0 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [0,0,0,0,0,0|3,0,0]=3 2 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,0,0,0,0,0|2,0,0]=2 3 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,0,0,0,0,0|1,0,0]=1 4 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,0,0,0,0,0|1,0,0]=1 5 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,0,0,0,0,0|2,1,1]=4 8 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,0,0,0,0,0|2,0,1]=3 10 B12R1.43 C=C(Sc1ccccc1)C(N)=O Amb24739855 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,0,0,0,0,0|3,0,0]=3 12 B12R1.43 CC(=C)C(N)Cc1cc[n]cc1 Amb25779646 [0,0,0,0,0,0|3,0,0]=3 13 B12R1.43 CC(=C)C(N)Cc1cccc[n]1 Amb24438082 [0,0,0,0,0,0|3,0,0]=3 14 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.43 CC(=Cc1ccccc1)C(=O)Cl Amb24061289 [0,0,0,0,0,0|2,0,2]=4 16 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,0,0,0,0,0|2,0,1]=3 20 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.43 CC(=O)C(C)Oc1cccc[n]1 Amb25120521 [0,0,0,0,0,0|4,0,0]=4 22 B12R1.43 CC(=O)C(C)Sc1cc[n]cc1 Amb25792214 [0,0,0,0,0,0|4,0,0]=4 23 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [0,0,0,0,0,0|3,0,0]=3 25 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [0,0,0,0,0,0|3,0,0]=3 26 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.43 CC(=O)C(Oc1cccnc1)C Amb2407640 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,0,0,0,0,0|3,0,0]=3 32 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,0,0,0,0,0|2,0,0]=2 34 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,0,0,0,0,0|3,0,0]=3 35 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,0,0,0,0,0|2,0,0]=2 36 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,0,0,0,0,0|2,0,0]=2 37 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [0,0,0,0,0,0|3,0,0]=3 38 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,0,0,0,0,0|2,0,0]=2 39 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,0,0,0,0,0|2,0,2]=4 40 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,0,0,0,0,0|3,1,0]=4 41 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,0,0,0,0,0|2,0,0]=2 42 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,0,0,0,0,0|3,0,0]=3 44 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,0,0,0,0,0|2,0,0]=2 46 B12R1.43 CC(C(=O)O)Nc1ncccn1 Amb2372391 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.43 CC(C(=O)O)Sc1cnccn1 Amb2446097 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,0,0,0,0,0|3,1,0]=4 50 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,0,0,0,0,0|3,0,1]=4 51 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,0,0,0,0,0|2,0,1]=3 52 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [0,0,0,0,0,0|3,0,1]=4 53 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.43 CC(C)C(N)Cc1cc[n]cc1 Amb18299313 [0,0,0,0,0,0|3,0,1]=4 55 B12R1.43 CC(C)C(N)Cc1ccc[n]c1 Amb18299298 [0,0,0,0,0,0|3,0,1]=4 56 B12R1.43 CC(Cc1c[n]c[n]c1)C(O)=O Amb24375035 [0,0,0,0,0,0|3,0,0]=3 57 B12R1.43 CC(Cc1cc[n]cc1)C(C)O Amb25710238 [0,0,0,0,0,0|3,0,1]=4 58 B12R1.43 CC(Cc1cccc[n]1)C(C)O Amb24341829 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,0,0,0,0,0|3,0,1]=4 60 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,0,0,0,0,0|2,0,1]=3 62 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [0,0,0,0,0,0|3,0,1]=4 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@H](O)Cc1ccccc1 Amb24389484 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.43 CC(Nc1c[n]c[n]c1)C(O)=O Amb18270384 [0,0,0,0,0,0|4,0,0]=4 68 B12R1.43 CC(Nc1cc[n][n]c1)C(O)=O Amb25261344 [0,0,0,0,0,0|4,0,0]=4 69 B12R1.43 CC(Nc1cc[n]c[n]1)C(O)=O Amb18973870 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.43 CC(Nc1ccc[n][n]1)C(O)=O Amb18991526 [0,0,0,0,0,0|4,0,0]=4 71 B12R1.43 CC(Nc1ccc[n]c1)C(O)=O Amb18270393 [0,0,0,0,0,0|3,0,0]=3 72 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,0,0,0,0,0|3,0,0]=3 73 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,0,0,0,0,0|2,0,2]=4 74 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,0,0,0,0,0|2,0,2]=4 75 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,0,0,0,0,0|2,0,1]=3 76 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,0,0,0,0,0|1,0,1]=2 77 B12R1.43 CC(O)C(O)Cc1cc[n]cc1 Amb25158222 [0,0,0,0,0,0|3,0,1]=4 78 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,0,0,0,0,0|2,0,1]=3 79 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,0,0,0,0,0|1,0,1]=2 80 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,0,0,0,0,0|2,0,1]=3 81 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,0,0,0,0,0|1,0,1]=2 82 B12R1.43 CC(OC1=CC=CNN1)C(O)=O Amb25775008 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.43 CC(Oc1ccc[n]c1)C(N)=O Amb24760938 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [0,0,0,0,0,0|3,0,1]=4 85 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,0,0,0,0,0|4,0,0]=4 86 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,0,0,0,0,0|2,0,0]=2 87 B12R1.43 CC(Sc1cc[n]c[n]1)C(O)=O Amb18973866 [0,0,0,0,0,0|4,0,0]=4 88 B12R1.43 CC(Sc1ccc[n][n]1)C(O)=O Amb18991532 [0,0,0,0,0,0|4,0,0]=4 89 B12R1.43 CC(Sc1ccccc1)C(N)=N Amb18805146 [0,0,0,0,0,0|4,0,0]=4 90 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [0,0,0,0,0,0|3,0,0]=3 91 B12R1.43 CN(Cc1cc[n]cc1)C(=O)Cl Amb24357639 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.43 CN(Cc1ccc[n]c1)C(=O)Cl Amb25034672 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.43 CN(Cc1ccccc1)C(N)=N Amb22586446 [0,0,0,0,0,0|4,0,0]=4 94 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,0,0,0,0,0|1,0,0]=1 95 B12R1.43 C[C@@H](C(=O)O)Nc1ccncc1 Amb10604191 [0,0,0,0,0,0|3,0,0]=3 96 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,0,0,0,0,0|2,0,1]=3 97 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,0,0,0,0,0|2,0,0]=2 98 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,0,0,0,0,0|4,0,0]=4 99 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,0,0,0,0,0|2,0,1]=3 100 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,0,0,0,0,0|3,0,1]=4 101 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [0,0,0,0,0,0|2,0,1]=3 102 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [0,0,0,0,0,0|3,0,1]=4 103 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [0,0,0,0,0,0|3,0,1]=4 104 B12R1.43 C[C@@H](Nc1[n]ccc[n]1)C(O)=O Amb24707746 [0,0,0,0,0,0|4,0,0]=4 105 B12R1.43 C[C@@H](Nc1cccc[n]1)C(O)=O Amb24475793 [0,0,0,0,0,0|3,0,0]=3 106 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,0,0,0,0,0|2,0,0]=2 107 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,0,0,0,0,0|3,0,1]=4 108 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,0,0,0,0,0|2,0,2]=4 109 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,0,0,0,0,0|2,0,1]=3 110 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,0,0,0,0,0|2,0,1]=3 111 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,0,0,0,0,0|1,0,1]=2 112 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,0,0,0,0,0|2,0,0]=2 113 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [0,0,0,0,0,0|3,0,1]=4 114 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [0,0,0,0,0,0|3,0,1]=4 115 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [0,0,0,0,0,0|3,0,1]=4 116 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,0,0,0,0,0|1,0,0]=1 117 B12R1.43 C[C@H](C(=O)O)Nc1cnccn1 Amb16233069 [0,0,0,0,0,0|4,0,0]=4 118 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,0,0,0,0,0|2,0,1]=3 119 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,0,0,0,0,0|2,0,1]=3 120 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [0,0,0,0,0,0|2,0,1]=3 121 B12R1.43 C[C@H](Nc1c[n]cc[n]1)C(O)=O Amb25829931 [0,0,0,0,0,0|4,0,0]=4 122 B12R1.43 C[C@H](Nc1ccc[n][n]1)C(O)=O Amb25268668 [0,0,0,0,0,0|4,0,0]=4 123 B12R1.43 C[C@H](Nc1ccc[n]c1)C(O)=O Amb25320831 [0,0,0,0,0,0|3,0,0]=3 124 B12R1.43 C[C@H](Nc1cccc[n]1)C(O)=O Amb24066967 [0,0,0,0,0,0|3,0,0]=3 125 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,0,0,0,0,0|2,0,0]=2 126 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,0,0,0,0,0|2,0,2]=4 127 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,0,0,0,0,0|1,0,1]=2 128 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,0,0,0,0,0|2,0,1]=3 129 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,0,0,0,0,0|1,0,1]=2 130 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,0,0,0,0,0|2,0,0]=2 131 B12R1.43 C[C@H](Sc1cccc[n]1)C(O)=O Amb22388633 [0,0,0,0,0,0|3,0,0]=3 132 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,0,0,0,0,0|2,0,0]=2 133 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [0,0,0,0,0,0|3,0,1]=4 134 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,0,0,0,0,0|2,0,2]=4 135 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,0,0,0,0,0|1,0,2]=3 136 B12R1.43 C\C(=C\c1ccccc1)\C(N)=O Amb24388896 [0,0,0,0,0,0|2,0,2]=4 137 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,0,0,0,0,0|1,0,2]=3 138 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,0,0,0,0,0|3,0,1]=4 139 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,0,0,0,0,0|2,0,1]=3 140 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,0,0,0,0,0|2,0,0]=2 