)O Amb16767184 [0,2,0,0,0,0|0,0,0]=2 7070 B14R1.6049 Nc1cc(O)ccc1CC(N)C(=O)O Amb30988010 [0,2,0,0,0,0|0,0,0]=2 7071 B14R1.6049 Nc1cc(O)ccc1C[C@@H](N)C(=O)O Amb27952647 [0,2,0,0,0,0|0,0,0]=2 7072 B14R1.6049 Nc1ccc(CC(N)C(=O)O)c(Br)c1 Amb27451291 [0,2,0,0,0,0|0,0,0]=2 7073 B14R1.6049 Nc1ccc(C[C@@H](N)C(=O)O)c(Br)c1 Amb28124897 [0,2,0,0,0,0|0,0,0]=2 7074 B14R1.6049 Nc1ccc(SC(F)C(=O)O)c(Cl)c1 Amb28142710 [0,2,0,0,0,0|2,0,0]=4 7075 B14R1.6049 Nc1ccc(SC(F)C(=O)O)c(F)c1 Amb27495081 [0,2,0,0,0,0|2,0,0]=4 7076 B14R1.6049 O=C(O)C(=O)Cc1ccc(Br)cc1Cl Amb25823249 [0,2,0,0,0,0|1,0,1]=4 7077 B14R1.6049 O=C(O)C(=O)Cc1ccc(Br)cc1F Amb9303747 [0,2,0,0,0,0|1,0,1]=4 7078 B14R1.6049 O=C(O)C(=O)Cc1ccc(Br)cc1O Amb33388522 [0,2,0,0,0,0|1,0,1]=4 7079 B14R1.6049 O=C(O)C(=O)Cc1ccc(Cl)cc1Br Amb25165671 [0,2,0,0,0,0|1,0,1]=4 7080 B14R1.6049 O=C(O)C(=O)Cc1ccc(Cl)cc1F Amb25167113 [0,2,0,0,0,0|1,0,1]=4 7081 B14R1.6049 O=C(O)C(=O)Cc1ccc(Cl)cc1O Amb33260078 [0,2,0,0,0,0|1,0,1]=4 7082 B14R1.6049 O=C(O)C(=O)Cc1ccc(F)cc1Br Amb26357199 [0,2,0,0,0,0|1,0,1]=4 7083 B14R1.6049 O=C(O)C(=O)Cc1ccc(F)cc1Cl Amb25914172 [0,2,0,0,0,0|1,0,1]=4 7084 B14R1.6049 O=C(O)C(=O)Cc1ccc(F)cc1F Amb1140150 [0,2,0,0,0,0|1,0,1]=4 7085 B14R1.6049 O=C(O)C(=O)Cc1ccc(O)cc1Cl Amb33221569 [0,2,0,0,0,0|1,0,1]=4 7086 B14R1.6049 O=C(O)C(=O)Cc1ccc(O)cc1F Amb33358196 [0,2,0,0,0,0|1,0,1]=4 7087 B14R1.6049 O=C(O)C(=O)Cc1ccc(O)cc1O Amb32733223 [0,2,0,0,0,0|1,0,1]=4 7088 B14R1.6049 O=C(O)C(Br)Cc1ccc(Cl)cc1Cl Amb10597007 [0,2,0,0,0,0|1,0,0]=3 7089 B14R1.6049 O=C(O)C(Br)Cc1ccc(F)cc1F Amb25754333 [0,2,0,0,0,0|1,0,0]=3 7090 B14R1.6049 O=C(O)C(Cl)Cc1ccc(Cl)cc1Cl Amb2782094 [0,2,0,0,0,0|1,0,0]=3 7091 B14R1.6049 O=C(O)C(Cl)Cc1ccc(F)cc1F Amb17204500 [0,2,0,0,0,0|1,0,0]=3 7092 B14R1.6049 O=C(O)C(F)Cc1ccc(Br)cc1F Amb27850860 [0,2,0,0,0,0|1,0,0]=3 7093 B14R1.6049 O=C(O)C(F)Cc1ccc(Cl)cc1Cl Amb27796033 [0,2,0,0,0,0|1,0,0]=3 7094 B14R1.6049 O=C(O)C(F)Cc1ccc(O)cc1F Amb35696533 [0,2,0,0,0,0|1,0,0]=3 7095 B14R1.6049 O=C(O)C(F)Cc1ncc(Br)cc1Br Amb27880040 [0,2,0,0,0,0|2,0,0]=4 7096 B14R1.6049 O=C(O)C(F)Oc1ccc(Br)cc1Cl Amb27641634 [0,2,0,0,0,0|2,0,0]=4 7097 B14R1.6049 O=C(O)C(F)Oc1ccc(Br)cc1F Amb27857055 [0,2,0,0,0,0|2,0,0]=4 7098 B14R1.6049 O=C(O)C(F)Oc1ccc(Cl)cc1Cl Amb27949262 [0,2,0,0,0,0|2,0,0]=4 7099 B14R1.6049 O=C(O)C(F)Sc1ccc(Cl)cc1Cl Amb28075409 [0,2,0,0,0,0|2,0,0]=4 7100 B14R1.6049 O=C(O)C(O)Cc1ccc(Br)cc1Cl Amb27457557 [0,2,0,0,0,0|1,0,0]=3 7101 B14R1.6049 O=C(O)C(O)Cc1ccc(Br)cc1F Amb24389246 [0,2,0,0,0,0|1,0,0]=3 7102 B14R1.6049 O=C(O)C(O)Cc1ccc(Br)cc1O Amb33388808 [0,2,0,0,0,0|1,0,0]=3 7103 B14R1.6049 O=C(O)C(O)Cc1ccc(Cl)cc1Br Amb33353443 [0,2,0,0,0,0|1,0,0]=3 7104 B14R1.6049 O=C(O)C(O)Cc1ccc(Cl)cc1Cl Amb27957337 [0,2,0,0,0,0|1,0,0]=3 7105 B14R1.6049 O=C(O)C(O)Cc1ccc(Cl)cc1F Amb27400048 [0,2,0,0,0,0|1,0,0]=3 7106 B14R1.6049 O=C(O)C(O)Cc1ccc(Cl)cc1O Amb33260102 [0,2,0,0,0,0|1,0,0]=3 7107 B14R1.6049 O=C(O)C(O)Cc1ccc(F)cc1Br Amb27212076 [0,2,0,0,0,0|1,0,0]=3 7108 B14R1.6049 O=C(O)C(O)Cc1ccc(F)cc1Cl Amb27957371 [0,2,0,0,0,0|1,0,0]=3 7109 B14R1.6049 O=C(O)C(O)Cc1ccc(F)cc1F Amb27957373 [0,2,0,0,0,0|1,0,0]=3 7110 B14R1.6049 O=C(O)C(O)Cc1ccc(O)cc1Cl Amb33221572 [0,2,0,0,0,0|1,0,0]=3 7111 B14R1.6049 O=C(O)C(O)Cc1ccc(O)cc1F Amb33353406 [0,2,0,0,0,0|1,0,0]=3 7112 B14R1.6049 O=C(O)C(O)Cc1ccc(O)cc1O Amb32733091 [0,2,0,0,0,0|1,0,0]=3 7113 B14R1.6049 O=C(O)C(O)Cc1cnc(Cl)cc1Cl Amb33256878 [0,2,0,0,0,0|2,0,0]=4 7114 B14R1.6049 O=C(O)C(O)Cc1ncc(Br)cc1Br Amb33353433 [0,2,0,0,0,0|2,0,0]=4 7115 B14R1.7626 CC(=O)C(C)(Cl)Cc1ccc(Cl)cc1 Amb4020122 [0,2,0,0,0,0|2,0,0]=4 7116 B14R1.7626 CC(Br)(Cc1ccc(Cl)cc1)C(=O)O Amb24507517 [0,2,0,0,0,0|1,0,0]=3 7117 B14R1.7626 CC(Br)(Cc1ccc(F)cc1)C(=O)O Amb28281728 [0,2,0,0,0,0|1,0,0]=3 7118 B14R1.7626 CC(C)(Cc1ccc(Br)cc1)C(=O)O Amb17265524 [0,2,0,0,0,0|1,0,0]=3 7119 B14R1.7626 CC(C)(Cc1ccc(Br)cn1)C(=O)O Amb27639224 [0,2,0,0,0,0|2,0,0]=4 7120 B14R1.7626 CC(C)(Cc1ccc(Br)nc1)C(=O)O Amb33388071 [0,2,0,0,0,0|2,0,0]=4 7121 B14R1.7626 CC(C)(Cc1ccc(Cl)cc1)C(=O)O Amb17241249 [0,2,0,0,0,0|1,0,0]=3 7122 B14R1.7626 CC(C)(Cc1ccc(Cl)cc1)C(N)=O Amb28364360 [0,2,0,0,0,0|2,0,0]=4 7123 B14R1.7626 CC(C)(Cc1ccc(Cl)nc1)C(=O)O Amb25715569 [0,2,0,0,0,0|2,0,0]=4 7124 B14R1.7626 CC(C)(Cc1ccc(F)cc1)C(=O)O Amb17236376 [0,2,0,0,0,0|1,0,0]=3 7125 B14R1.7626 CC(C)(Cc1ccc(F)cc1)C(N)=O Amb28428475 [0,2,0,0,0,0|2,0,0]=4 7126 B14R1.7626 CC(C)(Cc1ccc(F)cn1)C(=O)O Amb33315864 [0,2,0,0,0,0|2,0,0]=4 7127 B14R1.7626 CC(C)(Cc1ccc(F)nc1)C(=O)O Amb33426194 [0,2,0,0,0,0|2,0,0]=4 7128 B14R1.7626 CC(C)(Cc1ccc(O)cc1)C(=O)O Amb27978939 [0,2,0,0,0,0|1,0,0]=3 7129 B14R1.7626 CC(C)(Cc1ccc(S)cc1)C(=O)O Amb17613333 [0,2,0,0,0,0|1,0,0]=3 7130 B14R1.7626 CC(C)(Nc1ccc(Br)cc1)C(=O)O Amb840757 [0,2,0,0,0,0|2,0,0]=4 7131 B14R1.7626 CC(C)(Nc1ccc(Cl)cc1)C(=O)O Amb840754 [0,2,0,0,0,0|2,0,0]=4 7132 B14R1.7626 CC(C)(Nc1ccc(F)cc1)C(=O)O Amb840752 [0,2,0,0,0,0|2,0,0]=4 7133 B14R1.7626 CC(C)(Oc1ccc(Br)cc1)C(=O)O Amb6335014 [0,2,0,0,0,0|2,0,0]=4 7134 B14R1.7626 CC(C)(Oc1ccc(Cl)cc1)C(=O)O Amb6335827 [0,2,0,0,0,0|2,0,0]=4 7135 B14R1.7626 CC(C)(Oc1ccc(F)cc1)C(=O)O Amb6382244 [0,2,0,0,0,0|2,0,0]=4 7136 B14R1.7626 CC(C)(Oc1ccc(N)cc1)C(=O)O Amb2697317 [0,2,0,0,0,0|2,0,0]=4 7137 B14R1.7626 CC(C)(Oc1ccc(N)cc1)C(=O)O Amb33801426 [0,2,0,0,0,0|2,0,0]=4 7138 B14R1.7626 CC(C)(Oc1ccc(O)cc1)C(=O)O Amb18652342 [0,2,0,0,0,0|2,0,0]=4 7139 B14R1.7626 CC(C)(Sc1ccc(Br)cc1)C(=O)O Amb4296891 [0,2,0,0,0,0|2,0,0]=4 7140 B14R1.7626 CC(C)(Sc1ccc(Cl)cc1)C(=O)O Amb5763232 [0,2,0,0,0,0|2,0,0]=4 7141 B14R1.7626 CC(C)(Sc1ccc(N)cc1)C(=O)O Amb18976876 [0,2,0,0,0,0|2,0,0]=4 7142 B14R1.7626 CC(C)(Sc1ccc(O)cc1)C(=O)O Amb18976848 [0,2,0,0,0,0|2,0,0]=4 7143 B14R1.7626 CC(Cl)(Cc1ccc(Br)cc1)C(=O)O Amb26864756 [0,2,0,0,0,0|1,0,0]=3 7144 B14R1.7626 CC(Cl)(Cc1ccc(Cl)cc1)C(=O)O Amb24644127 [0,2,0,0,0,0|1,0,0]=3 7145 B14R1.7626 CC(Cl)(Cc1ccc(F)cc1)C(=O)O Amb28048166 [0,2,0,0,0,0|1,0,0]=3 7146 B14R1.7626 CC(F)(Cc1ccc(Cl)cc1)C(=O)O Amb27186046 [0,2,0,0,0,0|1,0,0]=3 7147 B14R1.7626 CC(F)(Cc1ccc(O)cc1)C(=O)O Amb27463477 [0,2,0,0,0,0|1,0,0]=3 7148 B14R1.7626 CC(N)(Cc1ccc(Br)cc1)C(=O)O Amb17266143 [0,2,0,0,0,0|0,0,0]=2 7149 B14R1.7626 CC(N)(Cc1ccc(Br)cc1)C(=O)O Amb30289727 [0,2,0,0,0,0|0,0,0]=2 7150 B14R1.7626 CC(N)(Cc1ccc(Cl)cc1)C(=O)O Amb32657116 [0,2,0,0,0,0|0,0,0]=2 7151 B14R1.7626 CC(N)(Cc1ccc(Cl)cc1)C(=O)O Amb4134856 [0,2,0,0,0,0|0,0,0]=2 7152 B14R1.7626 CC(N)(Cc1ccc(Cl)cn1)C(=O)O Amb27436543 [0,2,0,0,0,0|1,0,0]=3 7153 B14R1.7626 CC(N)(Cc1ccc(Cl)nc1)C(=O)O Amb18657756 [0,2,0,0,0,0|1,0,0]=3 7154 B14R1.7626 CC(N)(Cc1ccc(F)cc1)C(=O)O Amb17236544 [0,2,0,0,0,0|0,0,0]=2 7155 B14R1.7626 CC(N)(Cc1ccc(F)cc1)C(=O)O Amb32657990 [0,2,0,0,0,0|0,0,0]=2 7156 B14R1.7626 CC(N)(Cc1ccc(F)cc1)C(N)=O Amb27239436 [0,2,0,0,0,0|1,0,0]=3 7157 B14R1.7626 CC(N)(Cc1ccc(F)nc1)C(=O)O Amb27865818 [0,2,0,0,0,0|1,0,0]=3 7158 B14R1.7626 CC(N)(Cc1ccc(I)cc1)C(=O)O Amb27612194 [0,2,0,0,0,0|0,0,0]=2 7159 B14R1.7626 CC(N)(Cc1ccc(N)cc1)C(=O)O Amb24618145 [0,2,0,0,0,0|0,0,0]=2 7160 B14R1.7626 CC(N)(Cc1ccc(O)cc1)C(=O)O Amb4018744 [0,2,0,0,0,0|0,0,0]=2 7161 B14R1.7626 CC(O)(Cc1ccc(Br)cc1)C(=O)O Amb25327444 [0,2,0,0,0,0|1,0,0]=3 7162 B14R1.7626 CC(O)(Cc1ccc(Br)cn1)C(=O)O Amb33477423 [0,2,0,0,0,0|2,0,0]=4 7163 B14R1.7626 CC(O)(Cc1ccc(Br)nc1)C(=O)O Amb33388518 [0,2,0,0,0,0|2,0,0]=4 7164 B14R1.7626 CC(O)(Cc1ccc(Cl)cc1)C(=O)O Amb25104269 [0,2,0,0,0,0|1,0,0]=3 7165 B14R1.7626 CC(O)(Cc1ccc(Cl)cc1)C(N)=O Amb27212669 [0,2,0,0,0,0|2,0,0]=4 7166 B14R1.7626 CC(O)(Cc1ccc(Cl)cn1)C(=O)O Amb33058800 [0,2,0,0,0,0|2,0,0]=4 7167 B14R1.7626 CC(O)(Cc1ccc(Cl)nc1)C(=O)O Amb33261678 [0,2,0,0,0,0|2,0,0]=4 7168 B14R1.7626 CC(O)(Cc1ccc(F)cc1)C(=O)O Amb8010919 [0,2,0,0,0,0|1,0,0]=3 7169 B14R1.7626 CC(O)(Cc1ccc(F)cc1)C(N)=O Amb27480089 [0,2,0,0,0,0|2,0,0]=4 7170 B14R1.7626 CC(O)(Cc1ccc(F)cn1)C(=O)O Amb33315574 [0,2,0,0,0,0|2,0,0]=4 7171 B14R1.7626 CC(O)(Cc1ccc(F)nc1)C(=O)O Amb33425502 [0,2,0,0,0,0|2,0,0]=4 7172 B14R1.7626 CC(O)(Cc1ccc(O)cc1)C(=O)O Amb33268853 [0,2,0,0,0,0|1,0,0]=3 7173 B14R1.7626 C[C@@](N)(Cc1ccc(Br)cc1)C(=O)O Amb8630497 [0,2,0,0,0,0|0,0,0]=2 7174 B14R1.7626 C[C@@](N)(Cc1ccc(F)cc1)C(=O)O Amb22745963 [0,2,0,0,0,0|0,0,0]=2 7175 B14R1.7626 C[C@@](N)(Cc1ccc(I)cc1)C(=O)O Amb16183900 [0,2,0,0,0,0|0,0,0]=2 7176 B14R1.7626 C[C@@](N)(Cc1ccc(N)cc1)C(=O)O Amb27748250 [0,2,0,0,0,0|0,0,0]=2 7177 B14R1.7626 C[C@@](N)(Cc1ccc(O)cc1)C(=O)O Amb8629187 [0,2,0,0,0,0|0,0,0]=2 7178 B14R1.7626 C[C@](N)(Cc1ccc(Br)cc1)C(=O)O Amb16183906 [0,2,0,0,0,0|0,0,0]=2 7179 B14R1.7626 C[C@](N)(Cc1ccc(F)cc1)C(=O)O Amb25077186 [0,2,0,0,0,0|0,0,0]=2 7180 B14R1.7626 C[C@](N)(Cc1ccc(O)cc1)C(=O)O Amb3941540 [0,2,0,0,0,0|0,0,0]=2 7181 B14R1.7626 Cc1ccc(CC(C)(Br)C(=O)O)cc1 Amb25852765 [0,2,0,0,0,0|1,0,0]=3 7182 B14R1.7626 Cc1ccc(CC(C)(C)C(=O)O)cc1 Amb17235388 [0,2,0,0,0,0|1,0,0]=3 7183 B14R1.7626 Cc1ccc(CC(C)(C)C(=O)O)cn1 Amb32878272 [0,2,0,0,0,0|2,0,0]=4 7184 B14R1.7626 Cc1ccc(CC(C)(C)C(=O)O)nc1 Amb33226165 [0,2,0,0,0,0|2,0,0]=4 7185 B14R1.7626 Cc1ccc(CC(C)(C)C(N)=O)cc1 Amb22549662 [0,2,0,0,0,0|2,0,0]=4 7186 B14R1.7626 Cc1ccc(CC(C)(Cl)C(=O)O)cc1 Amb25783790 [0,2,0,0,0,0|1,0,0]=3 7187 B14R1.7626 Cc1ccc(CC(C)(N)C(=O)O)cc1 Amb17235616 [0,2,0,0,0,0|0,0,0]=2 7188 B14R1.7626 Cc1ccc(CC(C)(O)C(=O)O)cc1 Amb25779395 [0,2,0,0,0,0|1,0,0]=3 7189 B14R1.7626 Cc1ccc(CC(C)(O)C(=O)O)cn1 Amb32877437 [0,2,0,0,0,0|2,0,0]=4 7190 B14R1.7626 Cc1ccc(CC(C)(O)C(=O)O)nc1 Amb33198100 [0,2,0,0,0,0|2,0,0]=4 7191 B14R1.7626 Cc1ccc(CC(F)(F)C(=O)O)cc1 Amb33170784 [0,2,0,0,0,0|1,0,0]=3 7192 B14R1.7626 Cc1ccc(CC(F)(F)C(=O)O)cn1 Amb33170785 [0,2,0,0,0,0|2,0,0]=4 7193 B14R1.7626 Cc1ccc(CC(F)(F)C(=O)O)nc1 Amb32810422 [0,2,0,0,0,0|2,0,0]=4 7194 B14R1.7626 Cc1ccc(C[C@@](C)(N)C(=O)O)cc1 Amb28456531 [0,2,0,0,0,0|0,0,0]=2 7195 B14R1.7626 Cc1ccc(C[C@](C)(O)C(=O)O)cc1 Amb27254108 [0,2,0,0,0,0|1,0,0]=3 7196 B14R1.7626 Cc1ccc(NC(C)(C)C(=O)O)cc1 Amb840742 [0,2,0,0,0,0|2,0,0]=4 7197 B14R1.7626 Cc1ccc(OC(C)(C)C(=O)O)cc1 Amb6356918 [0,2,0,0,0,0|2,0,0]=4 7198 B14R1.7626 Cc1ccc(SC(C)(C)C(=O)O)cc1 Amb27397706 [0,2,0,0,0,0|2,0,0]=4 7199 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Br)cc1 Amb25313273 [0,2,0,0,0,0|1,0,0]=3 7200 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Br)cn1 Amb33171196 [0,2,0,0,0,0|2,0,0]=4 7201 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Br)nc1 Amb32811710 [0,2,0,0,0,0|2,0,0]=4 7202 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Cl)cc1 Amb26332966 [0,2,0,0,0,0|1,0,0]=3 7203 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Cl)cn1 Amb32744659 [0,2,0,0,0,0|2,0,0]=4 7204 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(Cl)nc1 Amb33399712 [0,2,0,0,0,0|2,0,0]=4 7205 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(F)cc1 Amb25747554 [0,2,0,0,0,0|1,0,0]=3 7206 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(F)cn1 Amb33401959 [0,2,0,0,0,0|2,0,0]=4 7207 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(F)nc1 Amb32745118 [0,2,0,0,0,0|2,0,0]=4 7208 B14R1.7626 O=C(O)C(F)(F)Cc1ccc(O)cc1 Amb28045068 [0,2,0,0,0,0|1,0,0]=3 7209 B14R1.7626 O=C(O)C(F)(F)Oc1ccc(Br)cc1 Amb9516661 [0,2,0,0,0,0|2,0,0]=4 7210 B14R1.7626 O=C(O)C(F)(F)Sc1ccc(Br)cc1 Amb25144915 [0,2,0,0,0,0|2,0,0]=4 7211 B14R1.7626 O=C(O)C(F)(F)Sc1ccc(F)cc1 Amb27835418 [0,2,0,0,0,0|2,0,0]=4 7212 B14R1.7626 O=C(O)C(F)(F)Sc1ccc(O)cc1 Amb27656837 [0,2,0,0,0,0|2,0,0]=4 7213 B14R1.7626 O=C1C=CN(CC(F)(F)C(=O)O)C=C1 Amb33170353 [0,2,0,0,0,0|2,0,0]=4 7214 B14R1.60 CC(Cc1ccccc1)C(=O)NC#N Amb27234738 [0,2,0,0,0,0|2,0,0]=4 7215 B14R1.60 CCNC(=O)C(N)Cc1ccccc1 Amb6272689 [0,2,0,0,0,0|1,0,0]=3 7216 B14R1.60 CCNC(=O)C(O)Cc1ccccc1 Amb32663008 [0,2,0,0,0,0|2,0,0]=4 7217 B14R1.60 CCNC(=O)N(N)Cc1ccccc1 Amb27827787 [0,2,0,0,0,0|2,0,0]=4 7218 B14R1.60 CCNC(=O)[C@@H](N)Cc1ccccc1 Amb17235472 [0,2,0,0,0,0|1,0,0]=3 7219 B14R1.60 CCNC(=O)[C@@H](O)Cc1ccccc1 Amb32663961 [0,2,0,0,0,0|2,0,0]=4 7220 B14R1.60 CCOC(=O)C(=O)Cc1ccccc1 Amb28989403 [0,2,0,0,0,0|1,0,1]=4 7221 B14R1.60 CCOC(=O)C(Br)Cc1ccccc1 Amb2794053 [0,2,0,0,0,0|1,0,0]=3 7222 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 Amb17940943 [0,2,0,0,0,0|2,0,0]=4 7223 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb6334959 [0,2,0,0,0,0|0,0,0]=2 7224 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb7762211 [0,2,0,0,0,0|0,0,0]=2 7225 B14R1.60 CCOC(=O)C(N)Cc1ccccn1 Amb22498620 [0,2,0,0,0,0|1,0,0]=3 7226 B14R1.60 CCOC(=O)C(N)Cc1ccccn1 Amb3788557 [0,2,0,0,0,0|1,0,0]=3 7227 B14R1.60 CCOC(=O)C(N)Cc1cccnc1 Amb3788558 [0,2,0,0,0,0|1,0,0]=3 7228 B14R1.60 CCOC(=O)C(N)Cc1ccncc1 Amb20622578 [0,2,0,0,0,0|1,0,0]=3 7229 B14R1.60 CCOC(=O)C(N)Cc1ccncc1 Amb3788559 [0,2,0,0,0,0|1,0,0]=3 7230 B14R1.60 CCOC(=O)C(N)Cc1ccncn1 Amb19043045 [0,2,0,0,0,0|2,0,0]=4 7231 B14R1.60 CCOC(=O)C(N)Cc1ccnnc1 Amb33230886 [0,2,0,0,0,0|2,0,0]=4 7232 B14R1.60 CCOC(=O)C(N)Cc1ncccn1 Amb33527184 [0,2,0,0,0,0|2,0,0]=4 7233 B14R1.60 CCOC(=O)C(N)Cc1ncccn1 Amb33542064 [0,2,0,0,0,0|2,0,0]=4 7234 B14R1.60 CCOC(=O)C(O)Cc1ccccc1 Amb19079971 [0,2,0,0,0,0|1,0,0]=3 7235 B14R1.60 CCOC(=O)N(C)Cc1ccccc1 Amb3095224 [0,2,0,0,0,0|2,0,0]=4 7236 B14R1.60 CCOC(=O)N(O)Cc1ccccc1 Amb28248736 [0,2,0,0,0,0|2,0,0]=4 7237 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb10844617 [0,2,0,0,0,0|0,0,0]=2 7238 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb2725501 [0,2,0,0,0,0|0,0,0]=2 7239 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccncc1 Amb33804700 [0,2,0,0,0,0|1,0,0]=3 7240 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb19889827 [0,2,0,0,0,0|0,0,0]=2 7241 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb3940062 [0,2,0,0,0,0|0,0,0]=2 7242 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccn1 Amb33804617 [0,2,0,0,0,0|1,0,0]=3 7243 B14R1.60 CN(Cc1ccccc1)C(=O)CCO Amb17336607 [0,2,0,0,0,0|2,0,0]=4 7244 B14R1.60 COCC(=O)N(C)Cc1ccccc1 Amb3115734 [0,2,0,0,0,0|2,0,0]=4 7245 B14R1.60 N#CNC(=O)[C@@H](N)Cc1ccccc1 Amb28250398 [0,2,0,0,0,0|1,0,0]=3 7246 B14R1.85 C=C(C(=O)OC)C(O)c1ccccc1 Amb6671058 [0,2,0,0,0,0|1,0,1]=4 7247 B14R1.85 CC(C(=O)NN)C(N)c1ccccc1 Amb28289947 [0,2,0,0,0,0|2,0,0]=4 7248 B14R1.85 CC(C(=O)NN)C(O)c1ccccc1 Amb28281864 [0,2,0,0,0,0|2,0,0]=4 7249 B14R1.85 CNC(=O)C(C)C(N)c1ccccc1 Amb27163495 [0,2,0,0,0,0|2,0,0]=4 7250 B14R1.85 CNC(=O)C(Cl)C(C)c1ccccc1 Amb27217826 [0,2,0,0,0,0|2,0,0]=4 7251 B14R1.85 CNC(=O)C(O)C(C)c1ccccc1 Amb27602292 [0,2,0,0,0,0|2,0,0]=4 7252 B14R1.85 CNC(=O)C(O)C(N)c1ccccc1 Amb27224926 [0,2,0,0,0,0|2,0,0]=4 7253 B14R1.85 CNC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb27390027 [0,2,0,0,0,0|2,0,0]=4 7254 B14R1.85 COC(=O)C(=O)C(C)c1ccccc1 Amb17139343 [0,2,0,0,0,0|1,0,1]=4 7255 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccc1 Amb18866388 [0,2,0,0,0,0|1,0,1]=4 7256 B14R1.85 COC(=O)C(C)C(=O)c1ccccc1 Amb10553472 [0,2,0,0,0,0|1,0,1]=4 7257 B14R1.85 COC(=O)C(C)C(N)c1ccccc1 Amb20623659 [0,2,0,0,0,0|1,0,0]=3 7258 B14R1.85 COC(=O)C(C)C(N)c1ccccc1 Amb32644838 [0,2,0,0,0,0|1,0,0]=3 7259 B14R1.85 COC(=O)C(Cl)C(=O)c1ccccc1 Amb18866389 [0,2,0,0,0,0|1,0,1]=4 7260 B14R1.85 COC(=O)C(Cl)C(C)c1ccccc1 Amb22059076 [0,2,0,0,0,0|1,0,0]=3 7261 B14R1.85 COC(=O)C(N)C(=O)c1ccccc1 Amb22325263 [0,2,0,0,0,0|0,0,1]=3 7262 B14R1.85 COC(=O)C(N)C(C)c1ccccc1 Amb19013065 [0,2,0,0,0,0|0,0,0]=2 7263 B14R1.85 COC(=O)C(N)C(C)c1ccccc1 Amb33534536 [0,2,0,0,0,0|0,0,0]=2 7264 B14R1.85 COC(=O)C(N)C(O)c1cccnc1 Amb33231051 [0,2,0,0,0,0|1,0,0]=3 7265 B14R1.85 COC(=O)C(N)C(O)c1ccncc1 Amb33230532 [0,2,0,0,0,0|1,0,0]=3 7266 B14R1.85 COC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb23439859 [0,2,0,0,0,0|1,0,0]=3 7267 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb17844463 [0,2,0,0,0,0|1,0,0]=3 7268 B14R1.85 COC(=O)[C@@H](O)[C@H](N)c1ccccc1 Amb22744727 [0,2,0,0,0,0|1,0,0]=3 7269 B14R1.85 COC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb10603125 [0,2,0,0,0,0|1,0,0]=3 7270 B14R1.85 COC(=O)[C@H](O)[C@H](N)c1ccccc1 Amb32409396 [0,2,0,0,0,0|1,0,0]=3 7271 B14R1.85 COC(=O)\C(N)=C(\C)c1ccccc1 Amb27629677 [0,2,0,0,0,0|0,0,2]=4 7272 B14R1.85 C[C@H](C(=O)NN)[C@@H](O)c1ccccc1 Amb27980479 [0,2,0,0,0,0|2,0,0]=4 7273 B14R1.85 NNC(=O)C(F)C(O)c1ccccc1 Amb27978204 [0,2,0,0,0,0|2,0,0]=4 7274 B14R1.85 N[C@@H](C(=O)NO)[C@@H](O)c1ccccc1 Amb27386910 [0,2,0,0,0,0|0,0,0]=2 7275 B14R1.135 CC(Oc1cccc(Cl)c1)C(=O)NO Amb27466689 [0,2,0,0,0,0|2,0,0]=4 7276 B14R1.135 CCC(=O)C(C)Cc1cccc(Br)c1 Amb17264256 [0,2,0,0,0,0|2,0,0]=4 7277 B14R1.135 CCC(=O)C(C)Cc1cccc(C)c1 Amb17234959 [0,2,0,0,0,0|2,0,0]=4 7278 B14R1.135 CCC(=O)C(C)Cc1cccc(Cl)c1 Amb17240772 [0,2,0,0,0,0|2,0,0]=4 7279 B14R1.135 CN(Cc1cccc(Br)c1)C(=O)CO Amb17415248 [0,2,0,0,0,0|2,0,0]=4 7280 B14R1.135 CN(Cc1cccc(Cl)c1)C(=O)CO Amb9421443 [0,2,0,0,0,0|2,0,0]=4 7281 B14R1.135 CNC(=O)C(N)Cc1cccc(Cl)c1 Amb27596640 [0,2,0,0,0,0|1,0,0]=3 7282 B14R1.135 CNC(=O)[C@@H](N)Cc1cccc(O)c1 Amb28129339 [0,2,0,0,0,0|1,0,0]=3 7283 B14R1.135 COC(=O)C(=O)Cc1cccc(Br)c1 Amb17162560 [0,2,0,0,0,0|1,0,1]=4 7284 B14R1.135 COC(=O)C(=O)Cc1cccc(C)c1 Amb17139341 [0,2,0,0,0,0|1,0,1]=4 7285 B14R1.135 COC(=O)C(=O)Cc1cccc(Cl)c1 Amb17140709 [0,2,0,0,0,0|1,0,1]=4 7286 B14R1.135 COC(=O)C(Br)Cc1cccc(Br)c1 Amb7092621 [0,2,0,0,0,0|1,0,0]=3 7287 B14R1.135 COC(=O)C(Br)Cc1cccc(C)c1 Amb4074140 [0,2,0,0,0,0|1,0,0]=3 7288 B14R1.135 COC(=O)C(Br)Cc1cccc(Cl)c1 Amb4074142 [0,2,0,0,0,0|1,0,0]=3 7289 B14R1.135 COC(=O)C(Br)Cc1cccc(F)c1 Amb17357773 [0,2,0,0,0,0|1,0,0]=3 7290 B14R1.135 COC(=O)C(C)Nc1cccc(Br)c1 Amb4137938 [0,2,0,0,0,0|2,0,0]=4 7291 B14R1.135 COC(=O)C(C)Nc1cccc(C)c1 Amb4314704 [0,2,0,0,0,0|2,0,0]=4 7292 B14R1.135 COC(=O)C(C)Nc1cccc(I)c1 Amb27590577 [0,2,0,0,0,0|2,0,0]=4 7293 B14R1.135 COC(=O)C(C)Nc1cccc(N)c1 Amb19017409 [0,2,0,0,0,0|2,0,0]=4 7294 B14R1.135 COC(=O)C(C)Oc1cccc(C)c1 Amb19079942 [0,2,0,0,0,0|2,0,0]=4 7295 B14R1.135 COC(=O)C(C)Oc1cccc(Cl)c1 Amb6551115 [0,2,0,0,0,0|2,0,0]=4 7296 B14R1.135 COC(=O)C(C)Oc1cccc(N)c1 Amb17110000 [0,2,0,0,0,0|2,0,0]=4 7297 B14R1.135 COC(=O)C(Cl)Cc1cccc(Br)c1 Amb17204953 [0,2,0,0,0,0|1,0,0]=3 7298 B14R1.135 COC(=O)C(Cl)Cc1cccc(C)c1 Amb17204447 [0,2,0,0,0,0|1,0,0]=3 7299 B14R1.135 COC(=O)C(Cl)Cc1cccc(Cl)c1 Amb17204592 [0,2,0,0,0,0|1,0,0]=3 7300 B14R1.135 COC(=O)C(Cl)Cc1cccc(F)c1 Amb17204464 [0,2,0,0,0,0|1,0,0]=3 7301 B14R1.135 COC(=O)C(N)Cc1cccc(Br)c1 Amb17415246 [0,2,0,0,0,0|0,0,0]=2 7302 B14R1.135 COC(=O)C(N)Cc1cccc(Br)c1 Amb33484187 [0,2,0,0,0,0|0,0,0]=2 7303 B14R1.135 COC(=O)C(N)Cc1cccc(C)c1 Amb17401771 [0,2,0,0,0,0|0,0,0]=2 7304 B14R1.135 COC(=O)C(N)Cc1cccc(Cl)c1 Amb17404295 [0,2,0,0,0,0|0,0,0]=2 7305 B14R1.135 COC(=O)C(N)Cc1cccc(F)c1 Amb28468152 [0,2,0,0,0,0|0,0,0]=2 7306 B14R1.135 COC(=O)C(N)Cc1cccc(F)c1 Amb32695421 [0,2,0,0,0,0|0,0,0]=2 7307 B14R1.135 COC(=O)C(N)Cc1cccc(O)c1 Amb33804284 [0,2,0,0,0,0|0,0,0]=2 7308 B14R1.135 COC(=O)C(N)Cc1ccnc(Br)c1 Amb35789290 [0,2,0,0,0,0|1,0,0]=3 7309 B14R1.135 COC(=O)C(N)Cc1cncc(Br)c1 Amb35788432 [0,2,0,0,0,0|1,0,0]=3 7310 B14R1.135 COC(=O)C(N)Cc1cncc(Br)c1 Amb35789208 [0,2,0,0,0,0|1,0,0]=3 7311 B14R1.135 COC(=O)C(N)Cc1nccc(O)n1 Amb33802640 [0,2,0,0,0,0|2,0,0]=4 7312 B14R1.135 COC(=O)C(N)Cc1nccc(O)n1 Amb33803479 [0,2,0,0,0,0|2,0,0]=4 7313 B14R1.135 COC(=O)C(O)Cc1cc(C)ccn1 Amb33318078 [0,2,0,0,0,0|2,0,0]=4 7314 B14R1.135 COC(=O)C(O)Cc1cc(F)ccn1 Amb33320246 [0,2,0,0,0,0|2,0,0]=4 7315 B14R1.135 COC(=O)C(O)Cc1cccc(Br)c1 Amb17163099 [0,2,0,0,0,0|1,0,0]=3 7316 B14R1.135 COC(=O)C(O)Cc1cccc(Br)n1 Amb33433168 [0,2,0,0,0,0|2,0,0]=4 7317 B14R1.135 COC(=O)C(O)Cc1cccc(C)c1 Amb17139449 [0,2,0,0,0,0|1,0,0]=3 7318 B14R1.135 COC(=O)C(O)Cc1cccc(C)n1 Amb33199592 [0,2,0,0,0,0|2,0,0]=4 7319 B14R1.135 COC(=O)C(O)Cc1cccc(Cl)c1 Amb17140887 [0,2,0,0,0,0|1,0,0]=3 7320 B14R1.135 COC(=O)C(O)Cc1cccc(Cl)n1 Amb33222667 [0,2,0,0,0,0|2,0,0]=4 7321 B14R1.135 COC(=O)C(O)Cc1cccc(F)c1 Amb33359442 [0,2,0,0,0,0|1,0,0]=3 7322 B14R1.135 COC(=O)C(O)Cc1cccc(O)c1 Amb30588577 [0,2,0,0,0,0|1,0,0]=3 7323 B14R1.135 COC(=O)C(O)Cc1ccnc(C)c1 Amb32733033 [0,2,0,0,0,0|2,0,0]=4 7324 B14R1.135 COC(=O)C(O)Cc1cncc(Br)c1 Amb33242607 [0,2,0,0,0,0|2,0,0]=4 7325 B14R1.135 COC(=O)C(O)Cc1cncc(C)c1 Amb33317684 [0,2,0,0,0,0|2,0,0]=4 7326 B14R1.135 COC(=O)C(O)Cc1cncc(F)c1 Amb33196258 [0,2,0,0,0,0|2,0,0]=4 7327 B14R1.135 COC(=O)[C@@H](N)Cc1cccc(O)c1 Amb22746779 [0,2,0,0,0,0|0,0,0]=2 7328 B14R1.135 COC(=O)[C@H](N)Cc1cccc(C)c1 Amb29848699 [0,2,0,0,0,0|0,0,0]=2 7329 B14R1.135 COC(=O)[C@H](N)Cc1cccc(F)c1 Amb2698797 [0,2,0,0,0,0|0,0,0]=2 7330 B14R1.135 Cc1cccc(CC(N)C(=O)NO)c1 Amb27226078 [0,2,0,0,0,0|0,0,0]=2 7331 B14R1.135 Cc1cccc(CN(C)C(=O)CO)c1 Amb17401773 [0,2,0,0,0,0|2,0,0]=4 7332 B14R1.1007 CCC(=O)C(C)Cc1ccccc1C Amb17234957 [0,2,0,0,0,0|2,0,0]=4 7333 B14R1.1007 CCC(=O)C(C)Cc1ccccc1Cl Amb17240770 [0,2,0,0,0,0|2,0,0]=4 7334 B14R1.1007 CCC(=O)C(C)Cc1ccccc1F Amb17235956 [0,2,0,0,0,0|2,0,0]=4 7335 B14R1.1007 CN(Cc1ccccc1Cl)C(=O)CO Amb17404294 [0,2,0,0,0,0|2,0,0]=4 7336 B14R1.1007 CN(Cc1ccccc1F)C(=O)CO Amb9421465 [0,2,0,0,0,0|2,0,0]=4 7337 B14R1.1007 CNC(=O)C(N)Cc1ccccc1Br Amb33230534 [0,2,0,0,0,0|1,0,0]=3 7338 B14R1.1007 COC(=O)C(=O)Cc1ccccc1C Amb17139340 [0,2,0,0,0,0|1,0,1]=4 7339 B14R1.1007 COC(=O)C(=O)Cc1ccccc1Cl Amb17140708 [0,2,0,0,0,0|1,0,1]=4 7340 B14R1.1007 COC(=O)C(=O)Cc1ccccc1F Amb17139584 [0,2,0,0,0,0|1,0,1]=4 7341 B14R1.1007 COC(=O)C(Br)Cc1ccccc1C Amb17355935 [0,2,0,0,0,0|1,0,0]=3 7342 B14R1.1007 COC(=O)C(Br)Cc1ccccc1Cl Amb4074141 [0,2,0,0,0,0|1,0,0]=3 7343 B14R1.1007 COC(=O)C(Br)Cc1ccccc1F Amb17357772 [0,2,0,0,0,0|1,0,0]=3 7344 B14R1.1007 COC(=O)C(C)Nc1ccccc1Cl Amb19018595 [0,2,0,0,0,0|2,0,0]=4 7345 B14R1.1007 COC(=O)C(C)Oc1ccccc1C Amb4292034 [0,2,0,0,0,0|2,0,0]=4 7346 B14R1.1007 COC(=O)C(C)Oc1ccccc1N Amb17110001 [0,2,0,0,0,0|2,0,0]=4 7347 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1Br Amb17204952 [0,2,0,0,0,0|1,0,0]=3 7348 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1C Amb17204446 [0,2,0,0,0,0|1,0,0]=3 7349 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1Cl Amb17204591 [0,2,0,0,0,0|1,0,0]=3 7350 B14R1.1007 COC(=O)C(Cl)Cc1ccccc1F Amb17204462 [0,2,0,0,0,0|1,0,0]=3 7351 B14R1.1007 COC(=O)C(N)Cc1ccccc1Br Amb32753638 [0,2,0,0,0,0|0,0,0]=2 7352 B14R1.1007 COC(=O)C(N)Cc1ccccc1Br Amb32839096 [0,2,0,0,0,0|0,0,0]=2 7353 B14R1.1007 COC(=O)C(N)Cc1ccccc1C Amb17401769 [0,2,0,0,0,0|0,0,0]=2 7354 B14R1.1007 COC(=O)C(N)Cc1ccccc1Cl Amb17404292 [0,2,0,0,0,0|0,0,0]=2 7355 B14R1.1007 COC(=O)C(N)Cc1ccccc1F Amb17402181 [0,2,0,0,0,0|0,0,0]=2 7356 B14R1.1007 COC(=O)C(N)Cc1ccccc1O Amb28653208 [0,2,0,0,0,0|0,0,0]=2 7357 B14R1.1007 COC(=O)C(O)Cc1ccccc1Br Amb33430066 [0,2,0,0,0,0|1,0,0]=3 7358 B14R1.1007 COC(=O)C(O)Cc1ccccc1C Amb17139448 [0,2,0,0,0,0|1,0,0]=3 7359 B14R1.1007 COC(=O)C(O)Cc1ccccc1Cl Amb17140886 [0,2,0,0,0,0|1,0,0]=3 7360 B14R1.1007 COC(=O)C(O)Cc1ccccc1F Amb17139693 [0,2,0,0,0,0|1,0,0]=3 7361 B14R1.1007 COC(=O)C(O)Cc1ccccc1O Amb33079607 [0,2,0,0,0,0|1,0,0]=3 7362 B14R1.1007 COC(=O)C(O)Cc1cccnc1Br Amb33387847 [0,2,0,0,0,0|2,0,0]=4 7363 B14R1.1007 COC(=O)C(O)Cc1cccnc1C Amb32878952 [0,2,0,0,0,0|2,0,0]=4 7364 B14R1.1007 COC(=O)C(O)Cc1cccnc1Cl Amb33257313 [0,2,0,0,0,0|2,0,0]=4 7365 B14R1.1007 COC(=O)C(O)Cc1cccnc1F Amb33377180 [0,2,0,0,0,0|2,0,0]=4 7366 B14R1.1007 COC(=O)C(O)Cc1ccncc1Br Amb33388641 [0,2,0,0,0,0|2,0,0]=4 7367 B14R1.1007 COC(=O)C(O)Cc1ccncc1C Amb33426459 [0,2,0,0,0,0|2,0,0]=4 7368 B14R1.1007 COC(=O)C(O)Cc1ccncc1Cl Amb33406508 [0,2,0,0,0,0|2,0,0]=4 7369 B14R1.1007 COC(=O)C(O)Cc1ccncc1F Amb33316851 [0,2,0,0,0,0|2,0,0]=4 7370 B14R1.1007 COC(=O)C(O)Cc1cnccc1C Amb33376668 [0,2,0,0,0,0|2,0,0]=4 7371 B14R1.1007 COC(=O)C(O)Cc1ncccc1Br Amb33241226 [0,2,0,0,0,0|2,0,0]=4 7372 B14R1.1007 COC(=O)C(O)Cc1ncccc1C Amb33360258 [0,2,0,0,0,0|2,0,0]=4 7373 B14R1.1007 COC(=O)C(O)Cc1ncccc1F Amb33418448 [0,2,0,0,0,0|2,0,0]=4 7374 B14R1.1007 COC(=O)[C@@H](N)Cc1ccccc1C Amb34162481 [0,2,0,0,0,0|0,0,0]=2 7375 B14R1.1007 COC(=O)[C@@H](N)Cc1ccccc1Cl Amb30633893 [0,2,0,0,0,0|0,0,0]=2 7376 B14R1.1007 COC(=O)[C@H](N)Cc1ccccc1C Amb35825274 [0,2,0,0,0,0|0,0,0]=2 7377 B14R1.1007 COC(=O)[C@H](N)Cc1ccccc1Cl Amb34162293 [0,2,0,0,0,0|0,0,0]=2 7378 B14R1.1007 Cc1ccccc1CN(C)C(=O)CO Amb1109921 [0,2,0,0,0,0|2,0,0]=4 7379 B14R1.1031 CCC(Nc1ccccc1)C(=O)NO Amb27749302 [0,2,0,0,0,0|2,0,0]=4 7380 B14R1.1031 CCC(Nc1ccccc1)C(=O)OC Amb19050998 [0,2,0,0,0,0|2,0,0]=4 7381 B14R1.1031 CCN(Cc1ccccc1)C(=O)CO Amb5798081 [0,2,0,0,0,0|2,0,0]=4 7382 B14R1.1031 CNC(=O)C(C#N)Cc1ccccc1 Amb19077180 [0,2,0,0,0,0|1,0,1]=4 7383 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb19079328 [0,2,0,0,0,0|0,0,0]=2 7384 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb30633473 [0,2,0,0,0,0|0,0,0]=2 7385 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb16183825 [0,2,0,0,0,0|0,0,0]=2 7386 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb22745351 [0,2,0,0,0,0|0,0,0]=2 7387 B14R1.1031 CN[C@H](Cc1ccccc1)C(=O)OC Amb33483084 [0,2,0,0,0,0|0,0,0]=2 7388 B14R1.1031 CN[C@H](Cc1ccccc1)C(=O)OC Amb33483812 [0,2,0,0,0,0|0,0,0]=2 7389 B14R1.1031 COC(=O)C(C#N)Cc1ccccc1 Amb17336069 [0,2,0,0,0,0|0,0,1]=3 7390 B14R1.1031 COC(=O)C(CN)Cc1ccccc1 Amb2694062 [0,2,0,0,0,0|0,0,0]=2 7391 B14R1.1031 COC(=O)C(CN)Cc1ccccc1 Amb7800908 [0,2,0,0,0,0|0,0,0]=2 7392 B14R1.1031 COC(=O)C(CN)Cc1ccccn1 Amb7800909 [0,2,0,0,0,0|1,0,0]=3 7393 B14R1.1031 COC(=O)C(CN)Cc1cccnc1 Amb7800867 [0,2,0,0,0,0|1,0,0]=3 7394 B14R1.1031 COC(=O)C(CN)Cc1ccncc1 Amb19514908 [0,2,0,0,0,0|1,0,0]=3 7395 B14R1.1031 COC(=O)C(CN)Cc1ccncc1 Amb7800864 [0,2,0,0,0,0|1,0,0]=3 7396 B14R1.1031 COC(=O)C(CN)Oc1ccccc1 Amb32651896 [0,2,0,0,0,0|1,0,0]=3 7397 B14R1.1031 COC(=O)C(CN)Oc1ccccc1 Amb32651920 [0,2,0,0,0,0|1,0,0]=3 7398 B14R1.1031 COC(=O)C(CO)Cc1ccccc1 Amb10608962 [0,2,0,0,0,0|1,0,0]=3 7399 B14R1.1031 COC(=O)C(Cc1ccccc1)ON Amb33339253 [0,2,0,0,0,0|0,0,0]=2 7400 B14R1.1031 COC(=O)[C@@H](CN)Cc1ccccc1 Amb33329063 [0,2,0,0,0,0|0,0,0]=2 7401 B14R1.1031 COC(=O)[C@@H](CN)Cc1ccccc1 Amb33329082 [0,2,0,0,0,0|0,0,0]=2 7402 B14R1.1031 COC(=O)[C@@H](CN)Oc1ccccc1 Amb32680272 [0,2,0,0,0,0|1,0,0]=3 7403 B14R1.1031 COC(=O)[C@@H](CN)Oc1ccccc1 Amb32680273 [0,2,0,0,0,0|1,0,0]=3 7404 B14R1.1031 COC(=O)[C@H](CN)Cc1ccccc1 Amb33328927 [0,2,0,0,0,0|0,0,0]=2 7405 B14R1.1031 COC(=O)[C@H](CN)Cc1ccccc1 Amb33457754 [0,2,0,0,0,0|0,0,0]=2 7406 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb18650860 [0,2,0,0,0,0|0,0,2]=4 7407 B14R1.1031 COC(=O)\C(=C\c1ccccc1)CN Amb32413923 [0,2,0,0,0,0|0,0,2]=4 7408 B14R1.1031 N#CC(Cc1ccccc1)C(=O)NN Amb19748596 [0,2,0,0,0,0|1,0,1]=4 7409 B14R1.1107 CC(N)(Cc1ccccc1)C(=O)NN Amb28400132 [0,2,0,0,0,0|1,0,0]=3 7410 B14R1.1107 CNC(=O)C(C)(C)Cc1ccccc1 Amb16943079 [0,2,0,0,0,0|2,0,0]=4 7411 B14R1.1107 COC(=O)C(C)(C)Cc1ccccc1 Amb17844108 [0,2,0,0,0,0|1,0,0]=3 7412 B14R1.1107 COC(=O)C(C)(C)Nc1ccccc1 Amb18304726 [0,2,0,0,0,0|2,0,0]=4 7413 B14R1.1107 COC(=O)C(C)(C)Oc1ccccc1 Amb17401865 [0,2,0,0,0,0|2,0,0]=4 7414 B14R1.1107 COC(=O)C(C)(Cl)Cc1ccccc1 Amb32729440 [0,2,0,0,0,0|1,0,0]=3 7415 B14R1.1107 COC(=O)C(C)(N)Cc1ccccc1 Amb17401738 [0,2,0,0,0,0|0,0,0]=2 7416 B14R1.1107 COC(=O)C(C)(N)Cc1ccccc1 Amb6365465 [0,2,0,0,0,0|0,0,0]=2 7417 B14R1.1107 COC(=O)C(C)(N)Cc1ccccn1 Amb17401871 [0,2,0,0,0,0|1,0,0]=3 7418 B14R1.1107 COC(=O)C(C)(N)Cc1cccnc1 Amb17401875 [0,2,0,0,0,0|1,0,0]=3 7419 B14R1.1107 COC(=O)C(C)(N)Cc1ccncc1 Amb17401880 [0,2,0,0,0,0|1,0,0]=3 7420 B14R1.1107 C[C@@](N)(Cc1ccccc1)C(=O)NN Amb28436139 [0,2,0,0,0,0|1,0,0]=3 7421 B14R1.75 C#Cc1cccc(CC(=O)C(=O)O)c1 Amb33267698 [0,2,0,0,0,0|1,0,1]=4 7422 B14R1.75 C#Cc1cccc(CC(C)C(=O)O)c1 Amb33267716 [0,2,0,0,0,0|1,0,0]=3 7423 B14R1.75 C#Cc1cccc(CC(N)C(=O)O)c1 Amb27481658 [0,2,0,0,0,0|0,0,0]=2 7424 B14R1.75 C#Cc1cccc(CC(O)C(=O)O)c1 Amb33267465 [0,2,0,0,0,0|1,0,0]=3 7425 B14R1.75 C#Cc1cccc(C[C@H](N)C(=O)O)c1 Amb26476331 [0,2,0,0,0,0|0,0,0]=2 7426 B14R1.75 C#Cc1cccc(NC(C)C(=O)O)c1 Amb18999355 [0,2,0,0,0,0|2,0,0]=4 7427 B14R1.75 CC(=O)C(Br)Cc1cccc(C#N)c1 Amb27783996 [0,2,0,0,0,0|2,0,0]=4 7428 B14R1.75 CC(Cc1cccc(C#N)c1)C(=O)O Amb17605833 [0,2,0,0,0,0|1,0,0]=3 7429 B14R1.75 CC(Cc1ccnc(C#N)c1)C(=O)O Amb35708163 [0,2,0,0,0,0|2,0,0]=4 7430 B14R1.75 CC(Nc1cccc(CO)c1)C(=O)O Amb27871098 [0,2,0,0,0,0|2,0,0]=4 7431 B14R1.75 CC(Oc1cccc(C#N)c1)C(=O)O Amb9712984 [0,2,0,0,0,0|2,0,0]=4 7432 B14R1.75 CC(Oc1cccc(C=O)c1)C(=O)O Amb9702571 [0,2,0,0,0,0|2,0,0]=4 7433 B14R1.75 CC(Oc1cccc(CO)c1)C(=O)O Amb19064505 [0,2,0,0,0,0|2,0,0]=4 7434 B14R1.75 CCc1cccc(CC(=O)C(=O)O)c1 Amb32876491 [0,2,0,0,0,0|1,0,1]=4 7435 B14R1.75 CCc1cccc(CC(Br)C(C)=O)c1 Amb32677015 [0,2,0,0,0,0|2,0,0]=4 7436 B14R1.75 CCc1cccc(CC(C)C(=O)O)c1 Amb33362427 [0,2,0,0,0,0|1,0,0]=3 7437 B14R1.75 CCc1cccc(CC(N)C(=O)O)c1 Amb31204538 [0,2,0,0,0,0|0,0,0]=2 7438 B14R1.75 CCc1cccc(CC(O)C(=O)O)c1 Amb32876486 [0,2,0,0,0,0|1,0,0]=3 7439 B14R1.75 CCc1cccc(NC(C)C(=O)O)c1 Amb18315702 [0,2,0,0,0,0|2,0,0]=4 7440 B14R1.75 CCc1cccc(\C=C(\N)C(=O)O)c1 Amb27454467 [0,2,0,0,0,0|0,0,2]=4 7441 B14R1.75 CNc1cccc(CC(N)C(=O)O)c1 Amb27430354 [0,2,0,0,0,0|0,0,0]=2 7442 B14R1.75 COc1cc(CC(C)C(=O)O)ccn1 Amb33320584 [0,2,0,0,0,0|2,0,0]=4 7443 B14R1.75 COc1cc(CC(N)C(=O)O)ccn1 Amb33359771 [0,2,0,0,0,0|1,0,0]=3 7444 B14R1.75 COc1cc(CC(O)C(=O)O)ccn1 Amb33320563 [0,2,0,0,0,0|2,0,0]=4 7445 B14R1.75 COc1cccc(CC(=O)C(=O)O)c1 Amb1129281 [0,2,0,0,0,0|1,0,1]=4 7446 B14R1.75 COc1cccc(CC(Br)C(C)=O)c1 Amb17507792 [0,2,0,0,0,0|2,0,0]=4 7447 B14R1.75 COc1cccc(CC(C)C(=O)O)c1 Amb5744017 [0,2,0,0,0,0|1,0,0]=3 7448 B14R1.75 COc1cccc(CC(C)C(=O)O)n1 Amb33449148 [0,2,0,0,0,0|2,0,0]=4 7449 B14R1.75 COc1cccc(CC(C)C(C)=O)c1 Amb17235391 [0,2,0,0,0,0|2,0,0]=4 7450 B14R1.75 COc1cccc(CC(Cl)C(=O)O)c1 Amb17204460 [0,2,0,0,0,0|1,0,0]=3 7451 B14R1.75 COc1cccc(CC(Cl)C(C)=O)c1 Amb17204449 [0,2,0,0,0,0|2,0,0]=4 7452 B14R1.75 COc1cccc(CC(Cl)C(N)=O)c1 Amb17204454 [0,2,0,0,0,0|2,0,0]=4 7453 B14R1.75 COc1cccc(CC(N)C(=O)O)c1 Amb32668396 [0,2,0,0,0,0|0,0,0]=2 7454 B14R1.75 COc1cccc(CC(N)C(=O)O)c1 Amb3788569 [0,2,0,0,0,0|0,0,0]=2 7455 B14R1.75 COc1cccc(CC(N)C(=O)O)n1 Amb33079806 [0,2,0,0,0,0|1,0,0]=3 7456 B14R1.75 COc1cccc(CC(O)C(=O)O)c1 Amb17139588 [0,2,0,0,0,0|1,0,0]=3 7457 B14R1.75 COc1cccc(CC(O)C(=O)O)n1 Amb33353442 [0,2,0,0,0,0|2,0,0]=4 7458 B14R1.75 COc1cccc(C[C@@H](C)C(=O)O)c1 Amb33739400 [0,2,0,0,0,0|1,0,0]=3 7459 B14R1.75 COc1cccc(C[C@@H](N)C(=O)O)c1 Amb16231882 [0,2,0,0,0,0|0,0,0]=2 7460 B14R1.75 COc1cccc(C[C@H](C)C(=O)O)c1 Amb33744357 [0,2,0,0,0,0|1,0,0]=3 7461 B14R1.75 COc1cccc(C[C@H](N)C(=O)O)c1 Amb6295865 [0,2,0,0,0,0|0,0,0]=2 7462 B14R1.75 COc1cccc(NC(C)C(=O)O)c1 Amb840552 [0,2,0,0,0,0|2,0,0]=4 7463 B14R1.75 COc1cccc(OC(C)C(=O)O)c1 Amb9702585 [0,2,0,0,0,0|2,0,0]=4 7464 B14R1.75 COc1cccc(SC(C)C(=O)O)c1 Amb1130562 [0,2,0,0,0,0|2,0,0]=4 7465 B14R1.75 COc1ccnc(CC(C)C(=O)O)c1 Amb33319075 [0,2,0,0,0,0|2,0,0]=4 7466 B14R1.75 COc1ccnc(CC(N)C(=O)O)c1 Amb33319088 [0,2,0,0,0,0|1,0,0]=3 7467 B14R1.75 COc1ccnc(CC(O)C(=O)O)c1 Amb33319046 [0,2,0,0,0,0|2,0,0]=4 7468 B14R1.75 COc1cncc(CC(C)C(=O)O)c1 Amb33172347 [0,2,0,0,0,0|2,0,0]=4 7469 B14R1.75 COc1cncc(CC(N)C(=O)O)c1 Amb32954594 [0,2,0,0,0,0|1,0,0]=3 7470 