141 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,0,0,0,0,0|2,0,0]=2 143 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,0,0,0,0,0|2,0,0]=2 144 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,0,0,0,0,0|1,0,0]=1 145 B12R1.43 FB(F)C(Cl)Cc1ccccc1 Amb25246443 [0,0,0,0,0,0|4,0,0]=4 146 B12R1.43 FB(F)[C@H](Cl)Cc1ccccc1 Amb25138719 [0,0,0,0,0,0|4,0,0]=4 147 B12R1.43 FC(C(=O)O)Sc1ncccn1 Amb2407790 [0,0,0,0,0,0|4,0,0]=4 148 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,0,0,0,0,0|1,0,2]=3 149 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,0,0,0,0,0|0,0,2]=2 150 B12R1.43 NC(=N)N(N)Cc1ccccc1 Amb25760721 [0,0,0,0,0,0|3,0,0]=3 151 B12R1.43 NC(=N)N(O)Cc1ccccc1 Amb25291446 [0,0,0,0,0,0|4,0,0]=4 152 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,0,0,0,0,0|2,0,2]=4 153 B12R1.43 NC(=O)C(=O)Cc1c[n]ccc1 Amb24400568 [0,0,0,0,0,0|3,0,1]=4 154 B12R1.43 NC(=O)C(Br)Cc1c[n]c[n]c1 Amb25188402 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,0,0,0,0,0|3,0,0]=3 156 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,0,0,0,0,0|2,0,0]=2 157 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,0,0,0,0,0|2,0,0]=2 158 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,0,0,0,0,0|1,0,0]=1 159 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,0,0,0,0,0|2,0,0]=2 160 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,0,0,0,0,0|2,0,0]=2 161 B12R1.43 NC(=O)C(Sc1ccccn1)C Amb13953849 [0,0,0,0,0,0|4,0,0]=4 162 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,0,0,0,0,0|2,0,0]=2 163 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,0,0,0,0,0|2,0,0]=2 164 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,0,0,0,0,0|1,1,0]=2 165 B12R1.43 NC(=S)N(Cl)Cc1ccccc1 Amb24681100 [0,0,0,0,0,0|3,1,0]=4 166 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,0,0,0,0,0|2,1,0]=3 167 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,0,0,0,0,0|1,0,0]=1 168 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [0,0,0,0,0,0|2,0,1]=3 169 B12R1.43 NC(CC=1CCCCC1)C(O)=O Amb22233021 [0,0,0,0,0,0|0,0,4]=4 170 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,0,0,0,0,0|0,0,0]=0 171 B12R1.43 NC(Cc1[n][n]c[n][n]1)C(O)=O Amb25215585 [0,0,0,0,0,0|4,0,0]=4 172 B12R1.43 NC(Cc1[n]ccc[n]1)C(O)=O Amb18995251 [0,0,0,0,0,0|2,0,0]=2 173 B12R1.43 NC(Cc1c[n][n]c[n]1)C(O)=O Amb18826715 [0,0,0,0,0,0|3,0,0]=3 174 B12R1.43 NC(Cc1c[n]c[n][n]1)C(O)=O Amb25174569 [0,0,0,0,0,0|3,0,0]=3 175 B12R1.43 NC(Cc1c[n]c[n]c1)C(O)=O Amb18302429 [0,0,0,0,0,0|2,0,0]=2 176 B12R1.43 NC(Cc1c[n]cc[n]1)C(O)=O Amb19000859 [0,0,0,0,0,0|2,0,0]=2 177 B12R1.43 NC(Cc1cc[n]c[n]1)C(O)=O Amb19000856 [0,0,0,0,0,0|2,0,0]=2 178 B12R1.43 NC(Cc1cc[n]cc1)C(F)F Amb25733681 [0,0,0,0,0,0|3,0,1]=4 179 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,0,0,0,0,0|1,0,0]=1 180 B12R1.43 NC(Cc1ccc[n][n]1)C(O)=O Amb18827268 [0,0,0,0,0,0|2,0,0]=2 181 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,0,0,0,0,0|1,0,0]=1 182 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,0,0,0,0,0|1,0,0]=1 183 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,0,0,0,0,0|1,0,0]=1 184 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,0,0,0,0,0|1,0,0]=1 185 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,0,0,0,0,0|0,1,0]=1 186 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,0,0,0,0,0|0,0,0]=0 187 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,0,0,0,0,0|1,0,1]=2 188 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,0,0,0,0,0|0,0,0]=0 189 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,0,0,0,0,0|2,0,0]=2 190 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,0,0,0,0,0|1,0,0]=1 191 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,0,0,0,0,0|0,0,0]=0 192 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,0,0,0,0,0|0,0,0]=0 193 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,0,0,0,0,0|0,0,0]=0 194 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,0,0,0,0,0|0,0,0]=0 195 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,0,0,0,0,0|1,0,0]=1 196 B12R1.43 N[C@@H](CC=1CC=CCC1)C(O)=O Amb24080592 [0,0,0,0,0,0|0,0,2]=2 197 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,0,0,0,0,0|0,0,0]=0 198 B12R1.43 N[C@@H](Cc1[n]ccc[n]1)C(O)=O Amb24524889 [0,0,0,0,0,0|2,0,0]=2 199 B12R1.43 N[C@@H](Cc1c[n]c[n]c1)C(O)=O Amb19149168 [0,0,0,0,0,0|2,0,0]=2 200 B12R1.43 N[C@@H](Cc1c[n]cc[n]1)C(O)=O Amb22801697 [0,0,0,0,0,0|2,0,0]=2 201 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,0,0,0,0,0|1,0,0]=1 202 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,0,0,0,0,0|1,0,0]=1 203 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,0,0,0,0,0|1,0,0]=1 204 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,0,0,0,0,0|1,0,1]=2 205 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,0,0,0,0,0|0,0,0]=0 206 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,0,0,0,0,0|1,0,1]=2 207 B12R1.43 N[C@H](Cc1c[n]cc[n]1)C(O)=O Amb24671229 [0,0,0,0,0,0|2,0,0]=2 208 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,0,0,0,0,0|1,0,0]=1 209 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,0,0,0,0,0|1,0,0]=1 210 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,0,0,0,0,0|1,0,0]=1 211 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,0,0,0,0,0|1,0,0]=1 212 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,0,0,0,0,0|1,0,0]=1 213 B12R1.43 N\C(=C/c1cc[n]c[n]1)\C(O)=O Amb24390213 [0,0,0,0,0,0|2,0,2]=4 214 B12R1.43 N\C(=C\c1cc[n]c[n]1)\C(O)=O Amb24518466 [0,0,0,0,0,0|2,0,2]=4 215 B12R1.43 N\C(=C\c1ccc[n]c1)\C(O)=O Amb25254657 [0,0,0,0,0,0|1,0,2]=3 216 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,0,0,0,0,0|3,0,1]=4 217 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,0,0,0,0,0|3,0,1]=4 218 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,0,0,0,0,0|2,0,1]=3 219 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,0,0,0,0,0|2,0,0]=2 220 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,0,0,0,0,0|3,0,1]=4 221 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,0,0,0,0,0|3,0,1]=4 222 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,0,0,0,0,0|2,0,1]=3 223 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,0,0,0,0,0|2,0,1]=3 224 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,0,0,0,0,0|2,0,1]=3 225 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,0,0,0,0,0|2,0,1]=3 226 B12R1.43 OC(=O)C(=S)Cc1cccc[n]1 Amb25059246 [0,0,0,0,0,0|2,0,1]=3 227 B12R1.43 OC(=O)C(=S)Nc1cc[n]cc1 Amb24368096 [0,0,0,0,0,0|3,0,1]=4 228 B12R1.43 OC(=O)C(Br)Cc1c[n]c[n]c1 Amb23571329 [0,0,0,0,0,0|3,0,0]=3 229 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,0,0,0,0,0|2,0,0]=2 230 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,0,0,0,0,0|1,0,0]=1 231 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,0,0,0,0,0|2,0,0]=2 232 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,0,0,0,0,0|2,0,0]=2 233 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,0,0,0,0,0|1,0,2]=3 234 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,0,0,0,0,0|2,0,0]=2 235 B12R1.43 OC(=O)C(F)Sc1cc[n]cc1 Amb24487398 [0,0,0,0,0,0|3,0,0]=3 236 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,0,0,0,0,0|2,0,0]=2 237 B12R1.43 OC(=O)C(O)Cc1c[n]c[n]c1 Amb25722221 [0,0,0,0,0,0|3,0,0]=3 238 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,0,0,0,0,0|2,0,0]=2 239 B12R1.43 OC(=O)C(S)Cc1cc[n]c[n]1 Amb24587068 [0,0,0,0,0,0|3,0,0]=3 240 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,0,0,0,0,0|2,0,0]=2 241 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,0,0,0,0,0|2,0,0]=2 242 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,0,0,0,0,0|2,0,0]=2 243 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,0,0,0,0,0|1,0,0]=1 244 B12R1.43 OC(=O)C(Sc1ccccn1)C Amb1139396 [0,0,0,0,0,0|3,0,0]=3 245 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,0,0,0,0,0|1,0,0]=1 246 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,0,0,0,0,0|1,0,0]=1 247 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,0,0,0,0,0|1,0,0]=1 248 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,0,0,0,0,0|1,0,0]=1 249 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,0,0,0,0,0|1,0,0]=1 250 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,0,0,0,0,0|2,0,0]=2 251 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,0,0,0,0,0|2,0,0]=2 252 B12R1.43 OC(=O)\C(=C\c1ccccn1)\S Amb1761004 [0,0,0,0,0,0|2,0,2]=4 253 B12R1.43 OC(=O)\C(=C\c1cccnc1)\F Amb17614474 [0,0,0,0,0,0|2,0,2]=4 254 B12R1.43 OC(=O)\C(=C\c1cccnc1)\S Amb1761005 [0,0,0,0,0,0|2,0,2]=4 255 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,0,0,0,0,0|1,0,2]=3 256 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,0,0,0,0,0|1,0,2]=3 257 B12R1.43 OC(=O)\C(\F)=C\c1cc[n]cc1 Amb24377793 [0,0,0,0,0,0|2,0,2]=4 258 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,0,0,0,0,0|1,1,0]=2 259 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,0,0,0,0,0|2,0,0]=2 260 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [0,0,0,0,0,0|3,0,1]=4 261 B12R1.43 OC(Cc1ccccc1)C(F)Cl Amb25288246 [0,0,0,0,0,0|3,0,1]=4 262 B12R1.43 