B14R1.75 COc1cncc(CC(O)C(=O)O)c1 Amb32873861 [0,2,0,0,0,0|2,0,0]=4 7471 B14R1.75 CSc1cccc(CC(=O)C(=O)O)c1 Amb33143915 [0,2,0,0,0,0|1,0,1]=4 7472 B14R1.75 CSc1cccc(CC(C)C(=O)O)c1 Amb33143805 [0,2,0,0,0,0|1,0,0]=3 7473 B14R1.75 CSc1cccc(CC(N)C(=O)O)c1 Amb33172288 [0,2,0,0,0,0|0,0,0]=2 7474 B14R1.75 CSc1cccc(CC(O)C(=O)O)c1 Amb33353445 [0,2,0,0,0,0|1,0,0]=3 7475 B14R1.75 C[C@H](Oc1cccc(C#N)c1)C(=O)O Amb27761919 [0,2,0,0,0,0|2,0,0]=4 7476 B14R1.75 N#Cc1cc(C[C@H](N)C(=O)O)ccn1 Amb26847784 [0,2,0,0,0,0|1,0,0]=3 7477 B14R1.75 N#Cc1cccc(CC(=O)C(=O)O)c1 Amb1130314 [0,2,0,0,0,0|1,0,1]=4 7478 B14R1.75 N#Cc1cccc(CC(N)C(=O)O)c1 Amb18650431 [0,2,0,0,0,0|0,0,0]=2 7479 B14R1.75 N#Cc1cccc(CC(N)C(=O)O)c1 Amb31291113 [0,2,0,0,0,0|0,0,0]=2 7480 B14R1.75 N#Cc1cccc(CC(N)C(=O)O)n1 Amb27746772 [0,2,0,0,0,0|1,0,0]=3 7481 B14R1.75 N#Cc1cccc(CC(O)C(=O)O)c1 Amb33353415 [0,2,0,0,0,0|1,0,0]=3 7482 B14R1.75 N#Cc1cccc(C[C@@H](N)C(=O)O)c1 Amb8397027 [0,2,0,0,0,0|0,0,0]=2 7483 B14R1.75 N#Cc1cccc(C[C@H](N)C(=O)O)c1 Amb6357194 [0,2,0,0,0,0|0,0,0]=2 7484 B14R1.75 N#Cc1cccc(C[C@H](N)C(=O)O)n1 Amb27831613 [0,2,0,0,0,0|1,0,0]=3 7485 B14R1.75 N#Cc1ccnc(C[C@H](N)C(=O)O)c1 Amb27611763 [0,2,0,0,0,0|1,0,0]=3 7486 B14R1.75 N#Cc1cncc(C[C@@H](N)C(=O)O)c1 Amb27781081 [0,2,0,0,0,0|1,0,0]=3 7487 B14R1.75 NCc1cccc(CC(N)C(=O)O)c1 Amb31031105 [0,2,0,0,0,0|0,0,0]=2 7488 B14R1.75 NCc1cccc(CC(N)C(=O)O)c1 Amb31204539 [0,2,0,0,0,0|0,0,0]=2 7489 B14R1.75 NCc1cccc(C[C@@H](N)C(=O)O)c1 Amb8397031 [0,2,0,0,0,0|0,0,0]=2 7490 B14R1.75 NCc1cccc(C[C@H](N)C(=O)O)c1 Amb8397030 [0,2,0,0,0,0|0,0,0]=2 7491 B14R1.150 C=C(C(=O)O)[C@@H](O)c1cccc(O)c1 Amb27478068 [0,2,0,0,0,0|1,0,1]=4 7492 B14R1.150 CC(=O)C(Br)C(C)c1cccc(Br)c1 Amb27193664 [0,2,0,0,0,0|2,0,0]=4 7493 B14R1.150 CC(=O)C(C)C(O)c1cccc(C)c1 Amb27164419 [0,2,0,0,0,0|2,0,0]=4 7494 B14R1.150 CC(=O)C(C)C(O)c1cccc(F)c1 Amb27829907 [0,2,0,0,0,0|2,0,0]=4 7495 B14R1.150 CC(=O)[C@@H](C)[C@@H](O)c1cccc(F)c1 Amb27980379 [0,2,0,0,0,0|2,0,0]=4 7496 B14R1.150 CC(=O)[C@H](C)[C@@H](O)c1cccc(F)c1 Amb27605444 [0,2,0,0,0,0|2,0,0]=4 7497 B14R1.150 CC(C(=O)O)C(C)c1cccc(F)c1 Amb25707225 [0,2,0,0,0,0|1,0,0]=3 7498 B14R1.150 CC(C(=O)O)C(C)c1cncc(Br)c1 Amb35669517 [0,2,0,0,0,0|2,0,0]=4 7499 B14R1.150 CC(C(=O)O)N(C)c1cccc(F)c1 Amb28075913 [0,2,0,0,0,0|2,0,0]=4 7500 B14R1.150 CC(C(=O)O)N(C)c1cccc(N)c1 Amb18294613 [0,2,0,0,0,0|2,0,0]=4 7501 B14R1.150 CC(C(=O)O)N(N)c1cccc(Cl)c1 Amb28239514 [0,2,0,0,0,0|2,0,0]=4 7502 B14R1.150 CC(c1cccc(Br)c1)C(N)C(=O)O Amb35660775 [0,2,0,0,0,0|0,0,0]=2 7503 B14R1.150 CC(c1cccc(Cl)c1)C(N)C(=O)O Amb35660778 [0,2,0,0,0,0|0,0,0]=2 7504 B14R1.150 CC(c1cccc(F)c1)C(N)C(=O)O Amb27847154 [0,2,0,0,0,0|0,0,0]=2 7505 B14R1.150 CC(c1cccc(F)c1)[C@@H](C)C(=O)O Amb33738119 [0,2,0,0,0,0|1,0,0]=3 7506 B14R1.150 CC(c1cccc(F)c1)[C@H](C)C(=O)O Amb33749538 [0,2,0,0,0,0|1,0,0]=3 7507 B14R1.150 CC(c1cncc(Br)c1)C(F)C(=O)O Amb35669508 [0,2,0,0,0,0|2,0,0]=4 7508 B14R1.150 CC(c1cncc(Br)c1)C(N)C(=O)O Amb35663284 [0,2,0,0,0,0|1,0,0]=3 7509 B14R1.150 CC(c1cncc(F)c1)C(N)C(=O)O Amb35663192 [0,2,0,0,0,0|1,0,0]=3 7510 B14R1.150 Cc1cc(C(O)C(N)C(=O)O)ccn1 Amb32733157 [0,2,0,0,0,0|1,0,0]=3 7511 B14R1.150 Cc1cccc(C(C)C(N)C(=O)O)c1 Amb29892508 [0,2,0,0,0,0|0,0,0]=2 7512 B14R1.150 Cc1cccc(C(C)C(O)C(=O)O)c1 Amb27387139 [0,2,0,0,0,0|1,0,0]=3 7513 B14R1.150 Cc1cccc(C(O)C(N)C(=O)O)c1 Amb18814158 [0,2,0,0,0,0|0,0,0]=2 7514 B14R1.150 Cc1cccc(C(O)C(N)C(=O)O)n1 Amb33201936 [0,2,0,0,0,0|1,0,0]=3 7515 B14R1.150 Cc1cccc(S(=O)C(C)C(=O)O)c1 Amb18979570 [0,2,0,0,0,0|2,0,0]=4 7516 B14R1.150 Cc1cccc([C@@H](N)[C@H](O)C(=O)O)c1 Amb27200721 [0,2,0,0,0,0|1,0,0]=3 7517 B14R1.150 Cc1cccc([C@H](N)[C@@H](O)C(=O)O)c1 Amb28041508 [0,2,0,0,0,0|1,0,0]=3 7518 B14R1.150 Cc1cccc([C@H](N)[C@H](O)C(=O)O)c1 Amb27883662 [0,2,0,0,0,0|1,0,0]=3 7519 B14R1.150 Cc1ccnc(C(O)C(N)C(=O)O)c1 Amb33318136 [0,2,0,0,0,0|1,0,0]=3 7520 B14R1.150 Cc1cncc(C(O)C(N)C(=O)O)c1 Amb33318298 [0,2,0,0,0,0|1,0,0]=3 7521 B14R1.150 NC(C(=O)O)C(O)c1cc(F)ccn1 Amb33414561 [0,2,0,0,0,0|1,0,0]=3 7522 B14R1.150 NC(C(=O)O)C(O)c1cccc(Br)c1 Amb18692061 [0,2,0,0,0,0|0,0,0]=2 7523 B14R1.150 NC(C(=O)O)C(O)c1cccc(Br)n1 Amb33433117 [0,2,0,0,0,0|1,0,0]=3 7524 B14R1.150 NC(C(=O)O)C(O)c1cccc(Cl)c1 Amb18657877 [0,2,0,0,0,0|0,0,0]=2 7525 B14R1.150 NC(C(=O)O)C(O)c1cccc(Cl)n1 Amb33222327 [0,2,0,0,0,0|1,0,0]=3 7526 B14R1.150 NC(C(=O)O)C(O)c1cccc(F)c1 Amb18187798 [0,2,0,0,0,0|0,0,0]=2 7527 B14R1.150 NC(C(=O)O)C(O)c1cccc(O)c1 Amb25211277 [0,2,0,0,0,0|0,0,0]=2 7528 B14R1.150 NC(C(=O)O)C(O)c1cncc(Br)c1 Amb26942550 [0,2,0,0,0,0|1,0,0]=3 7529 B14R1.150 NC(C(=O)O)C(O)c1cncc(F)c1 Amb33196656 [0,2,0,0,0,0|1,0,0]=3 7530 B14R1.150 NC(c1cccc(Br)c1)C(O)C(=O)O Amb27789890 [0,2,0,0,0,0|1,0,0]=3 7531 B14R1.150 NC(c1cccc(F)c1)C(O)C(=O)O Amb25122657 [0,2,0,0,0,0|1,0,0]=3 7532 B14R1.150 NC(c1cccc(O)c1)C(O)C(=O)O Amb27182755 [0,2,0,0,0,0|1,0,0]=3 7533 B14R1.150 NC(c1ccnc(F)c1)C(O)C(=O)O Amb27880639 [0,2,0,0,0,0|2,0,0]=4 7534 B14R1.150 NC(c1cncc(Br)c1)C(O)C(=O)O Amb27216514 [0,2,0,0,0,0|2,0,0]=4 7535 B14R1.150 N[C@@H](C(=O)O)C(O)c1cccc(F)c1 Amb27876066 [0,2,0,0,0,0|0,0,0]=2 7536 B14R1.150 N[C@@H](c1cc(Cl)ccn1)[C@@H](O)C(=O)O Amb27796504 [0,2,0,0,0,0|2,0,0]=4 7537 B14R1.150 N[C@@H](c1cccc(Br)c1)[C@@H](O)C(=O)O Amb27246692 [0,2,0,0,0,0|1,0,0]=3 7538 B14R1.150 N[C@@H](c1cccc(F)c1)[C@H](O)C(=O)O Amb26855578 [0,2,0,0,0,0|1,0,0]=3 7539 B14R1.150 N[C@@H](c1ccnc(Cl)c1)[C@@H](O)C(=O)O Amb27239258 [0,2,0,0,0,0|2,0,0]=4 7540 B14R1.150 N[C@@H](c1cncc(Cl)c1)[C@@H](O)C(=O)O Amb27962990 [0,2,0,0,0,0|2,0,0]=4 7541 B14R1.150 N[C@@H](c1cncc(F)c1)[C@@H](O)C(=O)O Amb27670083 [0,2,0,0,0,0|2,0,0]=4 7542 B14R1.150 N[C@H](C(=O)O)[C@@H](O)c1cccc(O)c1 Amb27388765 [0,2,0,0,0,0|0,0,0]=2 7543 B14R1.150 N[C@H](C(=O)O)[C@H](O)c1cccc(Cl)c1 Amb27754030 [0,2,0,0,0,0|0,0,0]=2 7544 B14R1.150 N[C@H](C(=O)O)[C@H](O)c1cccc(O)c1 Amb28343175 [0,2,0,0,0,0|0,0,0]=2 7545 B14R1.150 N[C@H](c1cc(Br)ccn1)[C@H](O)C(=O)O Amb27795264 [0,2,0,0,0,0|2,0,0]=4 7546 B14R1.150 N[C@H](c1cc(F)ccn1)[C@H](O)C(=O)O Amb28436385 [0,2,0,0,0,0|2,0,0]=4 7547 B14R1.150 N[C@H](c1ccnc(Cl)c1)[C@H](O)C(=O)O Amb28436386 [0,2,0,0,0,0|2,0,0]=4 7548 B14R1.150 N[C@H](c1cncc(Cl)c1)[C@H](O)C(=O)O Amb27441938 [0,2,0,0,0,0|2,0,0]=4 7549 B14R1.150 N[C@H](c1cncc(F)c1)[C@H](O)C(=O)O Amb27209680 [0,2,0,0,0,0|2,0,0]=4 7550 B14R1.150 Nc1cccc(C(Br)C(Br)C(=O)O)c1 Amb21968238 [0,2,0,0,0,0|1,0,0]=3 7551 B14R1.153 CC(=O)C(Br)Cc1cccc(Br)c1Cl Amb29865465 [0,2,0,0,0,0|2,0,0]=4 7552 B14R1.153 CC(=O)C(Br)Cc1cccc(Br)c1F Amb35653989 [0,2,0,0,0,0|2,0,0]=4 7553 B14R1.153 CC(=O)C(Br)Cc1cccc(C)c1C Amb18072848 [0,2,0,0,0,0|2,0,0]=4 7554 B14R1.153 CC(=O)C(Br)Cc1cccc(Cl)c1Br Amb28136131 [0,2,0,0,0,0|2,0,0]=4 7555 B14R1.153 CC(=O)C(Br)Cc1cccc(Cl)c1C Amb18074220 [0,2,0,0,0,0|2,0,0]=4 7556 B14R1.153 CC(=O)C(Br)Cc1cccc(Cl)c1Cl Amb18084861 [0,2,0,0,0,0|2,0,0]=4 7557 B14R1.153 CC(=O)C(Br)Cc1cccc(Cl)c1F Amb26609805 [0,2,0,0,0,0|2,0,0]=4 7558 B14R1.153 CC(=O)C(Br)Cc1cccc(F)c1Cl Amb35706288 [0,2,0,0,0,0|2,0,0]=4 7559 B14R1.153 CC(=O)C(Cl)Cc1cccc(C)c1C Amb17204432 [0,2,0,0,0,0|2,0,0]=4 7560 B14R1.153 CC(=O)C(Cl)Cc1cccc(Cl)c1C Amb17204554 [0,2,0,0,0,0|2,0,0]=4 7561 B14R1.153 CC(=O)C(Cl)Cc1cccc(Cl)c1Cl Amb17204746 [0,2,0,0,0,0|2,0,0]=4 7562 B14R1.153 CC(=O)C(N)Cc1cccc(C)c1C Amb24507236 [0,2,0,0,0,0|1,0,0]=3 7563 B14R1.153 CC(=O)C(N)Cc1cccc(Cl)c1C Amb28188764 [0,2,0,0,0,0|1,0,0]=3 7564 B14R1.153 CC(=O)C(N)Cc1cccc(Cl)c1Cl Amb26454515 [0,2,0,0,0,0|1,0,0]=3 7565 B14R1.153 CC(Cc1cccc(Br)c1Cl)C(=O)O Amb26358388 [0,2,0,0,0,0|1,0,0]=3 7566 B14R1.153 CC(Cc1cccc(Br)c1F)C(=O)O Amb27478472 [0,2,0,0,0,0|1,0,0]=3 7567 B14R1.153 CC(Cc1cccc(Br)c1O)C(=O)O Amb33332251 [0,2,0,0,0,0|1,0,0]=3 7568 B14R1.153 CC(Cc1cccc(Cl)c1Br)C(=O)O Amb26502409 [0,2,0,0,0,0|1,0,0]=3 7569 B14R1.153 CC(Cc1cccc(Cl)c1Cl)C(=O)O Amb17605805 [0,2,0,0,0,0|1,0,0]=3 7570 B14R1.153 CC(Cc1cccc(Cl)c1F)C(=O)O Amb27236719 [0,2,0,0,0,0|1,0,0]=3 7571 B14R1.153 CC(Cc1cccc(Cl)c1O)C(=O)O Amb33223575 [0,2,0,0,0,0|1,0,0]=3 7572 B14R1.153 CC(Cc1cccc(F)c1Br)C(=O)O Amb24521620 [0,2,0,0,0,0|1,0,0]=3 7573 B14R1.153 CC(Cc1cccc(F)c1Cl)C(=O)O Amb27199268 [0,2,0,0,0,0|1,0,0]=3 7574 B14R1.153 CC(Cc1cccc(F)c1F)C(=O)Cl Amb28292568 [0,2,0,0,0,0|2,0,0]=4 7575 B14R1.153 CC(Cc1cccc(F)c1F)C(=O)O Amb18972344 [0,2,0,0,0,0|1,0,0]=3 7576 B14R1.153 CC(Cc1cccc(F)c1O)C(=O)O Amb33311185 [0,2,0,0,0,0|1,0,0]=3 7577 B14R1.153 CC(Cc1cccc(O)c1Br)C(=O)O Amb25674846 [0,2,0,0,0,0|1,0,0]=3 7578 B14R1.153 CC(Cc1cccc(O)c1Cl)C(=O)O Amb25699254 [0,2,0,0,0,0|1,0,0]=3 7579 B14R1.153 CC(Cc1cccc(O)c1F)C(=O)O Amb27158832 [0,2,0,0,0,0|1,0,0]=3 7580 B14R1.153 CC(Cc1cccc(O)c1O)C(=O)O Amb33269533 [0,2,0,0,0,0|1,0,0]=3 7581 B14R1.153 CC(Nc1cccc(Br)c1Cl)C(=O)O Amb29865269 [0,2,0,0,0,0|2,0,0]=4 7582 B14R1.153 CC(Nc1cccc(Br)c1F)C(=O)O Amb35592896 [0,2,0,0,0,0|2,0,0]=4 7583 B14R1.153 CC(Nc1cccc(Cl)c1Br)C(=O)O Amb27869179 [0,2,0,0,0,0|2,0,0]=4 7584 B14R1.153 CC(Nc1cccc(Cl)c1Cl)C(=O)O Amb17408472 [0,2,0,0,0,0|2,0,0]=4 7585 B14R1.153 CC(Nc1cccc(F)c1Cl)C(=O)O Amb29864356 [0,2,0,0,0,0|2,0,0]=4 7586 B14R1.153 CC(Nc1cccc(F)c1F)C(=O)O Amb18293675 [0,2,0,0,0,0|2,0,0]=4 7587 B14R1.153 CC(Oc1cccc(Cl)c1Cl)C(=O)O Amb9729578 [0,2,0,0,0,0|2,0,0]=4 7588 B14R1.153 CC(Oc1cccc(F)c1F)C(=O)O Amb19002175 [0,2,0,0,0,0|2,0,0]=4 7589 B14R1.153 CC(Sc1cccc(Cl)c1Cl)C(=O)O Amb5769843 [0,2,0,0,0,0|2,0,0]=4 7590 B14R1.153 CC1=CC=CN(CC(Cl)C(=O)O)C1=O Amb27469378 [0,2,0,0,0,0|2,0,0]=4 7591 B14R1.153 CC1=CC=CN(CC(N)C(=O)O)C1=O Amb28322531 [0,2,0,0,0,0|1,0,0]=3 7592 B14R1.153 CC1=CC=CN(CC(N)C(N)=O)C1=O Amb27418303 [0,2,0,0,0,0|2,0,0]=4 7593 B14R1.153 CC1=NC=CN(CC(N)C(=O)O)C1=O Amb28381500 [0,2,0,0,0,0|2,0,0]=4 7594 B14R1.153 C[C@@H](Cc1cccc(F)c1F)C(=O)O Amb33744623 [0,2,0,0,0,0|1,0,0]=3 7595 B14R1.153 C[C@H](Cc1cccc(F)c1F)C(=O)O Amb33726961 [0,2,0,0,0,0|1,0,0]=3 7596 B14R1.153 Cc1c(Br)cccc1CC(=O)C(=O)O Amb33478395 [0,2,0,0,0,0|1,0,1]=4 7597 B14R1.153 Cc1c(Br)cccc1CC(Br)C(N)=O Amb27590594 [0,2,0,0,0,0|2,0,0]=4 7598 B14R1.153 Cc1c(Br)cccc1CC(C)C(=O)O Amb25705224 [0,2,0,0,0,0|1,0,0]=3 7599 B14R1.153 Cc1c(Br)cccc1CC(N)C(=O)O Amb25365005 [0,2,0,0,0,0|0,0,0]=2 7600 B14R1.153 Cc1c(Br)cccc1CC(O)C(=O)O Amb33478396 [0,2,0,0,0,0|1,0,0]=3 7601 B14R1.153 Cc1c(Br)cccc1C[C@H](N)C(=O)O Amb27401057 [0,2,0,0,0,0|0,0,0]=2 7602 B14R1.153 Cc1c(Cl)cccc1CC(Br)C(=O)O Amb23320623 [0,2,0,0,0,0|1,0,0]=3 7603 B14R1.153 Cc1c(Cl)cccc1CC(Br)C(N)=O Amb27189227 [0,2,0,0,0,0|2,0,0]=4 7604 B14R1.153 Cc1c(Cl)cccc1CC(C)C(=O)O Amb24439500 [0,2,0,0,0,0|1,0,0]=3 7605 B14R1.153 Cc1c(Cl)cccc1CC(Cl)C(=O)O Amb17204585 [0,2,0,0,0,0|1,0,0]=3 7606 B14R1.153 Cc1c(Cl)cccc1CC(Cl)C(N)=O Amb17204558 [0,2,0,0,0,0|2,0,0]=4 7607 B14R1.153 Cc1c(Cl)cccc1C[C@@H](N)C(=O)O Amb27393507 [0,2,0,0,0,0|0,0,0]=2 7608 B14R1.153 Cc1c(Cl)cccc1C[C@H](N)C(=O)O Amb27967300 [0,2,0,0,0,0|0,0,0]=2 7609 B14R1.153 Cc1c(Cl)cccc1NC(C)C(=O)O Amb17404300 [0,2,0,0,0,0|2,0,0]=4 7610 B14R1.153 Cc1c(F)cccc1CC(=O)C(=O)O Amb33372721 [0,2,0,0,0,0|1,0,1]=4 7611 B14R1.153 Cc1c(F)cccc1CC(C)C(=O)O Amb28410822 [0,2,0,0,0,0|1,0,0]=3 7612 B14R1.153 Cc1c(F)cccc1CC(N)C(=O)O Amb22738001 [0,2,0,0,0,0|0,0,0]=2 7613 B14R1.153 Cc1c(F)cccc1CC(O)C(=O)O Amb33372713 [0,2,0,0,0,0|1,0,0]=3 7614 B14R1.153 Cc1c(I)cccc1CC(N)C(=O)O Amb28368283 [0,2,0,0,0,0|0,0,0]=2 7615 B14R1.153 Cc1c(N)cccc1C[C@H](N)C(=O)O Amb27413077 [0,2,0,0,0,0|0,0,0]=2 7616 B14R1.153 Cc1c(N)cccc1SC(C)C(=O)O Amb27747662 [0,2,0,0,0,0|2,0,0]=4 7617 B14R1.153 Cc1c(O)cccc1CC(C)C(=O)O Amb25282969 [0,2,0,0,0,0|1,0,0]=3 7618 B14R1.153 Cc1c(O)cccc1C[C@H](N)C(=O)O Amb27226135 [0,2,0,0,0,0|0,0,0]=2 7619 B14R1.153 Cc1cccc(CC(=O)C(=O)O)c1F Amb25359744 [0,2,0,0,0,0|1,0,1]=4 7620 B14R1.153 Cc1cccc(CC(Br)C(=O)O)c1C Amb23320604 [0,2,0,0,0,0|1,0,0]=3 7621 B14R1.153 Cc1cccc(CC(Br)C(N)=O)c1F Amb28044265 [0,2,0,0,0,0|2,0,0]=4 7622 B14R1.153 Cc1cccc(CC(C)C(=O)O)c1Br Amb24645293 [0,2,0,0,0,0|1,0,0]=3 7623 B14R1.153 Cc1cccc(CC(C)C(=O)O)c1C Amb27985848 [0,2,0,0,0,0|1,0,0]=3 7624 B14R1.153 Cc1cccc(CC(C)C(=O)O)c1Cl Amb25316214 [0,2,0,0,0,0|1,0,0]=3 7625 B14R1.153 Cc1cccc(CC(C)C(=O)O)c1F Amb25763027 [0,2,0,0,0,0|1,0,0]=3 7626 B14R1.153 Cc1cccc(CC(C)C(=O)O)c1O Amb26383767 [0,2,0,0,0,0|1,0,0]=3 7627 B14R1.153 Cc1cccc(CC(Cl)C(=O)O)c1C Amb17204444 [0,2,0,0,0,0|1,0,0]=3 7628 B14R1.153 Cc1cccc(CC(Cl)C(N)=O)c1C Amb17204438 [0,2,0,0,0,0|2,0,0]=4 7629 B14R1.153 Cc1cccc(CC(N)C(=O)O)c1C Amb3788504 [0,2,0,0,0,0|0,0,0]=2 7630 B14R1.153 Cc1cccc(CC(N)C(=O)O)c1Cl Amb27873462 [0,2,0,0,0,0|0,0,0]=2 7631 B14R1.153 Cc1cccc(CC(N)C(=O)O)c1F Amb27161314 [0,2,0,0,0,0|0,0,0]=2 7632 B14R1.153 Cc1cccc(CC(N)C(=O)O)c1I Amb27792936 [0,2,0,0,0,0|0,0,0]=2 7633 B14R1.153 Cc1cccc(CC(N)C(=O)O)c1O Amb4020373 [0,2,0,0,0,0|0,0,0]=2 7634 B14R1.153 Cc1cccc(CC(O)C(=O)O)c1C Amb33353407 [0,2,0,0,0,0|1,0,0]=3 7635 B14R1.153 Cc1cccc(CC(O)C(=O)O)c1F Amb33353316 [0,2,0,0,0,0|1,0,0]=3 7636 B14R1.153 Cc1cccc(C[C@@H](N)C(=O)O)c1C Amb19061743 [0,2,0,0,0,0|0,0,0]=2 7637 B14R1.153 Cc1cccc(C[C@H](N)C(=O)O)c1C Amb24093651 [0,2,0,0,0,0|0,0,0]=2 7638 B14R1.153 Cc1cccc(C[C@H](N)C(=O)O)c1F Amb27830599 [0,2,0,0,0,0|0,0,0]=2 7639 B14R1.153 Cc1cccc(C[C@H](N)C(=O)O)c1I Amb27256696 [0,2,0,0,0,0|0,0,0]=2 7640 B14R1.153 Cc1cccc(NC(C)C(=O)O)c1C Amb840568 [0,2,0,0,0,0|2,0,0]=4 7641 B14R1.153 Cc1cccc(OC(C)C(=O)O)c1C Amb9702386 [0,2,0,0,0,0|2,0,0]=4 7642 B14R1.153 Cc1cccc(OC(C)C(=O)O)c1I Amb33512388 [0,2,0,0,0,0|2,0,0]=4 7643 B14R1.153 Cc1cccc(OC(C)C(=O)O)c1N Amb18999351 [0,2,0,0,0,0|2,0,0]=4 7644 B14R1.153 Cc1cccc(OC(F)C(=O)O)c1F Amb28045381 [0,2,0,0,0,0|2,0,0]=4 7645 B14R1.153 NC(=O)C(Br)Cc1cccc(Br)c1Cl Amb29865472 [0,2,0,0,0,0|2,0,0]=4 7646 B14R1.153 NC(=O)C(Br)Cc1cccc(Br)c1F Amb35653990 [0,2,0,0,0,0|2,0,0]=4 7647 B14R1.153 NC(=O)C(Br)Cc1cccc(Cl)c1F Amb28124605 [0,2,0,0,0,0|2,0,0]=4 7648 B14R1.153 NC(=O)C(Br)Cc1cccc(F)c1Cl Amb35706289 [0,2,0,0,0,0|2,0,0]=4 7649 B14R1.153 NC(=O)C(Br)Cc1cccc(F)c1I Amb27806418 [0,2,0,0,0,0|2,0,0]=4 7650 B14R1.153 NC(=O)C(Cl)Cc1cccc(Br)c1Cl Amb29865503 [0,2,0,0,0,0|2,0,0]=4 7651 B14R1.153 NC(=O)C(Cl)Cc1cccc(Br)c1F Amb35653982 [0,2,0,0,0,0|2,0,0]=4 7652 B14R1.153 NC(=O)C(Cl)Cc1cccc(Cl)c1Br Amb27627756 [0,2,0,0,0,0|2,0,0]=4 7653 B14R1.153 NC(=O)C(Cl)Cc1cccc(Cl)c1Cl Amb17204753 [0,2,0,0,0,0|2,0,0]=4 7654 B14R1.153 NC(=O)C(Cl)Cc1cccc(Cl)c1F Amb28206697 [0,2,0,0,0,0|2,0,0]=4 7655 B14R1.153 NC(=O)C(Cl)Cc1cccc(F)c1Cl Amb35706291 [0,2,0,0,0,0|2,0,0]=4 7656 B14R1.153 NC(=O)C(N)CN1C=CC=C(Br)C1=O Amb27813829 [0,2,0,0,0,0|2,0,0]=4 7657 B14R1.153 NC(=O)C(N)Cc1cccc(Cl)c1Cl Amb28122693 [0,2,0,0,0,0|1,0,0]=3 7658 B14R1.153 NC(=O)C(N)Cc1cccc(Cl)c1F Amb27663018 [0,2,0,0,0,0|1,0,0]=3 7659 B14R1.153 NC(=O)C(N)Cc1cccc(F)c1Br Amb27418127 [0,2,0,0,0,0|1,0,0]=3 7660 B14R1.153 NC(CN1C=NC=C(Br)C1=O)C(=O)O Amb27402931 [0,2,0,0,0,0|2,0,0]=4 7661 B14R1.153 NC(CN1C=NC=C(I)C1=O)C(=O)O Amb27172479 [0,2,0,0,0,0|2,0,0]=4 7662 B14R1.153 NC(Cc1cccc(Br)c1Br)C(=O)O Amb27387845 [0,2,0,0,0,0|0,0,0]=2 7663 B14R1.153 NC(Cc1cccc(Br)c1F)C(=O)O Amb25253473 [0,2,0,0,0,0|0,0,0]=2 7664 B14R1.153 NC(Cc1cccc(Br)c1O)C(=O)O Amb27387854 [0,2,0,0,0,0|0,0,0]=2 7665 B14R1.153 NC(Cc1cccc(Cl)c1Cl)C(=O)O Amb3790208 [0,2,0,0,0,0|0,0,0]=2 7666 B14R1.153 NC(Cc1cccc(Cl)c1F)C(=O)O Amb22738179 [0,2,0,0,0,0|0,0,0]=2 7667 B14R1.153 NC(Cc1cccc(Cl)c1I)C(=O)O Amb27600231 [0,2,0,0,0,0|0,0,0]=2 7668 B14R1.153 NC(Cc1cccc(Cl)c1O)C(=O)O Amb25752870 [0,2,0,0,0,0|0,0,0]=2 7669 B14R1.153 NC(Cc1cccc(F)c1Br)C(=O)O Amb24540531 [0,2,0,0,0,0|0,0,0]=2 7670 B14R1.153 NC(Cc1cccc(F)c1Cl)C(=O)O Amb28073840 [0,2,0,0,0,0|0,0,0]=2 7671 B14R1.153 NC(Cc1cccc(F)c1F)C(=O)O Amb2687229 [0,2,0,0,0,0|0,0,0]=2 7672 B14R1.153 NC(Cc1cccc(F)c1O)C(=O)O Amb24526128 [0,2,0,0,0,0|0,0,0]=2 7673 B14R1.153 NC(Cc1cccc(O)c1Br)C(=O)O Amb27816325 [0,2,0,0,0,0|0,0,0]=2 7674 B14R1.153 NC(Cc1cccc(O)c1F)C(=O)O Amb27454815 [0,2,0,0,0,0|0,0,0]=2 7675 B14R1.153 NC(Cc1cccc(O)c1O)C(=O)O Amb21858507 [0,2,0,0,0,0|0,0,0]=2 7676 B14R1.153 NC(Cc1cncc(Br)c1O)C(=O)O Amb27790865 [0,2,0,0,0,0|1,0,0]=3 7677 B14R1.153 N[C@@H](CN1C=CC=C(O)C1=O)C(=O)O Amb28253143 [0,2,0,0,0,0|1,0,0]=3 7678 B14R1.153 N[C@@H](Cc1cccc(Br)c1Cl)C(=O)O Amb25990540 [0,2,0,0,0,0|0,0,0]=2 7679 B14R1.153 N[C@@H](Cc1cccc(Br)c1F)C(=O)O Amb27393078 [0,2,0,0,0,0|0,0,0]=2 7680 B14R1.153 N[C@@H](Cc1cccc(Cl)c1Br)C(=O)O Amb28144198 [0,2,0,0,0,0|0,0,0]=2 7681 B14R1.153 N[C@@H](Cc1cccc(Cl)c1Cl)C(=O)O Amb22228263 [0,2,0,0,0,0|0,0,0]=2 7682 B14R1.153 N[C@@H](Cc1cccc(Cl)c1I)C(=O)O Amb27868728 [0,2,0,0,0,0|0,0,0]=2 7683 B14R1.153 N[C@@H](Cc1cccc(F)c1Br)C(=O)O Amb27467619 [0,2,0,0,0,0|0,0,0]=2 7684 B14R1.153 N[C@@H](Cc1cccc(F)c1F)C(=O)O Amb6296000 [0,2,0,0,0,0|0,0,0]=2 7685 B14R1.153 N[C@@H](Cc1cccc(F)c1O)C(=O)O Amb27214648 [0,2,0,0,0,0|0,0,0]=2 7686 B14R1.153 N[C@@H](Cc1cccc(O)c1Br)C(=O)O Amb27418194 [0,2,0,0,0,0|0,0,0]=2 7687 B14R1.153 N[C@@H](Cc1cccc(O)c1Cl)C(=O)O Amb27488628 [0,2,0,0,0,0|0,0,0]=2 7688 B14R1.153 N[C@@H](Cc1cccc(O)c1O)C(=O)O Amb22228292 [0,2,0,0,0,0|0,0,0]=2 7689 B14R1.153 N[C@@H](Cc1ccnc(Br)c1Br)C(=O)O Amb28347885 [0,2,0,0,0,0|1,0,0]=3 7690 B14R1.153 N[C@@H](Cc1ccnc(Cl)c1Br)C(=O)O Amb27773701 [0,2,0,0,0,0|1,0,0]=3 7691 B14R1.153 N[C@H](Cc1cccc(Br)c1F)C(=O)O Amb25346904 [0,2,0,0,0,0|0,0,0]=2 7692 B14R1.153 N[C@H](Cc1cccc(Cl)c1Cl)C(=O)O Amb22228262 [0,2,0,0,0,0|0,0,0]=2 7693 B14R1.153 N[C@H](Cc1cccc(Cl)c1I)C(=O)O Amb27621460 [0,2,0,0,0,0|0,0,0]=2 7694 B14R1.153 N[C@H](Cc1cccc(F)c1F)C(=O)O Amb20241135 [0,2,0,0,0,0|0,0,0]=2 7695 B14R1.153 N[C@H](Cc1cccc(F)c1I)C(=O)O Amb27494683 [0,2,0,0,0,0|0,0,0]=2 7696 B14R1.153 N[C@H](Cc1cccc(O)c1Br)C(=O)O Amb28437196 [0,2,0,0,0,0|0,0,0]=2 7697 B14R1.153 N[C@H](Cc1cccc(O)c1O)C(=O)O Amb22228291 [0,2,0,0,0,0|0,0,0]=2 7698 B14R1.153 N[C@H](Cc1ccnc(Br)c1Br)C(=O)O Amb27667955 [0,2,0,0,0,0|1,0,0]=3 7699 B14R1.153 N[C@H](Cc1ccnc(Cl)c1Br)C(=O)O Amb27265606 [0,2,0,0,0,0|1,0,0]=3 7700 B14R1.153 Nc1c(F)cccc1C[C@H](N)C(=O)O Amb27440238 [0,2,0,0,0,0|0,0,0]=2 7701 B14R1.153 Nc1c(I)cncc1CC(N)C(=O)O Amb28289954 [0,2,0,0,0,0|1,0,0]=3 7702 B14R1.153 Nc1c(O)cccc1C[C@H](N)C(=O)O Amb27858468 [0,2,0,0,0,0|0,0,0]=2 7703 B14R1.153 Nc1cccc(C[C@H](N)C(=O)O)c1F Amb27252983 [0,2,0,0,0,0|0,0,0]=2 7704 B14R1.153 Nc1cccc(C[C@H](N)C(=O)O)c1N Amb28057138 [0,2,0,0,0,0|0,0,0]=2 7705 B14R1.153 O=C(O)C(=O)Cc1cccc(Br)c1F Amb24527493 [0,2,0,0,0,0|1,0,1]=4 7706 B14R1.153 O=C(O)C(=O)Cc1cccc(Br)c1O Amb33332282 [0,2,0,0,0,0|1,0,1]=4 7707 B14R1.153 O=C(O)C(=O)Cc1cccc(Cl)c1Cl Amb6269198 [0,2,0,0,0,0|1,0,1]=4 7708 B14R1.153 O=C(O)C(=O)Cc1cccc(Cl)c1F Amb28456828 [0,2,0,0,0,0|1,0,1]=4 7709 B14R1.153 O=C(O)C(=O)Cc1cccc(Cl)c1O Amb33056875 [0,2,0,0,0,0|1,0,1]=4 7710 B14R1.153 O=C(O)C(=O)Cc1cccc(F)c1Br Amb27843975 [0,2,0,0,0,0|1,0,1]=4 7711 B14R1.153 O=C(O)C(=O)Cc1cccc(F)c1Cl Amb26540573 [0,2,0,0,0,0|1,0,1]=4 7712 B14R1.153 O=C(O)C(=O)Cc1cccc(F)c1F Amb28077669 [0,2,0,0,0,0|1,0,1]=4 7713 B14R1.153 O=C(O)C(=O)Cc1cccc(F)c1O Amb33311162 [0,2,0,0,0,0|1,0,1]=4 7714 B14R1.153 O=C(O)C(=O)Cc1cccc(O)c1Br Amb33386532 [0,2,0,0,0,0|1,0,1]=4 7715 B14R1.153 O=C(O)C(=O)Cc1cccc(O)c1Cl Amb28320588 [0,2,0,0,0,0|1,0,1]=4 7716 B14R1.153 O=C(O)C(=O)Cc1cccc(O)c1O Amb33269431 [0,2,0,0,0,0|1,0,1]=4 7717 B14R1.153 O=C(O)C(Br)Cc1cccc(Cl)c1Cl Amb23320629 [0,2,0,0,0,0|1,0,0]=3 7718 B14R1.153 O=C(O)C(Cl)Cc1cccc(Cl)c1Cl Amb17204776 [0,2,0,0,0,0|1,0,0]=3 7719 B14R1.153 O=C(O)C(F)Cc1cccc(Br)c1F Amb27845245 [0,2,0,0,0,0|1,0,0]=3 7720 B14R1.153 O=C(O)C(F)Cc1cccc(Cl)c1Cl Amb28430314 [0,2,0,0,0,0|1,0,0]=3 7721 B14R1.153 O=C(O)C(F)Cc1cccc(F)c1Br Amb27867946 [0,2,0,0,0,0|1,0,0]=3 7722 B14R1.153 O=C(O)C(F)Cc1cccc(F)c1F Amb27852017 [0,2,0,0,0,0|1,0,0]=3 7723 B14R1.153 O=C(O)C(F)Cc1cccc(O)c1Cl Amb27653809 [0,2,0,0,0,0|1,0,0]=3 7724 B14R1.153 O=C(O)C(O)Cc1cccc(Br)c1Cl Amb33353273 [0,2,0,0,0,0|1,0,0]=3 7725 B14R1.153 O=C(O)C(O)Cc1cccc(Br)c1F Amb33353336 [0,2,0,0,0,0|1,0,0]=3 7726 B14R1.153 O=C(O)C(O)Cc1cccc(Br)c1O Amb33332230 [0,2,0,0,0,0|1,0,0]=3 7727 B14R1.153 O=C(O)C(O)Cc1cccc(Cl)c1Br Amb33353319 [0,2,0,0,0,0|1,0,0]=3 7728 B14R1.153 O=C(O)C(O)Cc1cccc(Cl)c1Cl Amb24358285 [0,2,0,0,0,0|1,0,0]=3 7729 B14R1.153 O=C(O)C(O)Cc1cccc(Cl)c1F Amb25079623 [0,2,0,0,0,0|1,0,0]=3 7730 B14R1.153 O=C(O)C(O)Cc1cccc(Cl)c1O Amb33223518 [0,2,0,0,0,0|1,0,0]=3 7731 B14R1.153 O=C(O)C(O)Cc1cccc(F)c1Br Amb27872843 [0,2,0,0,0,0|1,0,0]=3 7732 B14R1.153 O=C(O)C(O)Cc1cccc(F)c1Cl Amb27189093 [0,2,0,0,0,0|1,0,0]=3 7733 B14R1.153 O=C(O)C(O)Cc1cccc(F)c1F Amb27837028 [0,2,0,0,0,0|1,0,0]=3 7734 B14R1.153 O=C(O)C(O)Cc1cccc(F)c1O Amb33311159 [0,2,0,0,0,0|1,0,0]=3 7735 B14R1.153 O=C(O)C(O)Cc1cccc(O)c1Br Amb33386766 [0,2,0,0,0,0|1,0,0]=3 7736 B14R1.153 O=C(O)C(O)Cc1cccc(O)c1Cl Amb33353285 [0,2,0,0,0,0|1,0,0]=3 7737 B14R1.153 O=C(O)C(O)Cc1cccc(O)c1O Amb33269427 [0,2,0,0,0,0|1,0,0]=3 7738 B14R1.542 C=C=C(Cc1cccc(F)c1)C(=O)O Amb27878717 [0,2,0,0,0,0|1,0,1]=4 7739 B14R1.542 C=CC(Nc1cccc(Cl)c1)C(=O)O Amb27856755 [0,2,0,0,0,0|2,0,0]=4 7740 B14R1.542 C=CC(Nc1cccc(I)c1)C(=O)O Amb27851197 [0,2,0,0,0,0|2,0,0]=4 7741 B14R1.542 CC(=O)\C(=C\N)Cc1cccc(Cl)c1 Amb28041366 [0,2,0,0,0,0|1,0,1]=4 7742 B14R1.542 CCC(Cc1cccc(Br)c1)C(=O)O Amb19374383 [0,2,0,0,0,0|1,0,0]=3 7743 B14R1.542 CCC(Cc1cccc(Br)c1)C(C)=O Amb17264255 [0,2,0,0,0,0|2,0,0]=4 7744 B14R1.542 CCC(Cc1cccc(C)c1)C(=O)O Amb5744038 [0,2,0,0,0,0|1,0,0]=3 7745 B14R1.542 CCC(Cc1cccc(C)c1)C(C)=O Amb17234958 [0,2,0,0,0,0|2,0,0]=4 7746 B14R1.542 CCC(Cc1cccc(Cl)c1)C(=O)O Amb5744047 [0,2,0,0,0,0|1,0,0]=3 7747 B14R1.542 CCC(Cc1cccc(Cl)c1)C(C)=O Amb17240771 [0,2,0,0,0,0|2,0,0]=4 7748 B14R1.542 CCC(Cc1cccc(F)c1)C(=O)O Amb17605809 [0,2,0,0,0,0|1,0,0]=3 7749 B14R1.542 CCC(Cc1cccc(O)c1)C(=O)O Amb2697947 [0,2,0,0,0,0|1,0,0]=3 7750 B14R1.542 CCC(Nc1cccc(Br)c1)C(=O)O Amb840608 [0,2,0,0,0,0|2,0,0]=4 7751 B14R1.542 CCC(Oc1cccc(C)c1)C(=O)O Amb9702063 [0,2,0,0,0,0|2,0,0]=4 7752 B14R1.542 CCC(Oc1cccc(Cl)c1)C(=O)O Amb9702179 [0,2,0,0,0,0|2,0,0]=4 7753 B14R1.542 CCC(Oc1cccc(N)c1)C(=O)O Amb839770 [0,2,0,0,0,0|2,0,0]=4 7754 B14R1.542 COC(Cc1cc(C)ccn1)C(=O)O Amb33318072 [0,2,0,0,0,0|2,0,0]=4 7755 B14R1.542 COC(Cc1cc(F)ccn1)C(=O)O Amb33224240 [0,2,0,0,0,0|2,0,0]=4 7756 B14R1.542 COC(Cc1cccc(Br)c1)C(=O)O Amb23321086 [0,2,0,0,0,0|1,0,0]=3 7757 B14R1.542 COC(Cc1cccc(Br)n1)C(=O)O Amb33433180 [0,2,0,0,0,0|2,0,0]=4 7758 B14R1.542 COC(Cc1cccc(C)c1)C(=O)O Amb23320709 [0,2,0,0,0,0|1,0,0]=3 7759 B14R1.542 COC(Cc1cccc(C)n1)C(=O)O Amb33199588 [0,2,0,0,0,0|2,0,0]=4 7760 B14R1.542 COC(Cc1cccc(Cl)c1)C(=O)O Amb23321027 [0,2,0,0,0,0|1,0,0]=3 7761 B14R1.542 COC(Cc1cccc(Cl)n1)C(=O)O Amb33222390 [0,2,0,0,0,0|2,0,0]=4 7762 B14R1.542 COC(Cc1cccc(F)c1)C(=O)O Amb33314614 [0,2,0,0,0,0|1,0,0]=3 7763 B14R1.542 COC(Cc1cccc(O)c1)C(=O)O Amb33310886 [0,2,0,0,0,0|1,0,0]=3 7764 B14R1.542 COC(Cc1ccnc(C)c1)C(=O)O Amb32733028 [0,2,0,0,0,0|2,0,0]=4 7765 B14R1.542 COC(Cc1cncc(Br)c1)C(=O)O Amb33389150 [0,2,0,0,0,0|2,0,0]=4 7766 B14R1.542 COC(Cc1cncc(C)c1)C(=O)O Amb33317680 [0,2,0,0,0,0|2,0,0]=4 7767 B14R1.542 COC(Cc1cncc(F)c1)C(=O)O Amb33195897 [0,2,0,0,0,0|2,0,0]=4 7768 B14R1.542 Cc1cccc(CC(C#N)C(=O)O)c1 Amb17090111 [0,2,0,0,0,0|0,0,1]=3 7769 B14R1.542 Cc1cccc(CC(C#N)C(=O)O)n1 Amb35584167 [0,2,0,0,0,0|1,0,1]=4 7770 B14R1.542 Cc1cccc(CC(CN)C(=O)O)c1 Amb33550213 [0,2,0,0,0,0|0,0,0]=2 7771 B14R1.542 Cc1cccc(CC(CN)C(=O)O)c1 Amb5744252 [0,2,0,0,0,0|0,0,0]=2 7772 B14R1.542 Cc1cccc(C\C(=N\O)C(=O)O)c1 Amb25725090 [0,2,0,0,0,0|0,0,2]=4 7773 B14R1.542 Cc1cccc(NC(CN)C(=O)O)c1 Amb28367805 [0,2,0,0,0,0|1,0,0]=3 7774 B14R1.542 Cc1cncc(CC(C#N)C(=O)O)c1 Amb35621473 [0,2,0,0,0,0|1,0,1]=4 7775 B14R1.542 N#CC(Cc1cccc(Br)c1)C(=O)O Amb8631523 [0,2,0,0,0,0|0,0,1]=3 7776 B14R1.542 N#CC(Cc1cccc(Cl)c1)C(=O)O Amb17090119 [0,2,0,0,0,0|0,0,1]=3 7777 B14R1.542 N#CC(Cc1cccc(F)c1)C(=O)O Amb28075600 [0,2,0,0,0,0|0,0,1]=3 7778 B14R1.542 N#CC(Cc1cccc(O)c1)C(=O)O Amb17090136 [0,2,0,0,0,0|0,0,1]=3 7779 B14R1.542 N#CC(Cc1ccnc(Cl)c1)C(=O)O Amb35584190 [0,2,0,0,0,0|1,0,1]=4 7780 B14R1.542 N#CC(Cc1cncc(Br)c1)C(=O)O Amb35584196 [0,2,0,0,0,0|1,0,1]=4 7781 B14R1.542 N#CC(Cc1cncc(F)c1)C(=O)O Amb35584171 [0,2,0,0,0,0|1,0,1]=4 7782 B14R1.542 NCC(Cc1cccc(Br)c1)C(=O)O Amb8631346 [0,2,0,0,0,0|0,0,0]=2 7783 B14R1.542 NCC(Cc1cccc(Cl)c1)C(=O)O Amb19321126 [0,2,0,0,0,0|0,0,0]=2 7784 B14R1.542 NCC(Cc1cccc(Cl)c1)C(=O)O Amb5744259 [0,2,0,0,0,0|0,0,0]=2 7785 B14R1.542 NCC(Cc1cccc(F)c1)C(=O)O Amb32729356 [0,2,0,0,0,0|0,0,0]=2 7786 B14R1.542 NCC(Cc1cccc(F)c1)C(=O)O Amb33532052 [0,2,0,0,0,0|0,0,0]=2 7787 B14R1.542 NCC(Cc1cccc(O)c1)C(=O)O Amb32655849 [0,2,0,0,0,0|0,0,0]=2 7788 B14R1.542 NCC(Cc1cccc(O)c1)C(=O)O Amb7800913 [0,2,0,0,0,0|0,0,0]=2 7789 B14R1.542 NCC(Nc1cccc(Br)c1)C(=O)O Amb27606168 [0,2,0,0,0,0|1,0,0]=3 7790 B14R1.542 NCC(Nc1cncc(Cl)c1)C(=O)O Amb29865011 [0,2,0,0,0,0|2,0,0]=4 7791 B14R1.542 O=C(O)C(CO)Nc1cccc(Br)c1 Amb27170550 [0,2,0,0,0,0|2,0,0]=4 7792 B14R1.542 O=C(O)C(CO)Nc1cccc(F)c1 Amb28046749 [0,2,0,0,0,0|2,0,0]=4 7793 B14R1.542 O=C(O)\C(Cc1cccc(Br)c1)=N/O Amb33042413 [0,2,0,0,0,0|0,0,2]=4 7794 B14R1.542 O=C(O)\C(Cc1cccc(Cl)c1)=N/O Amb27949594 [0,2,0,0,0,0|0,0,2]=4 7795 B14R1.542 O=C(O)\C(Cc1cccc(F)c1)=N/O Amb33042278 [0,2,0,0,0,0|0,0,2]=4 7796 B14R1.542 O=C(O)\C(Cc1cccc(O)c1)=N/O Amb27478072 [0,2,0,0,0,0|0,0,2]=4 7797 B14R1.542 O=C(O)\C(Cc1cccc(O)c1)=N\O Amb27758598 [0,2,0,0,0,0|0,0,2]=4 7798 B14R1.4257 CC(=O)C(Br)Cc1cc(Br)cc(Br)c1 Amb35717612 [0,2,0,0,0,0|2,0,0]=4 7799 B14R1.4257 CC(=O)C(Br)Cc1cc(C)cc(C)c1 Amb18073008 [0,2,0,0,0,0|2,0,0]=4 7800 B14R1.4257 CC(=O)C(Br)Cc1cc(C)cc(I)c1 Amb35684315 [0,2,0,0,0,0|2,0,0]=4 7801 B14R1.4257 CC(=O)C(Br)Cc1cc(Cl)cc(Br)c1 Amb27392477 [0,2,0,0,0,0|2,0,0]=4 7802 B14R1.4257 CC(=O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb18084860 [0,2,0,0,0,0|2,0,0]=4 7803 B14R1.4257 CC(=O)C(Br)Cc1cc(I)cc(I)c1 Amb35717614 [0,2,0,0,0,0|2,0,0]=4 7804 B14R1.4257 CC(=O)C(Cl)Cc1cc(C)cc(C)c1 Amb17204431 [0,2,0,0,0,0|2,0,0]=4 7805 B14R1.4257 CC(=O)C(Cl)Cc1cc(Cl)cc(Cl)c1 Amb17204745 [0,2,0,0,0,0|2,0,0]=4 7806 B14R1.4257 CC(=O)C(N)Cc1cc(C)cc(C)c1 Amb25033445 [0,2,0,0,0,0|1,0,0]=3 7807 B14R1.4257 CC(=O)C(N)Cc1cc(Cl)cc(Cl)c1 Amb24556101 [0,2,0,0,0,0|1,0,0]=3 7808 B14R1.4257 CC(Cc1cc(Br)cc(Br)c1)C(=O)O Amb27620890 [0,2,0,0,0,0|1,0,0]=3 7809 B14R1.4257 CC(Cc1cc(Cl)cc(Br)c1)C(=O)O Amb27495696 [0,2,0,0,0,0|1,0,0]=3 7810 B14R1.4257 CC(Cc1cc(Cl)cc(Cl)c1)C(=O)O Amb17605838 [0,2,0,0,0,0|1,0,0]=3 7811 B14R1.4257 CC(Cc1cc(Cl)nc(Cl)c1)C(=O)O Amb33257763 [0,2,0,0,0,0|2,0,0]=4 7812 B14R1.4257 CC(Cc1cc(F)cc(Br)c1)C(=O)O Amb26044589 [0,2,0,0,0,0|1,0,0]=3 7813 B14R1.4257 CC(Cc1cc(F)cc(Cl)c1)C(=O)O Amb25762039 [0,2,0,0,0,0|1,0,0]=3 7814 B14R1.4257 CC(Cc1cc(F)cc(F)c1)C(=O)O Amb25850756 [0,2,0,0,0,0|1,0,0]=3 7815 B14R1.4257 CC(Cc1cc(O)cc(Br)c1)C(=O)O Amb24473206 [0,2,0,0,0,0|1,0,0]=3 7816 B14R1.4257 CC(Cc1cc(O)cc(Cl)c1)C(=O)O Amb25220157 [0,2,0,0,0,0|1,0,0]=3 7817 B14R1.4257 CC(Cc1cc(O)cc(F)c1)C(=O)O Amb26465246 [0,2,0,0,0,0|1,0,0]=3 7818 B14R1.4257 CC(Nc1cc(Br)cc(Br)c1)C(=O)O Amb35725761 [0,2,0,0,0,0|2,0,0]=4 7819 B14R1.4257 CC(Nc1cc(Cl)cc(Cl)c1)C(=O)O Amb17408471 [0,2,0,0,0,0|2,0,0]=4 7820 B14R1.4257 CC(Nc1cc(F)cc(Br)c1)C(=O)O Amb28383810 [0,2,0,0,0,0|2,0,0]=4 7821 B14R1.4257 CC(Nc1cc(I)cc(I)c1)C(=O)O Amb35706953 [0,2,0,0,0,0|2,0,0]=4 7822 B14R1.4257 CC(Oc1cc(Cl)cc(Br)c1)C(=O)O Amb35638872 [0,2,0,0,0,0|2,0,0]=4 7823 B14R1.4257 CC(Oc1cc(Cl)cc(Cl)c1)C(=O)O Amb5770174 [0,2,0,0,0,0|2,0,0]=4 7824 B14R1.4257 C[C@@H](Oc1cc(Cl)cc(Br)c1)C(=O)O Amb35638873 [0,2,0,0,0,0|2,0,0]=4 7825 B14R1.4257 C[C@@H](Oc1cc(F)cc(Br)c1)C(=O)O Amb27189798 [0,2,0,0,0,0|2,0,0]=4 7826 B14R1.4257 C[C@@H](Oc1cc(F)cc(F)c1)C(=O)O Amb27971469 [0,2,0,0,0,0|2,0,0]=4 7827 B14R1.4257 C[C@H](Oc1cc(Cl)cc(Br)c1)C(=O)O Amb35638874 [0,2,0,0,0,0|2,0,0]=4 7828 B14R1.4257 Cc1cc(Br)cc(CC(=O)C(=O)O)c1 Amb33435989 [0,2,0,0,0,0|1,0,1]=4 7829 B14R1.4257 Cc1cc(Br)cc(CC(Br)C(N)=O)c1 Amb27166382 [0,2,0,0,0,0|2,0,0]=4 7830 B14R1.4257 Cc1cc(Br)cc(CC(C)C(=O)O)c1 Amb26494230 [0,2,0,0,0,0|1,0,0]=3 7831 B14R1.4257 Cc1cc(Br)cc(CC(Cl)C(N)=O)c1 Amb27166976 [0,2,0,0,0,0|2,0,0]=4 7832 B14R1.4257 Cc1cc(Br)cc(CC(N)C(=O)O)c1 Amb3792302 [0,2,0,0,0,0|0,0,0]=2 7833 B14R1.4257 Cc1cc(Br)cc(CC(O)C(=O)O)c1 Amb33435975 [0,2,0,0,0,0|1,0,0]=3 7834 B14R1.4257 Cc1cc(C)cc(CC(=O)C(=O)O)c1 Amb18980661 [0,2,0,0,0,0|1,0,1]=4 7835 B14R1.4257 Cc1cc(C)cc(CC(Br)C(=O)O)c1 Amb23320610 [0,2,0,0,0,0|1,0,0]=3 7836 B14R1.4257 Cc1cc(C)cc(CC(C)C(=O)O)c1 Amb19050593 [0,2,0,0,0,0|1,0,0]=3 7837 B14R1.4257 Cc1cc(C)cc(CC(Cl)C(=O)O)c1 Amb17204443 [0,2,0,0,0,0|1,0,0]=3 7838 B14R1.4257 Cc1cc(C)cc(CC(Cl)C(N)=O)c1 Amb17204437 [0,2,0,0,0,0|2,0,0]=4 7839 B14R1.4257 Cc1cc(C)cc(CC(N)C(=O)O)c1 Amb33552076 [0,2,0,0,0,0|0,0,0]=2 7840 B14R1.4257 Cc1cc(C)cc(CC(N)C(=O)O)c1 Amb3788505 [0,2,0,0,0,0|0,0,0]=2 7841 B14R1.4257 Cc1cc(C)cc(CC(O)C(=O)O)c1 Amb25900978 [0,2,0,0,0,0|1,0,0]=3 7842 B14R1.4257 Cc1cc(C)cc(C[C@@H](C)C(=O)O)c1 Amb33727260 [0,2,0,0,0,0|1,0,0]=3 7843 B14R1.4257 Cc1cc(C)cc(C[C@H](C)C(=O)O)c1 Amb33744634 [0,2,0,0,0,0|1,0,0]=3 7844 B14R1.4257 Cc1cc(C)cc(NC(C)C(=O)O)c1 Amb840571 [0,2,0,0,0,0|2,0,0]=4 7845 B14R1.4257 Cc1cc(C)cc(OC(C)C(=O)O)c1 Amb9702273 [0,2,0,0,0,0|2,0,0]=4 7846 B14R1.4257 Cc1cc(C)cc(SC(C)C(=O)O)c1 Amb5768540 [0,2,0,0,0,0|2,0,0]=4 7847 B14R1.4257 Cc1cc(CC(C)C(=O)O)cc(Cl)n1 Amb25684945 [0,2,0,0,0,0|2,0,0]=4 7848 B14R1.4257 Cc1cc(CC(N)C(=O)O)cc(Cl)n1 Amb25055161 [0,2,0,0,0,0|1,0,0]=3 7849 B14R1.4257 Cc1cc(CC(O)C(=O)O)cc(Cl)n1 Amb33221913 [0,2,0,0,0,0|2,0,0]=4 7850 B14R1.4257 Cc1cc(Cl)cc(CC(=O)C(=O)O)c1 Amb26969000 [0,2,0,0,0,0|1,0,1]=4 7851 B14R1.4257 Cc1cc(Cl)cc(CC(C)C(=O)O)c1 Amb25754465 [0,2,0,0,0,0|1,0,0]=3 7852 B14R1.4257 Cc1cc(Cl)cc(CC(O)C(=O)O)c1 Amb33352786 [0,2,0,0,0,0|1,0,0]=3 7853 B14R1.4257 Cc1cc(F)cc(CC(=O)C(=O)O)c1 Amb33344177 [0,2,0,0,0,0|1,0,1]=4 7854 B14R1.4257 Cc1cc(F)cc(CC(C)C(=O)O)c1 Amb25251900 [0,2,0,0,0,0|1,0,0]=3 7855 B14R1.4257 Cc1cc(F)cc(CC(N)C(=O)O)c1 Amb3788636 [0,2,0,0,0,0|0,0,0]=2 7856 B14R1.4257 Cc1cc(F)cc(CC(O)C(=O)O)c1 Amb33343857 [0,2,0,0,0,0|1,0,0]=3 7857 B14R1.4257 Cc1cc(F)cc(C[C@H](N)C(=O)O)c1 Amb27170637 [0,2,0,0,0,0|0,0,0]=2 7858 B14R1.4257 Cc1cc(I)cc(CC(Br)C(N)=O)c1 Amb35684316 [0,2,0,0,0,0|2,0,0]=4 7859 B14R1.4257 Cc1cc(I)cc(CC(Cl)C(N)=O)c1 Amb35684318 [0,2,0,0,0,0|2,0,0]=4 7860 B14R1.4257 Cc1cc(I)cc(NC(C)C(=O)O)c1 Amb35684206 [0,2,0,0,0,0|2,0,0]=4 7861 B14R1.4257 Cc1cc(N)cc(C[C@@H](N)C(=O)O)c1 Amb28120711 [0,2,0,0,0,0|0,0,0]=2 7862 B14R1.4257 Cc1cc(O)cc(CC(C)C(=O)O)c1 Amb24359044 [0,2,0,0,0,0|1,0,0]=3 7863 B14R1.4257 Cc1cc(O)cc(C[C@@H](N)C(=O)O)c1 Amb27449888 [0,2,0,0,0,0|0,0,0]=2 7864 B14R1.4257 Cc1cc(O)nc(CC(N)C(=O)O)n1 Amb24546976 [0,2,0,0,0,0|2,0,0]=4 7865 B14R1.4257 Cc1nc(O)cc(CC(N)C(=O)O)n1 Amb27154769 [0,2,0,0,0,0|2,0,0]=4 7866 B14R1.4257 NC(=O)C(Br)Cc1cc(Br)cc(Br)c1 Amb35717606 [0,2,0,0,0,0|2,0,0]=4 7867 B14R1.4257 NC(=O)C(Br)Cc1cc(Cl)cc(Br)c1 Amb27409218 [0,2,0,0,0,0|2,0,0]=4 7868 B14R1.4257 NC(=O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb28409456 [0,2,0,0,0,0|2,0,0]=4 7869 B14R1.4257 NC(=O)C(Br)Cc1cc(F)cc(Br)c1 Amb27424602 [0,2,0,0,0,0|2,0,0]=4 7870 B14R1.4257 NC(=O)C(Br)Cc1cc(I)cc(I)c1 