OC(Cc1ccccc1)C(F)F Amb24665165 [0,0,0,0,0,0|3,0,1]=4 263 B12R1.43 O[C@@H](Cc1ccccc1)C(F)F Amb24371353 [0,0,0,0,0,0|3,0,1]=4 264 B12R1.43 O[C@@H](Cc1ccccc1)[C@H](F)Cl Amb24373884 [0,0,0,0,0,0|3,0,1]=4 265 B12R1.43 O[C@H](Cc1ccccc1)C(F)F Amb25129748 [0,0,0,0,0,0|3,0,1]=4 266 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,0,0,0,0,0|1,0,2]=3 267 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,0,0,0,0,0|2,0,1]=3 268 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,0,0,0,0,0|1,0,2]=3 269 B12R1.43 S\C(=C/c1ccncc1)\C(=O)O Amb1761003 [0,0,0,0,0,0|2,0,2]=4 270 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,0,0,0,0,0|1,0,2]=3 271 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,0,0,0,0,0|0,0,0]=0 272 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,0,0,0,0,0|1,0,2]=3 273 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [1,0,0,0,0,0|2,0,1]=4 274 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [1,0,0,0,0,0|2,0,1]=4 275 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.40 C#CC(N)Cc1c[n]ccc1 Amb25132596 [1,0,0,0,0,0|2,0,1]=4 277 B11R1.40 C#CC(N)Cc1cccc[n]1 Amb25340965 [1,0,0,0,0,0|2,0,1]=4 278 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [1,0,0,0,0,0|1,0,1]=3 279 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [1,0,0,0,0,0|2,0,1]=4 280 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [1,0,0,0,0,0|2,0,1]=4 281 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [1,0,0,0,0,0|2,0,1]=4 282 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [1,0,0,0,0,0|2,0,1]=4 283 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [1,0,0,0,0,0|3,0,0]=4 284 B11R1.40 C=CC(N)Cc1cccc[n]1 Amb25077646 [1,0,0,0,0,0|2,0,0]=3 285 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [1,0,0,0,0,0|1,0,0]=2 286 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [1,0,0,0,0,0|3,0,0]=4 288 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,0,0,0,0,0|2,0,0]=3 289 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [1,0,0,0,0,0|1,0,0]=2 290 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [1,0,0,0,0,0|1,0,0]=2 291 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [1,0,0,0,0,0|3,0,0]=4 292 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [1,0,0,0,0,0|3,0,0]=4 293 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [1,0,0,0,0,0|3,0,0]=4 294 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [1,0,0,0,0,0|3,0,0]=4 295 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [1,0,0,0,0,0|2,0,0]=3 296 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [1,0,0,0,0,0|2,0,0]=3 297 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,0,0,0,0,0|2,0,1]=4 298 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,0,0,0,0,0|2,0,1]=4 299 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [1,0,0,0,0,0|2,0,1]=4 300 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [1,0,0,0,0,0|2,0,1]=4 301 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [1,0,0,0,0,0|2,0,1]=4 302 B11R1.40 CC(Cc1c[n]c[n]c1)C=O Amb25056320 [1,0,0,0,0,0|3,0,0]=4 303 B11R1.40 CC(Cc1c[n]cc[n]1)C=O Amb25806959 [1,0,0,0,0,0|3,0,0]=4 304 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [1,0,0,0,0,0|2,0,1]=4 305 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [1,0,0,0,0,0|2,0,0]=3 306 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [1,0,0,0,0,0|3,0,0]=4 307 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,0,0,0,0,0|2,0,1]=4 311 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [1,0,0,0,0,0|2,0,1]=4 312 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [1,0,0,0,0,0|2,0,1]=4 313 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [1,0,0,0,0,0|2,0,1]=4 314 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [1,0,0,0,0,0|1,0,1]=3 315 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,0,0,0,0,0|1,0,1]=3 316 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,0,0,0,0,0|2,0,1]=4 317 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [1,0,0,0,0,0|2,0,1]=4 318 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [1,0,0,0,0,0|2,0,1]=4 319 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,0,0,0,0,0|1,0,1]=3 320 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [1,0,0,0,0,0|2,0,1]=4 321 B11R1.40 CN(Cc1c[n]ccc1)C=O Amb24096746 [1,0,0,0,0,0|3,0,0]=4 322 B11R1.40 CN(Cc1cccc[n]1)C=O Amb25189288 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [1,0,0,0,0,0|2,1,0]=4 324 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [1,0,0,0,0,0|3,0,0]=4 325 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [1,0,0,0,0,0|3,0,0]=4 326 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [1,0,0,0,0,0|3,0,0]=4 327 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [1,0,0,0,0,0|3,0,0]=4 328 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [1,0,0,0,0,0|3,0,0]=4 329 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [1,0,0,0,0,0|2,0,0]=3 330 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [1,0,0,0,0,0|2,0,0]=3 331 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,0,0,0,0,0|2,0,1]=4 332 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [1,0,0,0,0,0|2,0,0]=3 334 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,0,0,0,0,0|1,0,1]=3 335 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [1,0,0,0,0,0|1,0,0]=2 336 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [1,0,0,0,0,0|1,0,2]=4 337 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [1,0,0,0,0,0|2,0,1]=4 339 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [1,0,0,0,0,0|2,0,1]=4 340 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [1,0,0,0,0,0|2,0,1]=4 343 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [1,0,0,0,0,0|1,0,1]=3 344 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,0,0,0,0,0|2,0,1]=4 345 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [1,0,0,0,0,0|2,0,1]=4 346 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [1,0,0,0,0,0|2,0,1]=4 347 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,0,0,0,0,0|1,0,2]=4 348 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [1,0,0,0,0,0|1,0,1]=3 349 B11R1.40 NC(CO)Cc1cc[n]c[n]1 Amb24099661 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.40 NC(Cc1c[n]ccc1)C#N Amb23557154 [1,0,0,0,0,0|2,0,1]=4 351 B11R1.40 NC(Cc1cc[n]cc1)C#N Amb23557155 [1,0,0,0,0,0|2,0,1]=4 352 B11R1.40 NC(Cc1cccc[n]1)C#N Amb23557153 [1,0,0,0,0,0|2,0,1]=4 353 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [1,0,0,0,0,0|1,0,1]=3 354 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [1,0,0,0,0,0|1,0,1]=3 355 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [1,0,0,0,0,0|1,0,0]=2 356 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [1,0,0,0,0,0|2,0,1]=4 358 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [1,0,0,0,0,0|2,0,1]=4 359 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [1,0,0,0,0,0|2,0,1]=4 360 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [1,0,0,0,0,0|1,0,1]=3 361 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [1,0,0,0,0,0|1,0,1]=3 363 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,0,0,0,0,0|2,0,1]=4 364 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [1,0,0,0,0,0|1,0,1]=3 365 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [1,0,0,0,0,0|1,0,1]=3 366 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [1,0,0,0,0,0|1,0,1]=3 367 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [1,0,0,0,0,0|0,0,1]=2 368 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [1,0,0,0,0,0|0,1,1]=3 369 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [1,0,0,0,0,0|1,0,1]=3 370 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [1,0,0,0,0,0|1,0,1]=3 371 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [1,0,0,0,0,0|1,0,1]=3 372 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [1,0,0,0,0,0|0,1,1]=3 373 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [1,0,0,0,0,0|0,0,0]=1 374 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [1,0,0,0,0,0|0,0,1]=2 375 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [1,0,0,0,0,0|1,0,1]=3 379 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [1,0,0,0,0,0|2,0,0]=3 380 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [1,0,0,0,0,0|1,0,0]=2 381 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [1,0,0,0,0,0|1,0,0]=2 382 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [1,0,0,0,0,0|2,0,0]=3 383 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [1,0,0,0,0,0|1,0,0]=2 384 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [1,0,0,0,0,0|1,0,0]=2 385 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [1,0,0,0,0,0|1,0,0]=2 386 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [1,0,0,0,0,0|1,0,0]=2 387 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [1,0,0,0,0,0|1,0,2]=4 388 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [1,0,0,0,0,0|1,0,2]=4 389 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [1,0,0,0,0,0|1,0,2]=4 390 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [1,0,0,0,0,0|3,0,0]=4 391 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [1,0,0,0,0,0|1,1,1]=4 393 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [1,0,0,0,0,0|2,0,0]=3 394 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [1,0,0,0,0,0|2,0,0]=3 395 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [1,0,0,0,0,0|1,0,0]=2 396 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [1,0,0,0,0,0|1,0,2]=4 397 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [1,0,0,0,0,0|1,0,1]=3 398 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [1,0,0,0,0,0|1,0,1]=3 399 B11R1.40 OCC(Cc1ccccn1)N Amb17062682 [1,0,0,0,0,0|1,0,1]=3 400 B11R1.40 OCC(Cc1cccnc1)N Amb17062683 [1,0,0,0,0,0|1,0,1]=3 401 B11R1.40 OCC(Cc1ccncc1)N Amb17062684 [1,0,0,0,0,0|1,0,1]=3 402 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,0,0,0,0,0|1,0,1]=3 403 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [1,0,0,0,0,0|1,0,1]=3 404 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [1,0,0,0,0,0|2,0,1]=4 406 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [1,0,0,0,0,0|1,0,1]=3 407 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [1,0,0,0,0,0|1,0,1]=3 408 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [1,0,0,0,0,0|1,0,1]=3 409 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [1,0,0,0,0,0|2,0,1]=4 410 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,0,0,0,0,0|2,0,1]=4 411 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [1,0,0,0,0,0|2,0,1]=4 412 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,0,0,0,0,0|2,0,1]=4 413 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [1,0,0,0,0,0|1,0,0]=2 414 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [1,0,0,0,0,0|1,0,2]=4 415 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [1,0,0,0,0,0|1,0,2]=4 416 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [1,0,0,0,0,0|2,0,1]=4 417 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [1,0,0,0,0,0|1,0,1]=3 418 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [1,0,0,0,0,0|1,0,1]=3 419 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [1,0,0,0,0,0|2,0,1]=4 420 B11R1.91 C=C(Br)CSc1ccccc1 Amb24458275 [1,0,0,0,0,0|3,0,0]=4 421 B11R1.91 C=C(Cl)CNc1ccccc1 Amb18289308 [1,0,0,0,0,0|3,0,0]=4 422 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [1,0,0,0,0,0|3,0,0]=4 423 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,0,0,0,0,0|3,0,0]=4 424 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,0,0|3,0,0]=4 425 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,0,0|3,0,0]=4 426 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,0,0,0,0,0|3,0,0]=4 427 B11R1.91 CC(=O)CCN1CC=CC=C1 Amb24676819 [1,0,0,0,0,0|2,0,1]=4 428 B11R1.91 CC(=O)CCc1[n]ccc[n]1 Amb24726140 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.91 CC(=O)CCc1c[n]cc[n]1 Amb25307907 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,0,0|2,0,0]=3 431 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,0|2,0,0]=3 432 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,0|2,0,0]=3 433 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,0,0|2,0,0]=3 434 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [1,0,0,0,0,0|3,0,0]=4 435 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,0,0|2,0,0]=3 436 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [1,0,0,0,0,0|3,0,0]=4 438 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [1,0,0,0,0,0|3,0,0]=4 439 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,0,0,0,0,0|1,0,2]=4 441 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,0,0|1,0,2]=4 442 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,0,0,0,0,0|2,0,1]=4 443 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,0,0|2,1,0]=4 445 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,0,0,0,0,0|2,1,0]=4 446 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [1,0,0,0,0,0|2,0,1]=4 447 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [1,0,0,0,0,0|2,0,1]=4 448 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [1,0,0,0,0,0|2,0,1]=4 449 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,0,0,0,0,0|2,0,1]=4 450 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,0,0,0,0,0|2,0,1]=4 451 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [1,0,0,0,0,0|3,0,0]=4 452 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,0,0,0,0,0|3,0,0]=4 453 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [1,0,0,0,0,0|3,0,0]=4 454 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,0,0|1,0,1]=3 455 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [1,0,0,0,0,0|2,0,1]=4 456 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,0,0|1,0,1]=3 457 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [1,0,0,0,0,0|2,0,1]=4 458 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [1,0,0,0,0,0|2,0,1]=4 459 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [1,0,0,0,0,0|2,0,1]=4 460 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [1,0,0,0,0,0|2,1,0]=4 461 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.91 NC(=N)CCc1cccc[n]1 Amb22304703 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.91 NC(=N)CNc1ccccc1 Amb24426634 [1,0,0,0,0,0|3,0,0]=4 465 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [1,0,0,0,0,0|3,0,0]=4 468 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [1,0,0,0,0,0|3,0,0]=4 469 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [1,0,0,0,0,0|3,0,0]=4 470 B11R1.91 NC(=O)CCc1[n]ccc[n]1 Amb24355296 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.91 NC(=O)CCc1c[n]c[n]c1 Amb23571326 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.91 NC(=O)CCc1c[n]cc[n]1 Amb25321905 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.91 NC(=O)CCc1ccc[n][n]1 Amb25061349 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,0,0|2,0,0]=3 475 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,0,0|2,0,0]=3 476 B11R1.91 NC(=O)CSc1ccccn1 Amb1292665 [1,0,0,0,0,0|3,0,0]=4 477 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,0,0|2,0,0]=3 478 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [1,0,0,0,0,0|3,0,0]=4 479 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [1,0,0,0,0,0|3,0,0]=4 480 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,0,0|1,1,0]=3 482 B11R1.91 NC(=S)CCc1cccnc1 Amb17232623 [1,0,0,0,0,0|2,1,0]=4 483 B11R1.91 NC(=S)CCc1ccncc1 Amb17400216 [1,0,0,0,0,0|2,1,0]=4 484 B11R1.91 NC(=S)CNc1ccccc1 Amb17232624 [1,0,0,0,0,0|2,1,0]=4 485 B11R1.91 NC(=S)COc1ccccc1 Amb1155418 [1,0,0,0,0,0|2,1,0]=4 486 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [1,0,0,0,0,0|2,1,0]=4 487 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [1,0,0,0,0,0|2,1,0]=4 488 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [1,0,0,0,0,0|3,0,0]=4 489 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [1,0,0,0,0,0|2,0,0]=3 492 B11R1.91 O=C(Cl)CSc1cc[n]cc1 Amb22396542 [1,0,0,0,0,0|3,0,0]=4 493 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb19650937 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.91 O=C(Cl)CSc1cccc[n]1 Amb21959947 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [1,0,0,0,0,0|2,0,0]=3 496 B11R1.91 O=C(Cl)OCc1cc[n]cc1 Amb24559531 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.91 O=C(Cl)OCc1ccc[n]c1 Amb25852784 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [1,0,0,0,0,0|0,1,0]=2 499 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [1,0,0,0,0,0|2,0,0]=3 500 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [1,0,0,0,0,0|1,0,1]=3 501 B11R1.91 OB(O)CCc1c[n]ccc1 Amb25259201 [1,0,0,0,0,0|2,0,1]=4 502 B11R1.91 OB(O)CCc1cccc[n]1 Amb24392967 [1,0,0,0,0,0|2,0,1]=4 503 B11R1.91 OC(=O)C#Cc1c[n]ccc1 Amb20673066 [1,0,0,0,0,0|1,0,2]=4 504 B11R1.91 OC(=O)C#Cc1cc[n]cc1 Amb20673077 [1,0,0,0,0,0|1,0,2]=4 505 B11R1.91 OC(=O)C#Cc1ccccn1 Amb16233314 [1,0,0,0,0,0|1,0,2]=4 506 B11R1.91 OC(=O)CCc1[n][n]cc[n]1 Amb18201164 [1,0,0,0,0,0|3,0,0]=4 507 B11R1.91 OC(=O)CCc1[n]c[n]c[n]1 Amb18862491 [1,0,0,0,0,0|3,0,0]=4 508 B11R1.91 OC(=O)CCc1c[n][n]c[n]1 Amb18201165 [1,0,0,0,0,0|3,0,0]=4 509 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [1,0,0,0,0,0|2,0,0]=3 510 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [1,0,0,0,0,0|2,0,0]=3 511 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [1,0,0,0,0,0|2,0,0]=3 512 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,0,0,0,0,0|0,0,0]=1 513 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [1,0,0,0,0,0|1,0,0]=2 514 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,0|1,0,0]=2 515 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,0|1,0,0]=2 516 B11R1.91 OC(=O)CNC=1CC=CCC1 Amb21929324 [1,0,0,0,0,0|1,0,2]=4 517 B11R1.91 OC(=O)CNc1c[n]c[n]c1 Amb18933571 [1,0,0,0,0,0|3,0,0]=4 518 B11R1.91 OC(=O)CNc1cc[n]c[n]1 Amb18973871 [1,0,0,0,0,0|3,0,0]=4 519 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [1,0,0,0,0,0|2,0,0]=3 520 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [1,0,0,0,0,0|2,0,0]=3 521 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [1,0,0,0,0,0|2,0,0]=3 522 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [1,0,0,0,0,0|2,0,0]=3 523 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [1,0,0,0,0,0|2,0,0]=3 524 B11R1.91 OC(=O)CNc1ncccn1 