Amb35717615 [0,2,0,0,0,0|2,0,0]=4 7871 B14R1.4257 NC(=O)C(Cl)Cc1cc(Br)cc(Br)c1 Amb35717617 [0,2,0,0,0,0|2,0,0]=4 7872 B14R1.4257 NC(=O)C(Cl)Cc1cc(Cl)cc(Br)c1 Amb27417815 [0,2,0,0,0,0|2,0,0]=4 7873 B14R1.4257 NC(=O)C(Cl)Cc1cc(Cl)cc(Cl)c1 Amb17204752 [0,2,0,0,0,0|2,0,0]=4 7874 B14R1.4257 NC(=O)C(Cl)Cc1cc(I)cc(I)c1 Amb35717619 [0,2,0,0,0,0|2,0,0]=4 7875 B14R1.4257 NC(=O)C(N)Cc1cc(F)cc(Br)c1 Amb28200221 [0,2,0,0,0,0|1,0,0]=3 7876 B14R1.4257 NC(=O)C(N)Cc1cc(F)cc(F)c1 Amb26382906 [0,2,0,0,0,0|1,0,0]=3 7877 B14R1.4257 NC(CC1=CC(=O)NC(=O)N1)C(=O)O Amb35749901 [0,2,0,0,0,0|2,0,0]=4 7878 B14R1.4257 NC(CC1=CC(=O)NC(=S)N1)C(=O)O Amb25326044 [0,2,0,0,0,0|2,0,0]=4 7879 B14R1.4257 NC(CC1=CC(=O)NC(S)=N1)C(=O)O Amb35789595 [0,2,0,0,0,0|2,0,0]=4 7880 B14R1.4257 NC(Cc1cc(Br)cc(Br)c1)C(=O)O Amb28184259 [0,2,0,0,0,0|0,0,0]=2 7881 B14R1.4257 NC(Cc1cc(Br)nc(Br)c1)C(=O)O Amb33734668 [0,2,0,0,0,0|1,0,0]=3 7882 B14R1.4257 NC(Cc1cc(Br)nc(Br)c1)C(=O)O Amb33734852 [0,2,0,0,0,0|1,0,0]=3 7883 B14R1.4257 NC(Cc1cc(Cl)cc(Br)c1)C(=O)O Amb26312404 [0,2,0,0,0,0|0,0,0]=2 7884 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(=O)O Amb18300561 [0,2,0,0,0,0|0,0,0]=2 7885 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(=O)O Amb20627895 [0,2,0,0,0,0|0,0,0]=2 7886 B14R1.4257 NC(Cc1cc(Cl)nc(Cl)c1)C(=O)O Amb28129749 [0,2,0,0,0,0|1,0,0]=3 7887 B14R1.4257 NC(Cc1cc(Cl)nc(Cl)c1)C(=O)O Amb33299371 [0,2,0,0,0,0|1,0,0]=3 7888 B14R1.4257 NC(Cc1cc(F)cc(Br)c1)C(=O)O Amb27751264 [0,2,0,0,0,0|0,0,0]=2 7889 B14R1.4257 NC(Cc1cc(F)cc(Cl)c1)C(=O)O Amb22738184 [0,2,0,0,0,0|0,0,0]=2 7890 B14R1.4257 NC(Cc1cc(F)cc(F)c1)C(=O)O Amb2687234 [0,2,0,0,0,0|0,0,0]=2 7891 B14R1.4257 NC(Cc1cc(F)cc(I)c1)C(=O)O Amb27669845 [0,2,0,0,0,0|0,0,0]=2 7892 B14R1.4257 NC(Cc1cc(I)cc(I)c1)C(=O)O Amb26014440 [0,2,0,0,0,0|0,0,0]=2 7893 B14R1.4257 NC(Cc1cc(O)cc(F)c1)C(=O)O Amb25791570 [0,2,0,0,0,0|0,0,0]=2 7894 B14R1.4257 NC(Cc1cc(O)cc(O)c1)C(=O)O Amb31031034 [0,2,0,0,0,0|0,0,0]=2 7895 B14R1.4257 NC(Cc1cc(O)nc(O)c1)C(=O)O Amb27171448 [0,2,0,0,0,0|1,0,0]=3 7896 B14R1.4257 NC(Cc1cc(O)nc(O)n1)C(=O)O Amb26491438 [0,2,0,0,0,0|2,0,0]=4 7897 B14R1.4257 N[C@@H](Cc1cc(Br)cc(Br)c1)C(=O)O Amb26462063 [0,2,0,0,0,0|0,0,0]=2 7898 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(Br)c1)C(=O)O Amb27800813 [0,2,0,0,0,0|0,0,0]=2 7899 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O Amb22229070 [0,2,0,0,0,0|0,0,0]=2 7900 B14R1.4257 N[C@@H](Cc1cc(F)cc(Br)c1)C(=O)O Amb27239755 [0,2,0,0,0,0|0,0,0]=2 7901 B14R1.4257 N[C@@H](Cc1cc(F)cc(F)c1)C(=O)O Amb6295855 [0,2,0,0,0,0|0,0,0]=2 7902 B14R1.4257 N[C@@H](Cc1cc(I)cc(I)c1)C(=O)O Amb22232859 [0,2,0,0,0,0|0,0,0]=2 7903 B14R1.4257 N[C@@H](Cc1cc(O)cc(F)c1)C(=O)O Amb28456658 [0,2,0,0,0,0|0,0,0]=2 7904 B14R1.4257 N[C@@H](Cc1cc(O)cc(O)c1)C(=O)O Amb22229078 [0,2,0,0,0,0|0,0,0]=2 7905 B14R1.4257 N[C@H](Cc1cc(Br)cc(Br)c1)C(=O)O Amb25702985 [0,2,0,0,0,0|0,0,0]=2 7906 B14R1.4257 N[C@H](Cc1cc(Cl)cc(Cl)c1)C(=O)O Amb22229068 [0,2,0,0,0,0|0,0,0]=2 7907 B14R1.4257 N[C@H](Cc1cc(F)cc(Br)c1)C(=O)O Amb26868366 [0,2,0,0,0,0|0,0,0]=2 7908 B14R1.4257 N[C@H](Cc1cc(F)cc(Cl)c1)C(=O)O Amb27402548 [0,2,0,0,0,0|0,0,0]=2 7909 B14R1.4257 N[C@H](Cc1cc(F)cc(F)c1)C(=O)O Amb8397038 [0,2,0,0,0,0|0,0,0]=2 7910 B14R1.4257 N[C@H](Cc1cc(F)cc(I)c1)C(=O)O Amb27653393 [0,2,0,0,0,0|0,0,0]=2 7911 B14R1.4257 Nc1cc(Cl)nc(CC(N)C(=O)O)n1 Amb24452200 [0,2,0,0,0,0|2,0,0]=4 7912 B14R1.4257 Nc1cc(Cl)nc(CC(N)C(=O)O)n1 Amb33803880 [0,2,0,0,0,0|2,0,0]=4 7913 B14R1.4257 Nc1cc(F)cc(C[C@H](N)C(=O)O)c1 Amb27948049 [0,2,0,0,0,0|0,0,0]=2 7914 B14R1.4257 Nc1cc(N)cc(CC(N)C(=O)O)c1 Amb26610377 [0,2,0,0,0,0|0,0,0]=2 7915 B14R1.4257 Nc1cc(N)cc(CC(N)C(=O)O)c1 Amb33482893 [0,2,0,0,0,0|0,0,0]=2 7916 B14R1.4257 O=C(O)C(=O)Cc1cc(Cl)cc(Br)c1 Amb33435439 [0,2,0,0,0,0|1,0,1]=4 7917 B14R1.4257 O=C(O)C(=O)Cc1cc(Cl)cc(Cl)c1 Amb18288917 [0,2,0,0,0,0|1,0,1]=4 7918 B14R1.4257 O=C(O)C(=O)Cc1cc(F)cc(Br)c1 Amb27161380 [0,2,0,0,0,0|1,0,1]=4 7919 B14R1.4257 O=C(O)C(=O)Cc1cc(F)cc(Cl)c1 Amb26524423 [0,2,0,0,0,0|1,0,1]=4 7920 B14R1.4257 O=C(O)C(=O)Cc1cc(F)cc(F)c1 Amb25992006 [0,2,0,0,0,0|1,0,1]=4 7921 B14R1.4257 O=C(O)C(=O)Cc1cc(O)cc(F)c1 Amb25818974 [0,2,0,0,0,0|1,0,1]=4 7922 B14R1.4257 O=C(O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb23320633 [0,2,0,0,0,0|1,0,0]=3 7923 B14R1.4257 O=C(O)C(Cl)Cc1cc(Cl)cc(Cl)c1 Amb17204775 [0,2,0,0,0,0|1,0,0]=3 7924 B14R1.4257 O=C(O)C(F)Cc1cc(Cl)cc(Cl)c1 Amb28068253 [0,2,0,0,0,0|1,0,0]=3 7925 B14R1.4257 O=C(O)C(F)Oc1cc(Cl)cc(Br)c1 Amb35638875 [0,2,0,0,0,0|2,0,0]=4 7926 B14R1.4257 O=C(O)C(F)Oc1cc(Cl)cc(Cl)c1 Amb27952188 [0,2,0,0,0,0|2,0,0]=4 7927 B14R1.4257 O=C(O)C(O)Cc1cc(Br)cc(Br)c1 Amb33353254 [0,2,0,0,0,0|1,0,0]=3 7928 B14R1.4257 O=C(O)C(O)Cc1cc(Cl)cc(Br)c1 Amb33353268 [0,2,0,0,0,0|1,0,0]=3 7929 B14R1.4257 O=C(O)C(O)Cc1cc(Cl)cc(Cl)c1 Amb24472418 [0,2,0,0,0,0|1,0,0]=3 7930 B14R1.4257 O=C(O)C(O)Cc1cc(Cl)nc(Cl)c1 Amb33257788 [0,2,0,0,0,0|2,0,0]=4 7931 B14R1.4257 O=C(O)C(O)Cc1cc(F)cc(Br)c1 Amb26479166 [0,2,0,0,0,0|1,0,0]=3 7932 B14R1.4257 O=C(O)C(O)Cc1cc(F)cc(Cl)c1 Amb33353255 [0,2,0,0,0,0|1,0,0]=3 7933 B14R1.4257 O=C(O)C(O)Cc1cc(F)cc(F)c1 Amb27212477 [0,2,0,0,0,0|1,0,0]=3 7934 B14R1.4257 O=C(O)C(O)Cc1cc(O)cc(F)c1 Amb33353134 [0,2,0,0,0,0|1,0,0]=3 7935 B14R1.4257 O=C(O)[C@@H](O)Cc1cc(F)cc(F)c1 Amb27957800 [0,2,0,0,0,0|1,0,0]=3 7936 B14R1.4404 CC(Br)(Cc1cccc(Cl)c1)C(=O)O Amb25029122 [0,2,0,0,0,0|1,0,0]=3 7937 B14R1.4404 CC(Br)(Cc1cccc(F)c1)C(=O)O Amb27205708 [0,2,0,0,0,0|1,0,0]=3 7938 B14R1.4404 CC(C)(Cc1cc(F)ccn1)C(=O)O Amb33320305 [0,2,0,0,0,0|2,0,0]=4 7939 B14R1.4404 CC(C)(Cc1cccc(Br)c1)C(=O)O Amb17265522 [0,2,0,0,0,0|1,0,0]=3 7940 B14R1.4404 CC(C)(Cc1cccc(Br)n1)C(=O)O Amb33433138 [0,2,0,0,0,0|2,0,0]=4 7941 B14R1.4404 CC(C)(Cc1cccc(Cl)c1)C(=O)O Amb33531411 [0,2,0,0,0,0|1,0,0]=3 7942 B14R1.4404 CC(C)(Cc1cccc(Cl)n1)C(=O)O Amb33222415 [0,2,0,0,0,0|2,0,0]=4 7943 B14R1.4404 CC(C)(Cc1cccc(F)c1)C(=O)O Amb17333792 [0,2,0,0,0,0|1,0,0]=3 7944 B14R1.4404 CC(C)(Cc1cccc(O)c1)C(=O)O Amb27182248 [0,2,0,0,0,0|1,0,0]=3 7945 B14R1.4404 CC(C)(Cc1ccnc(Cl)c1)C(=O)O Amb26491305 [0,2,0,0,0,0|2,0,0]=4 7946 B14R1.4404 CC(C)(Cc1cncc(Br)c1)C(=O)O Amb25901883 [0,2,0,0,0,0|2,0,0]=4 7947 B14R1.4404 CC(C)(Cc1cncc(F)c1)C(=O)O Amb25256410 [0,2,0,0,0,0|2,0,0]=4 7948 B14R1.4404 CC(C)(Nc1cccc(Br)c1)C(=O)O Amb840756 [0,2,0,0,0,0|2,0,0]=4 7949 B14R1.4404 CC(C)(Nc1cccc(Cl)c1)C(=O)O Amb840753 [0,2,0,0,0,0|2,0,0]=4 7950 B14R1.4404 CC(C)(Nc1cccc(F)c1)C(=O)O Amb840751 [0,2,0,0,0,0|2,0,0]=4 7951 B14R1.4404 CC(C)(Oc1cccc(Br)c1)C(=O)O Amb5770779 [0,2,0,0,0,0|2,0,0]=4 7952 B14R1.4404 CC(C)(Oc1cccc(Cl)c1)C(=O)O Amb6550982 [0,2,0,0,0,0|2,0,0]=4 7953 B14R1.4404 CC(C)(Oc1cccc(F)c1)C(=O)O Amb18291705 [0,2,0,0,0,0|2,0,0]=4 7954 B14R1.4404 CC(C)(Oc1cccc(N)c1)C(=O)O Amb18111930 [0,2,0,0,0,0|2,0,0]=4 7955 B14R1.4404 CC(C)(Sc1cccc(N)c1)C(=O)O Amb35629952 [0,2,0,0,0,0|2,0,0]=4 7956 B14R1.4404 CC(C)(Sc1cccc(O)c1)C(=O)O Amb35629953 [0,2,0,0,0,0|2,0,0]=4 7957 B14R1.4404 CC(Cl)(Cc1cccc(Br)c1)C(=O)O Amb25029076 [0,2,0,0,0,0|1,0,0]=3 7958 B14R1.4404 CC(Cl)(Cc1cccc(Cl)c1)C(=O)O Amb27466532 [0,2,0,0,0,0|1,0,0]=3 7959 B14R1.4404 CC(Cl)(Cc1cccc(F)c1)C(=O)O Amb25871761 [0,2,0,0,0,0|1,0,0]=3 7960 B14R1.4404 CC(F)(Cc1cccc(F)c1)C(=O)O Amb28061914 [0,2,0,0,0,0|1,0,0]=3 7961 B14R1.4404 CC(N)(Cc1cc(Br)ccn1)C(=O)O Amb27219182 [0,2,0,0,0,0|1,0,0]=3 7962 B14R1.4404 CC(N)(Cc1cccc(Br)c1)C(=O)O Amb17266142 [0,2,0,0,0,0|0,0,0]=2 7963 B14R1.4404 CC(N)(Cc1cccc(Cl)c1)C(=O)O Amb17241539 [0,2,0,0,0,0|0,0,0]=2 7964 B14R1.4404 CC(N)(Cc1cccc(F)c1)C(=O)O Amb28255490 [0,2,0,0,0,0|0,0,0]=2 7965 B14R1.4404 CC(N)(Cc1cccc(N)c1)C(=O)O Amb28423374 [0,2,0,0,0,0|0,0,0]=2 7966 B14R1.4404 CC(N)(Cc1cccc(O)c1)C(=O)O Amb4035716 [0,2,0,0,0,0|0,0,0]=2 7967 B14R1.4404 CC(N)(Cc1cccc(S)c1)C(=O)O Amb27612205 [0,2,0,0,0,0|0,0,0]=2 7968 B14R1.4404 CC(N)(Cc1ccnc(Cl)c1)C(=O)O Amb27585789 [0,2,0,0,0,0|1,0,0]=3 7969 B14R1.4404 CC(N)(Cc1ccnc(N)c1)C(=O)O Amb26335980 [0,2,0,0,0,0|1,0,0]=3 7970 B14R1.4404 CC(N)(Cc1ccnc(O)c1)C(=O)O Amb28184081 [0,2,0,0,0,0|1,0,0]=3 7971 B14R1.4404 CC(N)(Cc1cncc(F)c1)C(=O)O Amb27641330 [0,2,0,0,0,0|1,0,0]=3 7972 B14R1.4404 CC(O)(Cc1cc(F)ccn1)C(=O)O Amb33325540 [0,2,0,0,0,0|2,0,0]=4 7973 B14R1.4404 CC(O)(Cc1cccc(Br)c1)C(=O)O Amb27488635 [0,2,0,0,0,0|1,0,0]=3 7974 B14R1.4404 CC(O)(Cc1cccc(Br)n1)C(=O)O Amb33433197 [0,2,0,0,0,0|2,0,0]=4 7975 B14R1.4404 CC(O)(Cc1cccc(Cl)c1)C(=O)O Amb25278384 [0,2,0,0,0,0|1,0,0]=3 7976 B14R1.4404 CC(O)(Cc1cccc(Cl)n1)C(=O)O Amb33222424 [0,2,0,0,0,0|2,0,0]=4 7977 B14R1.4404 CC(O)(Cc1cccc(F)c1)C(=O)O Amb26513573 [0,2,0,0,0,0|1,0,0]=3 7978 B14R1.4404 CC(O)(Cc1cccc(O)c1)C(=O)O Amb33310882 [0,2,0,0,0,0|1,0,0]=3 7979 B14R1.4404 CC(O)(Cc1cncc(Br)c1)C(=O)O Amb33389391 [0,2,0,0,0,0|2,0,0]=4 7980 B14R1.4404 CC(O)(Cc1cncc(F)c1)C(=O)O Amb33195891 [0,2,0,0,0,0|2,0,0]=4 7981 B14R1.4404 C[C@@](N)(Cc1cccc(Br)c1)C(=O)O Amb8630498 [0,2,0,0,0,0|0,0,0]=2 7982 B14R1.4404 C[C@@](N)(Cc1cccc(F)c1)C(=O)O Amb23439046 [0,2,0,0,0,0|0,0,0]=2 7983 B14R1.4404 C[C@@](N)(Cc1cccc(I)c1)C(=O)O Amb16183898 [0,2,0,0,0,0|0,0,0]=2 7984 B14R1.4404 C[C@](N)(Cc1cccc(I)c1)C(=O)O Amb16183904 [0,2,0,0,0,0|0,0,0]=2 7985 B14R1.4404 C[C@](N)(Cc1cccc(N)c1)C(=O)O Amb27746766 [0,2,0,0,0,0|0,0,0]=2 7986 B14R1.4404 C[C@](N)(Cc1cccc(O)c1)C(=O)O Amb24761288 [0,2,0,0,0,0|0,0,0]=2 7987 B14R1.4404 C[C@](O)(Cc1cccc(Cl)c1)C(=O)O Amb27644094 [0,2,0,0,0,0|1,0,0]=3 7988 B14R1.4404 Cc1cc(CC(C)(C)C(=O)O)ccn1 Amb33340418 [0,2,0,0,0,0|2,0,0]=4 7989 B14R1.4404 Cc1cc(CC(C)(O)C(=O)O)ccn1 Amb32733022 [0,2,0,0,0,0|2,0,0]=4 7990 B14R1.4404 Cc1cc(CC(F)(F)C(=O)O)ccn1 Amb33170786 [0,2,0,0,0,0|2,0,0]=4 7991 B14R1.4404 Cc1cccc(CC(C)(Br)C(=O)O)c1 Amb27164093 [0,2,0,0,0,0|1,0,0]=3 7992 B14R1.4404 Cc1cccc(CC(C)(C)C(=O)O)c1 Amb17235387 [0,2,0,0,0,0|1,0,0]=3 7993 B14R1.4404 Cc1cccc(CC(C)(C)C(=O)O)n1 Amb25331309 [0,2,0,0,0,0|2,0,0]=4 7994 B14R1.4404 Cc1cccc(CC(C)(C)C(N)=O)c1 Amb27668960 [0,2,0,0,0,0|2,0,0]=4 7995 B14R1.4404 Cc1cccc(CC(C)(Cl)C(=O)O)c1 Amb24463739 [0,2,0,0,0,0|1,0,0]=3 7996 B14R1.4404 Cc1cccc(CC(C)(N)C(=O)O)c1 Amb17235615 [0,2,0,0,0,0|0,0,0]=2 7997 B14R1.4404 Cc1cccc(CC(C)(N)C(=O)O)n1 Amb27171335 [0,2,0,0,0,0|1,0,0]=3 7998 B14R1.4404 Cc1cccc(CC(C)(O)C(=O)O)c1 Amb27841690 [0,2,0,0,0,0|1,0,0]=3 7999 B14R1.4404 Cc1cccc(CC(C)(O)C(=O)O)n1 Amb33199582 [0,2,0,0,0,0|2,0,0]=4 8000 B14R1.4404 Cc1cccc(CC(F)(F)C(=O)O)c1 Amb33170783 [0,2,0,0,0,0|1,0,0]=3 8001 B14R1.4404 Cc1cccc(CC(F)(F)C(=O)O)n1 Amb32809728 [0,2,0,0,0,0|2,0,0]=4 8002 B14R1.4404 Cc1cccc(C[C@@](C)(N)C(=O)O)c1 Amb27175275 [0,2,0,0,0,0|0,0,0]=2 8003 B14R1.4404 Cc1cccc(C[C@@](C)(O)C(=O)O)c1 Amb27175392 [0,2,0,0,0,0|1,0,0]=3 8004 B14R1.4404 Cc1cccc(C[C@](C)(N)C(=O)O)c1 Amb27873951 [0,2,0,0,0,0|0,0,0]=2 8005 B14R1.4404 Cc1cccc(NC(C)(C)C(=O)O)c1 Amb840741 [0,2,0,0,0,0|2,0,0]=4 8006 B14R1.4404 Cc1cccc(OC(C)(C)C(=O)O)c1 Amb6357054 [0,2,0,0,0,0|2,0,0]=4 8007 B14R1.4404 Cc1ccnc(CC(C)(C)C(=O)O)c1 Amb33318120 [0,2,0,0,0,0|2,0,0]=4 8008 B14R1.4404 Cc1ccnc(CC(C)(O)C(=O)O)c1 Amb33318067 [0,2,0,0,0,0|2,0,0]=4 8009 B14R1.4404 Cc1ccnc(CC(F)(F)C(=O)O)c1 Amb32811996 [0,2,0,0,0,0|2,0,0]=4 8010 B14R1.4404 Cc1cncc(CC(C)(C)C(=O)O)c1 Amb24591319 [0,2,0,0,0,0|2,0,0]=4 8011 B14R1.4404 Cc1cncc(CC(C)(N)C(=O)O)c1 Amb27641216 [0,2,0,0,0,0|1,0,0]=3 8012 B14R1.4404 Cc1cncc(CC(C)(O)C(=O)O)c1 Amb33317670 [0,2,0,0,0,0|2,0,0]=4 8013 B14R1.4404 Cc1cncc(CC(F)(F)C(=O)O)c1 Amb33170788 [0,2,0,0,0,0|2,0,0]=4 8014 B14R1.4404 O=C(O)C(F)(F)Cc1cc(Cl)ccn1 Amb32748979 [0,2,0,0,0,0|2,0,0]=4 8015 B14R1.4404 O=C(O)C(F)(F)Cc1cc(F)ccn1 Amb32745344 [0,2,0,0,0,0|2,0,0]=4 8016 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(Br)c1 Amb25994196 [0,2,0,0,0,0|1,0,0]=3 8017 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(Br)n1 Amb32743512 [0,2,0,0,0,0|2,0,0]=4 8018 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(Cl)c1 Amb27418269 [0,2,0,0,0,0|1,0,0]=3 8019 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(Cl)n1 Amb33408886 [0,2,0,0,0,0|2,0,0]=4 8020 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(F)c1 Amb27191933 [0,2,0,0,0,0|1,0,0]=3 8021 B14R1.4404 O=C(O)C(F)(F)Cc1cccc(O)c1 Amb33399509 [0,2,0,0,0,0|1,0,0]=3 8022 B14R1.4404 O=C(O)C(F)(F)Cc1ccnc(Cl)c1 Amb33405297 [0,2,0,0,0,0|2,0,0]=4 8023 B14R1.4404 O=C(O)C(F)(F)Cc1cncc(Br)c1 Amb33400496 [0,2,0,0,0,0|2,0,0]=4 8024 B14R1.4404 O=C(O)C(F)(F)Cc1cncc(F)c1 Amb33170800 [0,2,0,0,0,0|2,0,0]=4 8025 B14R1.4404 O=C(O)C(F)(F)Oc1cccc(Cl)c1 Amb9516674 [0,2,0,0,0,0|2,0,0]=4 8026 B14R1.4404 O=C(O)C(F)(F)Oc1cccc(I)c1 Amb9516775 [0,2,0,0,0,0|2,0,0]=4 8027 B14R1.4404 O=C(O)C(F)(F)Sc1cccc(O)c1 Amb28043601 [0,2,0,0,0,0|2,0,0]=4 8028 B14R1.4405 CC(C)(O)C(N)Cc1cccc(Cl)c1 Amb27480917 [0,2,0,0,0,0|1,0,1]=4 8029 B14R1.4405 CC(C)(O)C(N)Cc1cccc(F)c1 Amb28410826 [0,2,0,0,0,0|1,0,1]=4 8030 B14R1.4405 Cc1cccc(CC(N)P(C)(=O)O)c1 Amb27810870 [0,2,0,0,0,0|1,0,0]=3 8031 B14R1.4405 NC(Cc1cccc(O)c1)P(=O)(O)O Amb27614176 [0,2,0,0,0,0|1,0,0]=3 8032 B14R1.4474 CC(=O)C(Br)Cc1cc(C)ccc1Br Amb27418438 [0,2,0,0,0,0|2,0,0]=4 8033 B14R1.4474 CC(=O)C(Br)Cc1cc(C)ccc1C Amb18585222 [0,2,0,0,0,0|2,0,0]=4 8034 B14R1.4474 CC(=O)C(Br)Cc1cc(Cl)ccc1C Amb18076227 [0,2,0,0,0,0|2,0,0]=4 8035 B14R1.4474 CC(=O)C(Br)Cc1cc(Cl)ccc1I Amb30016227 [0,2,0,0,0,0|2,0,0]=4 8036 B14R1.4474 CC(=O)C(Br)Cc1cc(F)ccc1C Amb27753941 [0,2,0,0,0,0|2,0,0]=4 8037 B14R1.4474 CC(=O)C(Br)Cc1cc(F)ccc1F Amb27198176 [0,2,0,0,0,0|2,0,0]=4 8038 B14R1.4474 CC(=O)C(C)Cc1cc(C)ccc1C Amb17234965 [0,2,0,0,0,0|2,0,0]=4 8039 B14R1.4474 CC(=O)C(C)Cc1cc(Cl)ccc1F Amb18866568 [0,2,0,0,0,0|2,0,0]=4 8040 B14R1.4474 CC(=O)C(C)Cc1cc(Cl)ccc1I Amb29857023 [0,2,0,0,0,0|2,0,0]=4 8041 B14R1.4474 CC(=O)C(C)Cc1cc(F)ccc1Br Amb28250485 [0,2,0,0,0,0|2,0,0]=4 8042 B14R1.4474 CC(=O)C(C)Cc1cc(F)ccc1C Amb27978631 [0,2,0,0,0,0|2,0,0]=4 8043 B14R1.4474 CC(=O)C(C)Cc1cc(F)ccc1Cl Amb27395184 [0,2,0,0,0,0|2,0,0]=4 8044 B14R1.4474 CC(=O)C(Cl)Cc1cc(C)ccc1C Amb17204429 [0,2,0,0,0,0|2,0,0]=4 8045 B14R1.4474 CC(=O)C(Cl)Cc1cc(Cl)ccc1C Amb17204555 [0,2,0,0,0,0|2,0,0]=4 8046 B14R1.4474 CC(=O)C(Cl)Cc1cc(Cl)ccc1Cl Amb17204744 [0,2,0,0,0,0|2,0,0]=4 8047 B14R1.4474 CC(=O)C(N)Cc1cc(Cl)ccc1C Amb26383886 [0,2,0,0,0,0|1,0,0]=3 8048 B14R1.4474 CC(CN1C=C(F)C=CC1=O)C(=O)O Amb28075612 [0,2,0,0,0,0|2,0,0]=4 8049 B14R1.4474 CC(Cc1cc(Br)ccc1Cl)C(=O)O Amb27411547 [0,2,0,0,0,0|1,0,0]=3 8050 B14R1.4474 CC(Cc1cc(Br)ccc1F)C(=O)O Amb28118813 [0,2,0,0,0,0|1,0,0]=3 8051 B14R1.4474 CC(Cc1cc(Br)ccc1O)C(=O)O Amb33333184 [0,2,0,0,0,0|1,0,0]=3 8052 B14R1.4474 CC(Cc1cc(Br)cnc1Cl)C(=O)O Amb33009431 [0,2,0,0,0,0|2,0,0]=4 8053 B14R1.4474 CC(Cc1cc(Br)cnc1F)C(=O)O Amb33477684 [0,2,0,0,0,0|2,0,0]=4 8054 B14R1.4474 CC(Cc1cc(Cl)ccc1Br)C(=O)O Amb27663584 [0,2,0,0,0,0|1,0,0]=3 8055 B14R1.4474 CC(Cc1cc(Cl)ccc1Cl)C(=O)O Amb22483423 [0,2,0,0,0,0|1,0,0]=3 8056 B14R1.4474 CC(Cc1cc(Cl)ccc1F)C(=O)Cl Amb27756245 [0,2,0,0,0,0|2,0,0]=4 8057 B14R1.4474 CC(Cc1cc(Cl)ccc1F)C(=O)O Amb27495615 [0,2,0,0,0,0|1,0,0]=3 8058 B14R1.4474 CC(Cc1cc(Cl)ccc1I)C(=O)O Amb35689698 [0,2,0,0,0,0|1,0,0]=3 8059 B14R1.4474 CC(Cc1cc(Cl)ccc1O)C(=O)O Amb33052456 [0,2,0,0,0,0|1,0,0]=3 8060 B14R1.4474 CC(Cc1cc(Cl)cnc1F)C(=O)O Amb33257164 [0,2,0,0,0,0|2,0,0]=4 8061 B14R1.4474 CC(Cc1cc(Cl)cnc1N)C(=O)O Amb27172449 [0,2,0,0,0,0|2,0,0]=4 8062 B14R1.4474 CC(Cc1cc(Cl)ncc1Br)C(=O)O Amb33477820 [0,2,0,0,0,0|2,0,0]=4 8063 B14R1.4474 CC(Cc1cc(F)ccc1Br)C(=O)O Amb27979863 [0,2,0,0,0,0|1,0,0]=3 8064 B14R1.4474 CC(Cc1cc(F)ccc1Cl)C(=O)O Amb24695088 [0,2,0,0,0,0|1,0,0]=3 8065 B14R1.4474 CC(Cc1cc(F)ccc1F)C(=O)O Amb17605835 [0,2,0,0,0,0|1,0,0]=3 8066 B14R1.4474 CC(Cc1cc(F)ccc1N)C(=O)O Amb28384783 [0,2,0,0,0,0|1,0,0]=3 8067 B14R1.4474 CC(Cc1cc(F)ccc1O)C(=O)O Amb33374595 [0,2,0,0,0,0|1,0,0]=3 8068 B14R1.4474 CC(Cc1cc(O)ccc1Br)C(=O)O Amb26839568 [0,2,0,0,0,0|1,0,0]=3 8069 B14R1.4474 CC(Cc1cc(O)ccc1Cl)C(=O)O Amb25699867 [0,2,0,0,0,0|1,0,0]=3 8070 B14R1.4474 CC(Cc1cc(O)ccc1F)C(=O)O Amb26492866 [0,2,0,0,0,0|1,0,0]=3 8071 B14R1.4474 CC(Cc1cc(O)ccc1O)C(=O)O Amb33269247 [0,2,0,0,0,0|1,0,0]=3 8072 B14R1.4474 CC(Nc1cc(Br)ccc1Cl)C(=O)O Amb27647142 [0,2,0,0,0,0|2,0,0]=4 8073 B14R1.4474 CC(Nc1cc(Br)ccc1I)C(=O)O Amb28422018 [0,2,0,0,0,0|2,0,0]=4 8074 B14R1.4474 CC(Nc1cc(Cl)ccc1Br)C(=O)O Amb27262173 [0,2,0,0,0,0|2,0,0]=4 8075 B14R1.4474 CC(Nc1cc(Cl)ccc1Cl)C(=O)O Amb17408470 [0,2,0,0,0,0|2,0,0]=4 8076 B14R1.4474 CC(Nc1cc(Cl)ccc1I)C(=O)O Amb35706241 [0,2,0,0,0,0|2,0,0]=4 8077 B14R1.4474 CC(Nc1cc(F)ccc1Br)C(=O)O Amb28201387 [0,2,0,0,0,0|2,0,0]=4 8078 B14R1.4474 CC(Nc1cc(F)ccc1F)C(=O)O Amb18999357 [0,2,0,0,0,0|2,0,0]=4 8079 B14R1.4474 CC(Nc1cc(N)ccc1Cl)C(=O)O Amb27827858 [0,2,0,0,0,0|2,0,0]=4 8080 B14R1.4474 CC(Oc1cc(Cl)ccc1Cl)C(=O)O Amb9705732 [0,2,0,0,0,0|2,0,0]=4 8081 B14R1.4474 CC(Oc1cc(Cl)ccc1N)C(=O)O Amb18296944 [0,2,0,0,0,0|2,0,0]=4 8082 B14R1.4474 CC(Oc1cc(F)ccc1F)C(=O)O Amb27466703 [0,2,0,0,0,0|2,0,0]=4 8083 B14R1.4474 CC(Oc1cc(N)ccc1Cl)C(=O)O Amb27645106 [0,2,0,0,0,0|2,0,0]=4 8084 B14R1.4474 CC(Sc1cc(Br)ccc1N)C(=O)O Amb27792566 [0,2,0,0,0,0|2,0,0]=4 8085 B14R1.4474 CC(Sc1cc(Cl)ccc1Cl)C(=O)O Amb1114451 [0,2,0,0,0,0|2,0,0]=4 8086 B14R1.4474 CC(Sc1cc(N)ccc1Cl)C(=O)O Amb28424003 [0,2,0,0,0,0|2,0,0]=4 8087 B14R1.4474 CC1=CN(CC(N)C(=O)O)C(=O)N=C1 Amb28324828 [0,2,0,0,0,0|2,0,0]=4 8088 B14R1.4474 C[C@@H](Cc1cc(F)ccc1F)C(=O)O Amb33745936 [0,2,0,0,0,0|1,0,0]=3 8089 B14R1.4474 C[C@@H](Oc1cc(Br)ccc1F)C(=O)O Amb27183630 [0,2,0,0,0,0|2,0,0]=4 8090 B14R1.4474 C[C@@H](Oc1cc(Cl)ccc1Cl)C(=O)O Amb27969924 [0,2,0,0,0,0|2,0,0]=4 8091 B14R1.4474 C[C@@H](Oc1cc(F)ccc1F)C(=O)O Amb27183748 [0,2,0,0,0,0|2,0,0]=4 8092 B14R1.4474 C[C@H](Cc1cc(F)ccc1F)C(=O)O Amb33729610 [0,2,0,0,0,0|1,0,0]=3 8093 B14R1.4474 C[C@H](Oc1cc(Br)ccc1F)C(=O)O Amb27262148 [0,2,0,0,0,0|2,0,0]=4 8094 B14R1.4474 C[C@H](Oc1cc(F)ccc1Cl)C(=O)O Amb27172977 [0,2,0,0,0,0|2,0,0]=4 8095 B14R1.4474 C[C@H](Oc1cc(F)ccc1F)C(=O)O Amb27812380 [0,2,0,0,0,0|2,0,0]=4 8096 B14R1.4474 Cc1ccc(Br)c(CC(=O)C(=O)O)c1 Amb33477216 [0,2,0,0,0,0|1,0,1]=4 8097 B14R1.4474 Cc1ccc(Br)c(CC(C)C(=O)O)c1 Amb25320687 [0,2,0,0,0,0|1,0,0]=3 8098 B14R1.4474 Cc1ccc(Br)c(CC(O)C(=O)O)c1 Amb33477245 [0,2,0,0,0,0|1,0,0]=3 8099 B14R1.4474 Cc1ccc(Br)c(OC(C)C(=O)O)c1 Amb35651081 [0,2,0,0,0,0|2,0,0]=4 8100 B14R1.4474 Cc1ccc(Br)c(OC(F)C(=O)O)c1 Amb35660824 [0,2,0,0,0,0|2,0,0]=4 8101 B14R1.4474 Cc1ccc(Br)c(O[C@@H](C)C(=O)O)c1 Amb35660851 [0,2,0,0,0,0|2,0,0]=4 8102 B14R1.4474 Cc1ccc(Br)c(O[C@H](C)C(=O)O)c1 Amb35660850 [0,2,0,0,0,0|2,0,0]=4 8103 B14R1.4474 Cc1ccc(Br)cc1CC(=O)C(=O)O Amb25281136 [0,2,0,0,0,0|1,0,1]=4 8104 B14R1.4474 Cc1ccc(Br)cc1CC(C)C(=O)O Amb24361964 [0,2,0,0,0,0|1,0,0]=3 8105 B14R1.4474 Cc1ccc(Br)cc1CC(N)C(=O)O Amb25906302 [0,2,0,0,0,0|0,0,0]=2 8106 B14R1.4474 Cc1ccc(Br)cc1CC(O)C(=O)O Amb27402141 [0,2,0,0,0,0|1,0,0]=3 8107 B14R1.4474 Cc1ccc(Br)cc1C[C@H](N)C(=O)O Amb24664141 [0,2,0,0,0,0|0,0,0]=2 8108 B14R1.4474 Cc1ccc(Br)cc1NC(C)C(=O)O Amb27956757 [0,2,0,0,0,0|2,0,0]=4 8109 B14R1.4474 Cc1ccc(Br)cc1OC(F)C(=O)O Amb27883526 [0,2,0,0,0,0|2,0,0]=4 8110 B14R1.4474 Cc1ccc(C)c(CC(=O)C(=O)O)c1 Amb18978989 [0,2,0,0,0,0|1,0,1]=4 8111 B14R1.4474 Cc1ccc(C)c(CC(Br)C(=O)O)c1 Amb23320606 [0,2,0,0,0,0|1,0,0]=3 8112 B14R1.4474 Cc1ccc(C)c(CC(C)C(=O)O)c1 Amb19050594 [0,2,0,0,0,0|1,0,0]=3 8113 B14R1.4474 Cc1ccc(C)c(CC(Cl)C(=O)O)c1 Amb17204441 [0,2,0,0,0,0|1,0,0]=3 8114 B14R1.4474 Cc1ccc(C)c(CC(Cl)C(N)=O)c1 Amb17204435 [0,2,0,0,0,0|2,0,0]=4 8115 B14R1.4474 Cc1ccc(C)c(CC(N)C(=O)O)c1 Amb3788508 [0,2,0,0,0,0|0,0,0]=2 8116 B14R1.4474 Cc1ccc(C)c(CC(O)C(=O)O)c1 Amb25372528 [0,2,0,0,0,0|1,0,0]=3 8117 B14R1.4474 Cc1ccc(C)c(NC(C)C(=O)O)c1 Amb840570 [0,2,0,0,0,0|2,0,0]=4 8118 B14R1.4474 Cc1ccc(C)c(OC(C)C(=O)O)c1 Amb9702560 [0,2,0,0,0,0|2,0,0]=4 8119 B14R1.4474 Cc1ccc(C)c(SC(F)C(=O)O)c1 Amb28249904 [0,2,0,0,0,0|2,0,0]=4 8120 B14R1.4474 Cc1ccc(Cl)c(CC(=O)C(=O)O)c1 Amb33413726 [0,2,0,0,0,0|1,0,1]=4 8121 B14R1.4474 Cc1ccc(Cl)c(CC(C)C(=O)O)c1 Amb25028914 [0,2,0,0,0,0|1,0,0]=3 8122 B14R1.4474 Cc1ccc(Cl)c(CC(N)C(=O)O)c1 Amb25363453 [0,2,0,0,0,0|0,0,0]=2 8123 B14R1.4474 Cc1ccc(Cl)c(CC(O)C(=O)O)c1 Amb33260089 [0,2,0,0,0,0|1,0,0]=3 8124 B14R1.4474 Cc1ccc(Cl)c(OC(C)C(=O)O)c1 Amb9706292 [0,2,0,0,0,0|2,0,0]=4 8125 B14R1.4474 Cc1ccc(Cl)c(O[C@@H](C)C(=O)O)c1 Amb27495362 [0,2,0,0,0,0|2,0,0]=4 8126 B14R1.4474 Cc1ccc(Cl)cc1CC(Br)C(=O)O Amb23320627 [0,2,0,0,0,0|1,0,0]=3 8127 B14R1.4474 Cc1ccc(Cl)cc1CC(C)C(=O)O Amb26504716 [0,2,0,0,0,0|1,0,0]=3 8128 B14R1.4474 Cc1ccc(Cl)cc1CC(Cl)C(=O)O Amb17204586 [0,2,0,0,0,0|1,0,0]=3 8129 B14R1.4474 Cc1ccc(Cl)cc1CC(Cl)C(N)=O Amb17204559 [0,2,0,0,0,0|2,0,0]=4 8130 B14R1.4474 Cc1ccc(Cl)cc1CC(N)C(=O)O Amb27482797 [0,2,0,0,0,0|0,0,0]=2 8131 B14R1.4474 Cc1ccc(Cl)cc1C[C@@H](N)C(=O)O Amb25363915 [0,2,0,0,0,0|0,0,0]=2 8132 B14R1.4474 Cc1ccc(Cl)cc1C[C@H](N)C(=O)O Amb25786160 [0,2,0,0,0,0|0,0,0]=2 8133 B14R1.4474 Cc1ccc(Cl)cc1NC(C)C(=O)O Amb840578 [0,2,0,0,0,0|2,0,0]=4 8134 B14R1.4474 Cc1ccc(Cl)cc1OC(C)C(=O)O Amb27773728 [0,2,0,0,0,0|2,0,0]=4 8135 B14R1.4474 Cc1ccc(F)c(CC(=O)C(=O)O)c1 Amb25877344 [0,2,0,0,0,0|1,0,1]=4 8136 B14R1.4474 Cc1ccc(F)c(CC(C)C(=O)O)c1 Amb25777200 [0,2,0,0,0,0|1,0,0]=3 8137 B14R1.4474 Cc1ccc(F)c(CC(N)C(=O)O)c1 Amb22011666 [0,2,0,0,0,0|0,0,0]=2 8138 B14R1.4474 Cc1ccc(F)c(CC(O)C(=O)O)c1 Amb33352643 [0,2,0,0,0,0|1,0,0]=3 8139 B14R1.4474 Cc1ccc(F)c(C[C@@H](N)C(=O)O)c1 Amb27862484 [0,2,0,0,0,0|0,0,0]=2 8140 B14R1.4474 Cc1ccc(F)c(NC(C)C(=O)O)c1 Amb18981768 [0,2,0,0,0,0|2,0,0]=4 8141 B14R1.4474 Cc1ccc(F)c(O[C@H](C)C(=O)O)c1 Amb27183749 [0,2,0,0,0,0|2,0,0]=4 8142 B14R1.4474 Cc1ccc(F)cc1CC(=O)C(=O)O Amb25857137 [0,2,0,0,0,0|1,0,1]=4 8143 B14R1.4474 Cc1ccc(F)cc1CC(Br)C(N)=O Amb28409412 [0,2,0,0,0,0|2,0,0]=4 8144 B14R1.4474 Cc1ccc(F)cc1CC(C)C(=O)O Amb24732449 [0,2,0,0,0,0|1,0,0]=3 8145 B14R1.4474 Cc1ccc(F)cc1CC(N)C(=O)O Amb22738112 [0,2,0,0,0,0|0,0,0]=2 8146 B14R1.4474 Cc1ccc(F)cc1CC(O)C(=O)O Amb24688553 [0,2,0,0,0,0|1,0,0]=3 8147 B14R1.4474 Cc1ccc(F)cc1NC(C)C(=O)O Amb18999360 [0,2,0,0,0,0|2,0,0]=4 8148 B14R1.4474 Cc1ccc(I)c(CC(N)C(=O)O)c1 Amb27876367 [0,2,0,0,0,0|0,0,0]=2 8149 B14R1.4474 Cc1ccc(I)c(C[C@H](N)C(=O)O)c1 Amb27489690 [0,2,0,0,0,0|0,0,0]=2 8150 B14R1.4474 Cc1ccc(I)cc1CC(Br)C(N)=O Amb27592082 [0,2,0,0,0,0|2,0,0]=4 8151 B14R1.4474 Cc1ccc(I)cc1CC(N)C(=O)O Amb27436589 [0,2,0,0,0,0|0,0,0]=2 8152 B14R1.4474 Cc1ccc(I)cc1C[C@H](N)C(=O)O Amb25343363 [0,2,0,0,0,0|0,0,0]=2 8153 B14R1.4474 Cc1ccc(N)c(C[C@@H](N)C(=O)O)c1 Amb28346827 [0,2,0,0,0,0|0,0,0]=2 8154 B14R1.4474 Cc1ccc(N)c(SC(F)C(=O)O)c1 Amb27862197 [0,2,0,0,0,0|2,0,0]=4 8155 B14R1.4474 Cc1ccc(N)cc1C[C@@H](N)C(=O)O Amb28043037 [0,2,0,0,0,0|0,0,0]=2 8156 B14R1.4474 Cc1ccc(N)cc1C[C@H](N)C(=O)O Amb28239542 [0,2,0,0,0,0|0,0,0]=2 8157 B14R1.4474 Cc1ccc(N)cc1OC(C)C(=O)O Amb18999352 [0,2,0,0,0,0|2,0,0]=4 8158 B14R1.4474 Cc1ccc(N)cc1SC(C)C(=O)O Amb27747663 [0,2,0,0,0,0|2,0,0]=4 8159 B14R1.4474 Cc1ccc(N)cc1SC(F)C(=O)O Amb28383699 [0,2,0,0,0,0|2,0,0]=4 8160 B14R1.4474 Cc1ccc(O)c(CC(=O)C(=O)O)c1 Amb33269056 [0,2,0,0,0,0|1,0,1]=4 8161 B14R1.4474 Cc1ccc(O)c(CC(C)C(=O)O)c1 Amb24652411 [0,2,0,0,0,0|1,0,0]=3 8162 B14R1.4474 Cc1ccc(O)c(CC(N)C(=O)O)c1 Amb4013080 [0,2,0,0,0,0|0,0,0]=2 8163 B14R1.4474 Cc1ccc(O)c(CC(O)C(=O)O)c1 Amb33225053 [0,2,0,0,0,0|1,0,0]=3 8164 B14R1.4474 Cc1ccc(O)cc1CC(C)C(=O)O Amb26464943 [0,2,0,0,0,0|1,0,0]=3 8165 B14R1.4474 Cc1ccc(O)cc1CC(N)C(=O)O Amb27461429 [0,2,0,0,0,0|0,0,0]=2 8166 B14R1.4474 Cc1cnc(N)c(CC(C)C(=O)O)c1 Amb27406395 [0,2,0,0,0,0|2,0,0]=4 8167 B14R1.4474 Cc1cnc(N)c(CC(N)C(=O)O)c1 Amb27873931 [0,2,0,0,0,0|1,0,0]=3 8168 B14R1.4474 NC(=O)C(Br)Cc1cc(Cl)ccc1I Amb30016228 [0,2,0,0,0,0|2,0,0]=4 8169 B14R1.4474 NC(=O)C(Br)Cc1cc(I)ccc1Cl Amb27964934 [0,2,0,0,0,0|2,0,0]=4 8170 B14R1.4474 NC(=O)C(Cl)Cc1cc(Cl)ccc1Br Amb28409490 [0,2,0,0,0,0|2,0,0]=4 8171 B14R1.4474 NC(=O)C(Cl)Cc1cc(Cl)ccc1Cl Amb17204751 [0,2,0,0,0,0|2,0,0]=4 8172 B14R1.4474 NC(=O)C(Cl)Cc1cc(Cl)ccc1I Amb35690435 [0,2,0,0,0,0|2,0,0]=4 8173 B14R1.4474 NC(=O)C(Cl)Cc1cc(F)ccc1Br Amb27457049 [0,2,0,0,0,0|2,0,0]=4 8174 B14R1.4474 NC(=O)C(Cl)Cc1cc(I)ccc1Br Amb27806420 [0,2,0,0,0,0|2,0,0]=4 8175 B14R1.4474 NC(=O)C(N)Cc1cc(Br)ccc1F Amb27478203 [0,2,0,0,0,0|1,0,0]=3 8176 B14R1.4474 NC(=O)C(N)Cc1cc(Cl)ccc1I Amb35697719 [0,2,0,0,0,0|1,0,0]=3 8177 B14R1.4474 NC(=O)N(N)Cc1cc(O)ccc1Cl Amb27850611 [0,2,0,0,0,0|2,0,0]=4 8178 B14R1.4474 NC(CN1C=C(F)C=CC1=O)C(=O)O Amb27483244 [0,2,0,0,0,0|1,0,0]=3 8179 B14R1.4474 NC(Cc1cc(Br)ccc1Br)C(=O)O Amb3803501 [0,2,0,0,0,0|0,0,0]=2 8180 B14R1.4474 NC(Cc1cc(Br)ccc1Cl)C(=O)O Amb25193399 [0,2,0,0,0,0|0,0,0]=2 8181 B14R1.4474 NC(Cc1cc(Br)ccc1F)C(=O)O Amb6270572 [0,2,0,0,0,0|0,0,0]=2 8182 B14R1.4474 NC(Cc1cc(Br)ccc1I)C(=O)O Amb27955915 [0,2,0,0,0,0|0,0,0]=2 8183 B14R1.4474 NC(Cc1cc(Br)ccc1O)C(=O)O Amb28343250 [0,2,0,0,0,0|0,0,0]=2 8184 B14R1.4474 NC(Cc1cc(Br)cnc1Cl)C(=O)O Amb25905945 [0,2,0,0,0,0|1,0,0]=3 8185 B14R1.4474 NC(Cc1cc(Br)cnc1F)C(=O)O Amb33477771 [0,2,0,0,0,0|1,0,0]=3 8186 B14R1.4474 NC(Cc1cc(Cl)ccc1Br)C(=O)O Amb27866505 [0,2,0,0,0,0|0,0,0]=2 8187 B14R1.4474 NC(Cc1cc(Cl)ccc1Cl)C(=O)O Amb3790205 [0,2,0,0,0,0|0,0,0]=2 8188 B14R1.4474 NC(Cc1cc(Cl)ccc1F)C(=O)O Amb18225658 [0,2,0,0,0,0|0,0,0]=2 8189 B14R1.4474 NC(Cc1cc(Cl)ccc1I)C(=O)O Amb28240296 [0,2,0,0,0,0|0,0,0]=2 8190 B14R1.4474 NC(Cc1cc(Cl)ccc1O)C(=O)O Amb19000855 [0,2,0,0,0,0|0,0,0]=2 8191 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb27841448 [0,2,0,0,0,0|1,0,0]=3 8192 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb33620550 [0,2,0,0,0,0|1,0,0]=3 8193 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb33741518 [0,2,0,0,0,0|1,0,0]=3 8194 B14R1.4474 NC(Cc1cc(Cl)cnc1F)C(=O)O Amb27462027 [0,2,0,0,0,0|1,0,0]=3 8195 B14R1.4474 NC(Cc1cc(Cl)cnc1O)C(=O)O Amb27814150 [0,2,0,0,0,0|1,0,0]=3 8196 B14R1.4474 NC(Cc1cc(Cl)ncc1Br)C(=O)O Amb27647717 [0,2,0,0,0,0|1,0,0]=3 8197 B14R1.4474 NC(Cc1cc(Cl)ncc1Cl)C(=O)O Amb25995250 [0,2,0,0,0,0|1,0,0]=3 8198 B14R1.4474 NC(Cc1cc(Cl)nnc1Cl)C(=O)O Amb33258876 [0,2,0,0,0,0|2,0,0]=4 8199 B14R1.4474 NC(Cc1cc(F)ccc1Br)C(=O)O Amb26839422 [0,2,0,0,0,0|0,0,0]=2 8200 B14R1.4474 NC(Cc1cc(F)ccc1Cl)C(=O)O Amb18769201 [0,2,0,0,0,0|0,0,0]=2 8201 B14R1.4474 NC(Cc1cc(F)ccc1F)C(=O)O Amb2687231 [0,2,0,0,0,0|0,0,0]=2 8202 B14R1.4474 NC(Cc1cc(F)ccc1O)C(=O)O Amb26468792 [0,2,0,0,0,0|0,0,0]=2 8203 B14R1.4474 NC(Cc1cc(F)cnc1Cl)C(=O)O Amb25212912 [0,2,0,0,0,0|1,0,0]=3 8204 B14R1.4474 NC(Cc1cc(I)ccc1Br)C(=O)O Amb27587892 [0,2,0,0,0,0|0,0,0]=2 8205 B14R1.4474 NC(Cc1cc(I)ccc1F)C(=O)O Amb27168866 [0,2,0,0,0,0|0,0,0]=2 8206 B14R1.4474 NC(Cc1cc(I)ccc1O)C(=O)O Amb28053923 [0,2,0,0,0,0|0,0,0]=2 8207 B14R1.4474 NC(Cc1cc(O)ccc1O)C(=O)O Amb17595220 [0,2,0,0,0,0|0,0,0]=2 8208 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1Cl)C(=O)O Amb24678954 [0,2,0,0,0,0|0,0,0]=2 8209 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1F)C(=O)O Amb25062850 [0,2,0,0,0,0|0,0,0]=2 8210 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1I)C(=O)O Amb27619738 [0,2,0,0,0,0|0,0,0]=2 8211 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(=O)O Amb22228353 [0,2,0,0,0,0|0,0,0]=2 8212 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(=O)O Amb23399720 [0,2,0,0,0,0|0,0,0]=2 8213 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1O)C(=O)O Amb27181750 [0,2,0,0,0,0|0,0,0]=2 8214 B14R1.4474 N[C@@H](Cc1cc(Cl)cnc1O)C(=O)O Amb27400517 [0,2,0,0,0,0|1,0,0]=3 8215 B14R1.4474 N[C@@H](Cc1cc(F)ccc1Br)C(=O)O Amb27859075 [0,2,0,0,0,0|0,0,0]=2 8216 B14R1.4474 N[C@@H](Cc1cc(F)ccc1Cl)C(=O)O Amb27754158 [0,2,0,0,0,0|0,0,0]=2 8217 B14R1.4474 N[C@@H](Cc1cc(F)ccc1F)C(=O)O Amb19087680 [0,2,0,0,0,0|0,0,0]=2 8218 B14R1.4474 N[C@@H](Cc1cc(I)ccc1Br)C(=O)O Amb27800793 [0,2,0,0,0,0|0,0,0]=2 8219 B14R1.4474 N[C@@H](Cc1cc(O)ccc1F)C(=O)O Amb26872180 [0,2,0,0,0,0|0,0,0]=2 8220 B14R1.4474 N[C@H](Cc1cc(Br)ccc1Cl)C(=O)O Amb25691521 [0,2,0,0,0,0|0,0,0]=2 8221 B14R1.4474 N[C@H](Cc1cc(Br)ccc1F)C(=O)O Amb26589627 [0,2,0,0,0,0|0,0,0]=2 8222 B14R1.4474 N[C@H](Cc1cc(Br)cnc1Cl)C(=O)O Amb27848953 [0,2,0,0,0,0|1,0,0]=3 8223 B14R1.4474 N[C@H](Cc1cc(Br)cnc1O)C(=O)O Amb27465718 [0,2,0,0,0,0|1,0,0]=3 8224 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1Cl)C(=O)O Amb22228352 [0,2,0,0,0,0|0,0,0]=2 8225 B14R1.4474 N[C@H](Cc1cc(Cl)ncc1Br)C(=O)O Amb28187029 [0,2,0,0,0,0|1,0,0]=3 8226 B14R1.4474 N[C@H](Cc1cc(Cl)ncc1Cl)C(=O)O Amb28186514 [0,2,0,0,0,0|1,0,0]=3 8227 B14R1.4474 N[C@H](Cc1cc(F)ccc1F)C(=O)O Amb19887665 [0,2,0,0,0,0|0,0,0]=2 8228 B14R1.4474 N[C@H](Cc1cc(O)ccc1Br)C(=O)O Amb27957293 [0,2,0,0,0,0|0,0,0]=2 8229 B14R1.4474 N[C@H](Cc1cc(O)ccc1Cl)C(=O)O Amb27418201 [0,2,0,0,0,0|0,0,0]=2 8230 B14R1.4474 N[C@H](Cc1cc(O)ccc1O)C(=O)O Amb22228355 [0,2,0,0,0,0|0,0,0]=2 8231 B14R1.4474 N\C(=C\c1cc(Br)ccc1F)C(=O)O Amb27585905 [0,2,0,0,0,0|0,0,2]=4 8232 B14R1.4474 Nc1cc(C[C@@H](N)C(=O)O)c(Br)cn1 Amb27390232 [0,2,0,0,0,0|1,0,0]=3 8233 B14R1.4474 Nc1ccc(Br)cc1C[C@H](N)C(=O)O Amb28255613 [0,2,0,0,0,0|0,0,0]=2 8234 B14R1.4474 Nc1ccc(Cl)c(SC(F)C(=O)O)c1 Amb27954854 [0,2,0,0,0,0|2,0,0]=4 8235 B14R1.4474 Nc1ccc(Cl)cc1C[C@H](N)C(=O)O Amb27241335 [0,2,0,0,0,0|0,0,0]=2 8236 B14R1.4474 Nc1ccc(Cl)cc1SC(F)C(=O)O Amb28460960 [0,2,0,0,0,0|2,0,0]=4 8237 B14R1.4474 Nc1ccc(F)cc1CC(N)C(=O)O Amb18652765 [0,2,0,0,0,0|0,0,0]=2 8238 B14R1.4474 Nc1ccc(F)cc1SC(F)C(=O)O Amb28249890 [0,2,0,0,0,0|2,0,0]=4 8239 B14R1.4474 Nc1ccc(I)cc1CC(N)C(=O)O Amb27611946 [0,2,0,0,0,0|0,0,0]=2 8240 B14R1.4474 Nc1ccc(I)cc1C[C@@H](N)C(=O)O Amb27640129 [0,2,0,0,0,0|0,0,0]=2 8241 B14R1.4474 Nc1ccc(N)c(CC(N)C(=O)O)c1 Amb27794760 [0,2,0,0,0,0|0,0,0]=2 8242 B14R1.4474 Nc1ccc(O)cc1C[C@@H](N)C(=O)O Amb27173277 [0,2,0,0,0,0|0,0,0]=2 8243 B14R1.4474 Nc1ncc(Br)cc1CC(N)C(=O)O Amb28323276 [0,2,0,0,0,0|1,0,0]=3 8244 B14R1.4474 Nc1ncc(Cl)cc1CC(N)C(=O)O Amb27425407 [0,2,0,0,0,0|1,0,0]=3 8245 B14R1.4474 Nc1ncc(Cl)cc1C[C@H](N)C(=O)O Amb27459758 [0,2,0,0,0,0|1,0,0]=3 8246 B14R1.4474 O=C(O)C(=O)Cc1cc(Br)ccc1Cl Amb26021819 [0,2,0,0,0,0|1,0,1]=4 8247 B14R1.4474 O=C(O)C(=O)Cc1cc(Br)ccc1F Amb1139984 [0,2,0,0,0,0|1,0,1]=4 8248 B14R1.4474 O=C(O)C(=O)Cc1cc(Br)ccc1O Amb33333214 [0,2,0,0,0,0|1,0,1]=4 8249 B14R1.4474 O=C(O)C(=O)Cc1cc(Cl)ccc1Br Amb26312649 [0,2,0,0,0,0|1,0,1]=4 8250 B14R1.4474 O=C(O)C(=O)Cc1cc(Cl)ccc1Cl Amb26616027 [0,2,0,0,0,0|1,0,1]=4 8251 B14R1.4474 O=C(O)C(=O)Cc1cc(Cl)ccc1F Amb27867981 [0,2,0,0,0,0|1,0,1]=4 8252 B14R1.4474 O=C(O)C(=O)Cc1cc(Cl)ccc1I Amb29857026 [0,2,0,0,0,0|1,0,1]=4 8253 B14R1.4474 O=C(O)C(=O)Cc1cc(Cl)ccc1O Amb33053161 [0,2,0,0,0,0|1,0,1]=4 8254 B14R1.4474 O=C(O)C(=O)Cc1cc(F)ccc1Br Amb25028844 [0,2,0,0,0,0|1,0,1]=4 8255 B14R1.4474 O=C(O)C(=O)Cc1cc(F)ccc1Cl Amb26540574 [0,2,0,0,0,0|1,0,1]=4 8256 B14R1.4474 O=C(O)C(=O)Cc1cc(F)ccc1F Amb9303744 [0,2,0,0,0,0|1,0,1]=4 8257 B14R1.4474 O=C(O)C(=O)Cc1cc(F)ccc1O Amb33380302 [0,2,0,0,0,0|1,0,1]=4 8258 B14R1.4474 O=C(O)C(=O)Cc1cc(O)ccc1Br Amb33451007 [0,2,0,0,0,0|1,0,1]=4 8259 B14R1.4474 O=C(O)C(=O)Cc1cc(O)ccc1O Amb26334057 [0,2,0,0,0,0|1,0,1]=4 8260 B14R1.4474 O=C(O)C(Br)Cc1cc(Cl)ccc1Cl Amb10596988 [0,2,0,0,0,0|1,0,0]=3 8261 B14R1.4474 O=C(O)C(Cl)Cc1cc(Cl)ccc1Cl Amb17204774 [0,2,0,0,0,0|1,0,0]=3 8262 B14R1.4474 O=C(O)C(Cl)Cc1cc(F)ccc1F Amb28348671 [0,2,0,0,0,0|1,0,0]=3 8263 B14R1.4474 O=C(O)C(F)Cc1cc(Br)ccc1Cl Amb28142527 [0,2,0,0,0,0|1,0,0]=3 8264 B14R1.4474 O=C(O)C(F)Oc1cc(Br)ccc1Cl Amb27402420 [0,2,0,0,0,0|2,0,0]=4 8265 B14R1.4474 O=C(O)C(F)Oc1cc(F)ccc1Br Amb28289119 [0,2,0,0,0,0|2,0,0]=4 8266 B14R1.4474 O=C(O)C(F)Oc1cc(F)ccc1F Amb27817017 [0,2,0,0,0,0|2,0,0]=4 8267 B14R1.4474 O=C(O)C(F)Sc1cc(Cl)ccc1Cl Amb27471691 [0,2,0,0,0,0|2,0,0]=4 8268 B14R1.4474 O=C(O)C(O)Cc1cc(Br)ccc1Br Amb33353256 [0,2,0,0,0,0|1,0,0]=3 8269 B14R1.4474 O=C(O)C(O)Cc1cc(Br)ccc1Cl Amb33353325 [0,2,0,0,0,0|1,0,0]=3 8270 B14R1.4474 O=C(O)C(O)Cc1cc(Br)ccc1F Amb26427251 [0,2,0,0,0,0|1,0,0]=3 8271 B14R1.4474 O=C(O)C(O)Cc1cc(Br)ccc1O Amb33333191 [0,2,0,0,0,0|1,0,0]=3 8272 B14R1.4474 O=C(O)C(O)Cc1cc(Br)cnc1Cl Amb33007763 [0,2,0,0,0,0|2,0,0]=4 8273 B14R1.4474 O=C(O)C(O)Cc1cc(Br)cnc1F Amb33477755 [0,2,0,0,0,0|2,0,0]=4 8274 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ccc1Br Amb26554696 [0,2,0,0,0,0|1,0,0]=3 8275 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ccc1Cl Amb25193286 [0,2,0,0,0,0|1,0,0]=3 8276 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ccc1F Amb27749931 [0,2,0,0,0,0|1,0,0]=3 8277 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ccc1I Amb35717010 [0,2,0,0,0,0|1,0,0]=3 8278 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ccc1O Amb27449856 [0,2,0,0,0,0|1,0,0]=3 8279 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)cnc1F Amb33257485 [0,2,0,0,0,0|2,0,0]=4 8280 B14R1.4474 O=C(O)C(O)Cc1cc(Cl)ncc1Br Amb33477819 [0,2,0,0,0,0|2,0,0]=4 8281 B14R1.4474 O=C(O)C(O)Cc1cc(F)ccc1Br Amb27151784 [0,2,0,0,0,0|1,0,0]=3 8282 B14R1.4474 O=C(O)C(O)Cc1cc(F)ccc1Cl Amb26523686 [0,2,0,0,0,0|1,0,0]=3 8283 B14R1.4474 O=C(O)C(O)Cc1cc(F)ccc1F Amb27245525 [0,2,0,0,0,0|1,0,0]=3 8284 B14R1.4474 O=C(O)C(O)Cc1cc(F)ccc1O Amb33380298 [0,2,0,0,0,0|1,0,0]=3 8285 B14R1.4474 O=C(O)C(O)Cc1cc(O)ccc1Br Amb33353276 [0,2,0,0,0,0|1,0,0]=3 8286 B14R1.4474 O=C(O)C(O)Cc1cc(O)ccc1O Amb24498275 [0,2,0,0,0,0|1,0,0]=3 8287 B14R1.243 C=C(C(=O)O)C(N)c1ccccc1Cl Amb28120062 [0,2,0,0,0,0|1,0,1]=4 8288 B14R1.243 C=C(C(=O)O)C(O)c1ccccc1Cl Amb26382927 [0,2,0,0,0,0|1,0,1]=4 8289 B14R1.243 C=C(C(=O)O)[C@@H](O)c1ccccc1Cl Amb28398472 [0,2,0,0,0,0|1,0,1]=4 8290 B14R1.243 CC(=O)C(Br)C(C)c1ccccc1I Amb27403932 [0,2,0,0,0,0|2,0,0]=4 8291 B14R1.243 CC(=O)C(Cl)C(O)c1ccccc1F Amb28041365 [0,2,0,0,0,0|2,0,0]=4 8292 B14R1.243 CC(=O)[C@@H](Cl)[C@@H](O)c1ccccc1F Amb27827443 [0,2,0,0,0,0|2,0,0]=4 8293 B14R1.243 CC(=O)[C@H](O)[C@@H](O)c1ccccc1F Amb27981678 [0,2,0,0,0,0|2,0,0]=4 8294 B14R1.243 CC(C(=O)O)C(C)c1ccccc1Cl Amb24521299 [0,2,0,0,0,0|1,0,0]=3 8295 B14R1.243 CC(C(=O)O)C(C)c1ccccc1F Amb27792680 [0,2,0,0,0,0|1,0,0]=3 8296 B14R1.243 CC(C(=O)O)C(C)c1ccncc1F Amb27189389 [0,2,0,0,0,0|2,0,0]=4 8297 B14R1.243 CC(C(=O)O)C(N)c1ccccc1Br Amb17473599 [0,2,0,0,0,0|1,0,0]=3 8298 B14R1.243 CC(C(=O)O)N(C)c1ccccc1N Amb18984722 [0,2,0,0,0,0|2,0,0]=4 8299 B14R1.243 CC(C(=O)O)S(=O)c1ccccc1Br Amb27256800 [0,2,0,0,0,0|2,0,0]=4 8300 B14R1.243 CC(c1ccccc1Cl)C(F)C(=O)O Amb27780251 [0,2,0,0,0,0|1,0,0]=3 8301 B14R1.243 CC(c1ccccc1Cl)C(O)C(=O)O Amb27200592 [0,2,0,0,0,0|1,0,0]=3 8302 B14R1.243 CC(c1ccccc1F)C(N)C(=O)O Amb27968176 [0,2,0,0,0,0|0,0,0]=2 8303 B14R1.243 CC(c1ccccc1F)C(O)C(=O)O Amb27241999 [0,2,0,0,0,0|1,0,0]=3 8304 B14R1.243 CC(c1ccccc1F)[C@@H](C)C(=O)O Amb33749374 [0,2,0,0,0,0|1,0,0]=3 8305 B14R1.243 CC(c1ccccc1F)[C@H](C)C(=O)O Amb33743263 [0,2,0,0,0,0|1,0,0]=3 8306 B14R1.243 CC(c1ccccc1O)C(O)C(=O)O Amb27669992 [0,2,0,0,0,0|1,0,0]=3 8307 B14R1.243 Cc1ccccc1C(C)C(C)C(=O)O Amb24552960 [0,2,0,0,0,0|1,0,0]=3 8308 B14R1.243 Cc1ccccc1C(C)C(N)C(=O)O Amb27638995 [0,2,0,0,0,0|0,0,0]=2 8309 B14R1.243 Cc1ccccc1C(C)[C@@H](C)C(=O)O Amb33727261 [0,2,0,0,0,0|1,0,0]=3 8310 B14R1.243 Cc1ccccc1C(C)[C@H](C)C(=O)O Amb33744635 [0,2,0,0,0,0|1,0,0]=3 8311 B14R1.243 Cc1ccccc1C(N)C(O)C(=O)O Amb27152436 [0,2,0,0,0,0|1,0,0]=3 8312 B14R1.243 Cc1ccccc1C(O)C(N)C(=O)O Amb18814159 [0,2,0,0,0,0|0,0,0]=2 8313 B14R1.243 Cc1ccccc1N(C)C(C)C(=O)O Amb22966922 [0,2,0,0,0,0|2,0,0]=4 8314 B14R1.243 Cc1ccccc1[C@@H](N)[C@@H](O)C(=O)O Amb22756711 [0,2,0,0,0,0|1,0,0]=3 8315 B14R1.243 Cc1ccccc1[C@H](N)[C@@H](O)C(=O)O Amb27632959 [0,2,0,0,0,0|1,0,0]=3 8316 B14R1.243 Cc1ccccc1[C@H](N)[C@H](O)C(=O)O Amb25850769 [0,2,0,0,0,0|1,0,0]=3 8317 B14R1.243 Cc1ccccc1[C@H](O)[C@H](N)C(=O)O Amb28396648 [0,2,0,0,0,0|0,0,0]=2 8318 B14R1.243 Cc1cccnc1C(C)C(C)C(=O)O Amb27645492 [0,2,0,0,0,0|2,0,0]=4 8319 B14R1.243 Cc1cccnc1C(O)C(C)C(=O)O Amb27661088 [0,2,0,0,0,0|2,0,0]=4 8320 B14R1.243 Cc1cccnc1C(O)C(N)C(=O)O Amb33428994 [0,2,0,0,0,0|1,0,0]=3 8321 B14R1.243 Cc1ccncc1C(O)C(N)C(=O)O Amb24426460 [0,2,0,0,0,0|1,0,0]=3 8322 B14R1.243 Cc1cnccc1C(O)C(N)C(=O)O Amb28246818 [0,2,0,0,0,0|1,0,0]=3 8323 B14R1.243 Cc1ncccc1C(O)C(N)C(=O)O Amb32879577 [0,2,0,0,0,0|1,0,0]=3 8324 B14R1.243 Cc1nccnc1C(C)C(N)C(=O)O Amb29892510 [0,2,0,0,0,0|2,0,0]=4 8325 B14R1.243 Cc1nccnc1C(O)C(N)C(=O)O Amb33142572 [0,2,0,0,0,0|2,0,0]=4 8326 B14R1.243 Cc1ncncc1C(O)C(N)C(=O)O Amb33465808 [0,2,0,0,0,0|2,0,0]=4 8327 B14R1.243 NC(C(=O)O)C(O)c1ccccc1Br Amb18692060 [0,2,0,0,0,0|0,0,0]=2 8328 B14R1.243 NC(C(=O)O)C(O)c1ccccc1Cl Amb18170660 [0,2,0,0,0,0|0,0,0]=2 8329 B14R1.243 NC(C(=O)O)C(O)c1ccccc1F Amb24652416 [0,2,0,0,0,0|0,0,0]=2 8330 B14R1.243 NC(C(=O)O)C(O)c1ccccc1O Amb24365903 [0,2,0,0,0,0|0,0,0]=2 8331 B14R1.243 NC(C(=O)O)C(O)c1cccnc1Br Amb33387841 [0,2,0,0,0,0|1,0,0]=3 8332 B14R1.243 NC(C(=O)O)C(O)c1cccnc1Cl Amb33257015 [0,2,0,0,0,0|1,0,0]=3 8333 B14R1.243 NC(C(=O)O)C(O)c1cccnc1F Amb33377937 [0,2,0,0,0,0|1,0,0]=3 8334 B14R1.243 NC(C(=O)O)C(O)c1ccncc1Br Amb33389528 [0,2,0,0,0,0|1,0,0]=3 8335 B14R1.243 NC(C(=O)O)C(O)c1ccncc1Cl Amb33413761 [0,2,0,0,0,0|1,0,0]=3 8336 B14R1.243 NC(C(=O)O)C(O)c1ccncc1F Amb33317689 [0,2,0,0,0,0|1,0,0]=3 8337 B14R1.243 NC(C(=O)O)C(O)c1ncccc1Br Amb33336058 [0,2,0,0,0,0|1,0,0]=3 8338 B14R1.243 NC(C(=O)O)C(O)c1ncccc1F Amb33419617 [0,2,0,0,0,0|1,0,0]=3 8339 B14R1.243 NC(c1ccccc1F)C(O)C(=O)O Amb24419847 [0,2,0,0,0,0|1,0,0]=3 8340 B14R1.243 NC(c1ccccc1O)C(O)C(=O)O Amb28136799 [0,2,0,0,0,0|1,0,0]=3 8341 B14R1.243 NC(c1cnccc1Br)C(O)C(=O)O Amb27440045 [0,2,0,0,0,0|2,0,0]=4 8342 B14R1.243 NC(c1cnccc1Cl)C(O)C(=O)O Amb27630454 [0,2,0,0,0,0|2,0,0]=4 8343 B14R1.243 NC(c1cnccc1F)C(O)C(=O)O Amb28429581 [0,2,0,0,0,0|2,0,0]=4 8344 B14R1.243 NC(c1ncccc1F)C(O)C(=O)O Amb27818103 [0,2,0,0,0,0|2,0,0]=4 8345 B14R1.243 N[C@@H](C(=O)O)C(O)c1ccccc1F Amb27816147 [0,2,0,0,0,0|0,0,0]=2 8346 B14R1.243 N[C@@H](C(=O)O)[C@@H](O)c1ccccc1F Amb27165698 [0,2,0,0,0,0|0,0,0]=2 8347 B14R1.243 N[C@@H](C(=O)O)[C@H](O)c1ccccc1F Amb27401954 [0,2,0,0,0,0|0,0,0]=2 8348 B14R1.243 N[C@@H](c1ccccc1Cl)[C@@H](O)C(=O)O Amb28051720 [0,2,0,0,0,0|1,0,0]=3 8349 B14R1.243 N[C@@H](c1ccccc1F)[C@@H](O)C(=O)O Amb27388648 [0,2,0,0,0,0|1,0,0]=3 8350 B14R1.243 N[C@@H](c1ccccc1F)[C@H](O)C(=O)O Amb25990394 [0,2,0,0,0,0|1,0,0]=3 8351 B14R1.243 N[C@@H](c1cccnc1Br)[C@@H](O)C(=O)O Amb27847245 [0,2,0,0,0,0|2,0,0]=4 8352 B14R1.243 N[C@@H](c1cnccc1Cl)[C@@H](O)C(=O)O Amb27462480 [0,2,0,0,0,0|2,0,0]=4 8353 B14R1.243 N[C@@H](c1ncccc1Br)[C@@H](O)C(=O)O Amb27847130 [0,2,0,0,0,0|2,0,0]=4 8354 B14R1.243 N[C@@H](c1ncccc1Cl)[C@@H](O)C(=O)O Amb27209255 [0,2,0,0,0,0|2,0,0]=4 8355 B14R1.243 N[C@@H](c1ncccc1F)[C@@H](O)C(=O)O Amb27239997 [0,2,0,0,0,0|2,0,0]=4 8356 B14R1.243 N[C@H](C(=O)O)[C@H](O)c1ccccc1Br Amb27183933 [0,2,0,0,0,0|0,0,0]=2 8357 B14R1.243 N[C@H](C(=O)O)[C@H](O)c1ccccc1F Amb28118965 [0,2,0,0,0,0|0,0,0]=2 8358 B14R1.243 N[C@H](c1cnccc1F)[C@H](O)C(=O)O Amb27612876 [0,2,0,0,0,0|2,0,0]=4 8359 B14R1.243 Nc1ccccc1C(Br)C(Br)C(=O)O Amb4008711 [0,2,0,0,0,0|1,0,0]=3 8360 B14R1.243 Nc1ccccc1C(O)C(O)C(=O)O Amb27983793 [0,2,0,0,0,0|1,0,0]=3 8361 B14R1.243 O=C(O)C(=O)C(F)c1ccccc1Cl Amb27754074 [0,2,0,0,0,0|1,0,1]=4 8362 B14R1.243 O=C(O)C(Br)C(Br)c1ccccc1Br Amb17612539 [0,2,0,0,0,0|1,0,0]=3 8363 B14R1.1017 CC(c1ccccc1)C(C#N)C(=O)O Amb17089331 [0,2,0,0,0,0|0,0,1]=3 8364 B14R1.1017 CC(c1ccccc1)C(CN)C(=O)O Amb33081586 [0,2,0,0,0,0|0,0,0]=2 8365 B14R1.1017 CCC(C(=O)O)C(C)c1ccccc1 Amb18651266 [0,2,0,0,0,0|1,0,0]=3 8366 B14R1.1017 O=C(O)\C(=N/O)C(F)c1ccccc1 Amb25279502 [0,2,0,0,0,0|0,0,2]=4 8367 B14R1.1027 CC(C(=O)O)N(C=O)c1ccccc1 Amb2613670 [0,2,0,0,0,0|2,0,0]=4 8368 B14R1.1027 CCC(c1ccccc1)C(C)C(=O)O Amb18651267 [0,2,0,0,0,0|1,0,0]=3 8369 B14R1.1027 CCC(c1ccccc1)[C@@H](C)C(=O)O Amb33749377 [0,2,0,0,0,0|1,0,0]=3 8370 B14R1.1027 CCC(c1ccccc1)[C@H](C)C(=O)O Amb33749071 [0,2,0,0,0,0|1,0,0]=3 8371 B14R1.1027 CCN(c1ccccc1)C(C)C(=O)O Amb5768803 [0,2,0,0,0,0|2,0,0]=4 8372 B14R1.1027 N#CC(C(=O)C(=O)O)c1ccccc1 Amb28058827 [0,2,0,0,0,0|1,0,1]=4 8373 B14R1.1027 NC(C(=O)O)\C(=N\O)c1ccccc1 Amb28383538 [0,2,0,0,0,0|0,0,1]=3 8374 B14R1.6306 C=C(C(=O)O)C(C)(C)c1ccccc1 Amb33175854 [0,2,0,0,0,0|1,0,1]=4 8375 B14R1.6306 C=C(C(=O)O)C(F)(F)c1ccccc1 Amb33082233 [0,2,0,0,0,0|1,0,1]=4 8376 B14R1.6306 CC(C(=O)O)C(C)(C)c1ccccc1 Amb28398645 [0,2,0,0,0,0|1,0,0]=3 8377 B14R1.6306 CC(C(=O)O)C(C)(Cl)c1ccccc1 Amb27588180 [0,2,0,0,0,0|1,0,0]=3 8378 B14R1.6306 CC(C(=O)O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|1,0,0]=3 8379 B14R1.6306 CC(C(=O)O)C(F)(F)c1ccccc1 Amb33081967 [0,2,0,0,0,0|1,0,0]=3 8380 B14R1.6306 CC(C(=O)O)S(=O)(=O)c1ccccc1 Amb9207032 [0,2,0,0,0,0|2,0,0]=4 8381 B14R1.6306 CC(C)(C(=O)C(=O)O)c1ccccc1 Amb27417233 [0,2,0,0,0,0|1,0,1]=4 8382 B14R1.6306 CC(C)(c1ccccc1)C(N)C(=O)O Amb26893563 [0,2,0,0,0,0|0,0,0]=2 8383 B14R1.6306 CC(C)(c1ccccc1)C(N)C(=O)O Amb32992382 [0,2,0,0,0,0|0,0,0]=2 8384 B14R1.6306 CC(C)(c1ccccc1)C(O)C(=O)O Amb18651885 [0,2,0,0,0,0|1,0,0]=3 8385 B14R1.6306 CC(C)(c1ccccn1)C(N)C(=O)O Amb33361074 [0,2,0,0,0,0|1,0,0]=3 8386 B14R1.6306 CC(C)(c1ccccn1)C(O)C(=O)O Amb33361071 [0,2,0,0,0,0|2,0,0]=4 8387 B14R1.6306 CC(C)(c1cccnc1)C(N)C(=O)O Amb33429425 [0,2,0,0,0,0|1,0,0]=3 8388 B14R1.6306 CC(C)(c1cccnc1)C(O)C(=O)O Amb33429422 [0,2,0,0,0,0|2,0,0]=4 8389 B14R1.6306 CC(C)(c1ccncc1)C(N)C(=O)O Amb33380668 [0,2,0,0,0,0|1,0,0]=3 8390 B14R1.6306 CC(C)(c1ccncc1)C(O)C(=O)O Amb33380666 [0,2,0,0,0,0|2,0,0]=4 8391 B14R1.6306 CC(C)(c1ccncn1)C(N)C(=O)O Amb33269030 [0,2,0,0,0,0|2,0,0]=4 8392 B14R1.6306 CC(C)(c1cnccn1)C(N)C(=O)O Amb33360010 [0,2,0,0,0,0|2,0,0]=4 8393 B14R1.6306 CC(C)(c1cncnc1)C(N)C(=O)O Amb33465652 [0,2,0,0,0,0|2,0,0]=4 8394 B14R1.6306 CC(C)(c1ncccn1)C(N)C(=O)O Amb33270673 [0,2,0,0,0,0|2,0,0]=4 8395 B14R1.6306 CC(Cl)(c1ccccc1)C(O)C(=O)O Amb27390182 [0,2,0,0,0,0|1,0,0]=3 8396 B14R1.6306 CC(N)(c1ccccc1)C(N)C(=O)O Amb28189526 [0,2,0,0,0,0|0,0,0]=2 8397 B14R1.6306 CC(O)(c1ccccc1)C(F)C(=O)O Amb28430664 [0,2,0,0,0,0|1,0,0]=3 8398 B14R1.6306 C[C@@H](C(=O)O)C(C)(C)c1ccccc1 Amb33729611 [0,2,0,0,0,0|1,0,0]=3 8399 B14R1.6306 C[C@@H](C(=O)O)C(F)(F)c1ccccc1 Amb33729196 [0,2,0,0,0,0|1,0,0]=3 8400 B14R1.6306 C[C@@H](C(=O)O)[C@@](C)(O)c1ccccc1 Amb28190955 [0,2,0,0,0,0|1,0,0]=3 8401 B14R1.6306 C[C@H](C(=O)O)C(C)(C)c1ccccc1 Amb24498135 [0,2,0,0,0,0|1,0,0]=3 8402 B14R1.6306 C[C@H](C(=O)O)C(F)(F)c1ccccc1 Amb33728824 [0,2,0,0,0,0|1,0,0]=3 8403 B14R1.6306 C[C@H](C(=O)O)[C@@](C)(N)c1ccccc1 Amb27848243 [0,2,0,0,0,0|1,0,0]=3 8404 B14R1.6306 C[C@H](C(=O)O)[C@](C)(N)c1ccccc1 Amb28055956 [0,2,0,0,0,0|1,0,0]=3 8405 B14R1.6306 C[C@H](C(=O)O)[C@](C)(O)c1ccccc1 Amb27263067 [0,2,0,0,0,0|1,0,0]=3 8406 B14R1.6306 C[C@](N)(c1ccccc1)[C@@H](N)C(=O)O Amb27656558 [0,2,0,0,0,0|0,0,0]=2 8407 B14R1.6306 NC(=O)C(N)C(F)(F)c1ccccc1 Amb22325275 [0,2,0,0,0,0|1,0,0]=3 8408 B14R1.6306 NC(C(=O)O)C(F)(F)c1ccccc1 Amb22325271 [0,2,0,0,0,0|0,0,0]=2 8409 B14R1.6306 NC(C(=O)O)C(F)(F)c1ccccc1 Amb2696833 [0,2,0,0,0,0|0,0,0]=2 8410 B14R1.6306 NC(C(=O)O)C(O)(O)c1ccccc1 Amb28245330 [0,2,0,0,0,0|0,0,0]=2 8411 B14R1.6306 O=C(O)C(=O)C(F)(F)c1ccccc1 Amb10841761 [0,2,0,0,0,0|1,0,1]=4 8412 B14R1.6306 O=C(O)C(=O)C(F)(F)c1ccccc1 Amb22325268 [0,2,0,0,0,0|1,0,1]=4 8413 B14R1.6306 O=C(O)C(F)S(=O)(=O)c1ccccc1 Amb17595931 [0,2,0,0,0,0|2,0,0]=4 8414 B14R1.6306 O=C(O)C(O)C(F)(F)c1ccccc1 Amb2697847 [0,2,0,0,0,0|1,0,0]=3 8415 B14R1.6391 CC(=O)C(C)(C)C(O)c1ccccc1 Amb27218971 [0,2,0,0,0,0|2,0,0]=4 8416 B14R1.6391 CC(=O)[C@@](C)(N)[C@@H](O)c1ccccc1 Amb27230210 [0,2,0,0,0,0|1,0,0]=3 8417 B14R1.6391 CC(C)(C(=O)O)C(F)c1ccccc1 Amb32679303 [0,2,0,0,0,0|1,0,0]=3 8418 B14R1.6391 CC(C)(C(=O)O)C(N)c1ccccc1 Amb18651525 [0,2,0,0,0,0|1,0,0]=3 8419 B14R1.6391 CC(C)(C(=O)O)C(N)c1ccccc1 Amb20623909 [0,2,0,0,0,0|1,0,0]=3 8420 B14R1.6391 CC(C)(C(=O)O)C(N)c1ccccn1 Amb28423375 [0,2,0,0,0,0|2,0,0]=4 8421 B14R1.6391 CC(C)(C(=O)O)C(N)c1ccncc1 Amb27252057 [0,2,0,0,0,0|2,0,0]=4 8422 B14R1.6391 CC(C)(C(=O)O)[C@@H](N)c1ccccc1 Amb28456620 [0,2,0,0,0,0|1,0,0]=3 8423 B14R1.6391 CC(C)(C(=O)O)[C@@H](N)c1ccccn1 Amb27817767 [0,2,0,0,0,0|2,0,0]=4 8424 B14R1.6391 CC(C)(C(=O)O)[C@H](N)c1ccncc1 Amb27748249 [0,2,0,0,0,0|2,0,0]=4 8425 B14R1.6391 CC(O)(C(=O)O)C(N)c1ccccc1 Amb26054853 [0,2,0,0,0,0|1,0,0]=3 8426 B14R1.6391 CC(O)(C(=O)O)C(N)c1ccccc1 Amb28653359 [0,2,0,0,0,0|1,0,0]=3 8427 B14R1.6391 CC(c1ccccc1)C(C)(C)C(=O)O Amb17333790 [0,2,0,0,0,0|1,0,0]=3 8428 B14R1.6391 CC(c1ccccc1)C(C)(C)C(N)=O Amb27483083 [0,2,0,0,0,0|2,0,0]=4 8429 B14R1.6391 CC(c1ccccc1)C(C)(O)C(=O)O Amb20623542 [0,2,0,0,0,0|1,0,0]=3 8430 B14R1.6391 CC(c1ccccc1)C(F)(F)C(=O)O Amb33081618 [0,2,0,0,0,0|1,0,0]=3 8431 B14R1.6391 C[C@@H](c1ccccc1)C(C)(C)C(=O)O Amb28119850 [0,2,0,0,0,0|1,0,0]=3 8432 B14R1.6391 C[C@@H](c1ccccc1)[C@](C)(N)C(=O)O Amb27232767 [0,2,0,0,0,0|0,0,0]=2 8433 B14R1.6391 C[C@@](Cl)(C(=O)O)[C@@H](O)c1ccccc1 Amb28255654 [0,2,0,0,0,0|1,0,0]=3 8434 B14R1.6391 C[C@H](c1ccccc1)[C@@](C)(N)C(=O)O Amb27231750 [0,2,0,0,0,0|0,0,0]=2 8435 B14R1.6391 C[C@](N)(C(=O)O)[C@@H](O)c1ccccc1 Amb27966817 [0,2,0,0,0,0|0,0,0]=2 8436 B14R1.6391 NC(=O)C(F)(F)C(N)c1ccccc1 Amb27248386 [0,2,0,0,0,0|2,0,0]=4 8437 B14R1.6391 NC(c1ccccc1)C(F)(F)C(=O)O Amb3467734 [0,2,0,0,0,0|1,0,0]=3 8438 B14R1.6391 O=C(O)C(F)(F)C(=O)c1ccccc1 Amb27231272 [0,2,0,0,0,0|1,0,1]=4 8439 B14R1.6391 O=C(O)C(F)(F)C(F)c1ccccc1 Amb26864865 [0,2,0,0,0,0|1,0,0]=3 8440 B14R1.6391 O=C(O)C(F)(F)C(F)c1ccccn1 Amb32946935 [0,2,0,0,0,0|2,0,0]=4 8441 B14R1.6391 O=C(O)C(F)(F)C(F)c1cccnc1 Amb32946936 [0,2,0,0,0,0|2,0,0]=4 8442 B14R1.6391 O=C(O)C(F)(F)C(F)c1ccncc1 Amb32946941 [0,2,0,0,0,0|2,0,0]=4 8443 B14R1.6391 O=C(O)C(F)(F)C(O)c1ccccc1 Amb33025399 [0,2,0,0,0,0|1,0,0]=3 8444 B14R1.6391 O=C(O)C(F)(F)C(O)c1ccccn1 Amb24336590 [0,2,0,0,0,0|2,0,0]=4 8445 B14R1.6391 O=C(O)C(F)(F)C(O)c1cccnc1 Amb17612835 [0,2,0,0,0,0|2,0,0]=4 8446 B14R1.6391 O=C(O)C(F)(F)C(O)c1ccncc1 Amb25790565 [0,2,0,0,0,0|2,0,0]=4 8447 B14R1.6391 O=C(O)C(O)(O)C(F)c1ccccc1 Amb25756176 [0,2,0,0,0,0|1,0,0]=3 8448 B14R1.10526 CC(c1ccccc1)C(N)P(=O)(O)O Amb26897589 [0,2,0,0,0,0|1,0,0]=3 8449 B14R1.10526 NC(c1ccccc1)C(O)P(=O)(O)O Amb27653227 [0,2,0,0,0,0|2,0,0]=4 8450 B14R1.550 C=CC(Nc1ccccc1C)C(=O)O Amb27474196 [0,2,0,0,0,0|2,0,0]=4 8451 B14R1.550 CCC(Cc1ccccc1Br)C(=O)O Amb17605817 [0,2,0,0,0,0|1,0,0]=3 8452 B14R1.550 CCC(Cc1ccccc1C)C(=O)O Amb5744037 [0,2,0,0,0,0|1,0,0]=3 8453 B14R1.550 CCC(Cc1ccccc1C)C(C)=O Amb17234956 [0,2,0,0,0,0|2,0,0]=4 8454 B14R1.550 CCC(Cc1ccccc1Cl)C(=O)O Amb5744046 [0,2,0,0,0,0|1,0,0]=3 8455 B14R1.550 CCC(Cc1ccccc1Cl)C(C)=O Amb17240769 [0,2,0,0,0,0|2,0,0]=4 8456 B14R1.550 CCC(Cc1ccccc1F)C(=O)O Amb5744040 [0,2,0,0,0,0|1,0,0]=3 8457 B14R1.550 CCC(Cc1ccccc1F)C(C)=O Amb17235955 [0,2,0,0,0,0|2,0,0]=4 8458 B14R1.550 CCC(Oc1ccccc1C)C(=O)O Amb9702045 [0,2,0,0,0,0|2,0,0]=4 8459 B14R1.550 CCC(Oc1ccccc1Cl)C(=O)O Amb9702178 [0,2,0,0,0,0|2,0,0]=4 8460 B14R1.550 CCC(Oc1ccccc1F)C(=O)O Amb9702091 [0,2,0,0,0,0|2,0,0]=4 8461 B14R1.550 CCC(Oc1ccccc1N)C(=O)O Amb17110012 [0,2,0,0,0,0|2,0,0]=4 8462 B14R1.550 COC(Cc1ccccc1Br)C(=O)O Amb33389531 [0,2,0,0,0,0|1,0,0]=3 8463 B14R1.550 COC(Cc1ccccc1C)C(=O)O Amb23320703 [0,2,0,0,0,0|1,0,0]=3 8464 B14R1.550 COC(Cc1ccccc1Cl)C(=O)O Amb23320999 [0,2,0,0,0,0|1,0,0]=3 8465 B14R1.550 COC(Cc1ccccc1F)C(=O)O Amb23320945 [0,2,0,0,0,0|1,0,0]=3 8466 B14R1.550 COC(Cc1ccccc1O)C(=O)O Amb33359491 [0,2,0,0,0,0|1,0,0]=3 8467 B14R1.550 COC(Cc1cccnc1Br)C(=O)O Amb33227485 [0,2,0,0,0,0|2,0,0]=4 8468 B14R1.550 COC(Cc1cccnc1C)C(=O)O Amb32878943 [0,2,0,0,0,0|2,0,0]=4 8469 B14R1.550 COC(Cc1cccnc1Cl)C(=O)O Amb33257332 [0,2,0,0,0,0|2,0,0]=4 8470 B14R1.550 COC(Cc1cccnc1F)C(=O)O Amb33377170 [0,2,0,0,0,0|2,0,0]=4 8471 B14R1.550 COC(Cc1ccncc1Br)C(=O)O Amb33388656 [0,2,0,0,0,0|2,0,0]=4 8472 B14R1.550 COC(Cc1ccncc1C)C(=O)O Amb33426451 [0,2,0,0,0,0|2,0,0]=4 8473 B14R1.550 COC(Cc1ccncc1Cl)C(=O)O Amb33413762 [0,2,0,0,0,0|2,0,0]=4 8474 B14R1.550 COC(Cc1ccncc1F)C(=O)O Amb33316847 [0,2,0,0,0,0|2,0,0]=4 8475 B14R1.550 COC(Cc1cnccc1C)C(=O)O Amb33376663 [0,2,0,0,0,0|2,0,0]=4 8476 B14R1.550 COC(Cc1ncccc1Br)C(=O)O Amb33485086 [0,2,0,0,0,0|2,0,0]=4 8477 B14R1.550 COC(Cc1ncccc1C)C(=O)O Amb33360251 [0,2,0,0,0,0|2,0,0]=4 8478 B14R1.550 COC(Cc1ncccc1F)C(=O)O Amb33418442 [0,2,0,0,0,0|2,0,0]=4 8479 B14R1.550 Cc1ccccc1CC(C#N)C(=O)O Amb17090110 [0,2,0,0,0,0|0,0,1]=3 8480 B14R1.550 Cc1ccccc1CC(CN)C(=O)O Amb33550161 [0,2,0,0,0,0|0,0,0]=2 8481 B14R1.550 Cc1ccccc1CC(CN)C(=O)O Amb5744251 [0,2,0,0,0,0|0,0,0]=2 8482 B14R1.550 Cc1cccnc1CC(C#N)C(=O)O Amb35584168 [0,2,0,0,0,0|1,0,1]=4 8483 B14R1.550 Cc1ncccc1CC(C#N)C(=O)O Amb35621472 [0,2,0,0,0,0|1,0,1]=4 8484 B14R1.550 N#CC(Cc1ccccc1Br)C(=O)O Amb8631524 [0,2,0,0,0,0|0,0,1]=3 8485 B14R1.550 N#CC(Cc1ccccc1Cl)C(=O)O Amb4007699 [0,2,0,0,0,0|0,0,1]=3 8486 B14R1.550 N#CC(Cc1ccccc1F)C(=O)O Amb17090113 [0,2,0,0,0,0|0,0,1]=3 8487 B14R1.550 N#CC(Cc1ccncc1Cl)C(=O)O Amb35584189 [0,2,0,0,0,0|1,0,1]=4 8488 B14R1.550 N#CC(Cc1ncccc1Br)C(=O)O Amb35584195 [0,2,0,0,0,0|1,0,1]=4 8489 B14R1.550 NCC(Cc1ccccc1Br)C(=O)O Amb8631347 [0,2,0,0,0,0|0,0,0]=2 8490 B14R1.550 NCC(Cc1ccccc1Cl)C(=O)O Amb19419125 [0,2,0,0,0,0|0,0,0]=2 8491 B14R1.550 NCC(Cc1ccccc1Cl)C(=O)O Amb5744258 [0,2,0,0,0,0|0,0,0]=2 8492 B14R1.550 NCC(Cc1ccccc1Cl)C(N)=O Amb19327847 [0,2,0,0,0,0|1,0,0]=3 8493 B14R1.550 NCC(Cc1ccccc1Cl)C(N)=O Amb33194630 [0,2,0,0,0,0|1,0,0]=3 8494 B14R1.550 NCC(Cc1ccccc1F)C(=O)O Amb31308418 [0,2,0,0,0,0|0,0,0]=2 8495 B14R1.550 NCC(Cc1ccccc1F)C(=O)O Amb5744253 [0,2,0,0,0,0|0,0,0]=2 8496 B14R1.550 NCC(Nc1ccccc1Cl)C(=O)O Amb27877523 [0,2,0,0,0,0|1,0,0]=3 8497 B14R1.550 NCC(Nc1ccccc1I)C(=O)O Amb27221977 [0,2,0,0,0,0|1,0,0]=3 8498 B14R1.550 O=C(O)C(CO)Nc1ccccc1Cl Amb27464315 [0,2,0,0,0,0|2,0,0]=4 8499 B14R1.550 O=C(O)C(CO)Nc1ccccc1F Amb27251833 [0,2,0,0,0,0|2,0,0]=4 8500 B14R1.550 O=C(O)\C(Cc1ccccc1O)=N/O Amb27984944 [0,2,0,0,0,0|0,0,2]=4 8501 B14R1.3135 C#Cc1ccccc1CC(=O)C(=O)O Amb33204321 [0,2,0,0,0,0|1,0,1]=4 8502 B14R1.3135 C#Cc1ccccc1CC(C)C(=O)O Amb33314765 [0,2,0,0,0,0|1,0,0]=3 8503 B14R1.3135 C#Cc1ccccc1CC(N)C(=O)O Amb33314786 [0,2,0,0,0,0|0,0,0]=2 8504 B14R1.3135 C#Cc1ccccc1CC(O)C(=O)O Amb33204041 [0,2,0,0,0,0|1,0,0]=3 8505 B14R1.3135 CC(Cc1ccccc1C#N)C(=O)O Amb27758641 [0,2,0,0,0,0|1,0,0]=3 8506 B14R1.3135 CC(Cc1cccnc1C#N)C(=O)O Amb35610840 [0,2,0,0,0,0|2,0,0]=4 8507 B14R1.3135 CC(Oc1ccccc1C#N)C(=O)O Amb6249257 [0,2,0,0,0,0|2,0,0]=4 8508 B14R1.3135 CC(Oc1ccccc1C=O)C(=O)O Amb1783954 [0,2,0,0,0,0|2,0,0]=4 8509 B14R1.3135 CCc1ccccc1CC(=O)C(=O)O Amb19022205 [0,2,0,0,0,0|1,0,1]=4 8510 B14R1.3135 CCc1ccccc1CC(C)C(=O)O Amb33359205 [0,2,0,0,0,0|1,0,0]=3 8511 B14R1.3135 CCc1ccccc1CC(N)C(=O)O Amb19029523 [0,2,0,0,0,0|0,0,0]=2 8512 B14R1.3135 CCc1ccccc1CC(O)C(=O)O Amb33353277 [0,2,0,0,0,0|1,0,0]=3 8513 B14R1.3135 CCc1ccccc1NC(C)C(=O)O Amb19033691 [0,2,0,0,0,0|2,0,0]=4 8514 B14R1.3135 CCc1ccccc1OC(C)C(=O)O Amb9702376 [0,2,0,0,0,0|2,0,0]=4 8515 B14R1.3135 CNc1ccccc1OC(C)C(=O)O Amb27649627 [0,2,0,0,0,0|2,0,0]=4 8516 B14R1.3135 CNc1ncccc1CC(N)C(=O)O Amb27748173 [0,2,0,0,0,0|1,0,0]=3 8517 B14R1.3135 COc1ccccc1CC(=O)C(=O)O Amb1135187 [0,2,0,0,0,0|1,0,1]=4 8518 B14R1.3135 COc1ccccc1CC(Br)C(C)=O Amb17507793 [0,2,0,0,0,0|2,0,0]=4 8519 B14R1.3135 COc1ccccc1CC(C)C(=O)O Amb5744016 [0,2,0,0,0,0|1,0,0]=3 8520 B14R1.3135 COc1ccccc1CC(C)C(C)=O Amb17235389 [0,2,0,0,0,0|2,0,0]=4 8521 B14R1.3135 COc1ccccc1CC(N)C(=O)O Amb2697485 [0,2,0,0,0,0|0,0,0]=2 8522 B14R1.3135 COc1ccccc1CC(O)C(=O)O Amb17139587 [0,2,0,0,0,0|1,0,0]=3 8523 B14R1.3135 COc1ccccc1C[C@@H](N)C(=O)O Amb19063345 [0,2,0,0,0,0|0,0,0]=2 8524 B14R1.3135 COc1ccccc1C[C@H](N)C(=O)O Amb22641421 [0,2,0,0,0,0|0,0,0]=2 8525 B14R1.3135 COc1ccccc1C[C@H](N)C(=O)O Amb2699193 [0,2,0,0,0,0|0,0,0]=2 8526 B14R1.3135 COc1ccccc1NC(C)C(=O)O Amb840551 [0,2,0,0,0,0|2,0,0]=4 8527 B14R1.3135 COc1ccccc1OC(C)C(=O)O Amb6335883 [0,2,0,0,0,0|2,0,0]=4 8528 B14R1.3135 COc1cccnc1CC(C)C(=O)O Amb33448837 [0,2,0,0,0,0|2,0,0]=4 8529 B14R1.3135 COc1cccnc1CC(N)C(=O)O Amb33475046 [0,2,0,0,0,0|1,0,0]=3 8530 B14R1.3135 COc1cccnc1CC(O)C(=O)O Amb33225010 [0,2,0,0,0,0|2,0,0]=4 8531 B14R1.3135 COc1ncccc1CC(C)C(=O)O Amb32953979 [0,2,0,0,0,0|2,0,0]=4 8532 B14R1.3135 COc1ncccc1CC(O)C(=O)O Amb33379517 [0,2,0,0,0,0|2,0,0]=4 8533 B14R1.3135 CSc1ccccc1CC(=O)C(=O)O Amb33266273 [0,2,0,0,0,0|1,0,1]=4 8534 B14R1.3135 CSc1ccccc1CC(C)C(=O)O Amb33171703 [0,2,0,0,0,0|1,0,0]=3 8535 B14R1.3135 CSc1ccccc1CC(N)C(=O)O Amb33448512 [0,2,0,0,0,0|0,0,0]=2 8536 B14R1.3135 CSc1ccccc1CC(O)C(=O)O Amb33472559 [0,2,0,0,0,0|1,0,0]=3 8537 B14R1.3135 C[C@H](Oc1ccccc1C#N)C(=O)O Amb27973121 [0,2,0,0,0,0|2,0,0]=4 8538 B14R1.3135 N#Cc1ccccc1CC(=O)C(=O)O Amb27233669 [0,2,0,0,0,0|1,0,1]=4 8539 B14R1.3135 N#Cc1ccccc1CC(N)C(=O)O Amb21858527 [0,2,0,0,0,0|0,0,0]=2 8540 B14R1.3135 N#Cc1ccccc1CC(O)C(=O)O Amb33353384 [0,2,0,0,0,0|1,0,0]=3 8541 B14R1.3135 N#Cc1ccccc1C[C@@H](N)C(=O)O Amb8397026 [0,2,0,0,0,0|0,0,0]=2 8542 B14R1.3135 N#Cc1ccccc1C[C@H](N)C(=O)O Amb8397025 [0,2,0,0,0,0|0,0,0]=2 8543 B14R1.3135 NCc1ccccc1CC(N)C(=O)O Amb33330212 [0,2,0,0,0,0|0,0,0]=2 8544 B14R1.3135 NCc1ccccc1CC(N)C(=O)O Amb33330213 [0,2,0,0,0,0|0,0,0]=2 8545 B14R1.3135 NCc1ccccc1C[C@@H](N)C(=O)O Amb8397032 [0,2,0,0,0,0|0,0,0]=2 8546 B14R1.5882 CC(Br)(Cc1ccccc1Cl)C(=O)O Amb27466191 [0,2,0,0,0,0|1,0,0]=3 8547 B14R1.5882 CC(Br)(Cc1ccccc1F)C(=O)O Amb26481830 [0,2,0,0,0,0|1,0,0]=3 8548 B14R1.5882 CC(C)(CN1C=CC=CC1=O)C(=O)O Amb18535445 [0,2,0,0,0,0|2,0,0]=4 8549 B14R1.5882 CC(C)(Cc1ccccc1Br)C(=O)O Amb18586155 [0,2,0,0,0,0|1,0,0]=3 8550 B14R1.5882 CC(C)(Cc1ccccc1Cl)C(=O)O Amb17241246 [0,2,0,0,0,0|1,0,0]=3 8551 B14R1.5882 CC(C)(Cc1ccccc1F)C(=O)O Amb17236374 [0,2,0,0,0,0|1,0,0]=3 8552 B14R1.5882 CC(C)(Cc1ccccc1O)C(=O)O Amb33196412 [0,2,0,0,0,0|1,0,0]=3 8553 B14R1.5882 CC(C)(Cc1cccnc1Br)C(=O)O Amb33387785 [0,2,0,0,0,0|2,0,0]=4 8554 B14R1.5882 CC(C)(Cc1cccnc1Cl)C(=O)O Amb33257346 [0,2,0,0,0,0|2,0,0]=4 8555 B14R1.5882 CC(C)(Cc1cccnc1F)C(=O)O Amb33224052 [0,2,0,0,0,0|2,0,0]=4 8556 B14R1.5882 CC(C)(Cc1ccncc1Br)C(=O)O Amb33227497 [0,2,0,0,0,0|2,0,0]=4 8557 B14R1.5882 CC(C)(Cc1ccncc1Cl)C(=O)O Amb27773242 [0,2,0,0,0,0|2,0,0]=4 8558 B14R1.5882 CC(C)(Cc1ccncc1F)C(=O)O Amb33317558 [0,2,0,0,0,0|2,0,0]=4 8559 B14R1.5882 CC(C)(Cc1ncccc1Br)C(=O)O Amb26508649 [0,2,0,0,0,0|2,0,0]=4 8560 B14R1.5882 CC(C)(Cc1ncccc1F)C(=O)O Amb33419639 [0,2,0,0,0,0|2,0,0]=4 8561 B14R1.5882 CC(C)(Nc1ccccc1Br)C(=O)O Amb840755 [0,2,0,0,0,0|2,0,0]=4 8562 B14R1.5882 CC(C)(Nc1ccccc1Cl)C(=O)O Amb9702182 [0,2,0,0,0,0|2,0,0]=4 8563 B14R1.5882 CC(C)(Nc1ccccc1F)C(=O)O Amb840750 [0,2,0,0,0,0|2,0,0]=4 8564 B14R1.5882 CC(C)(Oc1ccccc1Br)C(=O)O Amb5764093 [0,2,0,0,0,0|2,0,0]=4 8565 B14R1.5882 CC(C)(Oc1ccccc1Cl)C(=O)O Amb6336378 [0,2,0,0,0,0|2,0,0]=4 8566 B14R1.5882 CC(C)(Oc1ccccc1F)C(=O)O Amb840734 [0,2,0,0,0,0|2,0,0]=4 8567 B14R1.5882 CC(C)(Sc1ccccc1N)C(=O)O Amb18976866 [0,2,0,0,0,0|2,0,0]=4 8568 B14R1.5882 CC(C)(Sc1ccccc1O)C(=O)O Amb18984796 [0,2,0,0,0,0|2,0,0]=4 8569 B14R1.5882 CC(Cl)(Cc1ccccc1Br)C(=O)O Amb27650183 [0,2,0,0,0,0|1,0,0]=3 8570 B14R1.5882 CC(Cl)(Cc1ccccc1Cl)C(=O)O Amb26040012 [0,2,0,0,0,0|1,0,0]=3 8571 B14R1.5882 CC(Cl)(Cc1ccccc1F)C(=O)O Amb26407368 [0,2,0,0,0,0|1,0,0]=3 8572 B14R1.5882 CC(F)(Cc1ccccc1Cl)C(=O)O Amb27186045 [0,2,0,0,0,0|1,0,0]=3 8573 B14R1.5882 CC(N)(Cc1ccccc1Br)C(=O)O Amb27167978 [0,2,0,0,0,0|0,0,0]=2 8574 B14R1.5882 CC(N)(Cc1ccccc1Cl)C(=O)O Amb17241538 [0,2,0,0,0,0|0,0,0]=2 8575 B14R1.5882 CC(N)(Cc1ccccc1F)C(=O)O Amb17236543 [0,2,0,0,0,0|0,0,0]=2 8576 B14R1.5882 CC(N)(Cc1ccccc1F)C(N)=O Amb27754863 [0,2,0,0,0,0|1,0,0]=3 8577 B14R1.5882 CC(N)(Cc1cccnc1O)C(=O)O Amb28144237 [0,2,0,0,0,0|1,0,0]=3 8578 B14R1.5882 CC(N)(Cc1cnccc1Cl)C(=O)O Amb27171481 [0,2,0,0,0,0|1,0,0]=3 8579 B14R1.5882 CC(N)(Cc1cnccc1N)C(=O)O Amb27951813 [0,2,0,0,0,0|1,0,0]=3 8580 B14R1.5882 CC(N)(Cc1ncccc1Cl)C(=O)O Amb28204159 [0,2,0,0,0,0|1,0,0]=3 8581 B14R1.5882 CC(O)(CN1C=CC=CC1=O)C(=O)O Amb23596488 [0,2,0,0,0,0|2,0,0]=4 8582 B14R1.5882 CC(O)(Cc1ccccc1Br)C(=O)O Amb25770677 [0,2,0,0,0,0|1,0,0]=3 8583 B14R1.5882 CC(O)(Cc1ccccc1Cl)C(=O)O Amb26559814 [0,2,0,0,0,0|1,0,0]=3 8584 B14R1.5882 CC(O)(Cc1ccccc1F)C(=O)O Amb8010920 [0,2,0,0,0,0|1,0,0]=3 8585 B14R1.5882 CC(O)(Cc1ccccc1O)C(=O)O Amb26891750 [0,2,0,0,0,0|1,0,0]=3 8586 B14R1.5882 CC(O)(Cc1cccnc1Br)C(=O)O Amb33387854 [0,2,0,0,0,0|2,0,0]=4 8587 B14R1.5882 CC(O)(Cc1cccnc1Cl)C(=O)O Amb33257369 [0,2,0,0,0,0|2,0,0]=4 8588 B14R1.5882 CC(O)(Cc1cccnc1F)C(=O)O Amb33377166 [0,2,0,0,0,0|2,0,0]=4 8589 B14R1.5882 CC(O)(Cc1ccncc1Br)C(=O)O Amb33388648 [0,2,0,0,0,0|2,0,0]=4 8590 B14R1.5882 CC(O)(Cc1ccncc1Cl)C(=O)O Amb33413773 [0,2,0,0,0,0|2,0,0]=4 8591 B14R1.5882 CC(O)(Cc1ccncc1F)C(=O)O Amb33316842 [0,2,0,0,0,0|2,0,0]=4 8592 B14R1.5882 CC(O)(Cc1ncccc1Br)C(=O)O Amb33336114 [0,2,0,0,0,0|2,0,0]=4 8593 B14R1.5882 CC(O)(Cc1ncccc1F)C(=O)O Amb33418432 [0,2,0,0,0,0|2,0,0]=4 8594 B14R1.5882 C[C@@](N)(Cc1ccccc1Br)C(=O)O Amb8630499 [0,2,0,0,0,0|0,0,0]=2 8595 B14R1.5882 C[C@@](N)(Cc1ccccc1Cl)C(=O)O Amb27952554 [0,2,0,0,0,0|0,0,0]=2 8596 B14R1.5882 C[C@@](N)(Cc1ccccc1I)C(=O)O Amb8630500 [0,2,0,0,0,0|0,0,0]=2 8597 B14R1.5882 C[C@](N)(Cc1ccccc1Br)C(=O)O Amb10066902 [0,2,0,0,0,0|0,0,0]=2 8598 B14R1.5882 C[C@](N)(Cc1ccccc1I)C(=O)O Amb10066903 [0,2,0,0,0,0|0,0,0]=2 8599 B14R1.5882 C[C@](O)(Cc1ccccc1Br)C(=O)O Amb28398186 [0,2,0,0,0,0|1,0,0]=3 8600 B14R1.5882 Cc1ccccc1CC(C)(Br)C(=O)O Amb28318460 [0,2,0,0,0,0|1,0,0]=3 8601 B14R1.5882 Cc1ccccc1CC(C)(C)C(=O)O Amb17235386 [0,2,0,0,0,0|1,0,0]=3 8602 B14R1.5882 Cc1ccccc1CC(C)(Cl)C(=O)O Amb27190001 [0,2,0,0,0,0|1,0,0]=3 8603 B14R1.5882 Cc1ccccc1CC(C)(F)C(=O)O Amb27782127 [0,2,0,0,0,0|1,0,0]=3 8604 B14R1.5882 Cc1ccccc1CC(C)(N)C(=O)O Amb17235614 [0,2,0,0,0,0|0,0,0]=2 8605 B14R1.5882 Cc1ccccc1CC(C)(O)C(=O)O Amb25683429 [0,2,0,0,0,0|1,0,0]=3 8606 B14R1.5882 Cc1ccccc1CC(F)(F)C(=O)O Amb33170782 [0,2,0,0,0,0|1,0,0]=3 8607 B14R1.5882 Cc1ccccc1C[C@@](C)(O)C(=O)O Amb28067639 [0,2,0,0,0,0|1,0,0]=3 8608 B14R1.5882 Cc1ccccc1C[C@](C)(N)C(=O)O Amb28241436 [0,2,0,0,0,0|0,0,0]=2 8609 B14R1.5882 Cc1ccccc1NC(C)(C)C(=O)O Amb2689746 [0,2,0,0,0,0|2,0,0]=4 8610 B14R1.5882 Cc1ccccc1OC(C)(C)C(=O)O Amb6356917 [0,2,0,0,0,0|2,0,0]=4 8611 B14R1.5882 Cc1ccccc1SC(C)(C)C(=O)O Amb5775235 [0,2,0,0,0,0|2,0,0]=4 8612 B14R1.5882 Cc1cccnc1CC(C)(C)C(=O)O Amb25127105 [0,2,0,0,0,0|2,0,0]=4 8613 B14R1.5882 Cc1cccnc1CC(C)(N)C(=O)O Amb27620981 [0,2,0,0,0,0|1,0,0]=3 8614 B14R1.5882 Cc1cccnc1CC(C)(O)C(=O)O Amb33360242 [0,2,0,0,0,0|2,0,0]=4 8615 B14R1.5882 Cc1cccnc1CC(F)(F)C(=O)O Amb32814283 [0,2,0,0,0,0|2,0,0]=4 8616 B14R1.5882 Cc1ccncc1CC(C)(C)C(=O)O Amb33376743 [0,2,0,0,0,0|2,0,0]=4 8617 B14R1.5882 Cc1ccncc1CC(C)(O)C(=O)O Amb33376651 [0,2,0,0,0,0|2,0,0]=4 8618 B14R1.5882 Cc1ccncc1CC(F)(F)C(=O)O Amb33170789 [0,2,0,0,0,0|2,0,0]=4 8619 B14R1.5882 Cc1cnccc1CC(C)(C)C(=O)O Amb33415535 [0,2,0,0,0,0|2,0,0]=4 8620 B14R1.5882 Cc1cnccc1CC(C)(N)C(=O)O Amb28118523 [0,2,0,0,0,0|1,0,0]=3 8621 B14R1.5882 Cc1cnccc1CC(C)(O)C(=O)O Amb33426444 [0,2,0,0,0,0|2,0,0]=4 8622 B14R1.5882 Cc1cnccc1CC(F)(F)C(=O)O Amb33170975 [0,2,0,0,0,0|2,0,0]=4 8623 B14R1.5882 Cc1ncccc1CC(C)(C)C(=O)O Amb24461821 [0,2,0,0,0,0|2,0,0]=4 8624 B14R1.5882 Cc1ncccc1CC(C)(O)C(=O)O Amb32878597 [0,2,0,0,0,0|2,0,0]=4 8625 B14R1.5882 Cc1ncccc1CC(F)(F)C(=O)O Amb33170977 [0,2,0,0,0,0|2,0,0]=4 8626 B14R1.5882 Nc1ccccc1OC(F)(F)C(=O)O Amb27395233 [0,2,0,0,0,0|2,0,0]=4 8627 B14R1.5882 Nc1ccccc1SC(F)(F)C(=O)O Amb27776055 [0,2,0,0,0,0|2,0,0]=4 8628 B14R1.5882 O=C(O)C(F)(F)Cc1ccccc1Br Amb32814241 [0,2,0,0,0,0|1,0,0]=3 8629 B14R1.5882 O=C(O)C(F)(F)Cc1ccccc1Cl Amb33170804 [0,2,0,0,0,0|1,0,0]=3 8630 B14R1.5882 O=C(O)C(F)(F)Cc1ccccc1F Amb26555007 [0,2,0,0,0,0|1,0,0]=3 8631 B14R1.5882 O=C(O)C(F)(F)Cc1ccccc1O Amb28410484 [0,2,0,0,0,0|1,0,0]=3 8632 B14R1.5882 O=C(O)C(F)(F)Cc1cccnc1Br Amb33400863 [0,2,0,0,0,0|2,0,0]=4 8633 B14R1.5882 O=C(O)C(F)(F)Cc1cccnc1Cl Amb32813729 [0,2,0,0,0,0|2,0,0]=4 8634 B14R1.5882 O=C(O)C(F)(F)Cc1cccnc1F Amb32812246 [0,2,0,0,0,0|2,0,0]=4 8635 B14R1.5882 O=C(O)C(F)(F)Cc1ccncc1Br Amb32813705 [0,2,0,0,0,0|2,0,0]=4 8636 B14R1.5882 O=C(O)C(F)(F)Cc1ccncc1Cl Amb32806795 [0,2,0,0,0,0|2,0,0]=4 8637 B14R1.5882 O=C(O)C(F)(F)Cc1ccncc1F Amb33170801 [0,2,0,0,0,0|2,0,0]=4 8638 B14R1.5882 O=C(O)C(F)(F)Cc1ncccc1Br Amb32745880 [0,2,0,0,0,0|2,0,0]=4 8639 B14R1.5882 O=C(O)C(F)(F)Cc1ncccc1F Amb32745021 [0,2,0,0,0,0|2,0,0]=4 8640 B14R1.5882 O=C(O)C(F)(F)Oc1ccccc1I Amb9516826 [0,2,0,0,0,0|2,0,0]=4 8641 B14R1.5882 O=C(O)C(F)(F)Sc1ccccc1F Amb27198200 [0,2,0,0,0,0|2,0,0]=4 8642 B14R1.5882 O=C1C=CC=CN1CC(F)(F)C(=O)O Amb33170352 [0,2,0,0,0,0|2,0,0]=4 8643 B14R1.5971 C=C(C)C(N)Cc1c(Cl)cccc1Cl Amb28348867 [0,2,0,0,0,0|2,0,0]=4 8644 B14R1.5971 CC(=O)C(Br)Cc1c(C)cccc1Br Amb29864767 [0,2,0,0,0,0|2,0,0]=4 8645 B14R1.5971 CC(=O)C(Br)Cc1c(F)cccc1Cl Amb27655443 [0,2,0,0,0,0|2,0,0]=4 8646 B14R1.5971 CC(=O)C(Br)Cc1c(F)cccc1F Amb25732849 [0,2,0,0,0,0|2,0,0]=4 8647 B14R1.5971 CC(=O)C(C)Cc1c(Cl)cccc1Cl Amb27435495 [0,2,0,0,0,0|2,0,0]=4 8648 B14R1.5971 CC(=O)C(C)Cc1c(F)cccc1Cl Amb17241804 [0,2,0,0,0,0|2,0,0]=4 8649 B14R1.5971 CC(Cc1c(Cl)cccc1Br)C(=O)O Amb24659007 [0,2,0,0,0,0|1,0,0]=3 8650 B14R1.5971 CC(Cc1c(Cl)cncc1Cl)C(=O)O Amb33260963 [0,2,0,0,0,0|2,0,0]=4 8651 B14R1.5971 CC(Cc1c(F)cccc1Br)C(=O)O Amb26861544 [0,2,0,0,0,0|1,0,0]=3 8652 B14R1.5971 CC(Cc1c(F)cccc1Cl)C(=O)O Amb5744023 [0,2,0,0,0,0|1,0,0]=3 8653 B14R1.5971 CC(Cc1c(F)cccc1F)C(=O)Cl Amb27946706 [0,2,0,0,0,0|2,0,0]=4 8654 B14R1.5971 CC(Cc1c(F)cccc1F)C(=O)O Amb26055884 [0,2,0,0,0,0|1,0,0]=3 8655 B14R1.5971 CC(Cc1c(F)cncc1F)C(=O)O Amb32881777 [0,2,0,0,0,0|2,0,0]=4 8656 B14R1.5971 CC(Cc1c(N)cccc1F)C(=O)O Amb27791115 [0,2,0,0,0,0|1,0,0]=3 8657 B14R1.5971 CC(Cc1c(O)cccc1Br)C(=O)O Amb33331546 [0,2,0,0,0,0|1,0,0]=3 8658 B14R1.5971 CC(Cc1c(O)cccc1Cl)C(=O)O Amb33261919 [0,2,0,0,0,0|1,0,0]=3 8659 B14R1.5971 CC(Nc1c(Br)cccc1Br)C(=O)O Amb27168770 [0,2,0,0,0,0|2,0,0]=4 8660 B14R1.5971 CC(Nc1c(F)cccc1F)C(=O)O Amb17402394 [0,2,0,0,0,0|2,0,0]=4 8661 B14R1.5971 CC(Sc1c(Cl)cccc1Cl)C(=O)O Amb1118013 [0,2,0,0,0,0|2,0,0]=4 8662 B14R1.5971 CC(Sc1c(N)cccc1Cl)C(=O)O Amb18292854 [0,2,0,0,0,0|2,0,0]=4 8663 B14R1.5971 CC1=CC=CC(=O)N1CC(C)C(=O)O Amb18302655 [0,2,0,0,0,0|2,0,0]=4 8664 B14R1.5971 CC1=CC=CC(=O)N1CC(Cl)C(=O)O