Amb2372087 [1,0,0,0,0,0|3,0,0]=4 525 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [1,0,0,0,0,0|2,0,0]=3 526 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [1,0,0,0,0,0|2,0,0]=3 527 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [1,0,0,0,0,0|2,0,0]=3 528 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [1,0,0,0,0,0|1,0,0]=2 529 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [1,0,0,0,0,0|1,0,0]=2 530 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [1,0,0,0,0,0|1,0,0]=2 531 B11R1.91 OC(=O)CSc1cc[n][n]c1 Amb24670204 [1,0,0,0,0,0|3,0,0]=4 532 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [1,0,0,0,0,0|2,0,0]=3 533 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [1,0,0,0,0,0|2,0,0]=3 534 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [1,0,0,0,0,0|1,0,0]=2 535 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [1,0,0,0,0,0|2,0,0]=3 536 B11R1.91 OC(=O)CSc1ncccn1 Amb1625763 [1,0,0,0,0,0|3,0,0]=4 537 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [1,0,0,0,0,0|1,0,0]=2 538 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,0,0,0,0,0|0,0,0]=1 539 B11R1.91 OC(=O)\C=C/c1cc[n]cc1 Amb20622011 [1,0,0,0,0,0|1,0,2]=4 540 B11R1.91 OC(=O)\C=C/c1ccc[n]c1 Amb25378742 [1,0,0,0,0,0|1,0,2]=4 541 B11R1.91 OC(=O)\C=C/c1ccccn1 Amb10071558 [1,0,0,0,0,0|1,0,2]=4 542 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [1,0,0,0,0,0|0,0,2]=3 543 B11R1.91 OC(=O)\C=C\c1ccncc1 Amb1107607 [1,0,0,0,0,0|1,0,2]=4 544 B11R1.91 OC(=O)\C=N/c1cc[n]cc1 Amb24068310 [1,0,0,0,0,0|2,0,1]=4 545 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [1,0,0,0,0,0|1,0,1]=3 546 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [1,0,0,0,0,0|0,0,2]=3 547 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [1,0,0,0,0,0|2,0,0]=3 548 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [1,0,0,0,0,0|2,0,0]=3 549 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,0,0,0,0,0|0,0,0]=1 550 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [1,0,0,0,0,0|0,2,0]=3 551 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [1,0,0,0,0,0|1,2,0]=4 552 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [1,0,0,0,0,0|1,2,0]=4 553 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [1,0,0,0,0,0|0,0,3]=4 554 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [1,0,0,0,0,0|0,0,1]=2 555 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [1,0,0,0,0,0|1,0,1]=3 556 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [1,0,0,0,0,0|1,0,1]=3 557 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [1,0,0,0,0,0|1,0,1]=3 558 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [1,0,0,0,0,0|0,0,3]=4 559 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [1,0,0,0,0,0|0,0,3]=4 560 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [1,0,0,0,0,0|2,0,1]=4 561 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [1,0,0,0,0,0|2,0,1]=4 562 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [1,0,0,0,0,0|1,0,1]=3 563 B11R1.91 [O-][N+](=O)CCc1ccccn1 Amb17399924 [1,0,0,0,0,0|2,0,1]=4 564 B11R1.91 [O-][N+](=O)CCc1cccnc1 Amb17399925 [1,0,0,0,0,0|2,0,1]=4 565 B11R1.91 [O-][N+](=O)CCc1ccncc1 Amb17399926 [1,0,0,0,0,0|2,0,1]=4 566 B11R1.91 [O-][N+](=O)CSc1ccccc1 Amb25689622 [1,0,0,0,0,0|2,0,1]=4 567 B13R1.133 Bc1ccc(CC(N)C(O)=O)cc1 Amb25056890 [0,1,0,0,0,0|0,0,0]=1 568 B13R1.133 Bc1ccc(C[C@H](N)C(O)=O)cc1 Amb24495483 [0,1,0,0,0,0|0,0,0]=1 569 B13R1.133 BrC(C(=O)C)Cc1ccc(cc1)Cl Amb17507836 [0,1,0,0,0,0|2,0,0]=3 570 B13R1.133 BrC(C(=O)C)Cc1ccc(cc1)F Amb17507837 [0,1,0,0,0,0|2,0,0]=3 571 B13R1.133 BrC(C(=O)O)Cc1ccc(cc1)F Amb2480736 [0,1,0,0,0,0|1,0,0]=2 572 B13R1.133 C=C(Cc1ccc(Cl)cc1)C(O)=O Amb18130358 [0,1,0,0,0,0|1,0,1]=3 573 B13R1.133 C=C(Oc1ccc(Cl)cc1)C(O)=O Amb18130544 [0,1,0,0,0,0|2,0,1]=4 574 B13R1.133 CC(=C)C(N)Cc1ccc(Br)cc1 Amb25049642 [0,1,0,0,0,0|2,0,0]=3 575 B13R1.133 CC(=C)C(O)Cc1ccc(Br)cc1 Amb25775689 [0,1,0,0,0,0|3,0,0]=4 576 B13R1.133 CC(=Cc1ccc(I)cc1)C(O)=O Amb17844105 [0,1,0,0,0,0|1,0,2]=4 577 B13R1.133 CC(=O)C(=O)Cc1ccc(Br)cc1 Amb23603629 [0,1,0,0,0,0|2,0,1]=4 578 B13R1.133 CC(=O)C(=O)Cc1ccc(C)cc1 Amb23603620 [0,1,0,0,0,0|2,0,1]=4 579 B13R1.133 CC(=O)C(=O)Cc1ccc(Cl)cc1 Amb23603627 [0,1,0,0,0,0|2,0,1]=4 580 B13R1.133 CC(=O)C(=O)Cc1ccc(F)cc1 Amb23603622 [0,1,0,0,0,0|2,0,1]=4 581 B13R1.133 CC(=O)C(Br)Cc1ccc(Br)cc1 Amb18088195 [0,1,0,0,0,0|2,0,0]=3 582 B13R1.133 CC(=O)C(Br)Cc1ccc(I)cc1 Amb25252609 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.133 CC(=O)C(Br)Cc1ccc(O)cc1 Amb25280115 [0,1,0,0,0,0|2,0,0]=3 584 B13R1.133 CC(=O)C(C)Cc1ccc(Br)c[n]1 Amb25849650 [0,1,0,0,0,0|3,0,0]=4 585 B13R1.133 CC(=O)C(C)Cc1ccc(I)cc1 Amb25841136 [0,1,0,0,0,0|2,0,0]=3 586 B13R1.133 CC(=O)C(C)Nc1ccc(F)cc1 Amb24468367 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.133 CC(=O)C(C)Oc1ccc(Br)cc1 Amb25141916 [0,1,0,0,0,0|3,0,0]=4 588 B13R1.133 CC(=O)C(C)Oc1ccc(I)cc1 Amb25331296 [0,1,0,0,0,0|3,0,0]=4 589 B13R1.133 CC(=O)C(C)Oc1ccc(O)cc1 Amb25719536 [0,1,0,0,0,0|3,0,0]=4 590 B13R1.133 CC(=O)C(Cc1ccc(cc1)C)C Amb17233205 [0,1,0,0,0,0|2,0,0]=3 591 B13R1.133 CC(=O)C(Cc1ccc(cc1)C)Cl Amb17204370 [0,1,0,0,0,0|2,0,0]=3 592 B13R1.133 CC(=O)C(F)Cc1ccc(O)cc1 Amb24553647 [0,1,0,0,0,0|2,0,0]=3 593 B13R1.133 CC(=O)C(Oc1ccc(cc1)C)C Amb2412522 [0,1,0,0,0,0|3,0,0]=4 594 B13R1.133 CC(=O)N(C)Cc1ccc(Br)cc1 Amb21520986 [0,1,0,0,0,0|3,0,0]=4 595 B13R1.133 CC(=O)N(Cl)Cc1ccc(Cl)cc1 Amb22479406 [0,1,0,0,0,0|3,0,0]=4 596 B13R1.133 CC(=O)[C@@H](C)Cc1ccc(O)cc1 Amb25703862 [0,1,0,0,0,0|2,0,0]=3 597 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(O)cc1 Amb24736376 [0,1,0,0,0,0|2,0,0]=3 598 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)Br Amb17255483 [0,1,0,0,0,0|2,0,0]=3 599 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)Cl Amb17236509 [0,1,0,0,0,0|2,0,0]=3 600 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)F Amb17233679 [0,1,0,0,0,0|2,0,0]=3 601 B13R1.133 CC(C(=O)C)Oc1ccc(cc1)Cl Amb2436605 [0,1,0,0,0,0|3,0,0]=4 602 B13R1.133 CC(C(=O)C)Oc1ccc(cc1)F Amb2437262 [0,1,0,0,0,0|3,0,0]=4 603 B13R1.133 CC(C(=O)C)Oc1ccc(cc1)N Amb17110086 [0,1,0,0,0,0|3,0,0]=4 604 B13R1.133 CC(C(=O)Cl)Oc1ccc(cc1)Br Amb16230063 [0,1,0,0,0,0|3,0,0]=4 605 B13R1.133 CC(C(=O)Cl)Oc1ccc(cc1)C Amb16230059 [0,1,0,0,0,0|3,0,0]=4 606 B13R1.133 CC(C(=O)Cl)Oc1ccc(cc1)F Amb16230027 [0,1,0,0,0,0|3,0,0]=4 607 B13R1.133 CC(C(=O)N)Oc1ccc(cc1)F Amb2136944 [0,1,0,0,0,0|3,0,0]=4 608 B13R1.133 CC(C(=O)N)Sc1ccc(cc1)Br Amb2346523 [0,1,0,0,0,0|3,0,0]=4 609 B13R1.133 CC(C(=O)N)Sc1ccc(cc1)Cl Amb10768873 [0,1,0,0,0,0|3,0,0]=4 610 B13R1.133 CC(C(=O)N)Sc1ccc(cc1)F Amb10665258 [0,1,0,0,0,0|3,0,0]=4 611 B13R1.133 CC(C(=O)O)Cc1ccc(cc1)Br Amb16185778 [0,1,0,0,0,0|1,0,0]=2 612 B13R1.133 CC(C(=O)O)Oc1ccc(cc1)Br Amb1215354 [0,1,0,0,0,0|2,0,0]=3 613 B13R1.133 CC(C(=O)O)Oc1ccc(cc1)F Amb1215582 [0,1,0,0,0,0|2,0,0]=3 614 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)Br Amb1115989 [0,1,0,0,0,0|2,0,0]=3 615 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)C Amb1653866 [0,1,0,0,0,0|2,0,0]=3 616 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)Cl Amb1545582 [0,1,0,0,0,0|2,0,0]=3 617 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)F Amb1115911 [0,1,0,0,0,0|2,0,0]=3 618 B13R1.133 CC(C(Cc1ccc(cc1)C)C)O Amb17233453 [0,1,0,0,0,0|2,0,1]=4 619 B13R1.133 CC(C(Cc1ccc(cc1)C)N)C Amb17138833 [0,1,0,0,0,0|2,0,1]=4 620 B13R1.133 CC(C(O)C)Cc1ccc(cc1)Br Amb17256432 [0,1,0,0,0,0|2,0,1]=4 621 B13R1.133 CC(C(O)C)Cc1ccc(cc1)Cl Amb17236861 [0,1,0,0,0,0|2,0,1]=4 622 B13R1.133 CC(C(O)C)Cc1ccc(cc1)F Amb17233914 [0,1,0,0,0,0|2,0,1]=4 623 B13R1.133 CC(C)C(N)Cc1ccc(Cl)cc1 Amb18034026 [0,1,0,0,0,0|2,0,1]=4 624 B13R1.133 CC(C)C(N)Cc1ccc(O)cc1 Amb18194386 [0,1,0,0,0,0|2,0,1]=4 625 B13R1.133 CC(CN1C=CC(=O)C=C1)C(N)=O Amb24462507 [0,1,0,0,0,0|3,0,0]=4 626 B13R1.133 CC(CN1C=CC(=O)C=C1)C(O)=O Amb18302709 [0,1,0,0,0,0|2,0,0]=3 627 B13R1.133 CC(Cc1ccc(Br)cc1)C(N)=O Amb24271353 [0,1,0,0,0,0|2,0,0]=3 628 B13R1.133 CC(Cc1ccc(Cl)[n]c1)C(O)=O Amb25685273 [0,1,0,0,0,0|2,0,0]=3 629 B13R1.133 CC(Cc1ccc(F)cc1)[N+]([O-])=O Amb24063662 [0,1,0,0,0,0|2,0,1]=4 630 B13R1.133 CC(Cc1ccc(I)cc1)C(C)O Amb25741546 [0,1,0,0,0,0|2,0,1]=4 631 B13R1.133 CC(Cc1ccc(I)cc1)C(O)=O Amb25155540 [0,1,0,0,0,0|1,0,0]=2 632 B13R1.133 CC(Cc1ccc(I)cc1)[N+]([O-])=O Amb24400433 [0,1,0,0,0,0|2,0,1]=4 633 B13R1.133 CC(Cc1ccc(N)cc1)[N+]([O-])=O Amb21959771 [0,1,0,0,0,0|2,0,1]=4 634 B13R1.133 CC(Cc1ccc(O)c[n]1)C(O)=O Amb25317406 [0,1,0,0,0,0|2,0,0]=3 635 B13R1.133 CC(Cc1ccc(O)cc1)C(C)O Amb25832821 [0,1,0,0,0,0|2,0,1]=4 636 B13R1.133 CC(Cc1ccc(O)cc1)C(O)=O Amb25798442 [0,1,0,0,0,0|1,0,0]=2 637 B13R1.133 CC(F)C(N)Cc1ccc(Cl)cc1 Amb24511261 [0,1,0,0,0,0|2,0,1]=4 638 B13R1.133 CC(F)C(N)Cc1ccc(F)cc1 Amb25267795 [0,1,0,0,0,0|2,0,1]=4 639 B13R1.133 CC(F)C(N)Cc1ccc(O)cc1 Amb25270307 [0,1,0,0,0,0|2,0,1]=4 640 B13R1.133 CC(Nc1ccc(Br)c[n]1)C(O)=O Amb24768599 [0,1,0,0,0,0|3,0,0]=4 641 B13R1.133 CC(Nc1ccc(Cl)c[n]1)C(O)=O Amb24768600 [0,1,0,0,0,0|3,0,0]=4 642 B13R1.133 CC(Nc1ccc(F)[n]c1)C(O)=O Amb25158611 [0,1,0,0,0,0|3,0,0]=4 643 B13R1.133 CC(Nc1ccc(I)cc1)C(O)=O Amb25821772 [0,1,0,0,0,0|2,0,0]=3 