Amb27168767 [0,2,0,0,0,0|2,0,0]=4 8665 B14R1.5971 Cc1cccc(Br)c1CC(Br)C(N)=O Amb29864768 [0,2,0,0,0,0|2,0,0]=4 8666 B14R1.5971 Cc1cccc(Br)c1NC(C)C(=O)O Amb35706803 [0,2,0,0,0,0|2,0,0]=4 8667 B14R1.5971 Cc1cccc(C)c1CC(=O)C(=O)O Amb27459241 [0,2,0,0,0,0|1,0,1]=4 8668 B14R1.5971 Cc1cccc(C)c1CC(Br)C(=O)O Amb23320607 [0,2,0,0,0,0|1,0,0]=3 8669 B14R1.5971 Cc1cccc(C)c1CC(C)C(=O)O Amb24429140 [0,2,0,0,0,0|1,0,0]=3 8670 B14R1.5971 Cc1cccc(C)c1CC(Cl)C(=O)O Amb27218514 [0,2,0,0,0,0|1,0,0]=3 8671 B14R1.5971 Cc1cccc(C)c1CC(N)C(=O)O Amb3788509 [0,2,0,0,0,0|0,0,0]=2 8672 B14R1.5971 Cc1cccc(C)c1CC(N)C(N)=O Amb27413569 [0,2,0,0,0,0|1,0,0]=3 8673 B14R1.5971 Cc1cccc(C)c1CC(O)C(=O)O Amb24731706 [0,2,0,0,0,0|1,0,0]=3 8674 B14R1.5971 Cc1cccc(C)c1CC(S)C(=O)O Amb27971881 [0,2,0,0,0,0|1,0,0]=3 8675 B14R1.5971 Cc1cccc(C)c1C[C@H](N)C(=O)O Amb24062379 [0,2,0,0,0,0|0,0,0]=2 8676 B14R1.5971 Cc1cccc(C)c1C[C@H](N)C(N)=O Amb27236853 [0,2,0,0,0,0|1,0,0]=3 8677 B14R1.5971 Cc1cccc(C)c1NC(C)C(=O)O Amb8589906 [0,2,0,0,0,0|2,0,0]=4 8678 B14R1.5971 Cc1cccc(C)c1OC(C)C(=O)O Amb6357061 [0,2,0,0,0,0|2,0,0]=4 8679 B14R1.5971 Cc1cccc(Cl)c1CC(=O)C(=O)O Amb33259452 [0,2,0,0,0,0|1,0,1]=4 8680 B14R1.5971 Cc1cccc(Cl)c1CC(C)C(=O)O Amb33259409 [0,2,0,0,0,0|1,0,0]=3 8681 B14R1.5971 Cc1cccc(Cl)c1CC(N)C(=O)O Amb27586826 [0,2,0,0,0,0|0,0,0]=2 8682 B14R1.5971 Cc1cccc(Cl)c1CC(O)C(=O)O Amb33259410 [0,2,0,0,0,0|1,0,0]=3 8683 B14R1.5971 Cc1cccc(Cl)c1C[C@H](N)C(=O)O Amb28254244 [0,2,0,0,0,0|0,0,0]=2 8684 B14R1.5971 Cc1cccc(Cl)c1OC(C)C(=O)O Amb25844001 [0,2,0,0,0,0|2,0,0]=4 8685 B14R1.5971 Cc1cccc(F)c1CC(=O)C(=O)O Amb33273567 [0,2,0,0,0,0|1,0,1]=4 8686 B14R1.5971 Cc1cccc(F)c1CC(C)C(=O)O Amb25228030 [0,2,0,0,0,0|1,0,0]=3 8687 B14R1.5971 Cc1cccc(F)c1CC(N)C(=O)O Amb24426809 [0,2,0,0,0,0|0,0,0]=2 8688 B14R1.5971 Cc1cccc(F)c1CC(O)C(=O)O Amb33273509 [0,2,0,0,0,0|1,0,0]=3 8689 B14R1.5971 Cc1ccnc(Br)c1CC(N)C(=O)O Amb27476341 [0,2,0,0,0,0|1,0,0]=3 8690 B14R1.5971 Cc1ccnc(Br)c1C[C@@H](N)C(=O)O Amb27392076 [0,2,0,0,0,0|1,0,0]=3 8691 B14R1.5971 Cc1ccnc(N)c1CC(C)C(=O)O Amb27971549 [0,2,0,0,0,0|2,0,0]=4 8692 B14R1.5971 NC(=O)C(Br)Cc1c(Br)cccc1Br Amb27883603 [0,2,0,0,0,0|2,0,0]=4 8693 B14R1.5971 NC(=O)C(N)Cc1c(F)cccc1F Amb27494483 [0,2,0,0,0,0|1,0,0]=3 8694 B14R1.5971 NC(CN1C(=O)C=CNC1=O)C(=O)O Amb27773803 [0,2,0,0,0,0|2,0,0]=4 8695 B14R1.5971 NC(Cc1c(Cl)cccc1Br)C(=O)O Amb26043864 [0,2,0,0,0,0|0,0,0]=2 8696 B14R1.5971 NC(Cc1c(Cl)cccc1Cl)C(=O)O Amb3790207 [0,2,0,0,0,0|0,0,0]=2 8697 B14R1.5971 NC(Cc1c(Cl)cncc1Cl)C(=O)O Amb26899759 [0,2,0,0,0,0|1,0,0]=3 8698 B14R1.5971 NC(Cc1c(Cl)cncc1Cl)C(=O)O Amb33299495 [0,2,0,0,0,0|1,0,0]=3 8699 B14R1.5971 NC(Cc1c(Cl)ncnc1Cl)C(=O)O Amb33262288 [0,2,0,0,0,0|2,0,0]=4 8700 B14R1.5971 NC(Cc1c(F)cccc1Br)C(=O)O Amb26645147 [0,2,0,0,0,0|0,0,0]=2 8701 B14R1.5971 NC(Cc1c(F)cccc1Cl)C(=O)O Amb3789314 [0,2,0,0,0,0|0,0,0]=2 8702 B14R1.5971 NC(Cc1c(F)cccc1F)C(=O)O Amb9725617 [0,2,0,0,0,0|0,0,0]=2 8703 B14R1.5971 NC(Cc1c(F)cncc1F)C(=O)O Amb27419681 [0,2,0,0,0,0|1,0,0]=3 8704 B14R1.5971 NC(Cc1c(F)cncc1F)C(=O)O Amb33733600 [0,2,0,0,0,0|1,0,0]=3 8705 B14R1.5971 NC(Cc1c(O)cccc1Br)C(=O)O Amb18668186 [0,2,0,0,0,0|0,0,0]=2 8706 B14R1.5971 NC(Cc1c(O)cccc1Cl)C(=O)O Amb27873041 [0,2,0,0,0,0|0,0,0]=2 8707 B14R1.5971 NC(Cc1c(O)cccc1F)C(=O)O Amb27793287 [0,2,0,0,0,0|0,0,0]=2 8708 B14R1.5971 NC(Cc1c(O)cccc1O)C(=O)O Amb22228380 [0,2,0,0,0,0|0,0,0]=2 8709 B14R1.5971 N[C@@H](Cc1c(Br)cccc1Br)C(=O)O Amb27418263 [0,2,0,0,0,0|0,0,0]=2 8710 B14R1.5971 N[C@@H](Cc1c(Br)cncc1Br)C(=O)O Amb27491305 [0,2,0,0,0,0|1,0,0]=3 8711 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1Cl)C(=O)O Amb22228372 [0,2,0,0,0,0|0,0,0]=2 8712 B14R1.5971 N[C@@H](Cc1c(Cl)cncc1Cl)C(=O)O Amb28323128 [0,2,0,0,0,0|1,0,0]=3 8713 B14R1.5971 N[C@@H](Cc1c(F)cccc1F)C(=O)O Amb19889726 [0,2,0,0,0,0|0,0,0]=2 8714 B14R1.5971 N[C@@H](Cc1c(F)cccc1F)C(=O)O Amb6295999 [0,2,0,0,0,0|0,0,0]=2 8715 B14R1.5971 N[C@@H](Cc1c(F)cccc1I)C(=O)O Amb27830535 [0,2,0,0,0,0|0,0,0]=2 8716 B14R1.5971 N[C@H](Cc1c(Br)cccc1Br)C(=O)O Amb27950143 [0,2,0,0,0,0|0,0,0]=2 8717 B14R1.5971 N[C@H](Cc1c(Cl)cccc1Cl)C(=O)O Amb22228371 [0,2,0,0,0,0|0,0,0]=2 8718 B14R1.5971 N[C@H](Cc1c(F)cccc1F)C(=O)O Amb19887663 [0,2,0,0,0,0|0,0,0]=2 8719 B14R1.5971 N[C@H](Cc1c(O)cccc1F)C(=O)O Amb27264654 [0,2,0,0,0,0|0,0,0]=2 8720 B14R1.5971 Nc1cccc(Cl)c1SC(F)C(=O)O Amb27880199 [0,2,0,0,0,0|2,0,0]=4 8721 B14R1.5971 O=C(O)C(=O)Cc1c(Cl)cccc1Br Amb33337601 [0,2,0,0,0,0|1,0,1]=4 8722 B14R1.5971 O=C(O)C(=O)Cc1c(Cl)cccc1Cl Amb17477772 [0,2,0,0,0,0|1,0,1]=4 8723 B14R1.5971 O=C(O)C(=O)Cc1c(F)cccc1Br Amb24565546 [0,2,0,0,0,0|1,0,1]=4 8724 B14R1.5971 O=C(O)C(=O)Cc1c(F)cccc1Cl Amb1134065 [0,2,0,0,0,0|1,0,1]=4 8725 B14R1.5971 O=C(O)C(=O)Cc1c(F)cccc1F Amb1128545 [0,2,0,0,0,0|1,0,1]=4 8726 B14R1.5971 O=C(O)C(=O)Cc1c(O)cccc1Br Amb33331551 [0,2,0,0,0,0|1,0,1]=4 8727 B14R1.5971 O=C(O)C(=O)Cc1c(O)cccc1Cl Amb33260761 [0,2,0,0,0,0|1,0,1]=4 8728 B14R1.5971 O=C(O)C(F)Cc1c(F)cccc1Br Amb27787381 [0,2,0,0,0,0|1,0,0]=3 8729 B14R1.5971 O=C(O)C(F)Cc1c(F)cccc1F Amb27165902 [0,2,0,0,0,0|1,0,0]=3 8730 B14R1.5971 O=C(O)C(F)Oc1c(F)cccc1F Amb27833994 [0,2,0,0,0,0|2,0,0]=4 8731 B14R1.5971 O=C(O)C(F)Sc1c(Cl)cccc1Cl Amb27167406 [0,2,0,0,0,0|2,0,0]=4 8732 B14R1.5971 O=C(O)C(O)Cc1c(Br)cncc1Br Amb33353400 [0,2,0,0,0,0|2,0,0]=4 8733 B14R1.5971 O=C(O)C(O)Cc1c(Cl)cccc1Br Amb33337605 [0,2,0,0,0,0|1,0,0]=3 8734 B14R1.5971 O=C(O)C(O)Cc1c(Cl)cccc1Cl Amb27586757 [0,2,0,0,0,0|1,0,0]=3 8735 B14R1.5971 O=C(O)C(O)Cc1c(Cl)cncc1Cl Amb33260949 [0,2,0,0,0,0|2,0,0]=4 8736 B14R1.5971 O=C(O)C(O)Cc1c(F)cccc1Br Amb33353412 [0,2,0,0,0,0|1,0,0]=3 8737 B14R1.5971 O=C(O)C(O)Cc1c(F)cccc1Cl Amb33549428 [0,2,0,0,0,0|1,0,0]=3 8738 B14R1.5971 O=C(O)C(O)Cc1c(F)cccc1F Amb24459613 [0,2,0,0,0,0|1,0,0]=3 8739 B14R1.5971 O=C(O)C(O)Cc1c(F)cncc1F Amb33353405 [0,2,0,0,0,0|2,0,0]=4 8740 B14R1.5971 O=C(O)C(O)Cc1c(O)cccc1Br Amb33431122 [0,2,0,0,0,0|1,0,0]=3 8741 B14R1.5971 O=C(O)C(O)Cc1c(O)cccc1Cl Amb33260694 [0,2,0,0,0,0|1,0,0]=3 8742 B14R1.548 CS(=O)(=O)C(CN)Cc1ccccc1 Amb18171708 [0,2,0,0,0,0|1,0,1]=4 8743 B14R1.980 C=CCC(Cc1ccccc1)C(=O)O Amb18650552 [0,2,0,0,0,0|1,0,0]=3 8744 B14R1.980 CC(=O)N(CCN)Cc1ccccc1 Amb17047258 [0,2,0,0,0,0|2,0,0]=4 8745 B14R1.980 CCC[C@@H](Nc1ccccc1)C(=O)O Amb33347514 [0,2,0,0,0,0|2,0,0]=4 8746 B14R1.980 CCC[C@H](Nc1ccccc1)C(=O)O Amb33347516 [0,2,0,0,0,0|2,0,0]=4 8747 B14R1.980 CCNC(Cc1ccccc1)C(=O)O Amb9620010 [0,2,0,0,0,0|0,0,0]=2 8748 B14R1.980 CCN[C@@H](Cc1ccccc1)C(=O)O Amb33347489 [0,2,0,0,0,0|0,0,0]=2 8749 B14R1.980 CCN[C@H](Cc1ccccc1)C(=O)O Amb33347484 [0,2,0,0,0,0|0,0,0]=2 8750 B14R1.980 COC[C@@H](Nc1ccccc1)C(=O)O Amb33347521 [0,2,0,0,0,0|2,0,0]=4 8751 B14R1.980 NCCC(Cc1ccccc1)C(=O)O Amb22371119 [0,2,0,0,0,0|0,0,0]=2 8752 B14R1.980 O=C(O)C(Cc1ccccc1)N=C=S Amb33471519 [0,2,0,0,0,0|0,0,1]=3 8753 B14R1.980 O=C(O)[C@@H](Cc1ccccc1)N=C=S Amb33471571 [0,2,0,0,0,0|0,0,1]=3 8754 B14R1.980 O=C(O)[C@H](Cc1ccccc1)N=C=S Amb33471565 [0,2,0,0,0,0|0,0,1]=3 8755 B14R1.980 O=C=NC(Cc1ccccc1)C(=O)O Amb33249718 [0,2,0,0,0,0|0,0,1]=3 8756 B14R1.980 O=C=N[C@@H](Cc1ccccc1)C(=O)O Amb33471335 [0,2,0,0,0,0|0,0,1]=3 8757 B14R1.980 O=C=N[C@H](Cc1ccccc1)C(=O)O Amb33471342 [0,2,0,0,0,0|0,0,1]=3 8758 B14R1.980 O=CNC(Cc1ccccc1)C(=O)O Amb2775438 [0,2,0,0,0,0|0,0,0]=2 8759 B14R1.980 O=CN[C@H](Cc1ccccc1)C(=O)O Amb19050931 [0,2,0,0,0,0|0,0,0]=2 8760 B14R1.980 [N-]=[N+]=NC(Cc1ccccc1)C(N)=O Amb32718782 [0,2,0,0,0,0|1,0,1]=4 8761 B14R1.980 [N-]=[N+]=N[C@@H](Cc1ccccc1)C(=O)O Amb32620177 [0,2,0,0,0,0|0,0,1]=3 8762 B14R1.980 [N-]=[N+]=N[C@H](Cc1ccccc1)C(=O)O Amb32620180 [0,2,0,0,0,0|0,0,1]=3 8763 B14R1.4513 CC(=O)C(Cc1ccccc1)C(C)=O Amb17778962 [0,2,0,0,0,0|2,0,0]=4 8764 B14R1.4513 CC(=O)\C(Cc1ccccc1)=C(\C)N Amb28381438 [0,2,0,0,0,0|1,0,1]=4 8765 B14R1.4513 CC(C)C(Cc1ccccc1)C(=O)O Amb33537109 [0,2,0,0,0,0|1,0,0]=3 8766 B14R1.4513 CC(C)C(Cc1cccnc1)C(=O)O Amb17235613 [0,2,0,0,0,0|2,0,0]=4 8767 B14R1.4513 CC(C)C(Nc1ccccc1)C(=O)O Amb17401789 [0,2,0,0,0,0|2,0,0]=4 8768 B14R1.4513 CC(C)C(Oc1ccccc1)C(=O)O Amb9716249 [0,2,0,0,0,0|2,0,0]=4 8769 B14R1.4513 CC(C)C(Sc1ccccc1)C(=O)O Amb9717008 [0,2,0,0,0,0|2,0,0]=4 8770 B14R1.4513 CC(C)[C@@H](Nc1ccccc1)C(=O)O Amb26630811 [0,2,0,0,0,0|2,0,0]=4 8771 B14R1.4513 CC(C)[C@H](Nc1ccccc1)C(=O)O Amb26493296 [0,2,0,0,0,0|2,0,0]=4 8772 B14R1.4513 CN(C)C(Cc1ccccc1)C(=O)O Amb9283593 [0,2,0,0,0,0|0,0,0]=2 8773 B14R1.4513 CN(C)C(Cc1cccnc1)C(=O)O Amb17235922 [0,2,0,0,0,0|1,0,0]=3 8774 B14R1.4513 CN(C)[C@@H](Cc1ccccc1)C(=O)O Amb3940798 [0,2,0,0,0,0|0,0,0]=2 8775 B14R1.4513 CN(C)[C@@H](Cc1ccccn1)C(=O)O Amb30527599 [0,2,0,0,0,0|1,0,0]=3 8776 B14R1.4513 CN(C)[C@H](Cc1ccccc1)C(=O)O Amb31291426 [0,2,0,0,0,0|0,0,0]=2 8777 B14R1.4513 C[C@@H](O)[C@H](Nc1ccccc1)C(=O)O Amb27953213 [0,2,0,0,0,0|2,0,0]=4 8778 B14R1.4513 O=C(O)C(Cc1ccccc1)C(=O)O Amb6356423 [0,2,0,0,0,0|1,0,0]=3 8779 B14R1.4513 O=C(O)C(Nc1ccccc1)C(=O)O Amb24106401 [0,2,0,0,0,0|2,0,0]=4 8780 B14R1.8844 C#CC(N)(Cc1ccccc1)C(=O)O Amb27650677 [0,2,0,0,0,0|0,0,0]=2 8781 B14R1.8844 CC(=O)C(C)(C#N)Cc1ccccc1 Amb27387044 [0,2,0,0,0,0|1,0,1]=4 8782 B14R1.8844 CC(C#N)(Cc1ccccc1)C(=O)O Amb4007831 [0,2,0,0,0,0|0,0,1]=3 8783 B14R1.8844 CC(C#N)(Cc1ccccc1)C(N)=O Amb4011098 [0,2,0,0,0,0|1,0,1]=4 8784 B14R1.8844 CC(CN)(Cc1ccccc1)C(=O)O Amb5744278 [0,2,0,0,0,0|0,0,0]=2 8785 B14R1.8844 CC(CN)(Cc1ccccn1)C(=O)O Amb5744275 [0,2,0,0,0,0|1,0,0]=3 8786 B14R1.8844 CC(CN)(Cc1cccnc1)C(=O)O Amb5744276 [0,2,0,0,0,0|1,0,0]=3 8787 B14R1.8844 CC(CN)(Cc1ccncc1)C(=O)O Amb28653231 [0,2,0,0,0,0|1,0,0]=3 8788 B14R1.8844 CC(CN)(Cc1ccncc1)C(=O)O Amb5744277 [0,2,0,0,0,0|1,0,0]=3 8789 B14R1.8844 CC(CO)(Nc1ccccc1)C(=O)O Amb27442377 [0,2,0,0,0,0|2,0,0]=4 8790 B14R1.8844 CC(Cc1ccccc1)(NN)C(=O)O Amb17401882 [0,2,0,0,0,0|0,0,0]=2 8791 B14R1.8844 CC(Cc1ccccn1)(NN)C(=O)O Amb17402011 [0,2,0,0,0,0|1,0,0]=3 8792 B14R1.8844 CC(Cc1cccnc1)(NN)C(=O)O Amb17402012 [0,2,0,0,0,0|1,0,0]=3 8793 B14R1.8844 CC(Cc1ccncc1)(NN)C(=O)O Amb17402013 [0,2,0,0,0,0|1,0,0]=3 8794 B14R1.8844 CC(O)C(C)(CN)Cc1ccccc1 Amb33547986 [0,2,0,0,0,0|1,0,1]=4 8795 B14R1.8844 CNC(C)(Cc1ccccc1)C(=O)O Amb19036440 [0,2,0,0,0,0|0,0,0]=2 8796 B14R1.8844 C[C@@](C#N)(Cc1ccccc1)C(N)=O Amb27865498 [0,2,0,0,0,0|1,0,1]=4 8797 B14R1.8844 NC[C@@](N)(Cc1ccccc1)C(=O)O Amb34915982 [0,2,0,0,0,0|0,0,0]=2 8798 B12R1.279 N=C\C=C1/C=CNC(C(=O)O)C1 Amb27252183 [0,0,1,1,0,0|1,0,0]=3 8799 B12R1.264 NC(CCc1ccco1)C(=O)O Amb17470473 [0,0,1,1,0,0|1,0,1]=4 8800 B12R1.264 NC(CCc1cccs1)C(=O)O Amb17470676 [0,0,1,1,0,0|1,0,1]=4 8801 B12R1.264 NC(CCc1ccsc1)C(=O)O Amb32788699 [0,0,1,1,0,0|1,0,1]=4 8802 B12R1.264 N[C@@H](CCc1cccs1)C(=O)O Amb33065951 [0,0,1,1,0,0|1,0,1]=4 8803 B12R1.264 N[C@@H](CCc1ccsc1)C(=O)O Amb33065931 [0,0,1,1,0,0|1,0,1]=4 8804 B12R1.264 N[C@H](CCc1cccs1)C(=O)O Amb32864929 [0,0,1,1,0,0|1,0,1]=4 8805 B12R1.264 N[C@H](CCc1ccsc1)C(=O)O Amb33036520 [0,0,1,1,0,0|1,0,1]=4 8806 B12R1.2197 NC(C(=O)O)C1=CC=CCC=C1 Amb27400396 [0,0,1,1,0,0|0,0,2]=4 8807 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [1,0,0,1,0,0|1,0,1]=4 8808 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [1,0,0,1,0,0|1,0,0]=3 8809 B12R2.18 CC1Cc2ccccc2C1O Amb27228534 [1,0,0,1,0,0|1,0,1]=4 8810 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [1,0,0,1,0,0|2,0,0]=4 8811 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [1,0,0,1,0,0|2,0,0]=4 8812 B12R2.18 CC1c2ccccc2CC1N Amb18124847 [1,0,0,1,0,0|1,0,1]=4 8813 B12R2.18 CC1c2ccccc2CC1N Amb32666792 [1,0,0,1,0,0|1,0,1]=4 8814 B12R2.18 CN1Cc2ccccc2C1=O Amb4006345 [1,0,0,1,0,0|2,0,0]=4 8815 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1O Amb27663152 [1,0,0,1,0,0|1,0,1]=4 8816 B12R2.18 C[C@@H]1c2ccccc2C[C@H]1N Amb27817400 [1,0,0,1,0,0|1,0,1]=4 8817 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb28723654 [1,0,0,1,0,0|1,0,1]=4 8818 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb32666899 [1,0,0,1,0,0|1,0,1]=4 8819 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [1,0,0,1,0,0|0,0,0]=2 8820 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [1,0,0,1,0,0|0,0,0]=2 8821 B12R2.18 NC1Cc2ccccc2C1N Amb13953204 [1,0,0,1,0,0|1,0,1]=4 8822 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [1,0,0,1,0,0|0,0,1]=3 8823 B12R2.18 NC1Cc2ccccc2C1O Amb2383051 [1,0,0,1,0,0|0,0,1]=3 8824 B12R2.18 NC1Cc2cccnc2C1=O Amb25922720 [1,0,0,1,0,0|1,0,0]=3 8825 B12R2.18 NN1Cc2ccccc2C1=O Amb28652918 [1,0,0,1,0,0|1,0,0]=3 8826 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [1,0,0,1,0,0|0,0,1]=3 8827 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1F Amb27493415 [1,0,0,1,0,0|1,0,1]=4 8828 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb25911961 [1,0,0,1,0,0|1,0,1]=4 8829 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [1,0,0,1,0,0|0,0,1]=3 8830 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [1,0,0,1,0,0|0,0,1]=3 8831 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1N Amb27881687 [1,0,0,1,0,0|1,0,1]=4 8832 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [1,0,0,1,0,0|0,0,1]=3 8833 B12R2.18 N[C@H]1c2ccccc2C[C@H]1N Amb22745804 [1,0,0,1,0,0|1,0,1]=4 8834 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [1,0,0,1,0,0|1,0,1]=4 8835 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [1,0,0,1,0,0|1,0,0]=3 8836 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [1,0,0,1,0,0|1,0,0]=3 8837 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [1,0,0,1,0,0|1,0,0]=3 8838 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [1,0,0,1,0,0|1,0,0]=3 8839 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [1,0,0,1,0,0|1,0,1]=4 8840 B12R2.18 OC1c2ccccc2CC1Br Amb1159074 [1,0,0,1,0,0|1,0,1]=4 8841 B12R2.18 OC1c2ccccc2CC1F Amb24423988 [1,0,0,1,0,0|1,0,1]=4 8842 B12R2.18 OC1c2ccccc2CC1S Amb27397064 [1,0,0,1,0,0|1,0,1]=4 8843 B12R2.18 O[C@@H]1Cc2ccccc2[C@H]1O Amb10982589 [1,0,0,1,0,0|1,0,1]=4 8844 B12R2.18 O[C@@H]1c2ccccc2CC1Br Amb27176336 [1,0,0,1,0,0|1,0,1]=4 8845 B12R2.18 O[C@@H]1c2ccccc2C[C@@H]1Cl Amb8394042 [1,0,0,1,0,0|1,0,1]=4 8846 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Br Amb28053369 [1,0,0,1,0,0|1,0,1]=4 8847 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Cl Amb24519428 [1,0,0,1,0,0|1,0,1]=4 8848 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1F Amb27228144 [1,0,0,1,0,0|1,0,1]=4 8849 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1O Amb27427979 [1,0,0,1,0,0|1,0,1]=4 8850 B12R2.18 O[C@H]1c2ccccc2CC1Br Amb25061997 [1,0,0,1,0,0|1,0,1]=4 8851 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Br Amb8629277 [1,0,0,1,0,0|1,0,1]=4 8852 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Cl Amb26565760 [1,0,0,1,0,0|1,0,1]=4 8853 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Br Amb27446678 [1,0,0,1,0,0|1,0,1]=4 8854 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Cl Amb2609427 [1,0,0,1,0,0|1,0,1]=4 8855 B12R2.18 O[C@H]1c2ccccc2C[C@H]1F Amb25176954 [1,0,0,1,0,0|1,0,1]=4 8856 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [1,0,0,1,0,0|1,0,1]=4 8857 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [1,0,0,1,0,0|1,0,1]=4 8858 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb28594309 [1,0,0,1,0,0|1,0,1]=4 8859 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb32665507 [1,0,0,1,0,0|1,0,1]=4 8860 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [1,0,0,1,0,0|1,0,1]=4 8861 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb33447016 [1,0,0,1,0,0|1,0,1]=4 8862 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685232 [1,0,0,1,0,0|0,0,1]=3 8863 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685233 [1,0,0,1,0,0|0,0,1]=3 8864 B12R2.23 N[C@H]1CC[C@H]1c2ccccc2 Amb27789894 [1,0,0,1,0,0|1,0,1]=4 8865 B12R2.23 N[C@H]1CS[C@@H]1c2ccccc2 Amb28245857 [1,0,0,1,0,0|0,1,1]=4 8866 B12R2.23 OC1COC1c2ccccc2 Amb26336587 [1,0,0,1,0,0|1,0,1]=4 8867 B12R2.23 O[C@@H]1CO[C@@H]1c2ccccc2 Amb32679855 [1,0,0,1,0,0|1,0,1]=4 8868 B12R2.23 O[C@@H]1CO[C@H]1c2ccccc2 Amb32679869 [1,0,0,1,0,0|1,0,1]=4 8869 B12R2.23 O[C@H]1CO[C@H]1c2ccccc2 Amb28345399 [1,0,0,1,0,0|1,0,1]=4 8870 B12R2.24 BrC1COc2ccccc2C1 Amb28202605 [1,0,0,1,0,0|1,0,1]=4 8871 B12R2.24 FC1COc2ccccc2C1 Amb28291388 [1,0,0,1,0,0|1,0,1]=4 8872 B12R2.24 NC1C=Cc2ccccc2C1 Amb17470378 [1,0,0,1,0,0|1,0,0]=3 8873 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [1,0,0,1,0,0|2,0,0]=4 8874 B12R2.24 NC1CCc2ccccc2C1 Amb13952050 [1,0,0,1,0,0|1,0,1]=4 8875 B12R2.24 NC1CCc2ccccc2C1 Amb2383251 [1,0,0,1,0,0|1,0,1]=4 8876 B12R2.24 NC1CNc2ccccc2C1 Amb2694925 [1,0,0,1,0,0|1,0,1]=4 8877 B12R2.24 NC1COc2ccccc2C1 Amb7969877 [1,0,0,1,0,0|0,0,1]=3 8878 B12R2.24 NC1COc2ccccc2C1 Amb9725226 [1,0,0,1,0,0|0,0,1]=3 8879 B12R2.24 NC1COc2ncccc2C1 Amb27482927 [1,0,0,1,0,0|1,0,1]=4 8880 B12R2.24 N[C@@H]1CCc2ccccc2C1 Amb25113422 [1,0,0,1,0,0|1,0,1]=4 8881 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb23385337 [1,0,0,1,0,0|0,0,1]=3 8882 B12R2.24 N[C@@H]1COc2ccccc2C1 Amb24485980 [1,0,0,1,0,0|0,0,1]=3 8883 B12R2.24 N[C@H]1C=Cc2ccccc2C1 Amb27779859 [1,0,0,1,0,0|1,0,0]=3 8884 B12R2.24 N[C@H]1CCc2ccccc2C1 Amb8383954 [1,0,0,1,0,0|1,0,1]=4 8885 B12R2.24 N[C@H]1CNc2ccccc2C1 Amb27165152 [1,0,0,1,0,0|1,0,1]=4 8886 B12R2.24 N[C@H]1COc2ccccc2C1 Amb22756584 [1,0,0,1,0,0|0,0,1]=3 8887 B12R2.24 N[C@H]1COc2ccccc2C1 Amb28313694 [1,0,0,1,0,0|0,0,1]=3 8888 B12R2.24 N[C@H]1CSc2ccccc2C1 Amb27489034 [1,0,0,1,0,0|0,1,1]=4 8889 B12R2.24 OC1COc2ccccc2C1 Amb22498287 [1,0,0,1,0,0|1,0,1]=4 8890 B12R2.24 O[C@@H]1COc2ccccc2C1 Amb28321438 [1,0,0,1,0,0|1,0,1]=4 8891 B12R2.24 SC1COc2ccccc2C1 Amb25949570 [1,0,0,1,0,0|1,0,1]=4 8892 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [1,0,0,1,0,0|2,0,0]=4 8893 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [1,0,0,1,0,0|1,0,0]=3 8894 B12R2.27 O=CC1CC1c2cccnc2 Amb27872437 [1,0,0,1,0,0|2,0,0]=4 8895 B12R2.27 O=CC1CC1c2ccncc2 Amb6572446 [1,0,0,1,0,0|2,0,0]=4 8896 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [1,0,0,1,0,0|0,0,2]=4 8897 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [1,0,0,1,0,0|1,0,0]=3 8898 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [1,0,0,1,0,0|1,0,0]=3 8899 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [1,0,0,1,0,0|1,0,0]=3 8900 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [1,0,0,1,0,0|1,0,0]=3 8901 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [1,0,0,1,0,0|1,0,0]=3 8902 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [1,0,0,1,0,0|1,0,0]=3 8903 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [1,0,0,1,0,0|1,0,1]=4 8904 B12R2.27 OCC1C[C@@H]1c2ccccc2 Amb28182630 [1,0,0,1,0,0|1,0,1]=4 8905 B12R2.27 OCC1C[C@H]1c2ccccc2 Amb28207313 [1,0,0,1,0,0|1,0,1]=4 8906 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [1,0,0,1,0,0|1,0,1]=4 8907 B12R2.27 OC[C@@H]1C[C@@H]1c2ccccc2 Amb25917153 [1,0,0,1,0,0|1,0,1]=4 8908 B12R2.27 OC[C@@H]1C[C@H]1c2ccccc2 Amb28146004 [1,0,0,1,0,0|1,0,1]=4 8909 B12R2.27 OC[C@H]1C[C@@H]1c2ccccc2 Amb3634122 [1,0,0,1,0,0|1,0,1]=4 8910 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [1,0,0,1,0,0|1,0,1]=4 8911 B12R2.27 OC[C@H]1O[C@H]1c2ccccc2 Amb27432251 [1,0,0,1,0,0|1,0,1]=4 8912 B12R2.32 C=CC1Cc2ccccc2C1 Amb33342617 [1,0,0,1,0,0|2,0,0]=4 8913 B12R2.32 C=CC1Cc2ccccc2N1 Amb28410346 [1,0,0,1,0,0|1,0,0]=3 8914 B12R2.32 CCC1Cc2ccccc2N1 Amb27238349 [1,0,0,1,0,0|1,0,1]=4 8915 B12R2.32 NC[C@@H]1Cc2ccccc2N1 Amb27606056 [1,0,0,1,0,0|1,0,1]=4 8916 B12R2.32 NNC1Cc2ccccc2N1 Amb27641029 [1,0,0,1,0,0|2,0,0]=4 8917 B12R2.32 O=CC1=Cc2ccccc2C1 Amb18644150 [1,0,0,1,0,0|1,0,1]=4 8918 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [1,0,0,1,0,0|1,0,0]=3 8919 B12R2.32 O=CC1Cc2ccccc2N1 Amb27232668 [1,0,0,1,0,0|0,0,0]=2 8920 B12R2.32 O=CC1Oc2ccccc2O1 Amb27409489 [1,0,0,1,0,0|2,0,0]=4 8921 B12R2.32 O=CN1Cc2ccccc2C1 Amb26325036 [1,0,0,1,0,0|2,0,0]=4 8922 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [1,0,0,1,0,0|1,0,1]=4 8923 B12R2.32 OCC1Cc2ccccc2N1 Amb2724872 [1,0,0,1,0,0|0,0,1]=3 8924 B12R2.32 OCC1Cc2ccccc2O1 Amb9782879 [1,0,0,1,0,0|1,0,1]=4 8925 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [1,0,0,1,0,0|0,0,1]=3 8926 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [1,0,0,1,0,0|0,0,1]=3 8927 B12R2.32 ONC1Cc2ccccc2C1 Amb27648605 [1,0,0,1,0,0|2,0,0]=4 8928 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [1,0,0,1,0,0|1,0,0]=3 8929 B12R2.37 CC1C(N)C1c2ccccc2 Amb26503439 [1,0,0,1,0,0|1,0,1]=4 8930 B12R2.37 CC1C(N)C1c2ccccc2 Amb35751900 [1,0,0,1,0,0|1,0,1]=4 8931 B12R2.37 NC1C(N)C1c2ccccc2 Amb27791909 [1,0,0,1,0,0|1,0,1]=4 8932 B12R2.94 CC1(Cc2ccccc2)CO1 Amb26023524 [1,0,0,1,0,0|1,0,1]=4 8933 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [1,0,0,1,0,0|1,0,1]=4 8934 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2607807 [1,0,0,1,0,0|1,0,1]=4 8935 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2721362 [1,0,0,1,0,0|1,0,1]=4 8936 B12R2.2051 C=CC1(C)Cc2ccccc21 Amb17778871 [1,0,0,1,0,0|2,0,0]=4 8937 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb33552346 [1,0,0,1,0,0|1,0,1]=4 8938 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb7808794 [1,0,0,1,0,0|1,0,1]=4 8939 B12R2.2058 c1ccc(CC2COC2)cc1 Amb27602505 [1,0,0,1,0,0|1,0,1]=4 8940 B12R2.22 C=C1CC(c2ccccc2)C1 Amb35681149 [1,0,0,1,0,0|2,0,0]=4 8941 B12R2.22 O=C1CC(c2ccccc2)C1 Amb6739873 [1,0,0,1,0,0|1,0,0]=3 8942 B12R2.22 O=C1CC(c2ccccc2)N1 Amb1993905 [1,0,0,1,0,0|1,0,0]=3 8943 B12R2.22 O=C1CC(c2ccccn2)C1 Amb25891417 [1,0,0,1,0,0|2,0,0]=4 8944 B12R2.22 O=C1CC(c2cccnc2)C1 Amb25151161 [1,0,0,1,0,0|2,0,0]=4 8945 B12R2.22 O=C1CC(c2ccncc2)C1 Amb24407200 [1,0,0,1,0,0|2,0,0]=4 8946 B12R2.22 O=C1CC(c2ccncc2)N1 Amb27262270 [1,0,0,1,0,0|2,0,0]=4 8947 B12R2.22 OC1CC(c2ccccc2)C1 Amb33550604 [1,0,0,1,0,0|1,0,1]=4 8948 B12R2.22 O[C@H]1C[C@@H](c2ccccc2)C1 Amb27839916 [1,0,0,1,0,0|1,0,1]=4 8949 B12R2.22 O[C@H]1C[C@H](c2ccccc2)C1 Amb25749083 [1,0,0,1,0,0|1,0,1]=4 8950 B12R2.22 S=C1CC(c2ccccc2)N1 Amb28182509 [1,0,0,1,0,0|1,1,0]=4 8951 B12R2.92 C[C@@]1(O)C[C@H]1c2ccccc2 Amb33743331 [1,0,0,1,0,0|1,0,1]=4 8952 B12R2.2057 c1ccc(CCC2CO2)cc1 Amb33540498 [1,0,0,1,0,0|1,0,1]=4 8953 B12R2.2057 c1ccc(CC[C@@H]2CO2)cc1 Amb32951908 [1,0,0,1,0,0|1,0,1]=4 8954 B12R2.2057 c1ccc(CC[C@H]2CO2)cc1 Amb33082099 [1,0,0,1,0,0|1,0,1]=4 8955 B12R2.2403 CC1(O)CCc2ccccc21 Amb9676017 [1,0,0,1,0,0|1,0,1]=4 8956 B12R2.2403 N=S1(=O)CCc2ccccc21 Amb32666887 [1,0,0,1,0,0|2,0,0]=4 8957 B12R2.2403 NC1(O)CCc2ccccc21 Amb2699122 [1,0,0,1,0,0|1,0,1]=4 8958 B12R2.2403 N[C@@]1(O)CCc2ccccc21 Amb28072855 [1,0,0,1,0,0|1,0,1]=4 8959 B12R2.2403 O=S1(=O)CCc2ccccc21 Amb5719001 [1,0,0,1,0,0|1,0,1]=4 8960 B12R2.3190 CC(=O)C1Cc2ccccc21 Amb28066759 [1,0,0,1,0,0|1,0,0]=3 8961 B12R2.3190 CC(=O)N1Cc2ccccc21 Amb25148191 [1,0,0,1,0,0|2,0,0]=4 8962 B12R2.3190 N=C(N)C1Cc2ccccc21 Amb28652925 [1,0,0,1,0,0|2,0,0]=4 8963 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [1,0,0,1,0,0|1,0,0]=3 8964 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [1,0,0,1,0,0|1,0,0]=3 8965 B12R2.3190 O=C(O)C1=Cc2ccccc21 Amb17593654 [1,0,0,1,0,0|0,0,2]=4 8966 B12R2.3190 O=C(O)C1Cc2ccccc21 Amb4017188 [1,0,0,1,0,0|0,0,0]=2 8967 B12R2.134 N[C@@H]1C(=O)N[C@H]1c2ccco2 Amb27803898 [0,0,0,1,1,0|2,0,0]=4 8968 B12R2.252 O=C(O)C1Cc2ccsc2C1 Amb10603806 [0,0,0,1,1,0|2,0,0]=4 8969 B12R2.252 O=C(O)C1Cc2cscc2C1 Amb24365365 [0,0,0,1,1,0|2,0,0]=4 8970 B12R2.252 O=C(O)C1Cc2sccc2N1 Amb27174646 [0,0,0,1,1,0|1,0,0]=3 8971 B12R2.1354 O=C(O)C1CC1c2ccco2 Amb9765540 [0,0,0,1,1,0|2,0,0]=4 8972 B12R2.1354 O=C(O)C1CC1c2cccs2 Amb9765566 [0,0,0,1,1,0|2,0,0]=4 8973 B12R2.1354 O=C(O)C1CC1c2ccoc2 Amb25921432 [0,0,0,1,1,0|2,0,0]=4 8974 B12R2.1354 O=C(O)C1CC1c2ccsc2 Amb9677089 [0,0,0,1,1,0|2,0,0]=4 8975 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccco2 Amb26945410 [0,0,0,1,1,0|2,0,0]=4 8976 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2cccs2 Amb26075145 [0,0,0,1,1,0|2,0,0]=4 8977 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccoc2 Amb33361251 [0,0,0,1,1,0|2,0,0]=4 8978 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccsc2 Amb28723392 [0,0,0,1,1,0|2,0,0]=4 8979 B12R2.1354 O=C(O)[C@H]1C[C@@H]1c2ccco2 Amb27780939 [0,0,0,1,1,0|2,0,0]=4 8980 B14R2.19 CC1=NC(Cc2ccccc2)CO1 Amb26964500 [0,0,0,1,0,1|2,0,0]=4 8981 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,1|2,0,0]=4 8982 B14R2.19 NC1=N[C@H](Cc2ccccc2)CO1 Amb27464486 [0,0,0,1,0,1|2,0,0]=4 8983 B14R2.19 O=C1C=C(Cc2ccccc2)NN1 Amb25299854 [0,0,0,1,0,1|1,0,1]=4 8984 B14R2.19 O=C1CC(Cc2ccccc2)=NO1 Amb1099037 [0,0,0,1,0,1|0,0,2]=4 8985 B14R2.19 O=C1CC(Cc2ccccc2)CN1 Amb10608007 [0,0,0,1,0,1|2,0,0]=4 8986 B14R2.19 O=C1CC(Cc2ccccc2)CO1 Amb8487117 [0,0,0,1,0,1|1,0,0]=3 8987 B14R2.19 O=C1CC(Cc2ccccc2)NN1 Amb29862360 [0,0,0,1,0,1|1,0,0]=3 8988 B14R2.19 O=C1CC(Nc2ccccc2)CO1 Amb27415556 [0,0,0,1,0,1|2,0,0]=4 8989 B14R2.19 O=C1CCC(Cc2ccccc2)C1 Amb24455173 [0,0,0,1,0,1|2,0,0]=4 8990 B14R2.19 O=C1CCC(Cc2ccccc2)N1 Amb6404055 [0,0,0,1,0,1|2,0,0]=4 8991 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,1|2,0,0]=4 8992 B14R2.19 O=C1CN(Cc2ccccc2)CO1 Amb27861590 [0,0,0,1,0,1|2,0,0]=4 8993 B14R2.19 O=C1CNC(Cc2ccccc2)=N1 Amb33548215 [0,0,0,1,0,1|1,0,1]=4 8994 B14R2.19 O=C1COC(Cc2ccccc2)C1 Amb35718934 [0,0,0,1,0,1|2,0,0]=4 8995 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CN1 Amb27777300 [0,0,0,1,0,1|2,0,0]=4 8996 B14R2.19 O=C1NC(Cc2ccccc2)CO1 Amb9809273 [0,0,0,1,0,1|1,0,0]=3 8997 B14R2.19 O=C1NC(Cc2ccccc2)CS1 Amb27618346 [0,0,0,1,0,1|1,1,0]=4 8998 B14R2.19 O=C1NC(Cc2ccncc2)CO1 Amb27607810 [0,0,0,1,0,1|2,0,0]=4 8999 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,1|2,0,0]=4 9000 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,1|2,0,0]=4 9001 B14R2.19 O=C1NC[C@H](Cc2ccccc2)N1 Amb27772403 [0,0,0,1,0,1|2,0,0]=4 9002 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CO1 Amb2725669 [0,0,0,1,0,1|1,0,0]=3 9003 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,1|1,1,0]=4 9004 B14R2.19 O=C1N[C@H](Cc2ccccc2)CO1 Amb6357181 [0,0,0,1,0,1|1,0,0]=3 9005 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,1|1,1,0]=4 9006 B14R2.19 OC1CNC(Cc2ccccc2)C1 Amb23454017 [0,0,0,1,0,1|1,0,1]=4 9007 B14R2.19 S=C1NC(Cc2ccccc2)CO1 Amb25938312 [0,0,0,1,0,1|1,1,0]=4 9008 B14R2.19 S=C1N[C@@H](Cc2ccccc2)CO1 Amb8629174 [0,0,0,1,0,1|1,1,0]=4 9009 B14R2.19 S=C1N[C@H](Cc2ccccc2)CO1 Amb8629175 [0,0,0,1,0,1|1,1,0]=4 9010 B14R2.431 NC1(Cc2ccccc2)CC(O)C1 Amb32953145 [0,0,0,1,0,1|1,0,1]=4 9011 B14R2.445 NC1CS(=O)(=O)C1c2ccccc2 Amb33620992 [0,0,0,1,0,1|1,0,1]=4 9012 B14R2.445 NC1CS(=O)(=O)C1c2ccccc2 Amb33746609 [0,0,0,1,0,1|1,0,1]=4 9013 B14R2.598 CC1CC(=O)CC1c2ccccc2 Amb27409582 [0,0,0,1,0,1|2,0,0]=4 9014 B14R2.598 CC1CC(=O)OC1c2ccccc2 Amb27429192 [0,0,0,1,0,1|1,0,0]=3 9015 B14R2.598 CC1N=C(N)OC1c2ccccc2 Amb22055741 [0,0,0,1,0,1|2,0,0]=4 9016 B14R2.598 CC1NC(=O)CC1c2ccccc2 Amb26880847 [0,0,0,1,0,1|2,0,0]=4 9017 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,0,0,1,0,1|1,0,0]=3 9018 B14R2.598 CC1NC(=O)OC1c2ccncc2 Amb25765525 [0,0,0,1,0,1|2,0,0]=4 9019 B14R2.598 CC1NC(=S)OC1c2ccccc2 Amb28143642 [0,0,0,1,0,1|1,1,0]=4 9020 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,0,0,1,0,1|2,0,0]=4 9021 B14R2.598 C[C@@H]1NC(=N)O[C@H]1c2ccccc2 Amb27614345 [0,0,0,1,0,1|2,0,0]=4 9022 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,0,0,1,0,1|1,0,0]=3 9023 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,0,0,1,0,1|1,0,0]=3 9024 B14R2.598 C[C@H]1N=C(N)O[C@@H]1c2ccccc2 Amb27666984 [0,0,0,1,0,1|2,0,0]=4 9025 B14R2.598 C[C@H]1NC(=N)O[C@H]1c2ccccc2 Amb26416907 [0,0,0,1,0,1|2,0,0]=4 9026 B14R2.598 C[C@H]1NC(=O)C[C@@H]1c2ccccc2 Amb27978591 [0,0,0,1,0,1|2,0,0]=4 9027 B14R2.598 C[C@H]1NC(=O)O[C@@H]1c2ccccc2 Amb26626803 [0,0,0,1,0,1|1,0,0]=3 9028 B14R2.598 C[C@H]1NC(=O)O[C@H]1c2ccccc2 Amb541248 [0,0,0,1,0,1|1,0,0]=3 9029 B14R2.598 C[C@H]1OC(=O)N[C@H]1c2ccccc2 Amb4090301 [0,0,0,1,0,1|2,0,0]=4 9030 B14R2.598 NC1=NC(=O)NC1c2ccccc2 Amb28130891 [0,0,0,1,0,1|1,0,1]=4 9031 B14R2.598 NC1=NC(=O)OC1c2ccccc2 Amb27202578 [0,0,0,1,0,1|0,0,1]=3 9032 B14R2.598 NC1=NC(=O)OC1c2cccnc2 Amb27590057 [0,0,0,1,0,1|1,0,1]=4 9033 B14R2.598 O=C1CC(Cl)C(c2ccccc2)O1 Amb28245285 [0,0,0,1,0,1|1,0,0]=3 9034 B14R2.598 O=C1C[C@@H](c2ccccc2)[C@H](O)C1 Amb28131452 [0,0,0,1,0,1|2,0,0]=4 9035 B14R2.598 O=C1C[C@H](O)[C@H](c2ccccc2)O1 Amb28194239 [0,0,0,1,0,1|1,0,0]=3 9036 B14R2.598 O=C1NC(=O)C(c2ccccc2)O1 Amb2731901 [0,0,0,1,0,1|1,0,1]=4 9037 B14R2.598 O=C1NC(=O)[C@@H](c2ccccc2)O1 Amb27441161 [0,0,0,1,0,1|1,0,1]=4 9038 B14R2.598 O=C1OC(=O)C(c2ccccc2)O1 Amb28063027 [0,0,0,1,0,1|1,0,1]=4 9039 B14R2.598 O=C1OC(=O)[C@@H](c2ccccc2)O1 Amb25073739 [0,0,0,1,0,1|1,0,1]=4 9040 B14R2.642 CC(=O)N1c2ccccc2CC1C Amb2616094 [0,0,0,1,0,1|2,0,0]=4 9041 B14R2.642 CC(=O)N1c2ccccc2CC1O Amb27399675 [0,0,0,1,0,1|2,0,0]=4 9042 B14R2.642 CC1Sc2ccccc2C1C(=O)O Amb27795162 [0,0,0,1,0,1|2,0,0]=4 9043 B14R2.642 CN1Cc2ccccc2C1C(=O)O Amb28121124 [0,0,0,1,0,1|2,0,0]=4 9044 B14R2.642 C[C@H]1Oc2ccccc2[C@H]1C(=O)O Amb27249800 [0,0,0,1,0,1|2,0,0]=4 9045 B14R2.642 NC(=O)C1=C(N)Cc2ccccc21 Amb26851168 [0,0,0,1,0,1|1,0,1]=4 9046 B14R2.642 NC1Cc2ccccc2C1C(=O)O Amb26557383 [0,0,0,1,0,1|0,0,0]=2 9047 B14R2.642 Nc1nc2ccccc2n1C(=O)O Amb24078483 [0,0,0,1,0,1|1,0,1]=4 9048 B14R2.642 O=C(O)[C@@H]1c2ccccc2C[C@@H]1O Amb27233456 [0,0,0,1,0,1|1,0,0]=3 9049 B14R2.738 NC1CC(=O)Nc2ccccc2C1 Amb8386211 [0,0,0,1,0,1|1,0,0]=3 9050 B14R2.764 CC(=O)[C@H]1O[C@H]1Cc2ccccc2 Amb28054314 [0,0,0,1,0,1|2,0,0]=4 9051 B14R2.764 O=C(O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,1|1,0,0]=3 9052 B14R2.764 O=C(O)C1CC1Oc2ccccc2 Amb27955312 [0,0,0,1,0,1|2,0,0]=4 9053 B14R2.764 O=C(O)C1CC1Sc2ccccc2 Amb28251062 [0,0,0,1,0,1|2,0,0]=4 9054 B14R2.764 O=C(O)C1CN1Cc2ccccc2 Amb9782119 [0,0,0,1,0,1|2,0,0]=4 9055 B14R2.764 O=C(O)C1OC1Cc2ccccc2 Amb28136429 [0,0,0,1,0,1|1,0,0]=3 9056 B14R2.764 O=C(O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,1|1,0,0]=3 9057 B14R2.764 O=C(O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25173187 [0,0,0,1,0,1|2,0,0]=4 9058 B14R2.764 O=C(O)[C@H]1C[C@@H]1Cc2ccccc2 Amb27211567 [0,0,0,1,0,1|1,0,0]=3 9059 B14R2.764 O=C(O)[C@H]1C[C@H]1Cc2ccccc2 Amb27878637 [0,0,0,1,0,1|1,0,0]=3 9060 B14R2.768 CC(=O)CC1Cc2ccccc2C1 Amb26062032 [0,0,0,1,0,1|2,0,0]=4 9061 B14R2.768 CC(=O)NC1Cc2ccccc2C1 Amb2031411 [0,0,0,1,0,1|2,0,0]=4 9062 B14R2.768 NC(=O)NC1Cc2ccccc2C1 Amb28325723 [0,0,0,1,0,1|2,0,0]=4 9063 B14R2.768 O=C(Cl)NC1Cc2ccccc2C1 Amb35625556 [0,0,0,1,0,1|2,0,0]=4 9064 B14R2.768 O=C(O)C=C1Cc2ccccc2C1 Amb9675734 [0,0,0,1,0,1|1,0,1]=4 9065 B14R2.768 O=C(O)CC1Cc2ccccc2C1 Amb3939855 [0,0,0,1,0,1|1,0,0]=3 9066 B14R2.768 O=C(O)CC1Cc2ccccc2N1 Amb27454797 [0,0,0,1,0,1|0,0,0]=2 9067 B14R2.768 O=C(O)CC1Cc2ccccc2O1 Amb33533869 [0,0,0,1,0,1|1,0,0]=3 9068 B14R2.768 O=C(O)CC1Cc2ccccc2S1 Amb18189899 [0,0,0,1,0,1|1,0,0]=3 9069 B14R2.768 O=C(O)CC1Oc2ccccc2O1 Amb28400696 [0,0,0,1,0,1|2,0,0]=4 9070 B14R2.768 O=C(O)CN1Cc2ccccc2C1 Amb13948972 [0,0,0,1,0,1|2,0,0]=4 9071 B14R2.768 O=C(O)CN1Cc2ccccc2C1 Amb2967233 [0,0,0,1,0,1|2,0,0]=4 9072 B14R2.768 O=C(O)C[C@@H]1Cc2ccccc2N1 Amb35752104 [0,0,0,1,0,1|0,0,0]=2 9073 B14R2.768 O=C(O)C[C@@H]1Cc2ccccc2N1 Amb35752340 [0,0,0,1,0,1|0,0,0]=2 9074 B14R2.768 O=C(O)C[C@H]1Cc2ccccc2N1 Amb35750382 [0,0,0,1,0,1|0,0,0]=2 9075 B14R2.768 O=C(O)C[C@H]1Cc2ccccc2N1 Amb35751896 [0,0,0,1,0,1|0,0,0]=2 9076 B14R2.790 CC(=O)CC1OC1c2ccccc2 Amb27750372 [0,0,0,1,0,1|2,0,0]=4 9077 B14R2.790 CC(=O)NC1CC1c2ccccc2 Amb6359955 [0,0,0,1,0,1|2,0,0]=4 9078 B14R2.790 CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24273291 [0,0,0,1,0,1|2,0,0]=4 9079 B14R2.790 NC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb27420759 [0,0,0,1,0,1|2,0,0]=4 9080 B14R2.790 NC(=O)N[C@H]1C[C@@H]1c2ccccc2 Amb27966822 [0,0,0,1,0,1|2,0,0]=4 9081 B14R2.790 O=C(Cl)NC1CC1c2ccccc2 Amb35625650 [0,0,0,1,0,1|2,0,0]=4 9082 B14R2.790 O=C(O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,1|1,0,0]=3 9083 B14R2.790 O=C(O)CN1OC1c2ccccc2 Amb27955880 [0,0,0,1,0,1|2,0,0]=4 9084 B14R2.790 O=C(O)C[C@@H]1C[C@@H]1c2ccccc2 Amb28385583 [0,0,0,1,0,1|1,0,0]=3 9085 B14R2.790 O=C(O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,1|1,0,0]=3 9086 B14R2.4586 C=C1[C@@H](C(=O)O)[C@@H]1c2ccccc2 Amb27792490 [0,0,0,1,0,1|1,0,1]=4 9087 B14R2.4586 CC1C(C(=O)O)C1c2ccccc2 Amb24440802 [0,0,0,1,0,1|1,0,0]=3 9088 B14R2.4586 CC1C(C(N)=O)C1c2ccccc2 Amb27484030 [0,0,0,1,0,1|2,0,0]=4 9089 B14R2.4586 C[C@H]1[C@H](C(=O)O)[C@@H]1c2ccccc2 Amb28052089 [0,0,0,1,0,1|1,0,0]=3 9090 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,0,0,1,0,1|2,0,0]=4 9091 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,0,0,1,0,1|2,0,0]=4 9092 B14R2.31 O=C1CC[C@H]1OCc2ccccc2 Amb27972934 [0,0,0,1,0,1|2,0,0]=4 9093 B14R2.31 O=C1NCC1OCc2ccccc2 Amb27969209 [0,0,0,1,0,1|2,0,0]=4 9094 B14R2.260 CC1=CC(c2ccccc2)OC1=O Amb28242302 [0,0,0,1,0,1|1,0,1]=4 9095 B14R2.260 CC1CC(c2ccccc2)=CC1=O Amb28240634 [0,0,0,1,0,1|2,0,0]=4 9096 B14R2.260 CC1CC(c2ccccc2)CC1=O Amb28285819 [0,0,0,1,0,1|2,0,0]=4 9097 B14R2.260 CC1CN(c2ccccc2)N=C1O Amb1804743 [0,0,0,1,0,1|2,0,0]=4 9098 B14R2.260 CC1CN(c2ccccc2)NC1=O Amb9752737 [0,0,0,1,0,1|2,0,0]=4 9099 B14R2.260 CC1N=C(c2ccccc2)OC1=O Amb2689618 [0,0,0,1,0,1|1,0,1]=4 9100 B14R2.260 CC1SC(c2ccccc2)NC1=O Amb2223062 [0,0,0,1,0,1|2,0,0]=4 9101 B14R2.260 CN1CC(c2ccccc2)OC1=O Amb4403466 [0,0,0,1,0,1|2,0,0]=4 9102 B14R2.260 C[C@@H]1C[C@@H](c2ccccc2)NC1=O Amb27841195 [0,0,0,1,0,1|2,0,0]=4 9103 B14R2.260 C[C@H]1C[C@@H](c2ccccc2)NC1=O Amb27439050 [0,0,0,1,0,1|2,0,0]=4 9104 B14R2.260 C[C@H]1C[C@H](c2ccccc2)NC1=O Amb27783312 [0,0,0,1,0,1|2,0,0]=4 9105 B14R2.260 C[C@H]1NC(c2ccccc2)OC1=O Amb27482934 [0,0,0,1,0,1|1,0,0]=3 9106 B14R2.260 C[C@H]1O[C@H](c2ccccc2)CC1=O Amb27433086 [0,0,0,1,0,1|2,0,0]=4 9107 B14R2.260 C[C@H]1O[C@H](c2ccccc2)NC1=O Amb27789600 [0,0,0,1,0,1|2,0,0]=4 9108 B14R2.260 NC1CC(c2ccccc2)OC1=O Amb17470561 [0,0,0,1,0,1|0,0,0]=2 9109 B14R2.260 NC1CN(c2ccccc2)CC1O Amb28042554 [0,0,0,1,0,1|1,0,1]=4 9110 B14R2.260 NC1CN(c2ccccc2)NC1=O Amb27415900 [0,0,0,1,0,1|1,0,0]=3 9111 B14R2.260 N[C@@H]1C[C@H](c2ccccc2)NC1=O Amb35788668 [0,0,0,1,0,1|1,0,0]=3 9112 B14R2.260 N[C@@H]1C[C@H](c2ccccc2)NC1=O Amb35788989 [0,0,0,1,0,1|1,0,0]=3 9113 B14R2.260 N[C@@H]1C[C@H](c2ccccc2)OC1=O Amb27788097 [0,0,0,1,0,1|0,0,0]=2 9114 B14R2.260 O=C1NC(c2ccccc2)CC1O Amb25325087 [0,0,0,1,0,1|2,0,0]=4 9115 B14R2.260 O=C1NC(c2ccccc2)SC1F Amb27449243 [0,0,0,1,0,1|2,0,0]=4 9116 B14R2.260 O=C1OC(c2ccccc2)C=C1O Amb23571856 [0,0,0,1,0,1|1,0,1]=4 9117 B14R2.260 O=C1O[C@H](c2ccccc2)C[C@H]1Cl Amb27985911 [0,0,0,1,0,1|1,0,0]=3 9118 B14R2.427 CC1C(=O)CN1Cc2ccccc2 Amb28070005 [0,0,0,1,0,1|2,0,0]=4 9119 B14R2.427 C[C@@H]1C(=O)N[C@H]1Cc2ccccc2 Amb27623877 [0,0,0,1,0,1|2,0,0]=4 9120 B14R2.427 C[C@H]1C(=O)C[C@@H]1Cc2ccccc2 Amb28202308 [0,0,0,1,0,1|2,0,0]=4 9121 B14R2.427 C[C@H]1C(=O)N[C@H]1Cc2ccccc2 Amb27203336 [0,0,0,1,0,1|2,0,0]=4 9122 B14R2.427 NC1C(=O)NC1Cc2ccccc2 Amb18196732 [0,0,0,1,0,1|1,0,0]=3 9123 B14R2.427 NC1C(=O)NC1Oc2ccccc2 Amb27792900 [0,0,0,1,0,1|1,0,0]=3 9124 B14R2.427 O=C1N[C@@H](Cc2ccccc2)[C@H]1O Amb27653339 [0,0,0,1,0,1|2,0,0]=4 9125 B14R2.741 CC1CNc2ccccc2NC1=O Amb1665015 [0,0,0,1,0,1|2,0,0]=4 9126 B14R2.741 CC1COc2ccccc2NC1=O Amb17570221 [0,0,0,1,0,1|2,0,0]=4 9127 B14R2.741 CC1CSc2ccccc2NC1=O Amb24463948 [0,0,0,1,0,1|2,0,0]=4 9128 B14R2.741 CC1NCc2ccccc2NC1=O Amb25900602 [0,0,0,1,0,1|2,0,0]=4 9129 B14R2.741 CC1NCc2ccccc2NC1=O Amb28556000 [0,0,0,1,0,1|2,0,0]=4 9130 B14R2.741 C[C@@H]1CCc2ccccc2NC1=O Amb25743449 [0,0,0,1,0,1|2,0,0]=4 9131 B14R2.741 C[C@@H]1NCc2ccccc2NC1=O Amb28071248 [0,0,0,1,0,1|2,0,0]=4 9132 B14R2.741 NC1=CCc2ccccc2NC1=O Amb27411952 [0,0,0,1,0,1|1,0,1]=4 9133 B14R2.741 NC1CCc2ccccc2CC1=O Amb27760472 [0,0,0,1,0,1|1,0,0]=3 9134 B14R2.741 NC1CCc2ccccc2CC1O Amb27392292 [0,0,0,1,0,1|1,0,1]=4 9135 B14R2.741 NC1CCc2ccccc2NC1=O Amb2695150 [0,0,0,1,0,1|1,0,0]=3 9136 B14R2.741 NC1CCc2ccccc2NC1=O Amb8383404 [0,0,0,1,0,1|1,0,0]=3 9137 B14R2.741 NC1COc2ccccc2NC1=O Amb21962443 [0,0,0,1,0,1|1,0,0]=3 9138 B14R2.741 NC1COc2ccccc2NC1=O Amb33483719 [0,0,0,1,0,1|1,0,0]=3 9139 B14R2.741 NC1CSc2ccccc2NC1=O Amb2695117 [0,0,0,1,0,1|1,0,0]=3 9140 B14R2.741 N[C@@H]1CCc2ccccc2NC1=O Amb2695220 [0,0,0,1,0,1|1,0,0]=3 9141 B14R2.741 N[C@@H]1COc2ccccc2NC1=O Amb24708380 [0,0,0,1,0,1|1,0,0]=3 9142 B14R2.741 N[C@@H]1COc2ccccc2NC1=O Amb33483910 [0,0,0,1,0,1|1,0,0]=3 9143 B14R2.741 N[C@@H]1CSc2ccccc2NC1=O Amb27803814 [0,0,0,1,0,1|1,0,0]=3 9144 B14R2.741 N[C@@H]1CSc2ccccc2NC1=O Amb33715265 [0,0,0,1,0,1|1,0,0]=3 9145 B14R2.741 N[C@H]1CCc2ccccc2NC1=O Amb2700630 [0,0,0,1,0,1|1,0,0]=3 9146 B14R2.741 N[C@H]1COc2ccccc2NC1=O Amb26548336 [0,0,0,1,0,1|1,0,0]=3 9147 B14R2.741 N[C@H]1COc2ccccc2NC1=O Amb33484191 [0,0,0,1,0,1|1,0,0]=3 9148 B14R2.741 N[C@H]1CSc2ccccc2NC1=O Amb28343135 [0,0,0,1,0,1|1,0,0]=3 9149 B14R2.741 O=C1Nc2ccccc2CCC1Br Amb535156 [0,0,0,1,0,1|2,0,0]=4 9150 B14R2.741 O=C1Nc2ccccc2CCC1Cl Amb21964387 [0,0,0,1,0,1|2,0,0]=4 9151 B14R2.741 O=C1Nc2ccccc2CCC1F Amb27482918 [0,0,0,1,0,1|2,0,0]=4 9152 B14R2.741 O=C1Nc2ccccc2CCC1O Amb25226835 [0,0,0,1,0,1|2,0,0]=4 9153 B14R2.741 O=C1Nc2ccccc2CCC1S Amb28141013 [0,0,0,1,0,1|2,0,0]=4 9154 B14R2.741 O=C1Nc2ccccc2CC[C@H]1O Amb28340942 [0,0,0,1,0,1|2,0,0]=4 9155 B14R2.741 O=C1Oc2ccccc2CCC1Cl Amb27863424 [0,0,0,1,0,1|1,0,0]=3 9156 B14R2.779 O=C(O)C1CC(c2ccccc2)C1 Amb13951336 [0,0,0,1,0,1|1,0,0]=3 9157 B14R2.779 O=C(O)C1CC(c2ccccc2)O1 Amb33726890 [0,0,0,1,0,1|1,0,0]=3 9158 B14R2.779 O=C(O)C1CC(c2ccccn2)C1 Amb26452972 [0,0,0,1,0,1|2,0,0]=4 9159 B14R2.779 O=C(O)C1CC(c2cccnc2)C1 Amb27840979 [0,0,0,1,0,1|2,0,0]=4 9160 B14R2.779 O=C(O)C1CC(c2ccncc2)C1 Amb28125778 [0,0,0,1,0,1|2,0,0]=4 9161 B14R2.779 O=C(O)C1CN(c2ccccc2)C1 Amb28315039 [0,0,0,1,0,1|1,0,0]=3 9162 B14R2.779 O=C(O)C1CN(c2ccccn2)C1 Amb22297689 [0,0,0,1,0,1|2,0,0]=4 9163 B14R2.779 O=C(O)C1CN(c2ccncc2)C1 Amb27187310 [0,0,0,1,0,1|2,0,0]=4 9164 B14R2.779 O=C(O)[C@H]1C[C@@H](c2ccccc2)C1 Amb27179340 [0,0,0,1,0,1|1,0,0]=3 9165 B14R2.779 O=C([O-])C1CC(c2ccccc2)O1 Amb33621270 [0,0,0,1,0,1|1,0,1]=4 9166 B14R2.781 C=C(C)C1CSc2ccccc2N1 Amb27949189 [0,0,0,1,0,1|2,0,0]=4 9167 B14R2.781 CC(=O)C1COc2ccccc2C1 Amb24670907 [0,0,0,1,0,1|2,0,0]=4 9168 B14R2.781 CC(=O)C1COc2ccccc2O1 Amb9752738 [0,0,0,1,0,1|2,0,0]=4 9169 B14R2.781 CC(=O)C1COc2ccccc2S1 Amb17570722 [0,0,0,1,0,1|2,0,0]=4 9170 B14R2.781 CC(=O)C1CSc2ccccc2O1 Amb27662768 [0,0,0,1,0,1|2,0,0]=4 9171 B14R2.781 CC(=O)[C@H]1COc2ccccc2O1 Amb27621290 [0,0,0,1,0,1|2,0,0]=4 9172 B14R2.781 NC(=O)C1CCc2ccccc2C1 Amb26478702 [0,0,0,1,0,1|2,0,0]=4 9173 B14R2.781 NC(=O)C1CCc2ccccc2N1 Amb9716189 [0,0,0,1,0,1|1,0,0]=3 9174 B14R2.781 NC(=O)C1CCc2ccccc2O1 Amb24097305 [0,0,0,1,0,1|2,0,0]=4 9175 B14R2.781 NC(=O)C1CNc2ccccc2C1 Amb19313064 [0,0,0,1,0,1|2,0,0]=4 9176 B14R2.781 NC(=O)C1CNc2ccccc2N1 Amb5722226 [0,0,0,1,0,1|1,0,0]=3 9177 B14R2.781 NC(=O)C1CNc2ccccc2O1 Amb414747 [0,0,0,1,0,1|2,0,0]=4 9178 B14R2.781 NC(=O)C1CNc2ccccc2O1 Amb6891888 [0,0,0,1,0,1|2,0,0]=4 9179 B14R2.781 NC(=O)C1COc2ccccc2C1 Amb8858642 [0,0,0,1,0,1|2,0,0]=4 9180 B14R2.781 NC(=O)C1COc2ccccc2O1 Amb1208479 [0,0,0,1,0,1|2,0,0]=4 9181 B14R2.781 NC(=O)C1Cc2ccccc2CN1 Amb439948 [0,0,0,1,0,1|2,0,0]=4 9182 B14R2.781 NC(=O)C1Cc2ccccc2CN1 Amb535217 [0,0,0,1,0,1|2,0,0]=4 9183 B14R2.781 NC(=O)C1Cc2ccccc2CO1 Amb22643156 [0,0,0,1,0,1|2,0,0]=4 9184 B14R2.781 NC(=O)[C@@H]1CCc2ccccc2O1 Amb24182081 [0,0,0,1,0,1|2,0,0]=4 9185 B14R2.781 NC(=O)[C@@H]1Cc2ccccc2CN1 Amb32674791 [0,0,0,1,0,1|2,0,0]=4 9186 B14R2.781 NC(=O)[C@@H]1Cc2ccccc2CN1 Amb6893339 [0,0,0,1,0,1|2,0,0]=4 9187 B14R2.781 NC(=O)[C@@H]1Cc2ccccc2CO1 Amb32668349 [0,0,0,1,0,1|2,0,0]=4 9188 B14R2.781 NC(=O)[C@H]1CCc2ccccc2O1 Amb27415802 [0,0,0,1,0,1|2,0,0]=4 9189 B14R2.781 NC(=O)[C@H]1CNc2ccccc2N1 Amb26476309 [0,0,0,1,0,1|1,0,0]=3 9190 B14R2.781 NC(=O)[C@H]1Cc2ccccc2CN1 Amb25255218 [0,0,0,1,0,1|2,0,0]=4 9191 B14R2.781 O=C(Cl)C1COc2ccccc2C1 Amb2723391 [0,0,0,1,0,1|2,0,0]=4 9192 B14R2.781 O=C(Cl)C1COc2ccccc2O1 Amb2687289 [0,0,0,1,0,1|2,0,0]=4 9193 B14R2.781 O=C(Cl)C1Cc2ccccc2CO1 Amb28243693 [0,0,0,1,0,1|2,0,0]=4 9194 B14R2.781 O=C(Cl)[C@@H]1CCc2ccccc2O1 Amb24496956 [0,0,0,1,0,1|2,0,0]=4 9195 B14R2.781 O=C(Cl)[C@@H]1COc2ccccc2O1 Amb28076077 [0,0,0,1,0,1|2,0,0]=4 9196 B14R2.781 O=C(O)C1=CCc2ccccc2O1 Amb27666943 [0,0,0,1,0,1|1,0,1]=4 9197 B14R2.781 O=C(O)C1=CSc2ccccc2N1 Amb27179145 [0,0,0,1,0,1|0,0,2]=4 9198 B14R2.781 O=C(O)C1=Cc2ccccc2CO1 Amb27232943 [0,0,0,1,0,1|1,0,1]=4 9199 B14R2.781 O=C(O)C1=Cc2ccccc2OC1 Amb1215611 [0,0,0,1,0,1|1,0,1]=4 9200 B14R2.781 O=C(O)C1C=Cc2ccccc2C1 Amb17470503 [0,0,0,1,0,1|1,0,1]=4 9201 B14R2.781 O=C(O)C1CCc2ccccc2C1 Amb3939918 [0,0,0,1,0,1|1,0,0]=3 9202 B14R2.781 O=C(O)C1CCc2ccccc2N1 Amb10604189 [0,0,0,1,0,1|0,0,0]=2 9203 B14R2.781 O=C(O)C1CCc2ccccc2N1 Amb18560475 [0,0,0,1,0,1|0,0,0]=2 9204 B14R2.781 O=C(O)C1CCc2ccccc2O1 Amb33542685 [0,0,0,1,0,1|1,0,0]=3 9205 B14R2.781 O=C(O)C1CCc2cccnc2C1 Amb18196206 [0,0,0,1,0,1|2,0,0]=4 9206 B14R2.781 O=C(O)C1CCc2ccncc2C1 Amb18196192 [0,0,0,1,0,1|2,0,0]=4 9207 B14R2.781 O=C(O)C1CCc2ncccc2C1 Amb21856877 [0,0,0,1,0,1|2,0,0]=4 9208 B14R2.781 O=C(O)C1CCc2ncccc2C1 Amb33620726 [0,0,0,1,0,1|2,0,0]=4 9209 B14R2.781 O=C(O)C1CNc2ccccc2C1 Amb22436789 [0,0,0,1,0,1|1,0,0]=3 9210 B14R2.781 O=C(O)C1CNc2ccccc2C1 Amb8631057 [0,0,0,1,0,1|1,0,0]=3 9211 B14R2.781 O=C(O)C1CNc2ccccc2O1 Amb22266726 [0,0,0,1,0,1|1,0,0]=3 9212 B14R2.781 O=C(O)C1CNc2ccccc2O1 Amb436746 [0,0,0,1,0,1|1,0,0]=3 9213 B14R2.781 O=C(O)C1CNc2ncccc2O1 Amb16230770 [0,0,0,1,0,1|2,0,0]=4 9214 B14R2.781 O=C(O)C1COc2ccccc2C1 Amb1657619 [0,0,0,1,0,1|1,0,0]=3 9215 B14R2.781 O=C(O)C1COc2ccccc2N1 Amb18061976 [0,0,0,1,0,1|0,0,0]=2 9216 B14R2.781 O=C(O)C1COc2ccccc2O1 Amb6336370 [0,0,0,1,0,1|1,0,0]=3 9217 B14R2.781 O=C(O)C1COc2ccccc2S1 Amb17570762 [0,0,0,1,0,1|1,0,0]=3 9218 B14R2.781 O=C(O)C1CSc2ccccc2C1 Amb17595111 [0,0,0,1,0,1|1,0,0]=3 9219 B14R2.781 O=C(O)C1CSc2ccccc2N1 Amb27641473 [0,0,0,1,0,1|0,0,0]=2 9220 B14R2.781 O=C(O)C1CSc2ccccc2O1 Amb13951585 [0,0,0,1,0,1|1,0,0]=3 9221 B14R2.781 O=C(O)C1Cc2ccccc2CN1 Amb1058838 [0,0,0,1,0,1|1,0,0]=3 9222 B14R2.781 O=C(O)C1Cc2ccccc2CN1 Amb22494613 [0,0,0,1,0,1|1,0,0]=3 9223 B14R2.781 O=C(O)C1Cc2ccccc2CN1 Amb6335187 [0,0,0,1,0,1|1,0,0]=3 9224 B14R2.781 O=C(O)C1Cc2ccccc2CO1 Amb22642211 [0,0,0,1,0,1|1,0,0]=3 9225 B14R2.781 O=C(O)C1Cc2ccncc2CN1 Amb28243334 [0,0,0,1,0,1|2,0,0]=4 9226 B14R2.781 O=C(O)[C@@H]1C=Cc2ccccc2C1 Amb27952482 [0,0,0,1,0,1|1,0,1]=4 9227 B14R2.781 O=C(O)[C@@H]1CCc2ccccc2N1 Amb19887699 [0,0,0,1,0,1|0,0,0]=2 9228 B14R2.781 O=C(O)[C@@H]1CCc2ccccc2N1 Amb22754395 [0,0,0,1,0,1|0,0,0]=2 9229 B14R2.781 O=C(O)[C@@H]1CCc2ccccc2O1 Amb26336126 [0,0,0,1,0,1|1,0,0]=3 9230 B14R2.781 O=C(O)[C@@H]1CNc2ccccc2C1 Amb27392433 [0,0,0,1,0,1|1,0,0]=3 9231 B14R2.781 O=C(O)[C@@H]1COc2ccccc2C1 Amb24376637 [0,0,0,1,0,1|1,0,0]=3 9232 B14R2.781 O=C(O)[C@@H]1COc2ccccc2O1 Amb3939819 [0,0,0,1,0,1|1,0,0]=3 9233 B14R2.781 O=C(O)[C@@H]1Cc2ccccc2CN1 Amb6295902 [0,0,0,1,0,1|1,0,0]=3 9234 B14R2.781 O=C(O)[C@@H]1Cc2ccccc2CN1 Amb6306676 [0,0,0,1,0,1|1,0,0]=3 9235 B14R2.781 O=C(O)[C@@H]1Cc2ccccc2CN1 Amb8515774 [0,0,0,1,0,1|1,0,0]=3 9236 B14R2.781 O=C(O)[C@@H]1Cc2ccccc2CO1 Amb24365966 [0,0,0,1,0,1|1,0,0]=3 9237 B14R2.781 O=C(O)[C@H]1CCc2ccccc2C1 Amb8396564 [0,0,0,1,0,1|1,0,0]=3 9238 B14R2.781 O=C(O)[C@H]1CCc2ccccc2N1 Amb19888454 [0,0,0,1,0,1|0,0,0]=2 9239 B14R2.781 O=C(O)[C@H]1CCc2ccccc2N1 Amb27236137 [0,0,0,1,0,1|0,0,0]=2 9240 B14R2.781 O=C(O)[C@H]1CCc2ccccc2O1 Amb25807936 [0,0,0,1,0,1|1,0,0]=3 9241 B14R2.781 O=C(O)[C@H]1CNc2ccccc2N1 Amb25043219 [0,0,0,1,0,1|0,0,0]=2 9242 B14R2.781 O=C(O)[C@H]1COc2ccccc2C1 Amb25074534 [0,0,0,1,0,1|1,0,0]=3 9243 B14R2.781 O=C(O)[C@H]1COc2ccccc2O1 Amb19889734 [0,0,0,1,0,1|1,0,0]=3 9244 B14R2.781 O=C(O)[C@H]1Cc2ccccc2CN1 Amb8496651 [0,0,0,1,0,1|1,0,0]=3 9245 B14R2.781 O=C([O-])C1COc2ccccc2O1 Amb33513154 [0,0,0,1,0,1|1,0,1]=4 9246 B14R2.781 OC(=S)C1=NCc2ccccc2N1 Amb27959152 [0,0,0,1,0,1|0,1,1]=4 9247 B14R2.786 CC(=O)[C@@]1(C)C[C@H]1c2ccccc2 Amb27427676 [0,0,0,1,0,1|2,0,0]=4 9248 B14R2.786 CC1(C(=O)Cl)OC1c2ccccc2 Amb24366113 [0,0,0,1,0,1|2,0,0]=4 9249 B14R2.786 CC1(C(=O)O)CC1c2ccccc2 Amb17335110 [0,0,0,1,0,1|1,0,0]=3 9250 B14R2.786 CC1(C(=O)O)CC1c2ccncc2 Amb17335162 [0,0,0,1,0,1|2,0,0]=4 9251 B14R2.786 CC1(C(=O)O)OC1c2ccccc2 Amb27184619 [0,0,0,1,0,1|1,0,0]=3 9252 B14R2.786 CC1(C(N)=O)CC1c2ccccc2 Amb28343268 [0,0,0,1,0,1|2,0,0]=4 9253 B14R2.786 C[C@@]1(C(=O)O)C[C@@H]1c2ccccc2 Amb27781533 [0,0,0,1,0,1|1,0,0]=3 9254 B14R2.786 C[C@@]1(C(=O)O)C[C@H]1c2ccccc2 Amb25022674 [0,0,0,1,0,1|1,0,0]=3 9255 B14R2.786 C[C@]1(C(=O)O)C[C@@H]1c2ccccc2 Amb24552946 [0,0,0,1,0,1|1,0,0]=3 9256 B14R2.786 C[C@]1(C(=O)O)C[C@H]1c2ccccc2 Amb25179070 [0,0,0,1,0,1|1,0,0]=3 9257 B14R2.786 NC1(C(=O)O)CC1c2ccccc2 Amb19374730 [0,0,0,1,0,1|0,0,0]=2 9258 B14R2.786 NC1(C(=O)O)CC1c2ccccc2 Amb22546302 [0,0,0,1,0,1|0,0,0]=2 9259 B14R2.786 O=C(O)C1(Cl)CC1c2ccccc2 Amb27179223 [0,0,0,1,0,1|1,0,0]=3 9260 B14R2.786 O=C(O)[C@@]1(F)C[C@@H]1c2ccccc2 Amb24538836 [0,0,0,1,0,1|1,0,0]=3 9261 B14R2.786 O=C(O)[C@]1(Cl)C[C@@H]1c2ccccc2 Amb27637654 [0,0,0,1,0,1|1,0,0]=3 9262 B14R2.786 O=C(O)[C@]1(Cl)C[C@H]1c2ccccc2 Amb27966840 [0,0,0,1,0,1|1,0,0]=3 9263 B14R2.786 O=C(O)[C@]1(F)C[C@H]1c2ccccc2 Amb32648816 [0,0,0,1,0,1|1,0,0]=3 9264 B14R2.9535 CC(=O)C1(O)CCc2ccccc21 Amb25282827 [0,0,0,1,0,1|2,0,0]=4 9265 B14R2.9535 CC1(C(=O)O)CCc2ccccc21 Amb33548002 [0,0,0,1,0,1|1,0,0]=3 9266 B14R2.9535 C[C@@]1(C(=O)O)CCc2ccccc21 Amb27165707 [0,0,0,1,0,1|1,0,0]=3 9267 B14R2.9535 NC1(C(=O)O)CCc2ccccc21 Amb33545824 [0,0,0,1,0,1|0,0,0]=2 9268 B14R2.9535 NC1(C(=O)O)CCc2ccccc21 Amb9721127 [0,0,0,1,0,1|0,0,0]=2 9269 B14R2.9535 N[C@]1(C(=O)O)COc2ccccc21 Amb27817740 [0,0,0,1,0,1|0,0,0]=2 9270 B14R2.9535 O=C(O)C1(F)CCc2ccccc21 Amb28436351 [0,0,0,1,0,1|1,0,0]=3 9271 B14R2.30834 O=C(O)C1=Cc2ccc(cc2)CS1 Amb27984906 [0,0,0,1,0,1|1,0,1]=4 9272 B14R2.4400 CC1C(=O)CC1c2ccc(Cl)cc2 Amb28120840 [0,1,0,1,0,0|2,0,0]=4 9273 B14R2.4400 CC1C(=O)CC1c2ccc(F)cc2 Amb27165630 [0,1,0,1,0,0|2,0,0]=4 9274 B14R2.4400 CC1C(=O)NC1c2ccc(Br)cc2 Amb25365933 [0,1,0,1,0,0|2,0,0]=4 9275 B14R2.4400 CC1C(=O)NC1c2ccc(Cl)cc2 Amb27487922 [0,1,0,1,0,0|2,0,0]=4 9276 B14R2.4400 CC1C(=O)NC1c2ccc(F)cc2 Amb26584176 [0,1,0,1,0,0|2,0,0]=4 9277 B14R2.4400 Cc1ccc(C2NC(=O)C2C)cc1 Amb27797990 [0,1,0,1,0,0|2,0,0]=4 9278 B14R2.4400 NC1C(=O)NC1c2ccc(Br)cc2 Amb18730235 [0,1,0,1,0,0|1,0,0]=3 9279 B14R2.4400 O=C1NC(c2ccc(Cl)cc2)C1Cl Amb27810967 [0,1,0,1,0,0|2,0,0]=4 9280 B14R2.4400 O=C1N[C@@H](c2ccc(F)cc2)[C@H]1O Amb28057510 [0,1,0,1,0,0|2,0,0]=4 9281 B14R2.4402 CC(=O)C1CC1c2ccc(Br)cc2 Amb9212606 [0,1,0,1,0,0|2,0,0]=4 9282 B14R2.4402 CC(=O)C1CC1c2ccc(C)cc2 Amb9212613 [0,1,0,1,0,0|2,0,0]=4 9283 B14R2.4402 CC(=O)C1CC1c2ccc(Cl)cc2 Amb2406920 [0,1,0,1,0,0|2,0,0]=4 9284 B14R2.4402 CC(=O)C1CC1c2ccc(F)cc2 Amb2415814 [0,1,0,1,0,0|2,0,0]=4 9285 B14R2.4402 CC(=O)C1CC1c2ccc(O)cc2 Amb28202670 [0,1,0,1,0,0|2,0,0]=4 9286 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb33503957 [0,1,0,1,0,0|2,0,0]=4 9287 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(C)cc2 Amb27844140 [0,1,0,1,0,0|2,0,0]=4 9288 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb29838225 [0,1,0,1,0,0|2,0,0]=4 9289 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb33503958 [0,1,0,1,0,0|2,0,0]=4 9290 B14R2.4402 CC(=O)[C@@H]1C[C@H]1c2ccc(N)cc2 Amb33503960 [0,1,0,1,0,0|2,0,0]=4 9291 B14R2.4402 CC(=O)[C@H]1C[C@@H]1c2ccc(C)cc2 Amb27420132 [0,1,0,1,0,0|2,0,0]=4 9292 B14R2.4402 Cc1ccc(C2CC2C(=O)O)cc1 Amb2692979 [0,1,0,1,0,0|1,0,0]=3 9293 B14R2.4402 Cc1ccc(C2CC2C(=O)O)cn1 Amb28322887 [0,1,0,1,0,0|2,0,0]=4 9294 B14R2.4402 Cc1ccc(C2CC2C(=O)O)nc1 Amb27609015 [0,1,0,1,0,0|2,0,0]=4 9295 B14R2.4402 Cc1ccc([C@@H]2C[C@H]2C(=O)O)cc1 Amb27637728 [0,1,0,1,0,0|1,0,0]=3 9296 B14R2.4402 Cc1ccc([C@@H]2C[C@H]2C(=O)O)cn1 Amb32878621 [0,1,0,1,0,0|2,0,0]=4 9297 B14R2.4402 Cc1ccc([C@@H]2C[C@H]2C(=O)O)nc1 Amb33198870 [0,1,0,1,0,0|2,0,0]=4 9298 B14R2.4402 Cc1ccc([C@@H]2C[C@H]2C(N)=O)cc1 Amb27803808 [0,1,0,1,0,0|2,0,0]=4 9299 B14R2.4402 Cc1ccc([C@H]2C[C@@H]2C(N)=O)cc1 Amb27444671 [0,1,0,1,0,0|2,0,0]=4 9300 B14R2.4402 NC(=O)C1CC1c2ccc(Cl)cc2 Amb25108306 [0,1,0,1,0,0|2,0,0]=4 9301 B14R2.4402 NC(=O)C1CC1c2ccc(F)cc2 Amb21811908 [0,1,0,1,0,0|2,0,0]=4 9302 B14R2.4402 NC(=O)C1OC1c2ccc(F)cc2 Amb27587251 [0,1,0,1,0,0|2,0,0]=4 9303 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb27420065 [0,1,0,1,0,0|2,0,0]=4 9304 B14R2.4402 NC(=O)[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb28132803 [0,1,0,1,0,0|2,0,0]=4 9305 B14R2.4402 NC(=O)[C@@H]1O[C@H]1c2ccc(Cl)cc2 Amb28058989 [0,1,0,1,0,0|2,0,0]=4 9306 B14R2.4402 NC(=O)[C@@H]1O[C@H]1c2ccc(F)cc2 Amb27219247 [0,1,0,1,0,0|2,0,0]=4 9307 B14R2.4402 NC(=O)[C@H]1C[C@@H]1c2ccc(F)cc2 Amb27471870 [0,1,0,1,0,0|2,0,0]=4 9308 B14R2.4402 Nc1ccc(C2CC2C(=O)O)cc1 Amb27231758 [0,1,0,1,0,0|1,0,0]=3 9309 B14R2.4402 Nc1ccc([C@@H]2C[C@H]2C(=O)O)cc1 Amb25799160 [0,1,0,1,0,0|1,0,0]=3 9310 B14R2.4402 Nc1ccc([C@@H]2C[C@H]2C(=O)O)cn1 Amb33715586 [0,1,0,1,0,0|2,0,0]=4 9311 B14R2.4402 O=C(Cl)C1CC1c2ccc(Cl)cc2 Amb27597615 [0,1,0,1,0,0|2,0,0]=4 9312 B14R2.4402 O=C(Cl)C1CC1c2ccc(F)cc2 Amb24738452 [0,1,0,1,0,0|2,0,0]=4 9313 B14R2.4402 O=C(O)C1CC1c2ccc(Br)cc2 Amb9774990 [0,1,0,1,0,0|1,0,0]=3 9314 B14R2.4402 O=C(O)C1CC1c2ccc(Cl)cc2 Amb1935060 [0,1,0,1,0,0|1,0,0]=3 9315 B14R2.4402 O=C(O)C1CC1c2ccc(Cl)cn2 Amb33409827 [0,1,0,1,0,0|2,0,0]=4 9316 B14R2.4402 O=C(O)C1CC1c2ccc(Cl)nc2 Amb33390269 [0,1,0,1,0,0|2,0,0]=4 9317 B14R2.4402 O=C(O)C1CC1c2ccc(F)cc2 Amb17073012 [0,1,0,1,0,0|1,0,0]=3 9318 B14R2.4402 O=C(O)C1CC1c2ccc(F)cn2 Amb25725062 [0,1,0,1,0,0|2,0,0]=4 9319 B14R2.4402 O=C(O)C1CC1c2ccc(F)nc2 Amb33449313 [0,1,0,1,0,0|2,0,0]=4 9320 B14R2.4402 O=C(O)C1CC1c2ccc(O)cc2 Amb17568130 [0,1,0,1,0,0|1,0,0]=3 9321 B14R2.4402 O=C(O)C1OC1c2ccc(Br)cc2 Amb19929977 [0,1,0,1,0,0|1,0,0]=3 9322 B14R2.4402 O=C(O)C1OC1c2ccc(Cl)cc2 Amb19929982 [0,1,0,1,0,0|1,0,0]=3 9323 B14R2.4402 O=C(O)C1OC1c2ccc(F)cc2 Amb19929985 [0,1,0,1,0,0|1,0,0]=3 9324 B14R2.4402 O=C(O)[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb33098419 [0,1,0,1,0,0|1,0,0]=3 9325 B14R2.4402 O=C(O)[C@@H]1C[C@@H]1c2ccc(O)cc2 Amb25236047 [0,1,0,1,0,0|1,0,0]=3 9326 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb25175756 [0,1,0,1,0,0|1,0,0]=3 9327 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(Br)cn2 Amb33477135 [0,1,0,1,0,0|2,0,0]=4 9328 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(Br)nc2 Amb30869757 [0,1,0,1,0,0|2,0,0]=4 9329 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24742590 [0,1,0,1,0,0|1,0,0]=3 9330 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(Cl)nc2 Amb33261192 [0,1,0,1,0,0|2,0,0]=4 9331 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24557857 [0,1,0,1,0,0|1,0,0]=3 9332 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(F)cn2 Amb33316216 [0,1,0,1,0,0|2,0,0]=4 9333 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(F)nc2 Amb33426546 [0,1,0,1,0,0|2,0,0]=4 9334 B14R2.4402 O=C(O)[C@@H]1C[C@H]1c2ccc(O)cc2 Amb30869329 [0,1,0,1,0,0|1,0,0]=3 9335 B14R2.4402 O=C(O)[C@H]1C[C@@H]1c2ccc(Br)cc2 Amb26532527 [0,1,0,1,0,0|1,0,0]=3 9336 B14R2.4402 O=C(O)[C@H]1C[C@@H]1c2ccc(Br)nc2 Amb33806147 [0,1,0,1,0,0|2,0,0]=4 9337 B14R2.4402 O=C(O)[C@H]1C[C@@H]1c2ccc(O)cc2 Amb33806166 [0,1,0,1,0,0|1,0,0]=3 9338 B14R2.4402 O=C(O)[C@H]1C[C@H]1c2ccc(O)cc2 Amb34915558 [0,1,0,1,0,0|1,0,0]=3 9339 B14R2.4402 O=C(O)[C@H]1O[C@@H]1c2ccc(Cl)cc2 Amb28244778 [0,1,0,1,0,0|1,0,0]=3 9340 B14R2.4529 Cc1ccc2c(c1)CC(C(=O)O)N2 Amb10607438 [0,1,0,1,0,0|0,0,0]=2 9341 B14R2.4529 Cc1ccc2c(c1)CC(C(=O)O)N2 Amb13949031 [0,1,0,1,0,0|0,0,0]=2 9342 B14R2.4529 Cc1ccc2c(c1)CC(C(=O)O)O2 Amb17605544 [0,1,0,1,0,0|1,0,0]=3 9343 B14R2.4529 Cc1ccc2c(c1)CC(C(=O)O)S2 Amb31156410 [0,1,0,1,0,0|1,0,0]=3 9344 B14R2.4529 Cc1ccc2c(c1)CC(C(N)=O)O2 Amb27760323 [0,1,0,1,0,0|2,0,0]=4 9345 B14R2.4529 Cc1ccc2c(c1)C[C@H](C(=O)O)N2 Amb27264858 [0,1,0,1,0,0|0,0,0]=2 9346 B14R2.4529 Cc1ccc2c(c1)NC(C(=O)O)C2 Amb25137184 [0,1,0,1,0,0|0,0,0]=2 9347 B14R2.4529 Cc1ccc2c(c1)OC(C(=O)O)C2 Amb22755246 [0,1,0,1,0,0|1,0,0]=3 9348 B14R2.4529 Cc1ccc2c(c1)OC(C(N)=O)C2 Amb28366080 [0,1,0,1,0,0|2,0,0]=4 9349 B14R2.4529 Cc1ccc2c(c1)SC(C(=O)O)C2 Amb9703077 [0,1,0,1,0,0|1,0,0]=3 9350 B14R2.4529 Cc1cnc2c(c1)CC(C(=O)O)C2 Amb18196184 [0,1,0,1,0,0|2,0,0]=4 9351 B14R2.4529 NC(=O)C1Cc2cc(F)ccc2O1 Amb27476222 [0,1,0,1,0,0|2,0,0]=4 9352 B14R2.4529 Nc1ccc2c(c1)CC(C(=O)O)N2 Amb26559667 [0,1,0,1,0,0|0,0,0]=2 9353 B14R2.4529 Nc1ccc2c(c1)CC(C(=O)O)N2 Amb33483947 [0,1,0,1,0,0|0,0,0]=2 9354 B14R2.4529 Nc1ccc2c(c1)CC(C(=O)O)O2 Amb18670745 [0,1,0,1,0,0|1,0,0]=3 9355 B14R2.4529 Nc1ccc2c(c1)C[C@H](C(=O)O)N2 Amb28400149 [0,1,0,1,0,0|0,0,0]=2 9356 B14R2.4529 Nc1ccc2c(c1)NC(B(O)O)C2 Amb27962652 [0,1,0,1,0,0|1,0,1]=4 9357 B14R2.4529 Nc1ccc2c(c1)NC(C(=O)O)C2 Amb27258088 [0,1,0,1,0,0|0,0,0]=2 9358 B14R2.4529 Nc1ccc2c(c1)N[C@H](C(=O)O)C2 Amb27410927 [0,1,0,1,0,0|0,0,0]=2 9359 B14R2.4529 O=C(O)C1=Cc2ccc(Cl)cc2C1 Amb27657657 [0,1,0,1,0,0|1,0,1]=4 9360 B14R2.4529 O=C(O)C1Cc2cc(Br)ccc2N1 Amb27863880 [0,1,0,1,0,0|0,0,0]=2 9361 B14R2.4529 O=C(O)C1Cc2cc(Br)ccc2O1 Amb22751595 [0,1,0,1,0,0|1,0,0]=3 9362 B14R2.4529 O=C(O)C1Cc2cc(Br)ccc2S1 Amb27468634 [0,1,0,1,0,0|1,0,0]=3 9363 B14R2.4529 O=C(O)C1Cc2cc(Br)cnc2C1 Amb25332005 [0,1,0,1,0,0|2,0,0]=4 9364 B14R2.4529 O=C(O)C1Cc2cc(Br)cnc2C1 Amb33483366 [0,1,0,1,0,0|2,0,0]=4 9365 B14R2.4529 O=C(O)C1Cc2cc(Cl)ccc2N1 Amb10607441 [0,1,0,1,0,0|0,0,0]=2 9366 B14R2.4529 O=C(O)C1Cc2cc(Cl)ccc2N1 Amb11012593 [0,1,0,1,0,0|0,0,0]=2 9367 B14R2.4529 O=C(O)C1Cc2cc(Cl)ccc2O1 Amb444968 [0,1,0,1,0,0|1,0,0]=3 9368 B14R2.4529 O=C(O)C1Cc2cc(Cl)cnc2C1 Amb28316734 [0,1,0,1,0,0|2,0,0]=4 9369 B14R2.4529 O=C(O)C1Cc2cc(F)ccc2N1 Amb23538786 [0,1,0,1,0,0|0,0,0]=2 9370 B14R2.4529 O=C(O)C1Cc2cc(F)ccc2O1 Amb7767328 [0,1,0,1,0,0|1,0,0]=3 9371 B14R2.4529 O=C(O)C1Cc2cc(F)ccc2S1 Amb2372511 [0,1,0,1,0,0|1,0,0]=3 9372 B14R2.4529 O=C(O)C1Cc2cc(I)ccc2O1 Amb22751604 [0,1,0,1,0,0|1,0,0]=3 9373 B14R2.4529 O=C(O)C1Cc2ccc(Br)cc2C1 Amb18156517 [0,1,0,1,0,0|1,0,0]=3 9374 B14R2.4529 O=C(O)C1Cc2ccc(Br)cc2N1 Amb18561156 [0,1,0,1,0,0|0,0,0]=2 9375 B14R2.4529 O=C(O)C1Cc2ccc(Br)cc2O1 Amb33167033 [0,1,0,1,0,0|1,0,0]=3 9376 B14R2.4529 O=C(O)C1Cc2ccc(Cl)cc2N1 Amb18561158 [0,1,0,1,0,0|0,0,0]=2 9377 B14R2.4529 O=C(O)C1Cc2ccc(Cl)cc2O1 Amb22751591 [0,1,0,1,0,0|1,0,0]=3 9378 B14R2.4529 O=C(O)C1Cc2ccc(Cl)cc2S1 Amb2372509 [0,1,0,1,0,0|1,0,0]=3 9379 B14R2.4529 O=C(O)C1Cc2ccc(F)cc2C1 Amb24055929 [0,1,0,1,0,0|1,0,0]=3 9380 B14R2.4529 O=C(O)C1Cc2ccc(F)cc2N1 Amb24740897 [0,1,0,1,0,0|0,0,0]=2 9381 B14R2.4529 O=C(O)C1Cc2ccc(F)cc2N1 Amb33743880 [0,1,0,1,0,0|0,0,0]=2 9382 B14R2.4529 O=C(O)C1Cc2ccc(F)cc2O1 Amb22755265 [0,1,0,1,0,0|1,0,0]=3 9383 B14R2.4529 O=C(O)C1Cc2ccc(O)cc2N1 Amb24649443 [0,1,0,1,0,0|0,0,0]=2 9384 B14R2.4529 O=C(O)C1Cc2ccc(O)cc2O1 Amb21837686 [0,1,0,1,0,0|1,0,0]=3 9385 B14R2.4529 O=C(O)[C@@H]1Cc2cc(Br)ccc2N1 Amb24331855 [0,1,0,1,0,0|0,0,0]=2 9386 B14R2.4529 O=C(O)[C@@H]1Cc2cc(Cl)ccc2N1 Amb24331853 [0,1,0,1,0,0|0,0,0]=2 9387 B14R2.4529 O=C(O)[C@@H]1Cc2ccc(Br)cc2C1 Amb28461632 [0,1,0,1,0,0|1,0,0]=3 9388 B14R2.4529 O=C(O)[C@@H]1Cc2ccc(Cl)cc2N1 Amb27231583 [0,1,0,1,0,0|0,0,0]=2 9389 B14R2.4529 O=C(O)[C@@H]1Cc2ccc(F)cc2N1 Amb27225936 [0,1,0,1,0,0|0,0,0]=2 9390 B14R2.4529 O=C(O)[C@H]1Cc2cc(Cl)ccc2N1 Amb28067556 [0,1,0,1,0,0|0,0,0]=2 9391 B14R2.4529 O=C(O)[C@H]1Cc2cc(Cl)ccc2O1 Amb27426842 [0,1,0,1,0,0|1,0,0]=3 9392 B14R2.4529 O=C(O)[C@H]1Cc2ccc(Br)cc2N1 Amb27224948 [0,1,0,1,0,0|0,0,0]=2 9393 B14R2.4529 O=C1C=C2CC(C(=O)O)CC2=CN1 Amb26317954 [0,1,0,1,0,0|2,0,0]=4 9394 B14R2.8239 CC1Cc2cc(Br)ccc2NC1=O Amb18061644 [0,1,0,1,0,0|2,0,0]=4 9395 B14R2.8239 CC1Cc2cc(Cl)ccc2NC1=O Amb28243360 [0,1,0,1,0,0|2,0,0]=4 9396 B14R2.8239 CC1Cc2cc(F)ccc2OC1=O Amb27254150 [0,1,0,1,0,0|1,0,0]=3 9397 B14R2.8239 CC1Cc2cc(N)ccc2NC1=O Amb17400550 [0,1,0,1,0,0|2,0,0]=4 9398 B14R2.8239 CC1Cc2ccc(O)cc2OC1=O Amb27427122 [0,1,0,1,0,0|1,0,0]=3 9399 B14R2.8239 CC1Nc2cc(Cl)ccc2OC1=O Amb17217250 [0,1,0,1,0,0|2,0,0]=4 9400 B14R2.8239 CN1Cc2cc(Br)ccc2OC1=O Amb17844347 [0,1,0,1,0,0|2,0,0]=4 9401 B14R2.8239 CN1Cc2cc(N)ccc2OC1=O Amb35751952 [0,1,0,1,0,0|2,0,0]=4 9402 B14R2.8239 CN1Cc2cc(N)ccc2OC1=O Amb35753089 [0,1,0,1,0,0|2,0,0]=4 9403 B14R2.8239 C[C@@H]1Cc2cc(Br)ccc2NC1=O Amb28242486 [0,1,0,1,0,0|2,0,0]=4 9404 B14R2.8239 Cc1ccc2c(c1)C=C(N)C(=O)O2 Amb26054633 [0,1,0,1,0,0|0,0,2]=4 9405 B14R2.8239 Cc1ccc2c(c1)CC(=O)C(=O)O2 Amb28144182 [0,1,0,1,0,0|1,0,1]=4 9406 B14R2.8239 Cc1ccc2c(c1)CC(C)C(=O)N2 Amb17335060 [0,1,0,1,0,0|2,0,0]=4 9407 B14R2.8239 Cc1ccc2c(c1)CC(N)C(=O)N2 Amb24085839 [0,1,0,1,0,0|1,0,0]=3 9408 B14R2.8239 Cc1ccc2c(c1)C[C@H](O)C(=O)N2 Amb28205939 [0,1,0,1,0,0|2,0,0]=4 9409 B14R2.8239 Cc1ccc2c(c1)N=C(N)C(=O)O2 Amb18647952 [0,1,0,1,0,0|1,0,1]=4 9410 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(C)C2 Amb17335059 [0,1,0,1,0,0|2,0,0]=4 9411 B14R2.8239 Cc1ccc2c(c1)NC(=O)C(N)C2 Amb17470551 [0,1,0,1,0,0|1,0,0]=3 9412 B14R2.8239 Cc1ccc2c(c1)NC(C)C(=O)O2 Amb17217251 [0,1,0,1,0,0|2,0,0]=4 9413 B14R2.8239 Cc1ccc2c(n1)NC(=O)C(N)C2 Amb23571831 [0,1,0,1,0,0|2,0,0]=4 9414 B14R2.8239 N=C1Cc2cc(N)ccc2OC1=O Amb28366042 [0,1,0,1,0,0|0,0,2]=4 9415 B14R2.8239 NC1=Cc2cc(Br)ccc2OC1=O Amb25116013 [0,1,0,1,0,0|0,0,2]=4 9416 B14R2.8239 NC1=Cc2cc(F)ccc2OC1=O Amb27631411 [0,1,0,1,0,0|0,0,2]=4 9417 B14R2.8239 NC1=Cc2cc(N)ccc2OC1=O Amb26033314 [0,1,0,1,0,0|0,0,2]=4 9418 B14R2.8239 NC1=Cc2cc(O)ccc2OC1=O Amb25189956 [0,1,0,1,0,0|0,0,2]=4 9419 B14R2.8239 NC1=Nc2cc(Cl)ccc2OC1=O Amb24309782 [0,1,0,1,0,0|1,0,1]=4 9420 B14R2.8239 NC1Cc2cc(Br)ccc2NC1=O Amb22549344 [0,1,0,1,0,0|1,0,0]=3 9421 B14R2.8239 NC1Cc2cc(Br)cnc2NC1=O Amb32679846 [0,1,0,1,0,0|2,0,0]=4 9422 B14R2.8239 NC1Cc2cc(Br)cnc2NC1=O Amb33071724 [0,1,0,1,0,0|2,0,0]=4 9423 B14R2.8239 NC1Cc2cc(Cl)ccc2NC1=O Amb22740164 [0,1,0,1,0,0|1,0,0]=3 9424 B14R2.8239 NC1Cc2cc(F)ccc2NC1=O Amb27246040 [0,1,0,1,0,0|1,0,0]=3 9425 B14R2.8239 NC1Cc2cc(I)ccc2NC1=O Amb27240955 [0,1,0,1,0,0|1,0,0]=3 9426 B14R2.8239 NC1Cc2cc(O)ccc2NC1=O Amb27878823 [0,1,0,1,0,0|1,0,0]=3 9427 B14R2.8239 NC1Cc2ccc(Br)cc2NC1=O Amb27145966 [0,1,0,1,0,0|1,0,0]=3 9428 B14R2.8239 NC1Cc2ccc(Br)cc2NC1=O Amb31217585 [0,1,0,1,0,0|1,0,0]=3 9429 B14R2.8239 NC1Cc2ccc(Cl)cc2NC1=O Amb10602231 [0,1,0,1,0,0|1,0,0]=3 9430 B14R2.8239 NC1Cc2ccc(F)cc2NC1=O Amb17470621 [0,1,0,1,0,0|1,0,0]=3 9431 B14R2.8239 NC1Cc2ccc(O)cc2NC1=O Amb22751306 [0,1,0,1,0,0|1,0,0]=3 9432 B14R2.8239 O=C1Cc2ccc(O)cc2OC1=O Amb28351683 [0,1,0,1,0,0|1,0,1]=4 9433 B14R2.8239 O=C1Nc2ccc(Br)cc2CC1O Amb22899291 [0,1,0,1,0,0|2,0,0]=4 9434 B14R2.8239 O=C1Oc2ccc(Cl)cc2NC1Cl Amb27248306 [0,1,0,1,0,0|2,0,0]=4 9435 B14R2.29037 NC1CC2(C=CC(=O)C=C2)OC1=O Amb27883448 [0,1,0,1,0,0|0,0,1]=3 9436 B14R2.30 O=C1CCCC1Cc2ccccc2 Amb3994669 [0,1,0,1,0,0|2,0,0]=4 9437 B14R2.30 O=C1CCNC1Cc2ccccc2 Amb27863834 [0,1,0,1,0,0|1,0,0]=3 9438 B14R2.30 O=C1CCN[C@@H]1Cc2ccccc2 Amb18197192 [0,1,0,1,0,0|1,0,0]=3 9439 B14R2.30 O=C1CCOC1Cc2ccccc2 Amb27802566 [0,1,0,1,0,0|2,0,0]=4 9440 B14R2.30 O=C1CNCN1Cc2ccccc2 Amb23558083 [0,1,0,1,0,0|2,0,0]=4 9441 B14R2.30 O=C1CNCN1Cc2ccccc2 Amb32686946 [0,1,0,1,0,0|2,0,0]=4 9442 B14R2.30 O=C1COCC1Cc2ccccc2 Amb27599380 [0,1,0,1,0,0|1,0,0]=3 9443 B14R2.30 O=C1COCC1Cc2ccccn2 Amb35589718 [0,1,0,1,0,0|2,0,0]=4 9444 B14R2.30 O=C1COCC1Cc2cccnc2 Amb35589719 [0,1,0,1,0,0|2,0,0]=4 9445 B14R2.30 O=C1COCC1Cc2ccncc2 Amb35589717 [0,1,0,1,0,0|2,0,0]=4 9446 B14R2.30 O=C1NCCC1Cc2ccccc2 Amb33547402 [0,1,0,1,0,0|2,0,0]=4 9447 B14R2.30 O=C1OCCC1Cc2ccccc2 Amb28363627 [0,1,0,1,0,0|1,0,0]=3 9448 B14R2.30 O=C1OCCC1Nc2ccccc2 Amb25743171 [0,1,0,1,0,0|2,0,0]=4 9449 B14R2.30 O=C1OCCC1Oc2ccccc2 Amb28140570 [0,1,0,1,0,0|2,0,0]=4 9450 B14R2.30 O=C1OCCC1Sc2ccccc2 Amb3836146 [0,1,0,1,0,0|2,0,0]=4 9451 B14R2.30 OC1CCNC1Cc2ccccc2 Amb32410236 [0,1,0,1,0,0|1,0,1]=4 9452 B14R2.30 OC1CCN[C@@H]1Cc2ccccc2 Amb18195900 [0,1,0,1,0,0|1,0,1]=4 9453 B14R2.30 OC1CCN[C@H]1Cc2ccccc2 Amb24489269 [0,1,0,1,0,0|1,0,1]=4 9454 B14R2.30 OC1CNCC1Cc2ccccc2 Amb26848016 [0,1,0,1,0,0|1,0,1]=4 9455 B14R2.30 O[C@@H]1CNC[C@H]1Cc2ccccc2 Amb22747057 [0,1,0,1,0,0|1,0,1]=4 9456 B14R2.30 O[C@@H]1CNC[C@H]1Cc2ccccc2 Amb32992315 [0,1,0,1,0,0|1,0,1]=4 9457 B14R2.30 O[C@H]1CCN[C@H]1Cc2ccccc2 Amb27966070 [0,1,0,1,0,0|1,0,1]=4 9458 B14R2.447 CN1C(=O)C(Cl)C1c2ccccc2 Amb24663002 [0,1,0,1,0,0|2,0,0]=4 9459 B14R2.727 N[C@@]1(Cc2ccccc2)CNC1=O Amb27643425 [0,1,0,1,0,0|1,0,0]=3 9460 B14R2.958 CCC(=O)[C@H]1CC1c2ccccc2 Amb28126605 [0,1,0,1,0,0|2,0,0]=4 9461 B14R2.958 CNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27255278 [0,1,0,1,0,0|2,0,0]=4 9462 B14R2.958 COC(=O)C1CC1c2ccccc2 Amb6740592 [0,1,0,1,0,0|1,0,0]=3 9463 B14R2.958 COC(=O)C1CC1c2ccccn2 Amb25957540 [0,1,0,1,0,0|2,0,0]=4 9464 B14R2.958 COC(=O)C1CC1c2cccnc2 Amb25852071 [0,1,0,1,0,0|2,0,0]=4 9465 B14R2.958 COC(=O)C1N=C1c2ccccc2 Amb22325239 [0,1,0,1,0,0|0,0,2]=4 9466 B14R2.958 COC(=O)C1NC1c2ccccc2 Amb33624814 [0,1,0,1,0,0|0,0,0]=2 9467 B14R2.958 COC(=O)C1OC1c2ccccc2 Amb3940627 [0,1,0,1,0,0|1,0,0]=3 9468 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,1,0,1,0,0|1,0,0]=3 9469 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccn2 Amb24617301 [0,1,0,1,0,0|2,0,0]=4 9470 B14R2.958 COC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb27626014 [0,1,0,1,0,0|1,0,0]=3 9471 B14R2.958 COC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25961866 [0,1,0,1,0,0|1,0,0]=3 9472 B14R2.958 COC(=O)[C@H]1O[C@H]1c2ccccc2 Amb26612812 [0,1,0,1,0,0|1,0,0]=3 9473 B14R2.958 C\C(=N\O)C1CC1c2ccccc2 Amb29838174 [0,1,0,1,0,0|2,0,0]=4 9474 B14R2.958 NCC(=O)C1CC1c2ccccc2 Amb27811597 [0,1,0,1,0,0|2,0,0]=4 9475 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,1,0,1,0,0|2,0,0]=4 9476 B14R2.958 NNC(=O)C1OC1c2ccccc2 Amb28045849 [0,1,0,1,0,0|2,0,0]=4 9477 B14R2.958 NNC(=O)[C@@H]1CC1c2ccccc2 Amb27758203 [0,1,0,1,0,0|2,0,0]=4 9478 B14R2.958 NNC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb6565396 [0,1,0,1,0,0|2,0,0]=4 9479 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,1,0,1,0,0|2,0,0]=4 9480 B14R2.958 NNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27650747 [0,1,0,1,0,0|2,0,0]=4 9481 B14R2.958 O=C(CBr)[C@@H]1C[C@H]1c2ccccc2 Amb35752595 [0,1,0,1,0,0|2,0,0]=4 9482 B14R2.958 O=C(CCl)C1CC1c2ccccc2 Amb27609156 [0,1,0,1,0,0|2,0,0]=4 9483 B14R2.958 O=C(NO)C1CC1c2ccncc2 Amb27825987 [0,1,0,1,0,0|2,0,0]=4 9484 B14R2.958 O=CC(O)C1CC1c2ccccc2 Amb27874923 [0,1,0,1,0,0|1,0,1]=4 9485 B14R2.972 C#CC(=O)C1Cc2ccccc2S1 Amb27465789 [0,1,0,1,0,0|2,0,0]=4 9486 B14R2.972 C#CC(O)C1Cc2ccccc2N1 Amb35583400 [0,1,0,1,0,0|1,0,1]=4 9487 B14R2.972 C=C(CO)C1Cc2ccccc2O1 Amb27969082 [0,1,0,1,0,0|2,0,0]=4 9488 B14R2.972 C=CC(=O)C1Cc2ccccc2C1 Amb27628334 [0,1,0,1,0,0|2,0,0]=4 9489 B14R2.972 CCC(=O)C1Cc2ccccc2C1 Amb27597373 [0,1,0,1,0,0|2,0,0]=4 9490 B14R2.972 CCC(=O)C1Cc2ccccc2O1 Amb27203228 [0,1,0,1,0,0|2,0,0]=4 9491 B14R2.972 CC[C@@H](O)[C@@H]1Cc2ccccc2N1 Amb27629722 [0,1,0,1,0,0|1,0,1]=4 9492 B14R2.972 CNC(=O)C1Cc2ccccc2N1 Amb28600354 [0,1,0,1,0,0|1,0,0]=3 9493 B14R2.972 CNC(=O)C1Cc2ccccc2N1 Amb7173129 [0,1,0,1,0,0|1,0,0]=3 9494 B14R2.972 CNC(=O)C1Cc2ccccc2O1 Amb8328022 [0,1,0,1,0,0|2,0,0]=4 9495 B14R2.972 CNC(=O)C1Cc2ccccc2S1 Amb8332053 [0,1,0,1,0,0|2,0,0]=4 9496 B14R2.972 CNC(=O)[C@@H]1Cc2ccccc2N1 Amb9753471 [0,1,0,1,0,0|1,0,0]=3 9497 B14R2.972 COC(=O)C1=Cc2ccccc2C1 Amb25776174 [0,1,0,1,0,0|1,0,1]=4 9498 B14R2.972 COC(=O)C1Cc2ccccc2C1 Amb21859222 [0,1,0,1,0,0|1,0,0]=3 9499 B14R2.972 COC(=O)C1Cc2ccccc2N1 Amb2724864 [0,1,0,1,0,0|0,0,0]=2 9500 B14R2.972 COC(=O)C1Cc2ccccc2N1 Amb33804592 [0,1,0,1,0,0|0,0,0]=2 9501 B14R2.972 COC(=O)C1Cc2ccccc2O1 Amb9246802 [0,1,0,1,0,0|1,0,0]=3 9502 B14R2.972 COC(=O)C1Cc2cccnc2N1 Amb25108180 [0,1,0,1,0,0|1,0,0]=3 9503 B14R2.972 COC(=O)C1Cc2cnccc2N1 Amb28290381 [0,1,0,1,0,0|1,0,0]=3 9504 B14R2.972 COC(=O)C1Oc2ccccc2O1 Amb9782874 [0,1,0,1,0,0|2,0,0]=4 9505 B14R2.972 COC(=O)N1Cc2ccccc2C1 Amb8439541 [0,1,0,1,0,0|2,0,0]=4 9506 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb18180641 [0,1,0,1,0,0|0,0,0]=2 9507 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb33716840 [0,1,0,1,0,0|0,0,0]=2 9508 B14R2.972 COC(=O)[C@H]1Cc2ccccc2N1 Amb25751911 [0,1,0,1,0,0|0,0,0]=2 9509 B14R2.972 NC(CO)C1Cc2ccccc2N1 Amb27209769 [0,1,0,1,0,0|1,0,1]=4 9510 B14R2.972 NCC(=O)C1Cc2ccccc2C1 Amb33143545 [0,1,0,1,0,0|2,0,0]=4 9511 B14R2.972 NNC(=O)C1Cc2ccccc2C1 Amb25694155 [0,1,0,1,0,0|2,0,0]=4 9512 B14R2.972 NNC(=O)C1Cc2ccccc2O1 Amb6245342 [0,1,0,1,0,0|2,0,0]=4 9513 B14R2.972 NNC(=O)C1Cc2ccccc2S1 Amb32708530 [0,1,0,1,0,0|2,0,0]=4 9514 B14R2.972 NNC(=O)[C@@H]1Cc2ccccc2N1 Amb27239419 [0,1,0,1,0,0|1,0,0]=3 9515 B14R2.972 N\C(=N\O)C1Cc2ccccc2C1 Amb27759828 [0,1,0,1,0,0|2,0,0]=4 9516 B14R2.972 N\C(=N\O)C1Cc2ccccc2O1 Amb27954535 [0,1,0,1,0,0|2,0,0]=4 9517 B14R2.972 O=C(CCl)C1Cc2ccccc2C1 Amb25721869 [0,1,0,1,0,0|2,0,0]=4 9518 B14R2.972 O=C(NO)[C@@H]1Cc2ccccc2N1 Amb27765437 [0,1,0,1,0,0|0,0,0]=2 9519 B14R2.1039 C[C@]1(Cc2ccccc2)O[C@@H]1C=O Amb28052719 [0,1,0,1,0,0|1,0,1]=4 9520 B14R2.1128 CCC1Cc2ccccc2NC1=O Amb17335061 [0,1,0,1,0,0|2,0,0]=4 9521 B14R2.1128 CNC1Cc2ccccc2NC1=O Amb27984872 [0,1,0,1,0,0|1,0,0]=3 9522 B14R2.1128 CNN1Cc2ccccc2CC1=O Amb27474470 [0,1,0,1,0,0|2,0,0]=4 9523 B14R2.1128 CN[C@@H]1Cc2ccccc2C[C@@H]1O Amb27848968 [0,1,0,1,0,0|1,0,1]=4 9524 B14R2.1128 CN[C@@H]1Cc2ccccc2C[C@H]1O Amb28052175 [0,1,0,1,0,0|1,0,1]=4 9525 B14R2.1128 CN[C@H]1Cc2ccccc2O[C@H]1C Amb27476224 [0,1,0,1,0,0|1,0,1]=4 9526 B14R2.1128 N#CC1Cc2ccccc2NC1=O Amb5744823 [0,1,0,1,0,0|1,0,1]=4 9527 B14R2.1128 NC1Cc2ccccc2C\C1=N\O Amb28422735 [0,1,0,1,0,0|1,0,0]=3 9528 B14R2.1128 NC1Cc2ccccc2OC1CBr Amb32670218 [0,1,0,1,0,0|1,0,1]=4 9529 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [0,1,0,1,0,0|0,0,2]=4 9530 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb32686597 [0,1,0,1,0,0|0,0,2]=4 9531 B14R2.1128 NCC1Cc2ccccc2NC1=O Amb19149340 [0,1,0,1,0,0|1,0,0]=3 9532 B14R2.1128 NCC1Cc2ccccc2NC1=O Amb5744688 [0,1,0,1,0,0|1,0,0]=3 9533 B14R2.1128 NCC1Oc2ccccc2NC1=O Amb17335218 [0,1,0,1,0,0|2,0,0]=4 9534 B14R2.1128 NNC1Nc2ccccc2NC1=O Amb27407927 [0,1,0,1,0,0|2,0,0]=4 9535 B14R2.1128 O=C1Oc2ccccc2C\C1=N\O Amb27441913 [0,1,0,1,0,0|0,0,2]=4 9536 B14R2.1128 O=C1Oc2ccccc2N=C1NO Amb20641490 [0,1,0,1,0,0|1,0,1]=4 9537 B14R2.1128 O\N=C1\Oc2ccccc2CC1O Amb28066022 [0,1,0,1,0,0|1,0,1]=4 9538 B14R2.4514 CC1C(=O)CCC1c2ccccc2 Amb24051457 [0,1,0,1,0,0|2,0,0]=4 9539 B14R2.4514 CC1C(=O)NCC1c2ccccc2 Amb24312552 [0,1,0,1,0,0|2,0,0]=4 9540 B14R2.4514 CC1C(=O)NNC1c2ccccc2 Amb35686094 [0,1,0,1,0,0|2,0,0]=4 9541 B14R2.4514 CN1C(=O)OC[C@H]1c2ccccc2 Amb28463841 [0,1,0,1,0,0|2,0,0]=4 9542 B14R2.4514 C[C@@H]1C(=O)C=C[C@H]1c2ccccc2 Amb28054304 [0,1,0,1,0,0|2,0,0]=4 9543 B14R2.4514 C[C@@H]1C(=O)NC[C@H]1c2ccccc2 Amb27197156 [0,1,0,1,0,0|2,0,0]=4 9544 B14R2.4514 C[C@@H]1CO[C@@H](c2ccccc2)[C@@H]1N Amb28058345 [0,1,0,1,0,0|1,0,1]=4 9545 B14R2.4514 C[C@H]1C(=O)CC[C@@H]1c2ccccc2 Amb27428256 [0,1,0,1,0,0|2,0,0]=4 9546 B14R2.4514 NC1C(=O)NCC1c2ccccc2 Amb9777200 [0,1,0,1,0,0|1,0,0]=3 9547 B14R2.4514 NC1C(=O)NN=C1c2ccccc2 Amb32664293 [0,1,0,1,0,0|1,0,1]=4 9548 B14R2.4514 NC1C(=O)NNC1c2ccccc2 Amb27233460 [0,1,0,1,0,0|1,0,0]=3 9549 B14R2.4514 NC1C(=O)NOC1c2ccccc2 Amb27173267 [0,1,0,1,0,0|0,0,0]=2 9550 B14R2.4514 N[C@@H]1C(=O)NC[C@@H]1c2ccccc2 Amb27446526 [0,1,0,1,0,0|1,0,0]=3 9551 B14R2.4514 N[C@@H]1C(=O)NC[C@H]1c2ccccc2 Amb28320723 [0,1,0,1,0,0|1,0,0]=3 9552 B14R2.4514 N[C@@H]1C(=O)NO[C@H]1c2ccccc2 Amb27637661 [0,1,0,1,0,0|0,0,0]=2 9553 B14R2.4514 N[C@H]1C(=O)NO[C@H]1c2ccccc2 Amb27781524 [0,1,0,1,0,0|0,0,0]=2 9554 B14R2.4514 O=C1NN[C@H](c2ccccc2)[C@H]1O Amb27213923 [0,1,0,1,0,0|2,0,0]=4 9555 B14R2.4514 O=C1OCC(c2ccccc2)C1O Amb27653185 [0,1,0,1,0,0|1,0,0]=3 9556 B14R2.8188 CC1=C(N)C(=O)Oc2ccccc21 Amb18127405 [0,1,0,1,0,0|0,0,2]=4 9557 B14R2.8188 CC1Cc2ccccc2N(C)C1=O Amb18061650 [0,1,0,1,0,0|2,0,0]=4 9558 B14R2.8188 CC1Oc2ccccc2C(O)C1N Amb27863475 [0,1,0,1,0,0|1,0,1]=4 9559 B14R2.8188 CC1Oc2ccccc2C(O)[C@H]1N Amb27984786 [0,1,0,1,0,0|1,0,1]=4 9560 B14R2.8188 CC1c2ccccc2NC(=O)C1N Amb27403035 [0,1,0,1,0,0|1,0,0]=3 9561 B14R2.8188 CN1C(=O)C(N)Cc2ccccc21 Amb18559243 [0,1,0,1,0,0|1,0,0]=3 9562 B14R2.8188 CN1C(=O)C(N)Cc2ccccc21 Amb28600349 [0,1,0,1,0,0|1,0,0]=3 9563 B14R2.8188 NC1=C(N)c2ccccc2OC1=O Amb18647951 [0,1,0,1,0,0|0,0,2]=4 9564 B14R2.8188 NC1=C(O)C(=O)c2ccccc2O1 Amb28054811 [0,1,0,1,0,0|1,0,1]=4 9565 B14R2.8188 NC1=Cc2ccccc2N(O)C1=O Amb27244820 [0,1,0,1,0,0|0,0,2]=4 9566 B14R2.8188 NC1Cc2ccccc2C(Cl)C1O Amb28342318 [0,1,0,1,0,0|1,0,1]=4 9567 B14R2.8188 NC1Cc2ccccc2N(O)C1=O Amb22372298 [0,1,0,1,0,0|0,0,0]=2 9568 B14R2.8188 NC1Cc2ccccc2N(O)C1O Amb27853902 [0,1,0,1,0,0|0,0,2]=4 9569 B14R2.8188 NC1Cc2cccnc2N(O)C1=O Amb27633860 [0,1,0,1,0,0|1,0,0]=3 9570 B14R2.8188 N[C@@H]1Cc2ccccc2N(O)C1=O Amb27597452 [0,1,0,1,0,0|0,0,0]=2 9571 B14R2.8188 N[C@@H]1Cc2ccccc2[C@@H](Cl)[C@H]1O Amb27865412 [0,1,0,1,0,0|1,0,1]=4 9572 B14R2.8188 N[C@H]1Cc2ccccc2N(O)C1=O Amb25039392 [0,1,0,1,0,0|0,0,0]=2 9573 B14R2.8188 N[C@H]1Cc2ccncc2N(O)C1=O Amb27606310 [0,1,0,1,0,0|1,0,0]=3 9574 B14R2.8188 O=C1C(Cl)Cc2ccccc2N1O Amb27179194 [0,1,0,1,0,0|1,0,0]=3 9575 B14R2.8188 O=C1C(O)Oc2ccccc2N1O Amb9824609 [0,1,0,1,0,0|2,0,0]=4 9576 B14R2.8188 O=C1Nc2ccccc2C(O)C1O Amb28120097 [0,1,0,1,0,0|2,0,0]=4 9577 B14R2.8188 O=C1Oc2ccccc2C(Br)C1Br Amb2137043 [0,1,0,1,0,0|1,0,0]=3 9578 B14R2.8188 O=C1Oc2ccccc2[C@H](O)[C@@H]1O Amb27631997 [0,1,0,1,0,0|1,0,0]=3 9579 B14R2.10659 COC(=O)C1(C)Cc2ccccc21 Amb25341517 [0,1,0,1,0,0|1,0,0]=3 9580 B14R2.4473 CC1C(=O)CC1c2cccc(Cl)c2 Amb27654891 [0,1,0,1,0,0|2,0,0]=4 9581 B14R2.4473 CC1C(=O)CC1c2cccc(F)c2 Amb27608703 [0,1,0,1,0,0|2,0,0]=4 9582 B14R2.4473 CC1C(=O)NC1c2cccc(Br)c2 Amb25158423 [0,1,0,1,0,0|2,0,0]=4 9583 B14R2.4473 CC1C(=O)NC1c2cccc(Cl)c2 Amb27257692 [0,1,0,1,0,0|2,0,0]=4 9584 B14R2.4473 CC1C(=O)NC1c2cccc(F)c2 Amb25744303 [0,1,0,1,0,0|2,0,0]=4 9585 B14R2.4473 Cc1cccc(C2NC(=O)C2C)c1 Amb26656949 [0,1,0,1,0,0|2,0,0]=4 9586 B14R2.4473 NC1C(=O)NC1c2cccc(Br)c2 Amb18730227 [0,1,0,1,0,0|1,0,0]=3 9587 B14R2.4476 CC(=O)C1CC1c2cccc(C)c2 Amb9212634 [0,1,0,1,0,0|2,0,0]=4 9588 B14R2.4476 CC(=O)C1CC1c2cccc(Cl)c2 Amb9212616 [0,1,0,1,0,0|2,0,0]=4 9589 B14R2.4476 CC(=O)C1CC1c2cccc(F)c2 Amb9212635 [0,1,0,1,0,0|2,0,0]=4 9590 B14R2.4476 CC(=O)C1CC1c2cccc(I)c2 Amb27463921 [0,1,0,1,0,0|2,0,0]=4 9591 B14R2.4476 CC(=O)C1OC1c2cccc(C)c2 Amb28351440 [0,1,0,1,0,0|2,0,0]=4 9592 B14R2.4476 CC(=O)[C@@H]1C[C@H]1c2cccc(Br)c2 Amb29838251 [0,1,0,1,0,0|2,0,0]=4 9593 B14R2.4476 CC(=O)[C@@H]1C[C@H]1c2cccc(C)c2 Amb25262717 [0,1,0,1,0,0|2,0,0]=4 9594 B14R2.4476 CC(=O)[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb32943317 [0,1,0,1,0,0|2,0,0]=4 9595 B14R2.4476 CC(=O)[C@@H]1C[C@H]1c2cccc(F)c2 Amb33503956 [0,1,0,1,0,0|2,0,0]=4 9596 B14R2.4476 CC(=O)[C@@H]1C[C@H]1c2cccc(N)c2 Amb33503959 [0,1,0,1,0,0|2,0,0]=4 9597 B14R2.4476 CC(=O)[C@H]1C[C@@H]1c2cccc(C)c2 Amb27420129 [0,1,0,1,0,0|2,0,0]=4 9598 B14R2.4476 Cc1cc(C2CC2C(=O)O)ccn1 Amb33172562 [0,1,0,1,0,0|2,0,0]=4 9599 B14R2.4476 Cc1cc([C@@H]2C[C@H]2C(=O)O)ccn1 Amb33268215 [0,1,0,1,0,0|2,0,0]=4 9600 B14R2.4476 Cc1cccc(C2CC2C(=O)O)c1 Amb9677088 [0,1,0,1,0,0|1,0,0]=3 9601 B14R2.4476 Cc1cccc(C2CC2C(=O)O)n1 Amb33448431 [0,1,0,1,0,0|2,0,0]=4 9602 B14R2.4476 Cc1cccc(C2CC2C(N)=O)c1 Amb24490097 [0,1,0,1,0,0|2,0,0]=4 9603 B14R2.4476 Cc1cccc([C@@H]2C[C@H]2C(=O)O)c1 Amb28208675 [0,1,0,1,0,0|1,0,0]=3 9604 B14R2.4476 Cc1cccc([C@@H]2C[C@H]2C(=O)O)n1 Amb33199986 [0,1,0,1,0,0|2,0,0]=4 9605 B14R2.4476 Cc1cccc([C@H]2C[C@@H]2C(=O)O)c1 Amb24567212 [0,1,0,1,0,0|1,0,0]=3 9606 B14R2.4476 Cc1ccnc(C2CC2C(=O)O)c1 Amb32953362 [0,1,0,1,0,0|2,0,0]=4 9607 B14R2.4476 Cc1ccnc([C@@H]2C[C@H]2C(=O)O)c1 Amb33318402 [0,1,0,1,0,0|2,0,0]=4 9608 B14R2.4476 Cc1cncc(C2CC2C(=O)O)c1 Amb33449633 [0,1,0,1,0,0|2,0,0]=4 9609 B14R2.4476 Cc1cncc([C@@H]2C[C@H]2C(=O)O)c1 Amb33318316 [0,1,0,1,0,0|2,0,0]=4 9610 B14R2.4476 NC(=O)C1CC1c2cccc(Br)c2 Amb13322380 [0,1,0,1,0,0|2,0,0]=4 9611 B14R2.4476 NC(=O)C1CC1c2cccc(Cl)c2 Amb25738001 [0,1,0,1,0,0|2,0,0]=4 9612 B14R2.4476 NC(=O)C1CC1c2cccc(F)c2 Amb24677885 [0,1,0,1,0,0|2,0,0]=4 9613 B14R2.4476 NC(=O)C1OC1c2cccc(Cl)c2 Amb27635277 [0,1,0,1,0,0|2,0,0]=4 9614 B14R2.4476 NC(=O)[C@H]1C[C@@H]1c2cccc(Cl)c2 Amb28142369 [0,1,0,1,0,0|2,0,0]=4 9615 B14R2.4476 NC(=O)[C@H]1C[C@@H]1c2cccc(O)c2 Amb27420733 [0,1,0,1,0,0|2,0,0]=4 9616 B14R2.4476 Nc1cccc(C2CC2C(=O)O)c1 Amb25238282 [0,1,0,1,0,0|1,0,0]=3 9617 B14R2.4476 O=C(O)C1CC1c2cc(Cl)ccn2 Amb33261403 [0,1,0,1,0,0|2,0,0]=4 9618 B14R2.4476 O=C(O)C1CC1c2cc(F)ccn2 Amb33415000 [0,1,0,1,0,0|2,0,0]=4 9619 B14R2.4476 O=C(O)C1CC1c2cccc(Br)c2 Amb9677125 [0,1,0,1,0,0|1,0,0]=3 9620 B14R2.4476 O=C(O)C1CC1c2cccc(Br)n2 Amb33432759 [0,1,0,1,0,0|2,0,0]=4 9621 B14R2.4476 O=C(O)C1CC1c2cccc(Cl)c2 Amb9677114 [0,1,0,1,0,0|1,0,0]=3 9622 B14R2.4476 O=C(O)C1CC1c2cccc(Cl)n2 Amb33052005 [0,1,0,1,0,0|2,0,0]=4 9623 B14R2.4476 O=C(O)C1CC1c2cccc(F)c2 Amb9677087 [0,1,0,1,0,0|1,0,0]=3 9624 B14R2.4476 O=C(O)C1CC1c2cccc(O)c2 Amb17568185 [0,1,0,1,0,0|1,0,0]=3 9625 B14R2.4476 O=C(O)C1CC1c2ccnc(Cl)c2 Amb33262019 [0,1,0,1,0,0|2,0,0]=4 9626 B14R2.4476 O=C(O)C1CC1c2cncc(Br)c2 Amb27254961 [0,1,0,1,0,0|2,0,0]=4 9627 B14R2.4476 O=C(O)C1CC1c2cncc(F)c2 Amb33475061 [0,1,0,1,0,0|2,0,0]=4 9628 B14R2.4476 O=C(O)C1OC1c2cccc(Br)c2 Amb19929979 [0,1,0,1,0,0|1,0,0]=3 9629 B14R2.4476 O=C(O)C1OC1c2cccc(Cl)c2 Amb19929981 [0,1,0,1,0,0|1,0,0]=3 9630 B14R2.4476 O=C(O)C1OC1c2cccc(F)c2 Amb19929984 [0,1,0,1,0,0|1,0,0]=3 9631 B14R2.4476 O=C(O)[C@@H]1CC1c2cccc(Br)c2 Amb24058242 [0,1,0,1,0,0|1,0,0]=3 9632 B14R2.4476 O=C(O)[C@@H]1C[C@@H]1c2cccc(Br)c2 Amb34916227 [0,1,0,1,0,0|1,0,0]=3 9633 B14R2.4476 O=C(O)[C@@H]1C[C@@H]1c2cccc(Cl)c2 Amb34916228 [0,1,0,1,0,0|1,0,0]=3 9634 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cc(F)ccn2 Amb33414598 [0,1,0,1,0,0|2,0,0]=4 9635 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(Br)c2 Amb27407185 [0,1,0,1,0,0|1,0,0]=3 9636 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(Br)n2 Amb33432776 [0,1,0,1,0,0|2,0,0]=4 9637 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(Cl)c2 Amb26928614 [0,1,0,1,0,0|1,0,0]=3 9638 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(Cl)n2 Amb33223319 [0,1,0,1,0,0|2,0,0]=4 9639 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(F)c2 Amb25322492 [0,1,0,1,0,0|1,0,0]=3 9640 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cccc(O)c2 Amb26480954 [0,1,0,1,0,0|1,0,0]=3 9641 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cncc(Br)c2 Amb33389099 [0,1,0,1,0,0|2,0,0]=4 9642 B14R2.4476 O=C(O)[C@@H]1C[C@H]1c2cncc(F)c2 Amb33196677 [0,1,0,1,0,0|2,0,0]=4 9643 B14R2.4476 O=C(O)[C@H]1C[C@@H]1c2cccc(F)c2 Amb28245102 [0,1,0,1,0,0|1,0,0]=3 9644 B14R2.4476 O=C(O)[C@H]1C[C@@H]1c2cccc(O)c2 Amb24738654 [0,1,0,1,0,0|1,0,0]=3 9645 B14R2.7969 CC(=O)C1Cc2c(O)cccc2O1 Amb27599393 [0,1,0,1,0,0|2,0,0]=4 9646 B14R2.7969 CC(=O)C1Cc2cccc(Br)c2C1 Amb27646074 [0,1,0,1,0,0|2,0,0]=4 9647 B14R2.7969 CC(=O)C1Cc2cccc(Cl)c2C1 Amb28249522 [0,1,0,1,0,0|2,0,0]=4 9648 B14R2.7969 Cc1cccc2c1CC(C(=O)O)N2 Amb25758824 [0,1,0,1,0,0|0,0,0]=2 9649 B14R2.7969 Cc1cccc2c1CC(C(=O)O)N2 Amb31146921 [0,1,0,1,0,0|0,0,0]=2 9650 B14R2.7969 Cc1cccc2c1CC(C(=O)O)O2 Amb22755232 [0,1,0,1,0,0|1,0,0]=3 9651 B14R2.7969 Cc1cccc2c1CC(C(N)=O)O2 Amb28291483 [0,1,0,1,0,0|2,0,0]=4 9652 B14R2.7969 Cc1cccc2c1OC(C(=O)O)C2 Amb22755216 [0,1,0,1,0,0|1,0,0]=3 9653 B14R2.7969 Cc1cccc2c1OC(C(N)=O)C2 Amb27862534 [0,1,0,1,0,0|2,0,0]=4 9654 B14R2.7969 Cc1cncc2c1CC(C(=O)O)C2 Amb18196183 [0,1,0,1,0,0|2,0,0]=4 9655 B14R2.7969 NC(=O)C1Cc2cccc(Br)c2C1 Amb27840889 [0,1,0,1,0,0|2,0,0]=4 9656 B14R2.7969 Nc1cccc2c1N[C@@H](C(=O)O)C2 Amb27194985 [0,1,0,1,0,0|0,0,0]=2 9657 B14R2.7969 O=C(O)C1C[n+]2cccc([O-])c2S1 Amb28195084 [0,1,0,1,0,0|2,0,0]=4 9658 B14R2.7969 O=C(O)C1Cc2c(Br)cccc2O1 Amb33167048 [0,1,0,1,0,0|1,0,0]=3 9659 B14R2.7969 O=C(O)C1Cc2c(Cl)cccc2O1 Amb26980965 [0,1,0,1,0,0|1,0,0]=3 9660 B14R2.7969 O=C(O)C1Cc2c(F)cccc2N1 Amb26066481 [0,1,0,1,0,0|0,0,0]=2 9661 B14R2.7969 O=C(O)C1Cc2c(F)cccc2S1 Amb9765509 [0,1,0,1,0,0|1,0,0]=3 9662 B14R2.7969 O=C(O)C1Cc2cccc(Br)c2C1 Amb18156516 [0,1,0,1,0,0|1,0,0]=3 9663 B14R2.7969 O=C(O)C1Cc2cccc(Br)c2O1 Amb27180897 [0,1,0,1,0,0|1,0,0]=3 9664 B14R2.7969 O=C(O)C1Cc2cccc(Cl)c2C1 Amb24740757 [0,1,0,1,0,0|1,0,0]=3 9665 B14R2.7969 O=C(O)C1Cc2cccc(Cl)c2N1 Amb27831484 [0,1,0,1,0,0|0,0,0]=2 9666 B14R2.7969 O=C(O)C1Cc2cccc(Cl)c2O1 Amb22235978 [0,1,0,1,0,0|1,0,0]=3 9667 B14R2.7969 O=C(O)C1Cc2cccc(F)c2O1 Amb19148286 [0,1,0,1,0,0|1,0,0]=3 9668 B14R2.7969 O=C(O)[C@@H]1Cc2c(I)cccc2N1 Amb27398479 [0,1,0,1,0,0|0,0,0]=2 9669 B14R2.7969 O=C(O)[C@H]1Cc2c(F)cccc2N1 Amb27948148 [0,1,0,1,0,0|0,0,0]=2 9670 B14R2.7969 O=C(O)[C@H]1Cc2cccc(Br)c2N1 Amb27225980 [0,1,0,1,0,0|0,0,0]=2 9671 B14R2.7969 O=C(O)[C@H]1Cc2cccc(F)c2N1 Amb27976362 [0,1,0,1,0,0|0,0,0]=2 9672 B14R2.28472 Cc1cccc2c1CC(N)C(=O)N2 Amb17470552 [0,1,0,1,0,0|1,0,0]=3 9673 B14R2.28472 Cc1cccc2c1NC(=O)C(C)C2 Amb17335058 [0,1,0,1,0,0|2,0,0]=4 9674 B14R2.28472 Cc1cccc2c1NC(=O)C(N)C2 Amb27632324 [0,1,0,1,0,0|1,0,0]=3 9675 B14R2.28472 Cc1cccc2c1NC(=O)C(O)C2 Amb28243418 [0,1,0,1,0,0|2,0,0]=4 9676 B14R2.28472 Cc1cccc2c1OC(=O)C(N)=C2 Amb27165226 [0,1,0,1,0,0|0,0,2]=4 9677 B14R2.28472 Cc1ccnc2c1CC(N)C(=O)N2 Amb32681980 [0,1,0,1,0,0|2,0,0]=4 9678 B14R2.28472 NC1=Cc2c(F)cccc2OC1=O Amb27242642 [0,1,0,1,0,0|0,0,2]=4 9679 B14R2.28472 NC1=Cc2cccc(O)c2OC1=O Amb18127813 [0,1,0,1,0,0|0,0,2]=4 9680 B14R2.28472 NC1Cc2c(Cl)cccc2NC1=O Amb17470947 [0,1,0,1,0,0|1,0,0]=3 9681 B14R2.28472 NC1Cc2c(F)cccc2NC1=O Amb17470622 [0,1,0,1,0,0|1,0,0]=3 9682 B14R2.28472 NC1Cc2c(O)cccc2CC1O Amb27792012 [0,1,0,1,0,0|1,0,1]=4 9683 B14R2.28472 NC1Cc2cccc(Br)c2NC1=O Amb27868645 [0,1,0,1,0,0|1,0,0]=3 9684 B14R2.28472 NC1Cc2cccc(Cl)c2NC1=O Amb28388410 [0,1,0,1,0,0|1,0,0]=3 9685 B14R2.28472 NC1Cc2cccc(I)c2NC1=O Amb28364429 [0,1,0,1,0,0|1,0,0]=3 9686 B14R2.28472 NC1Cc2cccc(O)c2CC1O Amb27847584 [0,1,0,1,0,0|1,0,1]=4 9687 B14R2.28472 NC1Cc2cccc(O)c2NC1=O Amb27231835 [0,1,0,1,0,0|1,0,0]=3 9688 B14R2.28472 N[C@H]1Cc2cccc(O)c2C[C@@H]1O Amb27788439 [0,1,0,1,0,0|1,0,1]=4 9689 B14R2.28472 Nc1cccc2c1CC(N)C(=O)N2 Amb27983585 [0,1,0,1,0,0|1,0,0]=3 9690 B14R2.28472 O=C1Nc2cccc(F)c2CC1O Amb27415161 [0,1,0,1,0,0|2,0,0]=4 9691 B14R2.28521 CC1(C(=O)O)Cc2cccc(Cl)c21 Amb32794571 [0,1,0,1,0,0|1,0,0]=3 9692 B14R2.335 O=C1COC1C(Cl)c2ccccc2 Amb28143592 [0,1,0,1,0,0|2,0,0]=4 9693 B14R2.335 O=C1CO[C@H]1[C@H](O)c2ccccc2 Amb27472644 [0,1,0,1,0,0|2,0,0]=4 9694 B14R2.335 O=C1NCC1C(O)c2ccccc2 Amb28128474 [0,1,0,1,0,0|2,0,0]=4 9695 B14R2.335 O=C1NC[C@H]1[C@H](O)c2ccccc2 Amb27789997 [0,1,0,1,0,0|2,0,0]=4 9696 B14R2.450 CC(=O)C1Cc2ccccc2C1=O Amb18803911 [0,1,0,1,0,0|2,0,0]=4 9697 B14R2.450 CC(=O)C1Nc2ccccc2C1=O Amb17594440 [0,1,0,1,0,0|1,0,1]=4 9698 B14R2.450 CC(=O)C1Sc2ccccc2C1O Amb27653069 [0,1,0,1,0,0|2,0,0]=4 9699 B14R2.450 CC1=C(C(=O)O)Cc2ccccc21 Amb6201317 [0,1,0,1,0,0|1,0,1]=4 9700 B14R2.450 CC1C(C(=O)O)=Cc2ccccc21 Amb8392929 [0,1,0,1,0,0|1,0,1]=4 9701 B14R2.450 CC1c2ccccc2CC1C(=O)Cl Amb27436861 [0,1,0,1,0,0|2,0,0]=4 9702 B14R2.450 CC1c2ccccc2CC1C(=O)O Amb18127727 [0,1,0,1,0,0|1,0,0]=3 9703 B14R2.450 CC1c2ccccc2OC1C(=O)O Amb33532147 [0,1,0,1,0,0|1,0,0]=3 9704 B14R2.450 CN1c2ccccc2CC1C(=O)Cl Amb28286759 [0,1,0,1,0,0|1,0,0]=3 9705 B14R2.450 CN1c2ccccc2CC1C(=O)O Amb28366047 [0,1,0,1,0,0|0,0,0]=2 9706 B14R2.450 CN1c2ccccc2CC1C(=O)[O-] Amb33484063 [0,1,0,1,0,0|0,0,1]=3 9707 B14R2.450 CS(=O)C1Cc2ccccc2C1N Amb27606645 [0,1,0,1,0,0|2,0,0]=4 9708 B14R2.450 C[C@@H]1c2ccccc2C[C@@H]1C(=O)O Amb27817900 [0,1,0,1,0,0|1,0,0]=3 9709 B14R2.450 C[C@H]1c2ccccc2C[C@H]1C(=O)O Amb27858845 [0,1,0,1,0,0|1,0,0]=3 9710 B14R2.450 Cn1c(C(=O)O)cc2ccccc21 Amb1832457 [0,1,0,1,0,0|0,0,2]=4 9711 B14R2.450 Cn1c(C(=O)O)nc2ccccc21 Amb2723073 [0,1,0,1,0,0|1,0,1]=4 9712 B14R2.450 Cn1c(C(=O)O)pc2ccccc21 Amb28291635 [0,1,0,1,0,0|1,0,1]=4 9713 B14R2.450 NC(=O)C1Cc2ccccc2C1=O Amb25111277 [0,1,0,1,0,0|2,0,0]=4 9714 B14R2.450 NC(=O)[C@@H]1Cc2ccccc2[C@@H]1N Amb27645334 [0,1,0,1,0,0|1,0,0]=3 9715 B14R2.450 NC(=O)[C@@H]1Cc2ccccc2[C@@H]1O Amb27625097 [0,1,0,1,0,0|2,0,0]=4 9716 B14R2.450 NC1c2ccccc2CC1C(=O)O Amb27862336 [0,1,0,1,0,0|0,0,0]=2 9717 B14R2.450 NC1c2ccccc2OC1C(=O)O Amb9783178 [0,1,0,1,0,0|1,0,0]=3 9718 B14R2.450 N[C@H]1c2ccccc2C[C@H]1C(=O)O Amb1993730 [0,1,0,1,0,0|0,0,0]=2 9719 B14R2.450 N[C@H]1c2ccccc2C[C@H]1C(=O)O Amb1993769 [0,1,0,1,0,0|0,0,0]=2 9720 B14R2.450 Nc1c(C(=O)O)oc2ccccc12 Amb18118466 [0,1,0,1,0,0|1,0,1]=4 9721 B14R2.450 Nc1c(C(=O)O)sc2ccccc12 Amb845439 [0,1,0,1,0,0|1,0,1]=4 9722 B14R2.450 O=C(O)C1=C(Cl)c2ccccc2C1 Amb27266149 [0,1,0,1,0,0|1,0,1]=4 9723 B14R2.450 O=C(O)C1=Cc2ccccc2C1O Amb26471384 [0,1,0,1,0,0|1,0,1]=4 9724 B14R2.450 O=C(O)C1Nc2ccccc2C1=O Amb17594502 [0,1,0,1,0,0|0,0,1]=3 9725 B14R2.450 O=C(O)[C@@H]1Cc2ccccc2S1=O Amb27974177 [0,1,0,1,0,0|1,0,0]=3 9726 B14R2.450 O=C(O)c1nc2ccccc2n1O Amb2795925 [0,1,0,1,0,0|1,0,1]=4 9727 B14R2.657 C[C@@]1(c2ccccc2)NC(=O)[C@@H]1O Amb27640586 [0,1,0,1,0,0|2,0,0]=4 9728 B14R2.780 CC(=O)[C@H]1CC[C@@H]1c2ccccc2 Amb27427949 [0,1,0,1,0,0|2,0,0]=4 9729 B14R2.780 O=C(O)C1CCC1c2ccccc2 Amb28076679 [0,1,0,1,0,0|1,0,0]=3 9730 B14R2.780 O=C(O)C1NCC1c2ccccc2 Amb26376881 [0,1,0,1,0,0|0,0,0]=2 9731 B14R2.780 O=C(O)C1NCC1c2ccccc2 Amb33189157 [0,1,0,1,0,0|0,0,0]=2 9732 B14R2.780 O=C(O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,1,0,1,0,0|0,0,0]=2 9733 B14R2.780 O=C(O)[C@@H]1NC[C@H]1c2ccccc2 Amb31156681 [0,1,0,1,0,0|0,0,0]=2 9734 B14R2.9520 CC1(c2ccccc2)CC1C(=O)O Amb4114255 [0,1,0,1,0,0|1,0,0]=3 9735 B14R2.9520 CC1(c2ccccc2)OC1C(=O)Cl Amb25799596 [0,1,0,1,0,0|2,0,0]=4 9736 B14R2.9520 CC1(c2cccnc2)CC1C(=O)O Amb18285805 [0,1,0,1,0,0|2,0,0]=4 9737 B14R2.9520 C[C@@]1(c2ccccc2)O[C@@H]1C(=O)Cl Amb28137822 [0,1,0,1,0,0|2,0,0]=4 9738 B14R2.9520 C[C@]1(c2ccccc2)C[C@@H]1C(=O)O Amb26441864 [0,1,0,1,0,0|1,0,0]=3 9739 B14R2.9520 C[C@]1(c2ccccc2)C[C@@H]1C(N)=O Amb27876029 [0,1,0,1,0,0|2,0,0]=4 9740 B14R2.9520 C[C@]1(c2ccccc2)C[C@H]1C(=O)O Amb25176089 [0,1,0,1,0,0|1,0,0]=3 9741 B14R2.9520 C[C@]1(c2ccccc2)O[C@H]1C(=O)Cl Amb27455502 [0,1,0,1,0,0|2,0,0]=4 9742 B14R2.9520 NC(=O)C1CC1(F)c2ccccc2 Amb27238646 [0,1,0,1,0,0|2,0,0]=4 9743 B14R2.9520 NC(=O)[C@@H]1C[C@]1(F)c2ccccc2 Amb28245348 [0,1,0,1,0,0|2,0,0]=4 9744 B14R2.9520 NC(=O)[C@H]1C[C@]1(F)c2ccccc2 Amb27666986 [0,1,0,1,0,0|2,0,0]=4 9745 B14R2.9520 O=C(O)C1CC1(Cl)c2ccccc2 Amb27165746 [0,1,0,1,0,0|1,0,0]=3 9746 B14R2.9520 O=C(O)C1CC1(F)c2ccccc2 Amb8389489 [0,1,0,1,0,0|1,0,0]=3 9747 B14R2.9520 O=C(O)[C@@H]1C[C@@]1(F)c2ccccc2 Amb25213297 [0,1,0,1,0,0|1,0,0]=3 9748 B14R2.9520 O=C(O)[C@@H]1C[C@]1(F)c2ccccc2 Amb24538835 [0,1,0,1,0,0|1,0,0]=3 9749 B14R2.9520 O=C(O)[C@H]1C[C@]1(F)c2ccccc2 Amb27781075 [0,1,0,1,0,0|1,0,0]=3 9750 B14R2.639 CC1(C)Cc2ccccc2NC1=O Amb4104434 [0,1,0,1,0,0|2,0,0]=4 9751 B14R2.789 CC(=O)C1(O)Cc2ccccc2C1 Amb27972965 [0,1,0,1,0,0|2,0,0]=4 9752 B14R2.789 CC1(C(=O)O)Cc2ccccc2C1 Amb33548001 [0,1,0,1,0,0|1,0,0]=3 9753 B14R2.789 CC1(C(=O)O)Cc2ccccc2N1 Amb24443112 [0,1,0,1,0,0|0,0,0]=2 9754 B14R2.789 CC1(C(=O)O)Cc2ccccc2N1 Amb32675570 [0,1,0,1,0,0|0,0,0]=2 9755 B14R2.789 CC1(C(=O)O)Cc2ccccc2O1 Amb18128109 [0,1,0,1,0,0|1,0,0]=3 9756 B14R2.789 NC(=O)C1(N)Cc2ccccc2C1 Amb18278307 [0,1,0,1,0,0|1,0,0]=3 9757 B14R2.789 NC(=O)C1(N)Cc2ccccc2C1 Amb19374206 [0,1,0,1,0,0|1,0,0]=3 9758 B14R2.789 NC(=O)C1(O)Cc2ccccc2C1 Amb18808955 [0,1,0,1,0,0|2,0,0]=4 9759 B14R2.789 NC1(C(=O)O)Cc2ccccc2C1 Amb2695136 [0,1,0,1,0,0|0,0,0]=2 9760 B14R2.789 NC1(C(=O)O)Cc2ccccc2C1 Amb8515308 [0,1,0,1,0,0|0,0,0]=2 9761 B14R2.789 NC1(C(=O)O)Cc2ccccc2N1 Amb25936983 [0,1,0,1,0,0|0,0,0]=2 9762 B14R2.789 NC1(C(=O)O)Cc2nccnc2C1 Amb18194851 [0,1,0,1,0,0|2,0,0]=4 9763 B14R2.789 O=C(O)C1(F)Cc2ccccc2C1 Amb28146713 [0,1,0,1,0,0|1,0,0]=3 9764 B14R2.789 O=C(O)C1(O)Cc2ccccc2C1 Amb18944711 [0,1,0,1,0,0|1,0,0]=3 9765 B14R2.5441 CC1C(=O)CC1c2ccccc2Cl Amb27172962 [0,1,0,1,0,0|2,0,0]=4 9766 B14R2.5441 CC1C(=O)NC1c2ccccc2F Amb26050442 [0,1,0,1,0,0|2,0,0]=4 9767 B14R2.5441 Cc1ccccc1C2CC(=O)C2C Amb27608704 [0,1,0,1,0,0|2,0,0]=4 9768 B14R2.5441 NC1C(=O)NC1c2ccccc2Br Amb18730236 [0,1,0,1,0,0|1,0,0]=3 9769 B14R2.5441 O=C1N[C@@H](c2ccccc2Cl)[C@H]1Cl Amb27428010 [0,1,0,1,0,0|2,0,0]=4 9770 B14R2.5443 CC(=O)C1CC1c2ccccc2Br Amb9212594 [0,1,0,1,0,0|2,0,0]=4 9771 B14R2.5443 CC(=O)C1CC1c2ccccc2C Amb9212614 [0,1,0,1,0,0|2,0,0]=4 9772 B14R2.5443 CC(=O)C1CC1c2ccccc2Cl Amb7807842 [0,1,0,1,0,0|2,0,0]=4 9773 B14R2.5443 CC(=O)C1CC1c2ccccc2F Amb7807837 [0,1,0,1,0,0|2,0,0]=4 9774 B14R2.5443 CC(=O)[C@@H]1C[C@H]1c2ccccc2C Amb29838234 [0,1,0,1,0,0|2,0,0]=4 9775 B14R2.5443 CC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb29838227 [0,1,0,1,0,0|2,0,0]=4 9776 B14R2.5443 CC(=O)[C@@H]1C[C@H]1c2ccccc2F Amb29838229 [0,1,0,1,0,0|2,0,0]=4 9777 B14R2.5443 Cc1ccccc1C2CC2C(=O)O Amb9677118 [0,1,0,1,0,0|1,0,0]=3 9778 B14R2.5443 Cc1ccccc1[C@@H]2C[C@H]2C(=O)O Amb16233255 [0,1,0,1,0,0|1,0,0]=3 9779 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(N)=O Amb27858251 [0,1,0,1,0,0|2,0,0]=4 9780 B14R2.5443 Cc1cccnc1C2CC2C(=O)O Amb33360713 [0,1,0,1,0,0|2,0,0]=4 9781 B14R2.5443 Cc1cccnc1[C@@H]2C[C@H]2C(=O)O Amb33429015 [0,1,0,1,0,0|2,0,0]=4 9782 B14R2.5443 Cc1ccncc1C2CC2C(=O)O Amb26868619 [0,1,0,1,0,0|2,0,0]=4 9783 B14R2.5443 Cc1ccncc1[C@@H]2C[C@H]2C(=O)O Amb33377043 [0,1,0,1,0,0|2,0,0]=4 9784 B14R2.5443 Cc1cnccc1C2CC2C(=O)O Amb26892938 [0,1,0,1,0,0|2,0,0]=4 9785 B14R2.5443 Cc1cnccc1[C@@H]2C[C@H]2C(=O)O Amb33414500 [0,1,0,1,0,0|2,0,0]=4 9786 B14R2.5443 Cc1ncccc1C2CC2C(=O)O Amb33474804 [0,1,0,1,0,0|2,0,0]=4 9787 B14R2.5443 Cc1ncccc1[C@@H]2C[C@H]2C(=O)O Amb32879598 [0,1,0,1,0,0|2,0,0]=4 9788 B14R2.5443 NC(=O)C1CC1c2ccccc2Cl Amb27759413 [0,1,0,1,0,0|2,0,0]=4 9789 B14R2.5443 NC(=O)C1CC1c2ccccc2F Amb26595882 [0,1,0,1,0,0|2,0,0]=4 9790 B14R2.5443 NC(=O)[C@H]1C[C@@H]1c2ccccc2Cl Amb27437403 [0,1,0,1,0,0|2,0,0]=4 9791 B14R2.5443 NC(=O)[C@H]1C[C@@H]1c2ccccc2F Amb27444587 [0,1,0,1,0,0|2,0,0]=4 9792 B14R2.5443 O=C(Cl)C1CC1c2ccccc2Cl Amb27870770 [0,1,0,1,0,0|2,0,0]=4 9793 B14R2.5443 O=C(O)C1CC1c2ccccc2Br Amb9677143 [0,1,0,1,0,0|1,0,0]=3 9794 B14R2.5443 O=C(O)C1CC1c2ccccc2Cl Amb17073010 [0,1,0,1,0,0|1,0,0]=3 9795 B14R2.5443 O=C(O)C1CC1c2ccccc2F Amb17073011 [0,1,0,1,0,0|1,0,0]=3 9796 B14R2.5443 O=C(O)C1CC1c2ccccc2O Amb24455728 [0,1,0,1,0,0|1,0,0]=3 9797 B14R2.5443 O=C(O)C1CC1c2cccnc2Br Amb33387456 [0,1,0,1,0,0|2,0,0]=4 9798 B14R2.5443 O=C(O)C1CC1c2cccnc2Cl Amb33390431 [0,1,0,1,0,0|2,0,0]=4 9799 B14R2.5443 O=C(O)C1CC1c2cccnc2F Amb33079702 [0,1,0,1,0,0|2,0,0]=4 9800 B14R2.5443 O=C(O)C1CC1c2ccncc2Br Amb33451162 [0,1,0,1,0,0|2,0,0]=4 9801 B14R2.5443 O=C(O)C1CC1c2ccncc2Cl Amb27618365 [0,1,0,1,0,0|2,0,0]=4 9802 B14R2.5443 O=C(O)C1CC1c2ccncc2F Amb33226227 [0,1,0,1,0,0|2,0,0]=4 9803 B14R2.5443 O=C(O)C1CC1c2ncccc2Br Amb33336025 [0,1,0,1,0,0|2,0,0]=4 9804 B14R2.5443 O=C(O)C1CC1c2ncccc2F Amb25188017 [0,1,0,1,0,0|2,0,0]=4 9805 B14R2.5443 O=C(O)C1OC1c2ccccc2F Amb19929983 [0,1,0,1,0,0|1,0,0]=3 9806 B14R2.5443 O=C(O)[C@@H]1C[C@@H]1c2ccccc2Cl Amb33098422 [0,1,0,1,0,0|1,0,0]=3 9807 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccccc2Br Amb26075606 [0,1,0,1,0,0|1,0,0]=3 9808 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24571313 [0,1,0,1,0,0|1,0,0]=3 9809 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccccc2F Amb26408108 [0,1,0,1,0,0|1,0,0]=3 9810 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccccc2O Amb33196491 [0,1,0,1,0,0|1,0,0]=3 9811 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2cccnc2Br Amb33387459 [0,1,0,1,0,0|2,0,0]=4 9812 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2cccnc2Cl Amb33257318 [0,1,0,1,0,0|2,0,0]=4 9813 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2cccnc2F Amb33378307 [0,1,0,1,0,0|2,0,0]=4 9814 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccncc2Br Amb33388246 [0,1,0,1,0,0|2,0,0]=4 9815 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccncc2Cl Amb16233312 [0,1,0,1,0,0|2,0,0]=4 9816 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ccncc2F Amb33317713 [0,1,0,1,0,0|2,0,0]=4 9817 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ncccc2Br Amb33485073 [0,1,0,1,0,0|2,0,0]=4 9818 B14R2.5443 O=C(O)[C@@H]1C[C@H]1c2ncccc2F Amb33419177 [0,1,0,1,0,0|2,0,0]=4 9819 B14R2.5443 O=C(O)[C@H]1C[C@H]1c2ccccc2Cl Amb27444175 [0,1,0,1,0,0|1,0,0]=3 9820 B14R2.3129 CC(C)(O)C1Cc2ccccc2N1 Amb27865049 [0,1,0,1,0,0|1,0,1]=4 9821 B14R2.3129 O=S(=O)(O)C1Cc2ccccc2N1 Amb25834326 [0,1,0,1,0,0|1,0,0]=3 9822 B14R2.15 CCC1C(=O)CC1c2ccccc2 Amb27608698 [0,1,0,1,0,0|2,0,0]=4 9823 B14R2.15 CCC1C(=O)NC1c2ccccc2 Amb2388317 [0,1,0,1,0,0|2,0,0]=4 9824 B14R2.15 CC[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb27640614 [0,1,0,1,0,0|2,0,0]=4 9825 B14R2.737 CC1NC(=O)C1Cc2ccccc2 Amb24493901 [0,1,0,1,0,0|2,0,0]=4 9826 B14R2.737 C[C@H]1NC(=O)[C@@H]1Cc2ccccc2 Amb27484839 [0,1,0,1,0,0|2,0,0]=4 9827 B14R2.788 CC(=O)C1(Cc2ccccc2)CC1 Amb18560528 [0,1,0,1,0,0|2,0,0]=4 9828 B14R2.788 NC(=O)C1(Cc2ccccc2)CC1 Amb28343101 [0,1,0,1,0,0|2,0,0]=4 9829 B14R2.788 O=C(O)C1(Cc2ccccc2)CC1 Amb17335122 [0,1,0,1,0,0|1,0,0]=3 9830 B14R2.788 O=C(O)C1(Cc2cccnc2)CC1 Amb25140752 [0,1,0,1,0,0|2,0,0]=4 9831 B14R2.788 O=C(O)C1(Cc2cccnc2)CC1 Amb32671252 [0,1,0,1,0,0|2,0,0]=4 9832 B14R2.788 O=C(O)C1(Cc2ccncc2)CC1 Amb27447769 [0,1,0,1,0,0|2,0,0]=4 9833 B14R2.788 O=C(O)C1(Nc2ccccc2)CC1 Amb27407014 [0,1,0,1,0,0|2,0,0]=4 9834 B14R2.788 O=C(O)C1(Oc2ccccc2)CC1 Amb23525074 [0,1,0,1,0,0|2,0,0]=4 9835 B14R2.788 O=C(O)C1(Sc2ccccc2)CC1 Amb17595112 [0,1,0,1,0,0|2,0,0]=4 9836 B14R2.788 O=C(O)[C@@]1(Cc2ccccc2)CO1 Amb28129276 [0,1,0,1,0,0|1,0,0]=3 9837 B14R2.14484 COC1(C(=O)Cl)Cc2ccccc21 Amb27247925 [0,1,0,1,0,0|2,0,0]=4 9838 B14R2.14484 O=C(O)C1(CO)Cc2ccccc21 Amb32946209 [0,1,0,1,0,0|1,0,0]=3 9839 B14R3.630 O=C1CC2c3ccccc3OC12 Amb27175987 [0,0,0,2,0,0|2,0,0]=4 9840 B14R3.630 O=C1C[C@H]2c3ccccc3C[C@@H]12 Amb27268023 [0,0,0,2,0,0|2,0,0]=4 9841 B14R3.630 O=C1NC2c3ccccc3CC12 Amb25808812 [0,0,0,2,0,0|2,0,0]=4 9842 B14R3.630 O=C1N[C@H]2c3ccccc3C[C@@H]12 Amb1993731 [0,0,0,2,0,0|2,0,0]=4 9843 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,0,0,0,1,0|1,0,1]=4 9844 B10R1.15 C#CC(N)c1ccccc1 Amb33204420 [1,0,0,0,1,0|1,0,1]=4 9845 B10R1.15 C#C[C@@H](N)c1ccccc1 Amb27599946 [1,0,0,0,1,0|1,0,1]=4 9846 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [1,0,0,0,1,0|1,0,1]=4 9847 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [1,0,0,0,1,0|2,0,0]=4 9848 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [1,0,0,0,1,0|2,0,0]=4 9849 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [1,0,0,0,1,0|2,0,0]=4 9850 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,0,0,0,1,0|1,0,0]=3 9851 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,0,0,0,1,0|1,0,0]=3 9852 B10R1.15 C=CC(N)c1ccccn1 Amb24561652 [1,0,0,0,1,0|2,0,0]=4 9853 B10R1.15 C=CC(N)c1cccnc1 Amb28193260 [1,0,0,0,1,0|2,0,0]=4 9854 B10R1.15 C=CC(N)c1ccncc1 Amb25789567 [1,0,0,0,1,0|2,0,0]=4 9855 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,0,0,0,1,0|2,0,0]=4 9856 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [1,0,0,0,1,0|1,0,0]=3 9857 B10R1.15 C=C[C@@H](N)c1cccnc1 Amb28289124 [1,0,0,0,1,0|2,0,0]=4 9858 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,0,0,0,1,0|2,0,0]=4 9859 B10R1.15 C=C[C@H](N)c1ccccn1 Amb25237215 [1,0,0,0,1,0|2,0,0]=4 9860 B10R1.15 C=C[C@H](N)c1cccnc1 Amb28280521 [1,0,0,0,1,0|2,0,0]=4 9861 B10R1.15 C=C[C@H](N)c1ccncc1 Amb27770577 [1,0,0,0,1,0|2,0,0]=4 9862 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [1,0,0,0,1,0|1,0,0]=3 9863 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [1,0,0,0,1,0|2,0,0]=4 9864 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [1,0,0,0,1,0|2,0,0]=4 9865 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [1,0,0,0,1,0|2,0,0]=4 9866 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [1,0,0,0,1,0|1,0,1]=4 9867 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [1,0,0,0,1,0|2,0,0]=4 9868 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,1,0|1,0,1]=4 9869 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [1,0,0,0,1,0|1,0,1]=4 9870 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,1,0|1,0,1]=4 9871 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [1,0,0,0,1,0|1,0,1]=4 9872 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,1,0|1,0,1]=4 9873 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [1,0,0,0,1,0|1,0,1]=4 9874 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [1,0,0,0,1,0|2,0,0]=4 9875 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,0,0,0,1,0|1,0,0]=3 9876 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [1,0,0,0,1,0|1,0,1]=4 9877 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,0,0,0,1,0|2,0,0]=4 9878 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,0,0,0,1,0|2,0,0]=4 9879 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,0,0,0,1,0|1,0,0]=3 9880 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [1,0,0,0,1,0|1,0,1]=4 9881 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [1,0,0,0,1,0|1,0,1]=4 9882 B10R1.15 N#CC(N)c1ccccc1 Amb3940545 [1,0,0,0,1,0|1,0,1]=4 9883 B10R1.15 N#C[C@@H](N)c1ccccc1 Amb17399826 [1,0,0,0,1,0|1,0,1]=4 9884 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [1,0,0,0,1,0|0,0,0]=2 9885 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [1,0,0,0,1,0|1,0,1]=4 9886 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [1,0,0,0,1,0|1,0,1]=4 9887 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [1,0,0,0,1,0|1,0,1]=4 9888 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [1,0,0,0,1,0|0,0,1]=3 9889 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,0,0,0,1,0|1,0,1]=4 9890 B10R1.15 NC(CO)c1ccccn1 Amb18560041 [1,0,0,0,1,0|1,0,1]=4 9891 B10R1.15 NC(CO)c1cccnc1 Amb2683353 [1,0,0,0,1,0|1,0,1]=4 9892 B10R1.15 NC(CO)c1cccnc1 Amb32644753 [1,0,0,0,1,0|1,0,1]=4 9893 B10R1.15 NC(CO)c1cccnc1 Amb33548117 [1,0,0,0,1,0|1,0,1]=4 9894 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,0,0,0,1,0|1,0,1]=4 9895 B10R1.15 NC(CO)c1ccncc1 Amb18561776 [1,0,0,0,1,0|1,0,1]=4 9896 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,1,0|1,0,1]=4 9897 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [1,0,0,0,1,0|1,0,1]=4 9898 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [1,0,0,0,1,0|1,0,1]=4 9899 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [1,0,0,0,1,0|1,0,1]=4 9900 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,1,0|1,0,1]=4 9901 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,1,0|1,0,1]=4 9902 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [1,0,0,0,1,0|0,0,1]=3 9903 B10R1.15 N[C@@H](CO)c1ccccn1 Amb28346863 [1,0,0,0,1,0|1,0,1]=4 9904 B10R1.15 N[C@@H](CO)c1ccccn1 Amb33483256 [1,0,0,0,1,0|1,0,1]=4 9905 B10R1.15 N[C@@H](CO)c1cccnc1 Amb25146409 [1,0,0,0,1,0|1,0,1]=4 9906 B10R1.15 N[C@@H](CO)c1ccncc1 Amb25146410 [1,0,0,0,1,0|1,0,1]=4 9907 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [1,0,0,0,1,0|1,0,1]=4 9908 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [1,0,0,0,1,0|1,0,1]=4 9909 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [1,0,0,0,1,0|1,0,1]=4 9910 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [1,0,0,0,1,0|0,0,1]=3 9911 B10R1.15 N[C@H](CO)c1ccccn1 Amb27617071 [1,0,0,0,1,0|1,0,1]=4 9912 B10R1.15 N[C@H](CO)c1ccccn1 Amb33483257 [1,0,0,0,1,0|1,0,1]=4 9913 B10R1.15 N[C@H](CO)c1cccnc1 Amb24712243 [1,0,0,0,1,0|1,0,1]=4 9914 B10R1.15 N[C@H](CO)c1ccncc1 Amb24714739 [1,0,0,0,1,0|1,0,1]=4 9915 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [1,0,0,0,1,0|1,0,1]=4 9916 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [1,0,0,0,1,0|1,0,1]=4 9917 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [1,0,0,0,1,0|1,0,1]=4 9918 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [1,0,0,0,1,0|1,0,1]=4 9919 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [1,0,0,0,1,0|1,0,1]=4 9920 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,0,0,0,1,0|1,0,0]=3 9921 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,0,0,0,1,0|1,0,0]=3 9922 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [1,0,0,0,1,0|1,0,0]=3 9923 B10R1.15 O=CC(O)c1ccccn1 Amb28321322 [1,0,0,0,1,0|2,0,0]=4 9924 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [1,0,0,0,1,0|1,0,0]=3 9925 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [1,0,0,0,1,0|1,0,0]=3 9926 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [1,0,0,0,1,0|1,0,1]=4 9927 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [1,0,0,0,1,0|1,0,1]=4 9928 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,1,0|1,0,1]=4 9929 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [1,0,0,0,1,0|1,0,1]=4 9930 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,1,0|1,0,1]=4 9931 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [1,0,0,0,1,0|1,0,1]=4 9932 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [1,0,0,0,1,0|1,0,1]=4 9933 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [1,0,0,0,1,0|1,0,1]=4 9934 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [1,0,0,0,1,0|1,0,1]=4 9935 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [1,0,0,0,1,0|1,0,1]=4 9936 B10R1.27 C[C@H](C=O)Cc1ccco1 Amb27861368 [1,0,0,0,1,0|2,0,0]=4 9937 B10R1.27 NC(CO)Cc1ccco1 Amb17062680 [1,0,0,0,1,0|1,0,1]=4 9938 B10R1.27 NC(CO)Cc1cccs1 Amb17062681 [1,0,0,0,1,0|1,0,1]=4 9939 B10R1.27 NC(CO)Cc1cccs1 Amb33330277 [1,0,0,0,1,0|1,0,1]=4 9940 B10R1.27 NC(CO)Cc1ccoc1 Amb24627260 [1,0,0,0,1,0|1,0,1]=4 9941 B10R1.27 NC(CO)Cc1ccsc1 Amb27413429 [1,0,0,0,1,0|1,0,1]=4 9942 B10R1.27 O=CC(F)Cc1ccoc1 Amb27595657 [1,0,0,0,1,0|2,0,0]=4 9943 B10R1.27 O=CC(O)Cc1ccco1 Amb27174865 [1,0,0,0,1,0|2,0,0]=4 9944 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [1,0,0,0,1,0|2,0,0]=4 9945 B10R1.66 CC(=O)CCc1cccs1 Amb5740049 [1,0,0,0,1,0|2,0,0]=4 9946 B10R1.66 CC(=O)CCc1ccoc1 Amb27425020 [1,0,0,0,1,0|2,0,0]=4 9947 B10R1.66 CC(=O)CCc1ccsc1 Amb33532312 [1,0,0,0,1,0|2,0,0]=4 9948 B10R1.66 O=C(Cl)CCc1cccs1 Amb23440823 [1,0,0,0,1,0|2,0,0]=4 9949 B10R1.66 O=C(Cl)CCc1ccoc1 Amb27636729 [1,0,0,0,1,0|2,0,0]=4 9950 B10R1.66 O=C(Cl)CCc1ccsc1 Amb28041943 [1,0,0,0,1,0|2,0,0]=4 9951 B10R1.66 O=C(O)CCc1ccco1 Amb1153073 [1,0,0,0,1,0|1,0,0]=3 9952 B10R1.66 O=C(O)CCc1cccs1 Amb1154297 [1,0,0,0,1,0|1,0,0]=3 9953 B10R1.66 O=C(O)CCc1ccno1 Amb1092001 [1,0,0,0,1,0|2,0,0]=4 9954 B10R1.66 O=C(O)CCc1ccns1 Amb18830640 [1,0,0,0,1,0|2,0,0]=4 9955 B10R1.66 O=C(O)CCc1ccoc1 Amb18643489 [1,0,0,0,1,0|1,0,0]=3 9956 B10R1.66 O=C(O)CCc1ccon1 Amb8009421 [1,0,0,0,1,0|2,0,0]=4 9957 B10R1.66 O=C(O)CCc1ccsc1 Amb1153814 [1,0,0,0,1,0|1,0,0]=3 9958 B10R1.66 O=C(O)CCc1ccsn1 Amb18830643 [1,0,0,0,1,0|2,0,0]=4 9959 B10R1.66 O=C(O)CCc1cnco1 Amb22011672 [1,0,0,0,1,0|2,0,0]=4 9960 B10R1.66 O=C(O)CCc1cncs1 Amb18830641 [1,0,0,0,1,0|2,0,0]=4 9961 B10R1.66 O=C(O)CCc1cncs1 Amb32661213 [1,0,0,0,1,0|2,0,0]=4 9962 B10R1.66 O=C(O)CCc1cnoc1 Amb8009420 [1,0,0,0,1,0|2,0,0]=4 9963 B10R1.66 O=C(O)CCc1cnsc1 Amb35719984 [1,0,0,0,1,0|2,0,0]=4 9964 B10R1.66 O=C(O)CCc1cocn1 Amb17399866 [1,0,0,0,1,0|2,0,0]=4 9965 B10R1.66 O=C(O)CCc1cscn1 Amb33528760 [1,0,0,0,1,0|2,0,0]=4 9966 B10R1.66 O=C(O)CCc1ncco1 Amb17399867 [1,0,0,0,1,0|2,0,0]=4 9967 B10R1.66 O=C(O)CCc1nccs1 Amb33528763 [1,0,0,0,1,0|2,0,0]=4 9968 B10R1.66 O=C(O)CCn1cc[nH+]c1 Amb4252703 [1,0,0,0,1,0|2,0,0]=4 9969 B10R1.66 O=C(O)CCn1cccc1 Amb1130611 [1,0,0,0,1,0|1,0,0]=3 9970 B10R1.66 O=C(O)CCn1cccn1 Amb1159216 [1,0,0,0,1,0|2,0,0]=4 9971 B10R1.66 O=C(O)CCn1cccn1 Amb22586761 [1,0,0,0,1,0|2,0,0]=4 9972 B10R1.66 O=C(O)CCn1ccnc1 Amb1159316 [1,0,0,0,1,0|2,0,0]=4 9973 B10R1.66 O=C(O)CCn1ccnc1 Amb3318874 [1,0,0,0,1,0|2,0,0]=4 9974 B10R1.66 O=C(O)CNc1ccco1 Amb27846560 [1,0,0,0,1,0|2,0,0]=4 9975 B10R1.66 O=C(O)CNc1cccs1 Amb26516474 [1,0,0,0,1,0|2,0,0]=4 9976 B10R1.66 O=C(O)CNc1ccsc1 Amb25322129 [1,0,0,0,1,0|2,0,0]=4 9977 B10R1.66 O=C(O)COc1ccco1 Amb28050105 [1,0,0,0,1,0|2,0,0]=4 9978 B10R1.66 O=C(O)COc1cccs1 Amb27233232 [1,0,0,0,1,0|2,0,0]=4 9979 B10R1.66 O=C(O)COc1ccoc1 Amb33360335 [1,0,0,0,1,0|2,0,0]=4 9980 B10R1.66 O=C(O)COc1ccsc1 Amb18126122 [1,0,0,0,1,0|2,0,0]=4 9981 B10R1.66 O=C(O)CSc1ccco1 Amb27975289 [1,0,0,0,1,0|2,0,0]=4 9982 B10R1.66 O=C(O)CSc1cccs1 Amb2796029 [1,0,0,0,1,0|2,0,0]=4 9983 B10R1.66 O=C(O)CSc1ccsc1 Amb2611518 [1,0,0,0,1,0|2,0,0]=4 9984 B10R1.66 O=C([O-])CCc1cccs1 Amb33512993 [1,0,0,0,1,0|1,0,1]=4 9985 B10R1.23 CC(=O)C(N)c1ccco1 Amb27170705 [0,0,0,0,2,0|2,0,0]=4 9986 B10R1.23 CC(=O)C(N)c1cccs1 Amb25836886 [0,0,0,0,2,0|2,0,0]=4 9987 B10R1.23 CC(C(=O)O)c1ccco1 Amb17087431 [0,0,0,0,2,0|2,0,0]=4 9988 B10R1.23 CC(C(=O)O)c1cccs1 Amb10844027 [0,0,0,0,2,0|2,0,0]=4 9989 B10R1.23 CC(C(=O)O)c1ccoc1 Amb27954518 [0,0,0,0,2,0|2,0,0]=4 9990 B10R1.23 CC(C(=O)O)c1ccsc1 Amb18284449 [0,0,0,0,2,0|2,0,0]=4 9991 B10R1.23 CC(C(=O)O)n1cccc1 Amb1058873 [0,0,0,0,2,0|2,0,0]=4 9992 B10R1.23 C[C@@H](C(=O)O)c1cccs1 Amb10844019 [0,0,0,0,2,0|2,0,0]=4 9993 B10R1.23 C[C@@H](C(=O)O)n1cccc1 Amb2236277 [0,0,0,0,2,0|2,0,0]=4 9994 B10R1.23 C[C@H](C(=O)O)c1ccco1 Amb27468877 [0,0,0,0,2,0|2,0,0]=4 9995 B10R1.23 NC(=O)C(N)c1ccco1 Amb17334171 [0,0,0,0,2,0|2,0,0]=4 9996 B10R1.23 NC(=O)C(N)c1cccs1 Amb17334394 [0,0,0,0,2,0|2,0,0]=4 9997 B10R1.23 NC(C(=O)O)c1ccco1 Amb2696257 [0,0,0,0,2,0|1,0,0]=3 9998 B10R1.23 NC(C(=O)O)c1cccs1 Amb1840251 [0,0,0,0,2,0|1,0,0]=3 9999 B10R1.23 NC(C(=O)O)c1ccns1 Amb18199897 [0,0,0,0,2,0|2,0,0]=4 10000 B10R1.23 NC(C(=O)O)c1ccon1 Amb18202657 [0,0,0,0,2,0|2,0,0]=4 10001 B10R1.23 NC(C(=O)O)c1ccsc1 Amb33549251 [0,0,0,0,2,0|1,0,0]=3 10002 B10R1.23 NC(C(=O)O)c1ccsc1 Amb9718858 [0,0,0,0,2,0|1,0,0]=3 10003 B10R1.23 NC(C(=O)O)c1cnco1 Amb18202656 [0,0,0,0,2,0|2,0,0]=4 10004 B10R1.23 NC(C(=O)O)c1cncs1 Amb18830497 [0,0,0,0,2,0|2,0,0]=4 10005 B10R1.23 NC(C(=O)O)c1cscn1 Amb18645003 [0,0,0,0,2,0|2,0,0]=4 10006 B10R1.23 NC(C(=O)O)c1cscn1 Amb35788158 [0,0,0,0,2,0|2,0,0]=4 10007 B10R1.23 NC(c1ccoc1)[PH](=O)O Amb28250808 [0,0,0,0,2,0|2,0,0]=4 10008 B10R1.23 N[C@@H](C(=O)O)c1cccs1 Amb22747193 [0,0,0,0,2,0|1,0,0]=3 10009 B10R1.23 N[C@@H](C(=O)O)c1ccsc1 Amb22750704 [0,0,0,0,2,0|1,0,0]=3 10010 B10R1.23 N[C@H](C(=O)O)c1ccco1 Amb4296942 [0,0,0,0,2,0|1,0,0]=3 10011 B10R1.23 N[C@H](C(=O)O)c1cccs1 Amb2694806 [0,0,0,0,2,0|1,0,0]=3 10012 B10R1.23 N[C@H](C(=O)O)c1ccoc1 Amb27214171 [0,0,0,0,2,0|1,0,0]=3 10013 B10R1.23 N[C@H](C(=O)O)c1ccsc1 Amb16232233 [0,0,0,0,2,0|1,0,0]=3 10014 B10R1.23 N[C@H](C(=O)O)c1cncs1 Amb28136968 [0,0,0,0,2,0|2,0,0]=4 10015 B10R1.23 O=C(O)C(Br)c1ccsc1 Amb27873590 [0,0,0,0,2,0|2,0,0]=4 10016 B10R1.23 O=C(O)C(Cl)c1cccs1 Amb17233234 [0,0,0,0,2,0|2,0,0]=4 10017 B10R1.23 O=C(O)C(Cl)c1ccsc1 Amb28138847 [0,0,0,0,2,0|2,0,0]=4 10018 B10R1.23 O=C(O)C(F)c1ccco1 Amb25825778 [0,0,0,0,2,0|2,0,0]=4 10019 B10R1.23 O=C(O)C(F)c1cccs1 Amb28193693 [0,0,0,0,2,0|2,0,0]=4 10020 B10R1.23 O=C(O)C(F)c1ccoc1 Amb26369748 [0,0,0,0,2,0|2,0,0]=4 10021 B10R1.23 O=C(O)C(F)c1ccsc1 Amb27952222 [0,0,0,0,2,0|2,0,0]=4 10022 B10R1.23 O=C(O)C(O)c1ccco1 Amb597147 [0,0,0,0,2,0|2,0,0]=4 10023 B10R1.23 O=C(O)C(O)c1cccs1 Amb17232241 [0,0,0,0,2,0|2,0,0]=4 10024 B10R1.23 O=C(O)C(O)c1ccoc1 Amb10810585 [0,0,0,0,2,0|2,0,0]=4 10025 B10R1.23 O=C(O)C(O)c1ccsc1 Amb18952015 [0,0,0,0,2,0|2,0,0]=4 10026 B10R1.23 O=C(O)[C@H](O)c1cccs1 Amb27614848 [0,0,0,0,2,0|2,0,0]=4 10027 B10R1.204 NC(CC1=CCC1)C(=O)O Amb28239360 [0,0,0,0,2,0|0,0,2]=4 10028 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [1,0,0,0,0,1|2,0,0]=4 10029 B12R1.252 C=C(C)CNCc1ccccc1 Amb10608684 [1,0,0,0,0,1|2,0,0]=4 10030 B12R1.252 C=C(C)CNCc1ccccc1 Amb17622487 [1,0,0,0,0,1|2,0,0]=4 10031 B12R1.252 C=C(C)COCc1ccccc1 Amb28062621 [1,0,0,0,0,1|2,0,0]=4 10032 B12R1.252 CC(=O)C#CCc1ccccc1 Amb27177980 [1,0,0,0,0,1|1,0,1]=4 10033 B12R1.252 CC(=O)CC#Cc1ccccc1 Amb28122481 [1,0,0,0,0,1|1,0,1]=4 10034 B12R1.252 CC(=O)CCCc1ccccc1 Amb4358586 [1,0,0,0,0,1|1,0,0]=3 10035 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [1,0,0,0,0,1|2,0,0]=4 10036 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [1,0,0,0,0,1|2,0,0]=4 10037 B12R1.252 CC(=O)CCNc1ccccc1 Amb26422328 [1,0,0,0,0,1|1,0,0]=3 10038 B12R1.252 CC(=O)CCOc1ccccc1 Amb7777351 [1,0,0,0,0,1|1,0,0]=3 10039 B12R1.252 CC(=O)CCSc1ccccc1 Amb4020770 [1,0,0,0,0,1|1,0,0]=3 10040 B12R1.252 CC(=O)COCc1ccccc1 Amb3433615 [1,0,0,0,0,1|1,0,0]=3 10041 B12R1.252 CC(=O)CONc1ccccc1 Amb28243855 [1,0,0,0,0,1|2,0,0]=4 10042 B12R1.252 CC(=O)CSCc1ccccc1 Amb4018341 [1,0,0,0,0,1|1,0,0]=3 10043 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,1|1,0,1]=4 10044 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,1|1,0,1]=4 10045 B12R1.252 CC(=O)NCCc1ccccc1 Amb2781514 [1,0,0,0,0,1|1,0,0]=3 10046 B12R1.252 CC(=O)NCSc1ccccc1 Amb27797274 [1,0,0,0,0,1|2,0,0]=4 10047 B12R1.252 CC(=O)OCCc1ccccc1 Amb6357159 [1,0,0,0,0,1|1,0,0]=3 10048 B12R1.252 CC(=O)OCCc1ccccn1 Amb8391177 [1,0,0,0,0,1|2,0,0]=4 10049 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb32954414 [1,0,0,0,0,1|1,0,1]=4 10050 B12R1.252 CC(=S)NCCc1ccccc1 Amb27412033 [1,0,0,0,0,1|1,1,0]=4 10051 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,1|2,0,0]=4 10052 B12R1.252 CC(O)CCCc1ccccc1 Amb17138575 [1,0,0,0,0,1|1,0,1]=4 10053 B12R1.252 CC(O)CCOc1ccccc1 Amb6298179 [1,0,0,0,0,1|1,0,1]=4 10054 B12R1.252 CC(O)CNCc1ccccc1 Amb837676 [1,0,0,0,0,1|1,0,1]=4 10055 B12R1.252 CC(O)COCc1ccccc1 Amb4020574 [1,0,0,0,0,1|1,0,1]=4 10056 B12R1.252 CN(O)CCCc1ccccc1 Amb32951844 [1,0,0,0,0,1|2,0,0]=4 10057 B12R1.252 C[C@@H](O)CCCc1ccccc1 Amb33082320 [1,0,0,0,0,1|1,0,1]=4 10058 B12R1.252 C[C@@H](O)CCOc1ccccc1 Amb32951805 [1,0,0,0,0,1|1,0,1]=4 10059 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [1,0,0,0,0,1|1,0,1]=4 10060 B12R1.252 C[C@H](O)CCCc1ccccc1 Amb32954841 [1,0,0,0,0,1|1,0,1]=4 10061 B12R1.252 C[C@H](O)CCOc1ccccc1 Amb32952875 [1,0,0,0,0,1|1,0,1]=4 10062 B12R1.252 C[C@H](O)CNCc1ccccc1 Amb27862492 [1,0,0,0,0,1|1,0,1]=4 10063 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [1,0,0,0,0,1|1,0,1]=4 10064 B12R1.252 ClC(Cl)=CCCc1ccccc1 Amb27443084 [1,0,0,0,0,1|2,0,0]=4 10065 B12R1.252 N=C(N)CCCc1ccccc1 Amb6276737 [1,0,0,0,0,1|2,0,0]=4 10066 B12R1.252 N=C(N)CCOc1ccccc1 Amb6279642 [1,0,0,0,0,1|2,0,0]=4 10067 B12R1.252 N=C(N)COCc1ccccc1 Amb6266963 [1,0,0,0,0,1|2,0,0]=4 10068 B12R1.252 N=C(N)COCc1ccccc1 Amb8630424 [1,0,0,0,0,1|2,0,0]=4 10069 B12R1.252 N=C(N)CSCc1ccccc1 Amb28555674 [1,0,0,0,0,1|2,0,0]=4 10070 B12R1.252 N=C(N)CSCc1ccccc1 Amb6678181 [1,0,0,0,0,1|2,0,0]=4 10071 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736089 [1,0,0,0,0,1|2,0,0]=4 10072 B12R1.252 N=C(N)NCCc1ccccc1 Amb22736599 [1,0,0,0,0,1|2,0,0]=4 10073 B12R1.252 N=C(N)NCCc1ccccc1 Amb28974714 [1,0,0,0,0,1|2,0,0]=4 10074 B12R1.252 N=C(N)NCCc1ccccc1 Amb6761287 [1,0,0,0,0,1|2,0,0]=4 10075 B12R1.252 N=C(N)NCCc1ccccc1 Amb838720 [1,0,0,0,0,1|2,0,0]=4 10076 B12R1.252 N=C(N)SCCc1ccccc1 Amb20675983 [1,0,0,0,0,1|2,0,0]=4 10077 B12R1.252 NC(=O)CC#Cc1ccccc1 Amb28256571 [1,0,0,0,0,1|1,0,1]=4 10078 B12R1.252 NC(=O)CCCc1ccccc1 Amb3886649 [1,0,0,0,0,1|1,0,0]=3 10079 B12R1.252 NC(=O)CCNc1ccccc1 Amb453169 [1,0,0,0,0,1|1,0,0]=3 10080 B12R1.252 NC(=O)CCOc1ccccc1 Amb8997689 [1,0,0,0,0,1|1,0,0]=3 10081 B12R1.252 NC(=O)CCSc1ccccc1 Amb3836115 [1,0,0,0,0,1|1,0,0]=3 10082 B12R1.252 NC(=O)CNCc1ccccc1 Amb2696395 [1,0,0,0,0,1|1,0,0]=3 10083 B12R1.252 NC(=O)CNCc1ccccn1 Amb6661065 [1,0,0,0,0,1|2,0,0]=4 10084 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [1,0,0,0,0,1|2,0,0]=4 10085 B12R1.252 NC(=O)CNCc1cccnc1 Amb33545533 [1,0,0,0,0,1|2,0,0]=4 10086 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [1,0,0,0,0,1|2,0,0]=4 10087 B12R1.252 NC(=O)COCc1ccccc1 Amb8858432 [1,0,0,0,0,1|1,0,0]=3 10088 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,1|1,0,0]=3 10089 B12R1.252 NC(=O)NCCc1ccccn1 Amb6274566 [1,0,0,0,0,1|2,0,0]=4 10090 B12R1.252 NC(=O)NCCc1cccnc1 Amb19515015 [1,0,0,0,0,1|2,0,0]=4 10091 B12R1.252 NC(=O)NCSc1ccccc1 Amb28200898 [1,0,0,0,0,1|2,0,0]=4 10092 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,1|2,0,0]=4 10093 B12R1.252 NC(=S)CCCc1ccccc1 Amb6244938 [1,0,0,0,0,1|1,1,0]=4 10094 B12R1.252 NC(=S)CCOc1ccccc1 Amb5542247 [1,0,0,0,0,1|1,1,0]=4 10095 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [1,0,0,0,0,1|1,1,0]=4 10096 B12R1.252 NC(=S)COCc1ccccc1 Amb6276568 [1,0,0,0,0,1|1,1,0]=4 10097 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [1,0,0,0,0,1|1,1,0]=4 10098 B12R1.252 O=C(Cl)CCCc1ccccc1 Amb2792925 [1,0,0,0,0,1|1,0,0]=3 10099 B12R1.252 O=C(Cl)CCOc1ccccc1 Amb33528394 [1,0,0,0,0,1|1,0,0]=3 10100 B12R1.252 O=C(Cl)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,1|1,0,0]=3 10101 B12R1.252 O=C(Cl)COCc1ccccc1 Amb3939158 [1,0,0,0,0,1|1,0,0]=3 10102 B12R1.252 O=C(Cl)CSCc1ccccc1 Amb10880013 [1,0,0,0,0,1|1,0,0]=3 10103 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [1,0,0,0,0,1|1,0,1]=4 10104 B12R1.252 O=C(Cl)NCCc1ccccn1 Amb35637082 [1,0,0,0,0,1|2,0,0]=4 10105 B12R1.252 O=C(Cl)NCCc1cccnc1 Amb35625524 [1,0,0,0,0,1|2,0,0]=4 10106 B12R1.252 O=C(Cl)NCCc1ccncc1 Amb35625591 [1,0,0,0,0,1|2,0,0]=4 10107 B12R1.252 O=C(Cl)OCCc1ccccc1 Amb32661047 [1,0,0,0,0,1|1,0,0]=3 10108 B12R1.252 O=C(Cl)OCCc1ccccn1 Amb33297001 [1,0,0,0,0,1|2,0,0]=4 10109 B12R1.252 O=C(Cl)OCCc1cccnc1 Amb33297282 [1,0,0,0,0,1|2,0,0]=4 10110 B12R1.252 O=C(O)C#CSc1ccccc1 Amb27645390 [1,0,0,0,0,1|0,0,2]=4 10111 B12R1.252 O=C(O)C=C=Cc1ccccc1 Amb25102534 [1,0,0,0,0,1|0,0,2]=4 10112 B12R1.252 O=C(O)CC#Cc1ccccc1 Amb18296382 [1,0,0,0,0,1|0,0,1]=3 10113 B12R1.252 O=C(O)CC#Cc1ccccn1 Amb27222218 [1,0,0,0,0,1|1,0,1]=4 10114 B12R1.252 O=C(O)CC#Cc1cccnc1 Amb25159668 [1,0,0,0,0,1|1,0,1]=4 10115 B12R1.252 O=C(O)CC#Cc1ccncc1 Amb24423393 [1,0,0,0,0,1|1,0,1]=4 10116 B12R1.252 O=C(O)CCCC1=CCC=CC1 Amb6295892 [1,0,0,0,0,1|0,0,2]=4 10117 B12R1.252 O=C(O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,1|0,0,0]=2 10118 B12R1.252 O=C(O)CCCc1ccccn1 Amb1099328 [1,0,0,0,0,1|1,0,0]=3 10119 B12R1.252 O=C(O)CCCc1ccccn1 Amb19356883 [1,0,0,0,0,1|1,0,0]=3 10120 B12R1.252 O=C(O)CCCc1cccnc1 Amb17232526 [1,0,0,0,0,1|1,0,0]=3 10121 B12R1.252 O=C(O)CCCc1cccnc1 Amb33529414 [1,0,0,0,0,1|1,0,0]=3 10122 B12R1.252 O=C(O)CCCc1cccnc1 Amb33541549 [1,0,0,0,0,1|1,0,0]=3 10123 B12R1.252 O=C(O)CCCc1ccncc1 Amb1099336 [1,0,0,0,0,1|1,0,0]=3 10124 B12R1.252 O=C(O)CCCc1ccncc1 Amb19929548 [1,0,0,0,0,1|1,0,0]=3 10125 B12R1.252 O=C(O)CCCc1ccncn1 Amb33172094 [1,0,0,0,0,1|2,0,0]=4 10126 B12R1.252 O=C(O)CCCc1cncnc1 Amb18827885 [1,0,0,0,0,1|2,0,0]=4 10127 B12R1.252 O=C(O)CCCc1ncccn1 Amb18862661 [1,0,0,0,0,1|2,0,0]=4 10128 B12R1.252 O=C(O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,1|0,0,0]=2 10129 B12R1.252 O=C(O)CCNc1ccccn1 Amb10609119 [1,0,0,0,0,1|1,0,0]=3 10130 B12R1.252 O=C(O)CCNc1ccccn1 Amb6258091 [1,0,0,0,0,1|1,0,0]=3 10131 B12R1.252 O=C(O)CCNc1cccnc1 Amb18269696 [1,0,0,0,0,1|1,0,0]=3 10132 B12R1.252 O=C(O)CCNc1ccncc1 Amb33456130 [1,0,0,0,0,1|1,0,0]=3 10133 B12R1.252 O=C(O)CCNc1ccncc1 Amb6280380 [1,0,0,0,0,1|1,0,0]=3 10134 B12R1.252 O=C(O)CCNc1ccncn1 Amb19011486 [1,0,0,0,0,1|2,0,0]=4 10135 B12R1.252 O=C(O)CCNc1cncnc1 Amb18933238 [1,0,0,0,0,1|2,0,0]=4 10136 B12R1.252 O=C(O)CCNc1ncccn1 Amb33526612 [1,0,0,0,0,1|2,0,0]=4 10137 B12R1.252 O=C(O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,1|0,0,0]=2 10138 B12R1.252 O=C(O)CCOc1cccnc1 Amb33527345 [1,0,0,0,0,1|1,0,0]=3 10139 B12R1.252 O=C(O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,1|0,0,0]=2 10140 B12R1.252 O=C(O)CCSc1ccccn1 Amb1133894 [1,0,0,0,0,1|1,0,0]=3 10141 B12R1.252 O=C(O)CCSc1ncccn1 Amb6258426 [1,0,0,0,0,1|2,0,0]=4 10142 B12R1.252 O=C(O)CNCc1ccccc1 Amb2720113 [1,0,0,0,0,1|0,0,0]=2 10143 B12R1.252 O=C(O)CNCc1ccccc1 Amb6357824 [1,0,0,0,0,1|0,0,0]=2 10144 B12R1.252 O=C(O)CNCc1ccccn1 Amb1111426 [1,0,0,0,0,1|1,0,0]=3 10145 B12R1.252 O=C(O)CNCc1ccccn1 Amb13951702 [1,0,0,0,0,1|1,0,0]=3 10146 B12R1.252 O=C(O)CNCc1cccnc1 Amb1111197 [1,0,0,0,0,1|1,0,0]=3 10147 B12R1.252 O=C(O)CNCc1cccnc1 Amb6893093 [1,0,0,0,0,1|1,0,0]=3 10148 B12R1.252 O=C(O)CNCc1ccncc1 Amb1110916 [1,0,0,0,0,1|1,0,0]=3 10149 B12R1.252 O=C(O)CNCc1ccncc1 Amb32729434 [1,0,0,0,0,1|1,0,0]=3 10150 B12R1.252 O=C(O)CNCc1cnccn1 Amb19030033 [1,0,0,0,0,1|2,0,0]=4 10151 B12R1.252 O=C(O)COCc1ccccc1 Amb3939856 [1,0,0,0,0,1|0,0,0]=2 10152 B12R1.252 O=C(O)COCc1ccccn1 Amb32680346 [1,0,0,0,0,1|1,0,0]=3 10153 B12R1.252 O=C(O)COCc1ccccn1 Amb33548165 [1,0,0,0,0,1|1,0,0]=3 10154 B12R1.252 O=C(O)COCc1cccnc1 Amb28653073 [1,0,0,0,0,1|1,0,0]=3 10155 B12R1.252 O=C(O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,1|1,0,0]=3 10156 B12R1.252 O=C(O)COCc1ccncc1 Amb8010071 [1,0,0,0,0,1|1,0,0]=3 10157 B12R1.252 O=C(O)CSCc1ccccc1 Amb6357378 [1,0,0,0,0,1|0,0,0]=2 10158 B12R1.252 O=C(O)CSCc1ccccn1 Amb1126746 [1,0,0,0,0,1|1,0,0]=3 10159 B12R1.252 O=C(O)CSCc1cccnc1 Amb1129471 [1,0,0,0,0,1|1,0,0]=3 10160 B12R1.252 O=C(O)CSCc1ccncc1 Amb1134758 [1,0,0,0,0,1|1,0,0]=3 10161 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,1|0,0,0]=2 10162 B12R1.252 O=C(O)C[NH2+]Cc1ccccc1 Amb6366026 [1,0,0,0,0,1|0,0,0]=2 10163 B12R1.252 O=C(O)C\C=C\c1ccccc1 Amb6280352 [1,0,0,0,0,1|0,0,1]=3 10164 B12R1.252 O=C(O)C\C=C\c1ccccn1 Amb25073201 [1,0,0,0,0,1|1,0,1]=4 10165 B12R1.252 O=C(O)C\C=C\c1cccnc1 Amb26478515 [1,0,0,0,0,1|1,0,1]=4 10166 B12R1.252 O=C(O)C\C=C\c1ccncc1 Amb24571194 [1,0,0,0,0,1|1,0,1]=4 10167 B12R1.252 O=C(O)C\N=C/c1cccnc1 Amb27232669 [1,0,0,0,0,1|1,0,1]=4 10168 B12R1.252 O=C(O)C\N=C\c1cccnc1 Amb28077098 [1,0,0,0,0,1|1,0,1]=4 10169 B12R1.252 O=C(O)C\N=C\c1ccncc1 Amb27455443 [1,0,0,0,0,1|1,0,1]=4 10170 B12R1.252 O=C(O)C\N=N\c1ccccc1 Amb27863405 [1,0,0,0,0,1|1,0,0]=3 10171 B12R1.252 O=C(O)\C=C/Sc1ccccc1 Amb3940780 [1,0,0,0,0,1|0,0,2]=4 10172 B12R1.252 O=C(O)\C=C\Cc1ccccc1 Amb8392409 [1,0,0,0,0,1|0,0,1]=3 10173 B12R1.252 O=C(O)\C=C\Cc1cccnc1 Amb25849857 [1,0,0,0,0,1|1,0,1]=4 10174 B12R1.252 O=C(O)\C=C\Cc1ccncc1 Amb26841073 [1,0,0,0,0,1|1,0,1]=4 10175 B12R1.252 O=C(O)\C=C\Sc1ccccc1 Amb1661597 [1,0,0,0,0,1|0,0,2]=4 10176 B12R1.252 O=C(O)\C=N/Nc1ccccc1 Amb24068313 [1,0,0,0,0,1|1,0,1]=4 10177 B12R1.252 O=C(O)\C=N\Nc1ccccc1 Amb17594064 [1,0,0,0,0,1|1,0,1]=4 10178 B12R1.252 O=C([O-])CCCc1ccccc1 Amb15690987 [1,0,0,0,0,1|0,0,1]=3 10179 B12R1.252 O=C([O-])CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,1|0,0,1]=3 10180 B12R1.252 O=S([O-])CCCc1ccccc1 Amb32755679 [1,0,0,0,0,1|1,0,1]=4 10181 B12R1.252 O=S([O-])CCOc1ccccc1 Amb32755206 [1,0,0,0,0,1|1,0,1]=4 10182 B12R1.252 O=[PH](O)CNCc1ccccc1 Amb28383469 [1,0,0,0,0,1|1,0,0]=3 10183 B12R1.1343 O=C(O)CCC1=CCCCC=C1 Amb27232912 [1,0,0,0,0,1|0,0,2]=4 10184 B12R1.260 CC(CC(=O)O)Cc1ccco1 Amb17334712 [0,0,0,0,1,1|2,0,0]=4 10185 B12R1.260 CC(CC(=O)O)Cc1cccs1 Amb17335692 [0,0,0,0,1,1|2,0,0]=4 10186 B12R1.260 NC(CC(=O)O)Cc1ccco1 Amb17470474 [0,0,0,0,1,1|1,0,0]=3 10187 B12R1.260 NC(CC(=O)O)Cc1cccs1 Amb17470677 [0,0,0,0,1,1|1,0,0]=3 10188 B12R1.260 NC(CC(=O)O)Cc1cccs1 Amb33512732 [0,0,0,0,1,1|1,0,0]=3 10189 B12R1.260 NC(CC(=O)O)Cc1cncs1 Amb18822048 [0,0,0,0,1,1|2,0,0]=4 10190 B12R1.260 N[C@@H](CC(=O)O)Cc1cccs1 Amb24106410 [0,0,0,0,1,1|1,0,0]=3 10191 B12R1.260 N[C@@H](CC(=O)O)Cc1ccsc1 Amb33726073 [0,0,0,0,1,1|1,0,0]=3 10192 B12R1.260 N[C@H](CC(=O)O)Cc1ccco1 Amb2699215 [0,0,0,0,1,1|1,0,0]=3 10193 B12R1.260 N[C@H](CC(=O)O)Cc1ccsc1 Amb24106405 [0,0,0,0,1,1|1,0,0]=3 10194 B12R1.260 O=C(O)CC(Br)Cc1cccs1 Amb18111161 [0,0,0,0,1,1|2,0,0]=4 10195 B12R1.260 O=C(O)CC(Cl)Cc1cccs1 Amb18111160 [0,0,0,0,1,1|2,0,0]=4 10196 B14R1.423 CC(=O)N\N=C(\N)Cc1ccccc1 Amb27803656 [0,0,0,0,0,2|1,0,1]=4 10197 B14R1.423 CC(CCC(=O)O)Cc1ccccc1 Amb5718197 [0,0,0,0,0,2|1,0,0]=3 10198 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb19042074 [0,0,0,0,0,2|1,0,0]=3 10199 B14R1.423 CC(Cc1ccccc1)NCC(=O)O Amb4453185 [0,0,0,0,0,2|1,0,0]=3 10200 B14R1.423 CN(CCC(=O)O)Cc1ccccc1 Amb15740934 [0,0,0,0,0,2|2,0,0]=4 10201 B14R1.423 CN(CCC(=O)O)Cc1ccccc1 Amb5775403 [0,0,0,0,0,2|2,0,0]=4 10202 B14R1.423 NC(=O)OCC(N)Cc1ccccc1 Amb28653362 [0,0,0,0,0,2|1,0,0]=3 10203 B14R1.423 NC(CCC(=O)O)Cc1ccccc1 Amb28750738 [0,0,0,0,0,2|0,0,0]=2 10204 B14R1.423 NC(CCC(=O)O)Cc1ccccc1 Amb9782554 [0,0,0,0,0,2|0,0,0]=2 10205 B14R1.423 N[C@@H](CCC(=O)O)Cc1ccccc1 Amb33816442 [0,0,0,0,0,2|0,0,0]=2 10206 B14R1.423 N\C(=N/c1ccccc1)NCC(=O)O Amb5754445 [0,0,0,0,0,2|1,0,1]=4 10207 B14R1.423 N\C(=N/c1ccccc1)SCC(=O)O Amb17595657 [0,0,0,0,0,2|1,0,1]=4 10208 B14R1.423 O=C(O)CNC(=O)Cc1ccccc1 Amb1218287 [0,0,0,0,0,2|1,0,1]=4 10209 B14R1.818 CC(=O)CC(C)OCc1ccccc1 Amb28319449 [0,0,0,0,0,2|2,0,0]=4 10210 B14R1.818 CC(=O)CC(C)SCc1ccccc1 Amb32683046 [0,0,0,0,0,2|2,0,0]=4 10211 B14R1.818 CC(=O)NC(C)NCc1ccccc1 Amb27773815 [0,0,0,0,0,2|2,0,0]=4 10212 B14R1.818 CC(=O)OC(C)CCc1ccccc1 Amb4034624 [0,0,0,0,0,2|2,0,0]=4 10213 B14R1.818 CC(C#Cc1ccccc1)CC(=O)O Amb27760503 [0,0,0,0,0,2|1,0,1]=4 10214 B14R1.818 CC(CC(=O)O)NCc1ccccc1 Amb6357298 [0,0,0,0,0,2|1,0,0]=3 10215 B14R1.818 CC(CC(=O)O)NCc1ccccn1 Amb9398628 [0,0,0,0,0,2|2,0,0]=4 10216 B14R1.818 CC(CC(=O)O)NCc1cccnc1 Amb9398688 [0,0,0,0,0,2|2,0,0]=4 10217 B14R1.818 CC(CC(=O)O)NCc1ccncc1 Amb9398690 [0,0,0,0,0,2|2,0,0]=4 10218 B14R1.818 CC(CCc1ccccc1)CC(=O)O Amb6749216 [0,0,0,0,0,2|1,0,0]=3 10219 B14R1.818 CC(CNc1ccccc1)NC(N)=O Amb28122040 [0,0,0,0,0,2|2,0,0]=4 10220 B14R1.818 CC(\C=C\c1ccccc1)CC(=O)O Amb32952094 [0,0,0,0,0,2|1,0,1]=4 10221 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb28653100 [0,0,0,0,0,2|2,0,0]=4 10222 B14R1.818 CN(CCc1ccccc1)CC(=O)O Amb9301012 [0,0,0,0,0,2|2,0,0]=4 10223 B14R1.818 C[C@@H](CC(=O)O)NCc1ccccc1 Amb25124067 [0,0,0,0,0,2|1,0,0]=3 10224 B14R1.818 C[C@@H](CC(=O)O)OCc1ccccc1 Amb24335959 [0,0,0,0,0,2|1,0,0]=3 10225 B14R1.818 C[C@H](CC(N)=O)OCc1ccccc1 Amb27817889 [0,0,0,0,0,2|2,0,0]=4 10226 B14R1.818 C\C(=C/C(=O)O)CCc1ccccc1 Amb6749184 [0,0,0,0,0,2|1,0,1]=4 10227 B14R1.818 C\C(=C/C(=O)O)COc1ccccc1 Amb17235343 [0,0,0,0,0,2|1,0,1]=4 10228 B14R1.818 NC(=O)CC(N)C#Cc1ccccc1 Amb27874119 [0,0,0,0,0,2|1,0,1]=4 10229 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb1993736 [0,0,0,0,0,2|0,0,0]=2 10230 B14R1.818 NC(CCc1ccccc1)CC(=O)O Amb30117911 [0,0,0,0,0,2|0,0,0]=2 10231 B14R1.818 NC(\C=C\c1ccccc1)CC(=O)O Amb32954178 [0,0,0,0,0,2|0,0,1]=3 10232 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb19887670 [0,0,0,0,0,2|0,0,0]=2 10233 B14R1.818 N[C@@H](CCc1ccccc1)CC(=O)O Amb22746249 [0,0,0,0,0,2|0,0,0]=2 10234 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb16231748 [0,0,0,0,0,2|0,0,0]=2 10235 B14R1.818 N[C@H](CCc1ccccc1)CC(=O)O Amb19888418 [0,0,0,0,0,2|0,0,0]=2 10236 B14R1.818 O=C(O)CC(=O)NCc1ccccc1 Amb17401704 [0,0,0,0,0,2|1,0,1]=4 10237 B14R1.818 O=C(O)CC(=O)OCc1ccccc1 Amb3940863 [0,0,0,0,0,2|1,0,1]=4 10238 B14R1.818 O=C(O)CC(O)C#Cc1ccccc1 Amb28323736 [0,0,0,0,0,2|1,0,1]=4 10239 B14R1.818 O=C(O)CC(O)\C=C\c1ccccc1 Amb32954523 [0,0,0,0,0,2|1,0,1]=4 10240 B14R1.818 O=C(O)C[C@@H](O)\C=C\c1ccccc1 Amb33082662 [0,0,0,0,0,2|1,0,1]=4 10241 B14R1.818 O=C(O)C[C@H](O)\C=C\c1ccccc1 Amb32954719 [0,0,0,0,0,2|1,0,1]=4 10242 B14R1.6449 C=C(CC#Cc1ccccc1)C(=O)O Amb27984805 [0,0,0,0,0,2|1,0,1]=4 10243 B14R1.6449 C=C(CNCc1ccccc1)C(=O)O Amb27465081 [0,0,0,0,0,2|1,0,1]=4 10244 B14R1.6449 CC(=O)[C@H](C)COCc1ccccc1 Amb27750417 [0,0,0,0,0,2|2,0,0]=4 10245 B14R1.6449 CC(CCCc1ccccc1)C(=O)O Amb17235376 [0,0,0,0,0,2|1,0,0]=3 10246 B14R1.6449 CC(CCOc1ccccc1)C(=O)O Amb17235913 [0,0,0,0,0,2|1,0,0]=3 10247 B14R1.6449 CC(CNCc1ccccc1)C(=O)O Amb20623866 [0,0,0,0,0,2|1,0,0]=3 10248 B14R1.6449 CC(CNCc1ccccc1)C(=O)O Amb9400318 [0,0,0,0,0,2|1,0,0]=3 10249 B14R1.6449 CC(CNCc1ccccn1)C(=O)O Amb9400511 [0,0,0,0,0,2|2,0,0]=4 10250 B14R1.6449 CC(CNCc1cccnc1)C(=O)O Amb9400556 [0,0,0,0,0,2|2,0,0]=4 10251 B14R1.6449 CC(CNCc1ccncc1)C(=O)O Amb9400557 [0,0,0,0,0,2|2,0,0]=4 10252 B14R1.6449 CC(COCc1ccccc1)C(=O)O Amb9399793 [0,0,0,0,0,2|1,0,0]=3 10253 B14R1.6449 CC(COCc1ccccc1)C(N)=O Amb26620812 [0,0,0,0,0,2|2,0,0]=4 10254 B14R1.6449 CC(CSCc1ccccc1)C(=O)O Amb9400039 [0,0,0,0,0,2|1,0,0]=3 10255 B14R1.6449 CC(C\C=C\c1ccccc1)C(=O)O Amb33082406 [0,0,0,0,0,2|1,0,0]=3 10256 B14R1.6449 CC(NOCc1ccccc1)C(=O)O Amb18652109 [0,0,0,0,0,2|1,0,0]=3 10257 B14R1.6449 CC(OCCc1ccccc1)C(=O)O Amb7790062 [0,0,0,0,0,2|1,0,0]=3 10258 B14R1.6449 CC(SCCc1ccccn1)C(=O)O Amb601179 [0,0,0,0,0,2|2,0,0]=4 10259 B14R1.6449 C[C@@H](NOCc1ccccc1)C(=O)O Amb28385656 [0,0,0,0,0,2|1,0,0]=3 10260 B14R1.6449 C[C@H](COCc1ccccc1)C(N)=O Amb27814268 [0,0,0,0,0,2|2,0,0]=4 10261 B14R1.6449 C[C@H](NOCc1ccccc1)C(=O)O Amb27409004 [0,0,0,0,0,2|1,0,0]=3 10262 B14R1.6449 C[C@H](N\C=C\c1ccccc1)C(=O)O Amb16231751 [0,0,0,0,0,2|1,0,1]=4 10263 B14R1.6449 C\C(=C\CNc1ccccc1)C(=O)O Amb27495125 [0,0,0,0,0,2|1,0,1]=4 10264 B14R1.6449 C\C(=C\OCc1ccccc1)C(=O)O Amb27863456 [0,0,0,0,0,2|1,0,1]=4 10265 B14R1.6449 C\C(=N/NCc1ccccc1)C(=O)O Amb18651177 [0,0,0,0,0,2|1,0,1]=4 10266 B14R1.6449 C\C(=N\NCc1ccccc1)C(=O)O Amb27201364 [0,0,0,0,0,2|1,0,1]=4 10267 B14R1.6449 C\C(=N\OCc1ccccc1)C(=O)O Amb23512428 [0,0,0,0,0,2|1,0,1]=4 10268 B14R1.6449 NC(=O)C(N)CNCc1ccccc1 Amb27183784 [0,0,0,0,0,2|1,0,0]=3 10269 B14R1.6449 NC(=O)C(N)COCc1ccccc1 Amb25809213 [0,0,0,0,0,2|1,0,0]=3 10270 B14R1.6449 NC(=O)C(O)CNCc1ccccc1 Amb28075787 [0,0,0,0,0,2|2,0,0]=4 10271 B14R1.6449 NC(=O)C(O)COCc1ccccc1 Amb27591575 [0,0,0,0,0,2|2,0,0]=4 10272 B14R1.6449 NC(=O)[C@H](N)COCc1ccccc1 Amb27174294 [0,0,0,0,0,2|1,0,0]=3 10273 B14R1.6449 NC(CCCc1ccccc1)C(=O)O Amb19342362 [0,0,0,0,0,2|0,0,0]=2 10274 B14R1.6449 NC(CCCc1ccccc1)C(=O)O Amb9726682 [0,0,0,0,0,2|0,0,0]=2 10275 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb32752690 [0,0,0,0,0,2|0,0,0]=2 10276 B14R1.6449 NC(CCOc1ccccc1)C(=O)O Amb33547968 [0,0,0,0,0,2|0,0,0]=2 10277 B14R1.6449 NC(CCSc1ccccc1)C(=O)O Amb28653163 [0,0,0,0,0,2|0,0,0]=2 10278 B14R1.6449 NC(CNCc1ccccc1)C(=O)O Amb26032867 [0,0,0,0,0,2|0,0,0]=2 10279 B14R1.6449 NC(CNCc1ccccc1)C(=O)O Amb28750769 [0,0,0,0,0,2|0,0,0]=2 10280 B14R1.6449 NC(COCc1ccccc1)C(=O)O Amb3941669 [0,0,0,0,0,2|0,0,0]=2 10281 B14R1.6449 NC(CSCc1ccccc1)C(=O)O Amb9726318 [0,0,0,0,0,2|0,0,0]=2 10282 B14R1.6449 NC(C\C=C\c1ccccc1)C(=O)O Amb6270143 [0,0,0,0,0,2|0,0,0]=2 10283 B14R1.6449 N[C@@H](CC#Cc1ccccc1)C(=O)O Amb27874967 [0,0,0,0,0,2|0,0,0]=2 10284 B14R1.6449 N[C@@H](CCCc1ccccc1)C(=O)O Amb20241024 [0,0,0,0,0,2|0,0,0]=2 10285 B14R1.6449 N[C@@H](CCOc1ccccc1)C(=O)O Amb32667500 [0,0,0,0,0,2|0,0,0]=2 10286 B14R1.6449 N[C@@H](COCc1ccccc1)C(=O)O Amb2760730 [0,0,0,0,0,2|0,0,0]=2 10287 B14R1.6449 N[C@@H](COCc1ccccc1)C(=O)O Amb31289420 [0,0,0,0,0,2|0,0,0]=2 10288 B14R1.6449 N[C@@H](CSCc1ccccc1)C(=O)O Amb533304 [0,0,0,0,0,2|0,0,0]=2 10289 B14R1.6449 N[C@@H](C\C=C\c1ccccc1)C(=O)O Amb22746168 [0,0,0,0,0,2|0,0,0]=2 10290 B14R1.6449 N[C@H](CCCc1ccccc1)C(=O)O Amb6295896 [0,0,0,0,0,2|0,0,0]=2 10291 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668011 [0,0,0,0,0,2|0,0,0]=2 10292 B14R1.6449 N[C@H](CCOc1ccccc1)C(=O)O Amb32668012 [0,0,0,0,0,2|0,0,0]=2 10293 B14R1.6449 N[C@H](CNCc1ccccc1)C(=O)O Amb8389449 [0,0,0,0,0,2|0,0,0]=2 10294 B14R1.6449 N[C@H](COCc1ccccc1)C(=O)O Amb19944297 [0,0,0,0,0,2|0,0,0]=2 10295 B14R1.6449 N[C@H](COCc1ccccc1)C(=O)O Amb3938903 [0,0,0,0,0,2|0,0,0]=2 10296 B14R1.6449 N[C@H](CSCc1ccccc1)C(=O)O Amb8389452 [0,0,0,0,0,2|0,0,0]=2 10297 B14R1.6449 N[C@H](C\C=C\c1ccccc1)C(=O)O Amb34912482 [0,0,0,0,0,2|0,0,0]=2 10298 B14R1.6449 O=C(O)C(=O)C\C=C\c1ccccc1 Amb33081312 [0,0,0,0,0,2|1,0,1]=4 10299 B14R1.6449 O=C(O)C(=O)NCCc1ccccc1 Amb9303971 [0,0,0,0,0,2|1,0,1]=4 10300 B14R1.6449 O=C(O)C(F)CNCc1ccccc1 Amb27858443 [0,0,0,0,0,2|1,0,0]=3 10301 B14R1.6449 O=C(O)C(O)CNCc1ccccc1 Amb28240691 [0,0,0,0,0,2|1,0,0]=3 10302 B14R1.6449 O=C(O)C(O)COCc1ccccc1 Amb8393609 [0,0,0,0,0,2|1,0,0]=3 10303 B14R1.6449 O=C(O)C(O)C\C=C\c1ccccc1 Amb32954515 [0,0,0,0,0,2|1,0,0]=3 10304 B14R1.6449 O=C(O)[C@@H](O)COCc1ccccc1 Amb25088415 [0,0,0,0,0,2|1,0,0]=3 10305 B14R1.6449 O=C(O)[C@H](O)COCc1ccccc1 Amb24428781 [0,0,0,0,0,2|1,0,0]=3