644 B13R1.133 CC(Nc1ccc(N)cc1)C(O)=O Amb25850201 [0,1,0,0,0,0|2,0,0]=3 645 B13R1.133 CC(Nc1ccc(O)c[n]1)C(O)=O Amb24716012 [0,1,0,0,0,0|3,0,0]=4 646 B13R1.133 CC(O)C(N)Cc1ccc(Br)cc1 Amb18155745 [0,1,0,0,0,0|1,0,1]=3 647 B13R1.133 CC(O)C(N)Cc1ccc(Cl)cc1 Amb18810924 [0,1,0,0,0,0|1,0,1]=3 648 B13R1.133 CC(O)C(O)Cc1ccc(Cl)cc1 Amb24734450 [0,1,0,0,0,0|2,0,1]=4 649 B13R1.133 CC(O)C(O)Cc1ccc(I)cc1 Amb24496474 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.133 CC(Oc1ccc(Br)c[n]1)C(O)=O Amb18661826 [0,1,0,0,0,0|3,0,0]=4 651 B13R1.133 CC(Oc1ccc(Cl)c[n]1)C(O)=O Amb18130810 [0,1,0,0,0,0|3,0,0]=4 652 B13R1.133 CC(Oc1ccc(F)[n]c1)C(O)=O Amb25366418 [0,1,0,0,0,0|3,0,0]=4 653 B13R1.133 CC(Oc1ccc(I)cc1)C(N)=O Amb25113197 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.133 CC(Sc1ccc(F)c[n]1)C(O)=O Amb18975388 [0,1,0,0,0,0|3,0,0]=4 655 B13R1.133 CC(Sc1ccc(N)c[n]1)C(O)=O Amb18975671 [0,1,0,0,0,0|3,0,0]=4 656 B13R1.133 CC(Sc1ccc(N)cc1)C(O)=O Amb18975670 [0,1,0,0,0,0|2,0,0]=3 657 B13R1.133 CC(Sc1ccc(O)cc1)C(N)=O Amb19054336 [0,1,0,0,0,0|3,0,0]=4 658 B13R1.133 CC(Sc1ccc(O)cc1)C(O)=O Amb19000448 [0,1,0,0,0,0|2,0,0]=3 659 B13R1.133 CC([N+](=O)[O-])Cc1ccc(cc1)N Amb16186749 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.133 CN(C(=O)C)Cc1ccc(cc1)Cl Amb11014188 [0,1,0,0,0,0|3,0,0]=4 661 B13R1.133 CN(Cc1ccc(Br)cc1)C(=O)Cl Amb25081828 [0,1,0,0,0,0|3,0,0]=4 662 B13R1.133 CN(Cc1ccc(Br)cc1)C(N)=O Amb25731768 [0,1,0,0,0,0|3,0,0]=4 663 B13R1.133 CN(Cc1ccc(Cl)cc1)C(N)=O Amb18332178 [0,1,0,0,0,0|3,0,0]=4 664 B13R1.133 CN(Cc1ccc(F)cc1)C(N)=O Amb18187073 [0,1,0,0,0,0|3,0,0]=4 665 B13R1.133 CN(Cc1ccc(O)cc1)C(N)=O Amb18796233 [0,1,0,0,0,0|3,0,0]=4 666 B13R1.133 C[C@@H](C(=O)O)Cc1ccc(cc1)C Amb10844190 [0,1,0,0,0,0|1,0,0]=2 667 B13R1.133 C[C@@H](C(=O)O)Cc1ccc(cc1)N Amb10844177 [0,1,0,0,0,0|1,0,0]=2 668 B13R1.133 C[C@@H](Nc1ccc(Br)c[n]1)C(O)=O Amb24372513 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.133 C[C@@H](Nc1ccc(Cl)c[n]1)C(O)=O Amb24769732 [0,1,0,0,0,0|3,0,0]=4 670 B13R1.133 C[C@@H](Nc1ccc(Cl)cc1)C(O)=O Amb24626586 [0,1,0,0,0,0|2,0,0]=3 671 B13R1.133 C[C@@H](Nc1ccc(I)c[n]1)C(O)=O Amb25645142 [0,1,0,0,0,0|3,0,0]=4 672 B13R1.133 C[C@@H](Oc1ccc(Br)cc1)C(O)=O Amb25682170 [0,1,0,0,0,0|2,0,0]=3 673 B13R1.133 C[C@@H](Oc1ccc(I)cc1)C(O)=O Amb25180277 [0,1,0,0,0,0|2,0,0]=3 674 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)Br Amb10844183 [0,1,0,0,0,0|1,0,0]=2 675 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)C Amb10844191 [0,1,0,0,0,0|1,0,0]=2 676 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)Cl Amb10844184 [0,1,0,0,0,0|1,0,0]=2 677 B13R1.133 C[C@H](Nc1ccc(Br)c[n]1)C(O)=O Amb24769717 [0,1,0,0,0,0|3,0,0]=4 678 B13R1.133 C[C@H](Nc1ccc(Cl)c[n]1)C(O)=O Amb24769718 [0,1,0,0,0,0|3,0,0]=4 679 B13R1.133 C[C@H](Nc1ccc(F)cc1)C(O)=O Amb24375534 [0,1,0,0,0,0|2,0,0]=3 680 B13R1.133 C[C@H](Nc1ccc(O)c[n]1)C(O)=O Amb25258547 [0,1,0,0,0,0|3,0,0]=4 681 B13R1.133 C[C@H](Nc1ccc(O)cc1)C(O)=O Amb25111168 [0,1,0,0,0,0|2,0,0]=3 682 B13R1.133 C[C@H](O)C(Cl)Cc1ccc(Cl)cc1 Amb24638047 [0,1,0,0,0,0|2,0,1]=4 683 B13R1.133 C[C@H](O)[C@@H](Cl)Cc1ccc(Cl)cc1 Amb24490470 [0,1,0,0,0,0|2,0,1]=4 684 B13R1.133 C[C@H](O)[C@H](Cl)Cc1ccc(Cl)cc1 Amb24490469 [0,1,0,0,0,0|2,0,1]=4 685 B13R1.133 C[C@H](Oc1ccc(Br)c[n]1)C(O)=O Amb25049866 [0,1,0,0,0,0|3,0,0]=4 686 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(O)=O Amb24471254 [0,1,0,0,0,0|2,0,0]=3 687 B13R1.133 C[C@H](Oc1ccc(Cl)[n]c1)C(O)=O Amb24359675 [0,1,0,0,0,0|3,0,0]=4 688 B13R1.133 C[C@H](Oc1ccc(Cl)cc1)C(N)=O Amb24459106 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.133 C[C@H](Oc1ccc(F)cc1)C(O)=O Amb25059199 [0,1,0,0,0,0|2,0,0]=3 690 B13R1.133 C[C@H](Oc1ccc(I)cc1)C(O)=O Amb24623054 [0,1,0,0,0,0|2,0,0]=3 691 B13R1.133 C[C@H](Sc1ccc(F)cc1)C(O)=O Amb25160934 [0,1,0,0,0,0|2,0,0]=3 692 B13R1.133 C\C(=C/c1ccc(Br)cc1)\C(O)=O Amb25696415 [0,1,0,0,0,0|1,0,2]=4 693 B13R1.133 C\C(=C/c1ccc(O)cc1)\C(O)=O Amb18128066 [0,1,0,0,0,0|1,0,2]=4 694 B13R1.133 C\C(=C\c1ccc(F)cc1)\C(O)=O Amb25774175 [0,1,0,0,0,0|1,0,2]=4 695 B13R1.133 C\C(=C\c1ccc(S)cc1)\C(O)=O Amb25210469 [0,1,0,0,0,0|1,0,2]=4 696 B13R1.133 Cc1c[n]c(CC(=O)C(O)=O)cc1 Amb25710761 [0,1,0,0,0,0|2,0,1]=4 697 B13R1.133 Cc1ccc(CC(=C)C(O)=O)cc1 Amb18127720 [0,1,0,0,0,0|1,0,1]=3 698 B13R1.133 Cc1ccc(CC(Br)C(C)=O)cc1 Amb25190028 [0,1,0,0,0,0|2,0,0]=3 699 B13R1.133 Cc1ccc(CC(Br)C(N)=O)cc1 Amb24707261 [0,1,0,0,0,0|2,0,0]=3 700 B13R1.133 Cc1ccc(CC(Br)C(O)=O)cc1 Amb23320603 [0,1,0,0,0,0|1,0,0]=2 701 B13R1.133 Cc1ccc(CC(C)C(N)=O)cc1 Amb24433862 [0,1,0,0,0,0|2,0,0]=3 702 B13R1.133 Cc1ccc(CC(C)C(O)=O)[n]c1 Amb25335020 [0,1,0,0,0,0|2,0,0]=3 703 B13R1.133 Cc1ccc(CC(C)[N+]([O-])=O)cc1 Amb25104684 [0,1,0,0,0,0|2,0,1]=4 704 B13R1.133 Cc1ccc(CC(F)C(O)=O)[n]c1 Amb25835507 [0,1,0,0,0,0|2,0,0]=3 705 B13R1.133 Cc1ccc(CC(N)C(C)F)cc1 Amb25178534 [0,1,0,0,0,0|2,0,1]=4 706 B13R1.133 Cc1ccc(CC(N)C(F)F)cc1 Amb25067174 [0,1,0,0,0,0|2,0,1]=4 707 B13R1.133 Cc1ccc(CC(N)C(O)=O)c[n]1 Amb18193897 [0,1,0,0,0,0|1,0,0]=2 708 B13R1.133 Cc1ccc(CC(O)C(C)=C)cc1 Amb25820447 [0,1,0,0,0,0|3,0,0]=4 709 B13R1.133 Cc1ccc(CC(S)C(O)=O)[n]c1 Amb25704582 [0,1,0,0,0,0|2,0,0]=3 710 B13R1.133 Cc1ccc(CC(S)C(O)=O)c[n]1 Amb25153708 [0,1,0,0,0,0|2,0,0]=3 711 B13R1.133 Cc1ccc(CN(C)C(=O)Cl)cc1 Amb24428310 [0,1,0,0,0,0|3,0,0]=4 712 B13R1.133 Cc1ccc(CN(Cl)C(C)=O)cc1 Amb22479407 [0,1,0,0,0,0|3,0,0]=4 713 B13R1.133 Cc1ccc(C[C@@H](N)C(N)=O)cc1 Amb24488823 [0,1,0,0,0,0|1,0,0]=2 714 B13R1.133 Cc1ccc(C[C@@H](N)C(O)=O)[n]c1 Amb25160624 [0,1,0,0,0,0|1,0,0]=2 715 B13R1.133 Cc1ccc(C[C@@H](N)C(O)=O)c[n]1 Amb25836372 [0,1,0,0,0,0|1,0,0]=2 716 B13R1.133 Cc1ccc(C[C@@H](O)C(O)=O)cc1 Amb25858127 [0,1,0,0,0,0|1,0,0]=2 717 B13R1.133 Cc1ccc(C[C@H](C)C(C)=O)cc1 Amb24492516 [0,1,0,0,0,0|2,0,0]=3 718 B13R1.133 Cc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25274067 [0,1,0,0,0,0|1,0,0]=2 719 B13R1.133 Cc1ccc(C[C@H](N)C(N)=O)cc1 Amb24489140 [0,1,0,0,0,0|1,0,0]=2 720 B13R1.133 Cc1ccc(NC(C)C(O)=O)[n]c1 Amb25138397 [0,1,0,0,0,0|3,0,0]=4 721 B13R1.133 Cc1ccc(\C=C(/F)\C(O)=O)cc1 Amb18128596 [0,1,0,0,0,0|1,0,2]=4 722 B13R1.133 Cc1ccc(\C=C(/S)\C(O)=O)cc1 Amb18130091 [0,1,0,0,0,0|1,0,2]=4 723 B13R1.133 Cc1ccc(\C=C(\C)/C(O)=O)cc1 Amb25096128 [0,1,0,0,0,0|1,0,2]=4 724 B13R1.133 Cc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb25321952 [0,1,0,0,0,0|1,0,2]=4 725 B13R1.133 Cc1ccc(\C=C(\F)/C(O)=O)cc1 Amb24732322 [0,1,0,0,0,0|1,0,2]=4 726 B13R1.133 Cc1ccc(c[n]1)OC(C)C(O)=O Amb18986235 [0,1,0,0,0,0|3,0,0]=4 727 B13R1.133 Cc1ccc(c[n]1)O[C@H](C)C(O)=O Amb24623055 [0,1,0,0,0,0|3,0,0]=4 728 B13R1.133 Cc1ccc(cc1)NC(=N)C(O)=O Amb25362238 [0,1,0,0,0,0|1,0,2]=4 729 B13R1.133 Cc1ccc(cc1)NC(=S)C(O)=O Amb25320885 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.133 Cc1ccc(cc1)NC(C)C(C)=O Amb24489044 [0,1,0,0,0,0|3,0,0]=4 731 B13R1.133 Cc1ccc(cc1)OC(=O)C(O)=O Amb24652452 [0,1,0,0,0,0|2,0,1]=4 732 B13R1.133 Cc1ccc(cc1)O[C@@H](C)C(O)=O Amb24355314 [0,1,0,0,0,0|2,0,0]=3 733 B13R1.133 Cc1ccc(cc1)O[C@H](C)C(O)=O Amb25685384 [0,1,0,0,0,0|2,0,0]=3 734 B13R1.133 Cc1ccc(cc1)SC(Cl)C(O)=O Amb25770525 [0,1,0,0,0,0|2,0,0]=3 735 B13R1.133 Cc1ccc(cc1)SC(F)C(O)=O Amb24713978 [0,1,0,0,0,0|2,0,0]=3 736 B13R1.133 Cc1ccc(cc1)S[C@@H](C)C(O)=O Amb24375761 [0,1,0,0,0,0|2,0,0]=3 737 B13R1.133 Cc1ccc(cc1)\N=C(/C)\C(O)=O Amb24739492 [0,1,0,0,0,0|2,0,1]=4 738 B13R1.133 ClC(=O)C(Cc1ccc(cc1)Cl)Cl Amb17204629 [0,1,0,0,0,0|2,0,0]=3 739 B13R1.133 ClC(=O)C(Oc1ccc(cc1)Cl)C Amb17143747 [0,1,0,0,0,0|3,0,0]=4 740 B13R1.133 ClC(=O)C(Sc1ccc(cc1)Cl)C Amb17144558 [0,1,0,0,0,0|3,0,0]=4 741 B13R1.133 ClC(C(=O)C)Cc1ccc(cc1)Br Amb17204823 [0,1,0,0,0,0|2,0,0]=3 742 B13R1.133 ClC(C(=O)C)Cc1ccc(cc1)F Amb17204390 [0,1,0,0,0,0|2,0,0]=3 743 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)Br Amb17204830 [0,1,0,0,0,0|2,0,0]=3 744 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)C Amb17204373 [0,1,0,0,0,0|2,0,0]=3 745 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)Cl Amb17204475 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)F Amb17204395 [0,1,0,0,0,0|2,0,0]=3 747 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)C Amb17204376 [0,1,0,0,0,0|1,0,0]=2 748 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)Cl Amb17204492 [0,1,0,0,0,0|1,0,0]=2 749 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)F Amb17204398 [0,1,0,0,0,0|1,0,0]=2 750 B13R1.133 NC(=O)C(Br)Cc1ccc(Br)cc1 Amb24378735 [0,1,0,0,0,0|2,0,0]=3 751 B13R1.133 NC(=O)C(Br)Cc1ccc(F)cc1 Amb25774251 [0,1,0,0,0,0|2,0,0]=3 752 B13R1.133 NC(=O)C(F)Sc1ccc(Cl)cc1 Amb24402922 [0,1,0,0,0,0|3,0,0]=4 753 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)cc1 Amb18130578 [0,1,0,0,0,0|1,0,0]=2 754 B13R1.133 NC(=O)C(N)Cc1ccc(F)cc1 Amb18129023 [0,1,0,0,0,0|1,0,0]=2 755 B13R1.133 NC(=O)C(N)Cc1ccc(O)cc1 Amb18972786 [0,1,0,0,0,0|1,0,0]=2 756 B13R1.133 NC(=O)C(O)Cc1ccc(Cl)cc1 Amb25274037 [0,1,0,0,0,0|2,0,0]=3 757 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb24622174 [0,1,0,0,0,0|1,0,0]=2 758 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb22745198 [0,1,0,0,0,0|1,0,0]=2 759 B13R1.133 NC(=O)[C@H](N)Cc1ccc(O)cc1 Amb22432215 [0,1,0,0,0,0|1,0,0]=2 760 B13R1.133 NC(C(=O)O)Cc1cc[n+](cc1)[O-] Amb17594678 [0,1,0,0,0,0|1,0,0]=2 761 B13R1.133 NC(C(=O)O)Cc1ccc(cc1)Cl Amb1077887 [0,1,0,0,0,0|0,0,0]=1 762 B13R1.133 NC(C(C)C)Cc1ccc(cc1)F Amb17139012 [0,1,0,0,0,0|2,0,1]=4 763 B13R1.133 NC(CC=1C=CC(=O)NC1)C(O)=O Amb24649985 [0,1,0,0,0,0|1,0,0]=2 764 B13R1.133 NC(CN1C=CC(=O)C=C1)C(O)=O Amb24710070 [0,1,0,0,0,0|1,0,0]=2 765 B13R1.133 NC(Cc1ccc(Br)cc1)C(O)=O Amb22490717 [0,1,0,0,0,0|0,0,0]=1 766 B13R1.133 NC(Cc1ccc(Cl)[n]c1)C(O)=O Amb25282233 [0,1,0,0,0,0|1,0,0]=2 767 B13R1.133 NC(Cc1ccc(Cl)cc1)C(F)F Amb25710163 [0,1,0,0,0,0|2,0,1]=4 768 B13R1.133 NC(Cc1ccc(F)[n]c1)C(O)=O Amb24351607 [0,1,0,0,0,0|1,0,0]=2 769 B13R1.133 NC(Cc1ccc(F)c[n]1)C(O)=O Amb25843769 [0,1,0,0,0,0|1,0,0]=2 770 B13R1.133 NC(Cc1ccc(F)cc1)C(O)=O Amb20246818 [0,1,0,0,0,0|0,0,0]=1 771 B13R1.133 NC(Cc1ccc(I)cc1)C(F)F Amb25236687 [0,1,0,0,0,0|2,0,1]=4 772 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)Cl Amb25054004 [0,1,0,0,0,0|1,0,0]=2 773 B13R1.133 NC(Cc1ccc(O)cc1)C(O)=O Amb22352126 [0,1,0,0,0,0|0,0,0]=1 774 B13R1.133 NC(Cc1ccc(O)cc1)C(O)=O Amb22730237 [0,1,0,0,0,0|0,0,0]=1 775 B13R1.133 NC(Cc1ccc(O)cc1)C(O)O Amb25803511 [0,1,0,0,0,0|0,0,2]=3 776 B13R1.133 NC(Cc1ccc(O)cc1)C([O-])=O Amb23567002 [0,1,0,0,0,0|0,0,1]=2 777 B13R1.133 NC(Cc1ccc(O)cc1)P(O)=O Amb25315232 [0,1,0,0,0,0|1,0,0]=2 778 B13R1.133 NC(Cc1ccc(O)cc1)[13C](O)=O Amb22367400 [0,1,0,0,0,0|0,0,0]=1 779 B13R1.133 NC([13CH2]c1ccc(O)cc1)C(O)=O Amb22338815 [0,1,0,0,0,0|0,0,0]=1 780 B13R1.133 N[13CH](Cc1ccc(O)cc1)C(O)=O Amb22367333 [0,1,0,0,0,0|0,0,0]=1 781 B13R1.133 N[14C@@H]([14CH2][14c]1[14cH][14cH][14c](O)[14cH][14cH]1)[14C](O)=O Amb22350206 [0,1,0,0,0,0|0,0,0]=1 782 B13R1.133 N[C@@H](C(=O)N)Cc1ccc(cc1)O Amb16183978 [0,1,0,0,0,0|1,0,0]=2 783 B13R1.133 N[C@@H](CC1C=CC(O)=C=C1)C(O)=O Amb25123155 [0,1,0,0,0,0|0,0,2]=3 784 B13R1.133 N[C@@H](CC=1C=CC(=O)NC1)C(O)=O Amb25109157 [0,1,0,0,0,0|1,0,0]=2 785 B13R1.133 N[C@@H](Cc1cc[13c](O)cc1)C(O)=O Amb22367297 [0,1,0,0,0,0|0,0,0]=1 786 B13R1.133 N[C@@H](Cc1cc[n+]([O-])cc1)C(O)=O Amb24565918 [0,1,0,0,0,0|1,0,0]=2 787 B13R1.133 N[C@@H](Cc1ccc(Br)[n]c1)C(O)=O Amb25154880 [0,1,0,0,0,0|1,0,0]=2 788 B13R1.133 N[C@@H](Cc1ccc(Br)c[n]1)C(O)=O Amb25364955 [0,1,0,0,0,0|1,0,0]=2 789 B13R1.133 N[C@@H](Cc1ccc(Br)cc1)C(O)=O Amb19930758 [0,1,0,0,0,0|0,0,0]=1 790 B13R1.133 N[C@@H](Cc1ccc(Cl)cc1)C(O)=O Amb19930410 [0,1,0,0,0,0|0,0,0]=1 791 B13R1.133 N[C@@H](Cc1ccc(F)[n]c1)C(O)=O Amb25858507 [0,1,0,0,0,0|1,0,0]=2 792 B13R1.133 N[C@@H](Cc1ccc(F)c[n]1)C(O)=O Amb25330341 [0,1,0,0,0,0|1,0,0]=2 793 B13R1.133 N[C@@H](Cc1ccc(I)c[n]1)C(O)=O Amb25238691 [0,1,0,0,0,0|1,0,0]=2 794 B13R1.133 N[C@@H](Cc1ccc(I)cc1)C(O)=O Amb22801217 [0,1,0,0,0,0|0,0,0]=1 795 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(O)=O Amb22351112 [0,1,0,0,0,0|0,0,0]=1 796 B13R1.133 N[C@@H](Cc1ccc(O)cc1)[13C](O)=O Amb22351670 [0,1,0,0,0,0|0,0,0]=1 797 B13R1.133 N[C@@H](Cc1ccc(S)cc1)C(O)=O Amb24446740 [0,1,0,0,0,0|0,0,0]=1 798 B13R1.133 N[C@@H](Cc1ccc([17OH])cc1)C(O)=O Amb22367468 [0,1,0,0,0,0|0,0,0]=1 799 B13R1.133 N[C@@H](Cc1ccc([18OH])cc1)C(O)=O Amb22353627 [0,1,0,0,0,0|0,0,0]=1 800 B13R1.133 N[C@@H]([13CH2]c1ccc(O)cc1)C(O)=O Amb22336665 [0,1,0,0,0,0|0,0,0]=1 801 B13R1.133 N[C@H](Cc1ccc(Br)c[n]1)C(O)=O Amb25278417 [0,1,0,0,0,0|1,0,0]=2 802 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(O)=O Amb20241889 [0,1,0,0,0,0|0,0,0]=1 803 B13R1.133 N[C@H](Cc1ccc(F)[n]c1)C(O)=O Amb24680870 [0,1,0,0,0,0|1,0,0]=2 804 B13R1.133 N[C@H](Cc1ccc(I)cc1)C(O)=O Amb20240664 [0,1,0,0,0,0|0,0,0]=1 805 B13R1.133 N[C@H](Cc1ccc(S)cc1)C(O)=O Amb24599881 [0,1,0,0,0,0|0,0,0]=1 806 B13R1.133 Nc1[n]cc(C[C@H](N)C(O)=O)c[n]1 Amb25061327 [0,1,0,0,0,0|2,0,0]=3 807 B13R1.133 Nc1ccc(CC(=O)C(O)=O)cc1 Amb24433983 [0,1,0,0,0,0|1,0,1]=3 808 B13R1.133 Nc1ccc(CC(N)C(O)=O)[n]c1 Amb25187967 [0,1,0,0,0,0|1,0,0]=2 809 B13R1.133 Nc1ccc(CC(N)C(O)=O)c[n]1 Amb24533892 [0,1,0,0,0,0|1,0,0]=2 810 B13R1.133 Nc1ccc(CC(N)C(O)=O)cc1 Amb24079001 [0,1,0,0,0,0|0,0,0]=1 811 B13R1.133 Nc1ccc(CC(O)C(O)=O)cc1 Amb24635658 [0,1,0,0,0,0|1,0,0]=2 812 B13R1.133 Nc1ccc(C[C@@H](N)C(O)=O)c[n]1 Amb25039381 [0,1,0,0,0,0|1,0,0]=2 813 B13R1.133 Nc1ccc(C[C@@H](N)C(O)=O)cc1 Amb19130487 [0,1,0,0,0,0|0,0,0]=1 814 B13R1.133 Nc1ccc(C[C@H](N)C(O)=O)[n]c1 Amb24346938 [0,1,0,0,0,0|1,0,0]=2 815 B13R1.133 Nc1ccc(C[C@H](N)C(O)=O)cc1 Amb20242456 [0,1,0,0,0,0|0,0,0]=1 816 B13R1.133 Nc1ccc([n]c1)SC(F)C(O)=O Amb24369105 [0,1,0,0,0,0|3,0,0]=4 817 B13R1.133 Nc1ccc(\C=C(/F)\C(O)=O)cc1 Amb25274936 [0,1,0,0,0,0|1,0,2]=4 818 B13R1.133 Nc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb24408981 [0,1,0,0,0,0|1,0,2]=4 819 B13R1.133 Nc1ccc(cc1)SC(F)C(O)=O Amb25044594 [0,1,0,0,0,0|2,0,0]=3 820 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Br Amb1140012 [0,1,0,0,0,0|1,0,1]=3 821 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)C Amb1140634 [0,1,0,0,0,0|1,0,1]=3 822 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Cl Amb1141688 [0,1,0,0,0,0|1,0,1]=3 823 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)F Amb1130482 [0,1,0,0,0,0|1,0,1]=3 824 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)Cl Amb2371148 [0,1,0,0,0,0|2,0,1]=4 825 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)N Amb1348301 [0,1,0,0,0,0|2,0,1]=4 826 B13R1.133 O=C(Cl)[C@H](Cl)Cc1ccc(Cl)cc1 Amb24449993 [0,1,0,0,0,0|2,0,0]=3 827 B13R1.133 OC(=O)C(=O)Cc1ccc(Br)c[n]1 Amb25091452 [0,1,0,0,0,0|2,0,1]=4 828 B13R1.133 OC(=O)C(=S)Cc1ccc(Cl)cc1 Amb25827120 [0,1,0,0,0,0|1,0,1]=3 829 B13R1.133 OC(=O)C(=S)Nc1ccc(Cl)cc1 Amb25366124 [0,1,0,0,0,0|2,0,1]=4 830 B13R1.133 OC(=O)C(Br)Cc1ccc(Br)cc1 Amb23320621 [0,1,0,0,0,0|1,0,0]=2 831 B13R1.133 OC(=O)C(Br)Cc1ccc(Cl)cc1 Amb23320619 [0,1,0,0,0,0|1,0,0]=2 832 B13R1.133 OC(=O)C(Br)Cc1ccc(I)cc1 Amb23320622 [0,1,0,0,0,0|1,0,0]=2 833 B13R1.133 OC(=O)C(Cl)CN1C=CC(=O)C=C1 Amb25786958 [0,1,0,0,0,0|2,0,0]=3 834 B13R1.133 OC(=O)C(F)Cc1ccc(Br)c[n]1 Amb25248529 [0,1,0,0,0,0|2,0,0]=3 835 B13R1.133 OC(=O)C(F)Cc1ccc(Cl)cc1 Amb24450256 [0,1,0,0,0,0|1,0,0]=2 836 B13R1.133 OC(=O)C(F)Oc1ccc(Cl)cc1 Amb25679289 [0,1,0,0,0,0|2,0,0]=3 837 B13R1.133 OC(=O)C(F)Sc1ccc(Cl)c[n]1 Amb24623992 [0,1,0,0,0,0|3,0,0]=4 838 B13R1.133 OC(=O)C(O)Cc1ccc(Br)c[n]1 Amb24410790 [0,1,0,0,0,0|2,0,0]=3 839 B13R1.133 OC(=O)C(O)Cc1ccc(I)cc1 Amb25079589 [0,1,0,0,0,0|1,0,0]=2 840 B13R1.133 OC(=O)C(S)Cc1ccc(Cl)cc1 Amb25326151 [0,1,0,0,0,0|1,0,0]=2 841 B13R1.133 OC(=O)C(Sc1ccc(nc1)N)C Amb17305689 [0,1,0,0,0,0|3,0,0]=4 842 B13R1.133 OC(=O)[C@@H](O)Cc1ccc(Cl)cc1 Amb25816136 [0,1,0,0,0,0|1,0,0]=2 843 B13R1.133 OC(=O)[C@H](O)Cc1ccc(Cl)cc1 Amb25731054 [0,1,0,0,0,0|1,0,0]=2 844 B13R1.133 OC(=O)\C(\Cl)=C/c1ccc(F)cc1 Amb24598280 [0,1,0,0,0,0|1,0,2]=4 845 B13R1.133 OC(=O)\C(\Cl)=C\c1ccc(Cl)cc1 Amb18658048 [0,1,0,0,0,0|1,0,2]=4 846 B13R1.133 OC(=O)\C(\F)=C\c1ccc(Cl)cc1 Amb25209028 [0,1,0,0,0,0|1,0,2]=4 847 B13R1.133 OC(=O)\C(\F)=C\c1ccc(F)cc1 Amb25858140 [0,1,0,0,0,0|1,0,2]=4 848 B13R1.133 OC(=O)\C(\F)=C\c1ccc(I)cc1 Amb25678331 [0,1,0,0,0,0|1,0,2]=4 849 B13R1.133 OC(=O)\C(\S)=C\c1ccc(I)cc1 Amb24400252 [0,1,0,0,0,0|1,0,2]=4 850 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Br Amb17159703 [0,1,0,0,0,0|1,0,0]=2 851 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)C Amb17138950 [0,1,0,0,0,0|1,0,0]=2 852 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Cl Amb17139824 [0,1,0,0,0,0|1,0,0]=2 853 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)F Amb17139080 [0,1,0,0,0,0|1,0,0]=2 854 B13R1.133 O[C@H](Cc1ccc(F)cc1)C(O)=O Amb17935902 [0,1,0,0,0,0|1,0,0]=2 855 B13R1.133 O\C(=C/c1ccc(F)cc1)\C(O)=O Amb22549399 [0,1,0,0,0,0|1,0,2]=4 856 B13R1.133 O\C(=C/c1ccc(cc1)C)\C(=O)O Amb2398421 [0,1,0,0,0,0|1,0,2]=4 857 B13R1.133 Oc1ccc(CC(Br)C(O)=O)cc1 Amb24685050 [0,1,0,0,0,0|1,0,0]=2 858 B13R1.133 Oc1ccc(CC(Cl)C(O)=O)cc1 Amb25192678 [0,1,0,0,0,0|1,0,0]=2 859 B13R1.133 Oc1ccc(CC(F)C(O)=O)cc1 Amb20621279 [0,1,0,0,0,0|1,0,0]=2 860 B13R1.133 Oc1ccc(CC(S)C(O)=O)cc1 Amb24740732 [0,1,0,0,0,0|1,0,0]=2 861 B13R1.133 Oc1ccc(C[C@@H](O)C(O)=O)cc1 Amb22388639 [0,1,0,0,0,0|1,0,0]=2 862 B13R1.133 Oc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25277185 [0,1,0,0,0,0|1,0,0]=2 863 B13R1.133 Oc1ccc(\C=C(/Cl)\C(O)=O)cc1 Amb25208063 [0,1,0,0,0,0|1,0,2]=4 864 B13R1.133 Oc1ccc(\C=C(/S)\C(O)=O)cc1 Amb24112867 [0,1,0,0,0,0|1,0,2]=4 865 B13R1.133 Oc1ccc(cc1)CC(=O)C(=O)O Amb1124591 [0,1,0,0,0,0|1,0,1]=3 866 B13R1.133 SC(C(=O)O)Cc1ccc(cc1)C Amb2499266 [0,1,0,0,0,0|1,0,0]=2 867 B13R1.133 S\C(=C/c1ccc(cc1)Br)\C(=O)O Amb1250113 [0,1,0,0,0,0|1,0,2]=4 868 B13R1.133 S\C(=C/c1ccc(cc1)Cl)\C(=O)O Amb1250111 [0,1,0,0,0,0|1,0,2]=4 869 B13R1.133 S\C(=C/c1ccc(cc1)F)\C(=O)O Amb1250112 [0,1,0,0,0,0|1,0,2]=4 870 B13R1.133 S\C(=C\c1ccc(cc1)Cl)\C(=O)O Amb2550970 [0,1,0,0,0,0|1,0,2]=4 871 B13R1.133 [15NH2]C(Cc1ccc(O)cc1)C(O)=O Amb22336215 [0,1,0,0,0,0|0,0,0]=1 872 B13R1.133 [15NH2][13C@@H]([13CH2][13c]1[13cH][13cH][13c](O)[13cH][13cH]1)[13C](O)=O Amb22338916 [0,1,0,0,0,0|0,0,0]=1 873 B13R1.133 [O-]C(=O)[C@H](Cc1ccc(cc1)[O-])N Amb10072562 [0,1,0,0,0,0|0,0,1]=2 874 B13R1.135 BrCC(=O)N(Cc1ccccc1)C Amb17332398 [0,1,0,0,0,0|3,0,0]=4 875 B13R1.135 C#CC(O)C(N)Cc1ccccc1 Amb24760063 [0,1,0,0,0,0|1,0,1]=3 876 B13R1.135 C=C(C#N)C(O)Cc1ccccc1 Amb25115916 [0,1,0,0,0,0|3,0,0]=4 877 B13R1.135 C=CC(=O)C(Cc1ccccc1)O Amb10562284 [0,1,0,0,0,0|2,0,0]=3 878 B13R1.135 CC(Cc1ccccc1)C(=O)C#N Amb24492792 [0,1,0,0,0,0|2,0,0]=3 879 B13R1.135 CC(Cc1ccccc1)C(=O)NN Amb24501376 [0,1,0,0,0,0|2,0,0]=3 880 B13R1.135 CC(Cc1ccccc1)C(O)C#N Amb25152887 [0,1,0,0,0,0|2,0,1]=4 881 B13R1.135 CC(Nc1ccccc1)C(=C)C=O Amb25104898 [0,1,0,0,0,0|3,0,0]=4 882 B13R1.135 CC(Nc1ccccc1)\C(\N)=N\O Amb25771470 [0,1,0,0,0,0|3,0,0]=4 883 B13R1.135 CC(Oc1ccccc1)C(N)=NO Amb18184695 [0,1,0,0,0,0|3,0,0]=4 884 B13R1.135 CC(Sc1ccccc1)C(N)=NO Amb18325027 [0,1,0,0,0,0|3,0,0]=4 885 B13R1.135 CCC(=O)C(Cc1ccccc1)C Amb17233202 [0,1,0,0,0,0|2,0,0]=3 886 B13R1.135 CN(Cc1ccccc1)C(=O)C=O Amb24490334 [0,1,0,0,0,0|2,0,1]=4 887 B13R1.135 CN(Cc1ccccc1)C(=O)CN Amb21958324 [0,1,0,0,0,0|3,0,0]=4 888 B13R1.135 CN(Cc1ccccc1)C(N)=NO Amb18186378 [0,1,0,0,0,0|3,0,0]=4 889 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,0|2,0,1]=4 890 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,1,0,0,0,0|2,0,0]=3 891 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,1,0,0,0,0|2,0,0]=3 892 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,0|1,0,0]=2 893 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,1,0,0,0,0|2,0,0]=3 894 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,1,0,0,0,0|1,0,0]=2 895 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,1,0,0,0,0|2,0,0]=3 896 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,1,0,0,0,0|2,0,0]=3 897 B13R1.135 CNC(=O)[C@H](C)Nc1ccccc1 Amb25268956 [0,1,0,0,0,0|3,0,0]=4 898 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,1,0,0,0,0|1,0,0]=2 899 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,1,0,0,0,0|1,0,0]=2 900 B13R1.135 CNC(=S)C(C)Cc1ccccc1 Amb24710289 [0,1,0,0,0,0|2,1,0]=4 901 B13R1.135 CNC(=S)N(N)Cc1ccccc1 Amb25784598 [0,1,0,0,0,0|2,1,0]=4 902 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,0|1,0,1]=3 903 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,0,0|2,0,1]=4 904 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,0,0|2,0,1]=4 905 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,0,0|2,0,1]=4 906 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,0,0,0,0|2,0,1]=4 907 B13R1.135 COC(=O)C(C)Nc1ccc[n]c1 Amb18270387 [0,1,0,0,0,0|3,0,0]=4 908 B13R1.135 COC(=O)C(Cc1ccccc1)Cl Amb17204377 [0,1,0,0,0,0|1,0,0]=2 909 B13R1.135 COC(=O)C(Cc1ccccc1)N Amb1779248 [0,1,0,0,0,0|0,0,0]=1 910 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,1,0,0,0,0|1,0,0]=2 911 B13R1.135 COC(=O)C(Cc1ccccn1)O Amb17138998 [0,1,0,0,0,0|2,0,0]=3 912 B13R1.135 COC(=O)C(Cc1cccnc1)O Amb17138999 [0,1,0,0,0,0|2,0,0]=3 913 B13R1.135 COC(=O)C(Cc1ccncc1)O Amb17139000 [0,1,0,0,0,0|2,0,0]=3 914 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,0|0,0,0]=1 915 B13R1.135 COC(=O)[C@@H](Cc1cccnc1)N Amb15691971 [0,1,0,0,0,0|1,0,0]=2 916 B13R1.135 COC(=O)[C@@H](N)Cc1ccc[n]c1 Amb22756662 [0,1,0,0,0,0|1,0,0]=2 917 B13R1.135 COC(=O)[C@@H](N)Cc1cccc[n]1 Amb22745828 [0,1,0,0,0,0|1,0,0]=2 918 B13R1.135 COC(=O)[C@H](C)Nc1ccccc1 Amb25732039 [0,1,0,0,0,0|2,0,0]=3 919 B13R1.135 COC(=O)\C(\Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,0,0|1,0,2]=4 920 B13R1.135 COC(=O)\C(\F)=C\c1ccccc1 Amb25706644 [0,1,0,0,0,0|1,0,2]=4 921 B13R1.135 C[C@@H](Cc1ccccc1)C(=O)NO Amb24408073 [0,1,0,0,0,0|1,0,0]=2 922 B13R1.135 C[C@H](Cc1ccccc1)C(=O)C#C Amb24379008 [0,1,0,0,0,0|2,0,0]=3 923 B13R1.135 C[C@H](Cc1ccccc1)C(=O)NO Amb25370073 [0,1,0,0,0,0|1,0,0]=2 924 B13R1.135 C[C@H](Cc1ccccc1)[C@H](O)C#N Amb24372065 [0,1,0,0,0,0|2,0,1]=4 925 B13R1.135 C\C(=N/O)\C(=O)Cc1ccccc1 Amb24378518 [0,1,0,0,0,0|2,0,1]=4 926 B13R1.135 C\C(=N/O)\C(C)Oc1ccccc1 Amb24726176 [0,1,0,0,0,0|3,0,0]=4 927 B13R1.135 C\C(=N\O)\C(Cl)Cc1ccccc1 Amb25101542 [0,1,0,0,0,0|2,0,0]=3 928 B13R1.135 C\C(\C=O)=C(\Cl)/Cc1ccccc1 Amb18130159 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.135 ClCC(=O)C(Oc1ccccc1)C Amb17139731 [0,1,0,0,0,0|3,0,0]=4 930 B13R1.135 ClCC(=O)N(Cc1ccccc1)C Amb1204773 [0,1,0,0,0,0|3,0,0]=4 931 B13R1.135 FCC(C(Cc1ccccc1)N)O Amb10606530 [0,1,0,0,0,0|1,0,1]=3 932 B13R1.135 N#CC(O)C(O)Cc1ccccc1 Amb25091996 [0,1,0,0,0,0|2,0,1]=4 933 B13R1.135 N#CC(O)[C@@H](O)Cc1ccccc1 Amb25236084 [0,1,0,0,0,0|2,0,1]=4 934 B13R1.135 N#C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24404786 [0,1,0,0,0,0|2,0,1]=4 935 B13R1.135 N=C(NO)C(=O)Cc1ccccc1 Amb25059413 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,0,0|0,0,0]=1 937 B13R1.135 NNC(=O)C(Cc1ccccc1)N Amb16231875 [0,1,0,0,0,0|1,0,0]=2 938 B13R1.135 NNC(=O)C(O)Cc1ccccc1 Amb25129792 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.135 NNC(=O)C(Oc1ccccc1)C Amb2553856 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.135 NNC(=O)C(S)Cc1ccccc1 Amb24501331 [0,1,0,0,0,0|2,0,0]=3 941 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb22800040 [0,1,0,0,0,0|1,0,0]=2 942 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)NO Amb25268143 [0,1,0,0,0,0|0,0,0]=1 943 B13R1.135 N[C@H](Cc1ccccc1)C(=O)CCl Amb20243107 [0,1,0,0,0,0|1,0,0]=2 944 B13R1.135 N\C(=N/O)\C(N)Cc1ccccc1 Amb24519141 [0,1,0,0,0,0|1,0,0]=2 945 B13R1.135 O=CN(C(Cc1ccccc1)C)C Amb17614591 [0,1,0,0,0,0|3,0,0]=4 946 B13R1.135 O=CN([C@H](Cc1ccccc1)C)C Amb17614595 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.135 OC(Cc1ccccc1)\C(\F)=C\F Amb24495736 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.135 ON(Cc1ccccc1)C(=O)CCl Amb25053857 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,1,0,0,0,0|1,0,0]=2 950 B13R1.148 Brc1cccc(c1)CC(=O)C(=O)O Amb1137720 [0,1,0,0,0,0|1,0,1]=3 951 B13R1.148 CC(=C)C(N)Cc1cccc(Br)c1 Amb24446251 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.148 CC(=C)C(N)Cc1cccc(F)c1 Amb25076561 [0,1,0,0,0,0|2,0,0]=3 953 B13R1.148 CC(=C)C(O)Cc1cccc(Br)c1 Amb25783501 [0,1,0,0,0,0|3,0,0]=4 954 B13R1.148 CC(=C)C(O)Cc1cccc(F)c1 Amb25214163 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.148 CC(=O)C(=O)Cc1cc(C)ccc1 Amb23603621 [0,1,0,0,0,0|2,0,1]=4 956 B13R1.148 CC(=O)C(=O)Cc1cccc(Br)c1 Amb23603630 [0,1,0,0,0,0|2,0,1]=4 957 B13R1.148 CC(=O)C(=O)Cc1cccc(Cl)c1 Amb23603628 [0,1,0,0,0,0|2,0,1]=4 958 B13R1.148 CC(=O)C(=O)Cc1cccc(F)c1 Amb23603623 [0,1,0,0,0,0|2,0,1]=4 959 B13R1.148 CC(=O)C(Br)Cc1c[n]cc(F)c1 Amb25819947 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.148 CC(=O)C(Br)Cc1cc(Br)ccc1 Amb18601677 [0,1,0,0,0,0|2,0,0]=3 961 B13R1.148 CC(=O)C(Br)Cc1cccc(Cl)c1 Amb18589745 [0,1,0,0,0,0|2,0,0]=3 962 B13R1.148 CC(=O)C(Br)Cc1cccc(I)c1 Amb24466596 [0,1,0,0,0,0|2,0,0]=3 963 B13R1.148 CC(=O)C(Br)Cc1cccc(O)c1 Amb25158741 [0,1,0,0,0,0|2,0,0]=3 964 B13R1.148 CC(=O)C(C)Cc1c[n]cc(Br)c1 Amb24438054 [0,1,0,0,0,0|3,0,0]=4 965 B13R1.148 CC(=O)C(C)Cc1cccc(F)c1 Amb18796243 [0,1,0,0,0,0|2,0,0]=3 966 B13R1.148 CC(=O)C(C)Nc1cccc(Cl)c1 Amb24652627 [0,1,0,0,0,0|3,0,0]=4 967 B13R1.148 CC(=O)C(C)Sc1cccc(Cl)c1 Amb24434266 [0,1,0,0,0,0|3,0,0]=4 968 B13R1.148 CC(=O)C(C)Sc1cccc(F)c1 Amb25801589 [0,1,0,0,0,0|3,0,0]=4 969 B13R1.148 CC(=O)C(Cc1cccc(c1)Br)C Amb17255482 [0,1,0,0,0,0|2,0,0]=3 970 B13R1.148 CC(=O)C(Cc1cccc(c1)Br)Cl Amb17204825 [0,1,0,0,0,0|2,0,0]=3 971 B13R1.148 CC(=O)C(Cc1cccc(c1)C)Br Amb17507803 [0,1,0,0,0,0|2,0,0]=3 972 B13R1.148 CC(=O)C(Cc1cccc(c1)C)C Amb17233204 [0,1,0,0,0,0|2,0,0]=3 973 B13R1.148 CC(=O)C(Cc1cccc(c1)C)Cl Amb17204369 [0,1,0,0,0,0|2,0,0]=3 974 B13R1.148 CC(=O)C(Cc1cccc(c1)Cl)C Amb17236508 [0,1,0,0,0,0|2,0,0]=3 975 B13R1.148 CC(=O)C(Cc1cccc(c1)F)Cl Amb17204391 [0,1,0,0,0,0|2,0,0]=3 976 B13R1.148 CC(=O)C(Cl)Cc1cccc(O)c1 Amb25331957 [0,1,0,0,0,0|2,0,0]=3 977 B13R1.148 CC(=O)C(N)Cc1cccc(Br)c1 Amb18156180 [0,1,0,0,0,0|1,0,0]=2 978 B13R1.148 CC(=O)C(Oc1cccc(c1)C)C Amb2412509 [0,1,0,0,0,0|3,0,0]=4 979 B13R1.148 CC(=O)C(Oc1cccc(c1)Cl)C Amb2415403 [0,1,0,0,0,0|3,0,0]=4 980 B13R1.148 CC(=O)C(Oc1cccc(c1)F)C Amb2412534 [0,1,0,0,0,0|3,0,0]=4 981 B13R1.148 CC(=O)C(Oc1cccc(c1)N)C Amb17110087 [0,1,0,0,0,0|3,0,0]=4 982 B13R1.148 CC(=O)N(C)Cc1cccc(F)c1 Amb24072193 [0,1,0,0,0,0|3,0,0]=4 983 B13R1.148 CC(=O)N(C)Cc1cccc(O)c1 Amb25318056 [0,1,0,0,0,0|3,0,0]=4 984 B13R1.148 CC(C(Cc1cccc(c1)Br)C)O Amb17256429 [0,1,0,0,0,0|2,0,1]=4 985 B13R1.148 CC(C(Cc1cccc(c1)C)C)O Amb17233451 [0,1,0,0,0,0|2,0,1]=4 986 B13R1.148 CC(C(Cc1cccc(c1)C)N)C Amb17138832 [0,1,0,0,0,0|2,0,1]=4 987 B13R1.148 CC(C(Cc1cccc(c1)Cl)C)O Amb17236859 [0,1,0,0,0,0|2,0,1]=4 988 B13R1.148 CC(C(Cc1cccc(c1)Cl)N)C Amb17139688 [0,1,0,0,0,0|2,0,1]=4 989 B13R1.148 CC(C(Cc1cccc(c1)F)N)C Amb17139011 [0,1,0,0,0,0|2,0,1]=4 990 B13R1.148 CC(C)C(N)Cc1cccc(I)c1 Amb25277947 [0,1,0,0,0,0|2,0,1]=4 991 B13R1.148 CC(C)C(N)Cc1cccc(O)c1 Amb18194416 [0,1,0,0,0,0|2,0,1]=4 992 B13R1.148 CC(Cc1c[n]cc(Br)c1)C(O)=O Amb25821532 [0,1,0,0,0,0|2,0,0]=3 993 B13R1.148 CC(Cc1c[n]cc(F)c1)C(O)=O Amb25782318 [0,1,0,0,0,0|2,0,0]=3 994 B13R1.148 CC(Cc1cc(O)ccc1)C(C)O Amb24415928 [0,1,0,0,0,0|2,0,1]=4 995 B13R1.148 CC(Cc1cc[n]c(Cl)[n]1)C(O)=O Amb24460925 [0,1,0,0,0,0|3,0,0]=4 996 B13R1.148 CC(Cc1cccc(Br)c1)C(=O)Cl Amb25828945 [0,1,0,0,0,0|2,0,0]=3 997 B13R1.148 CC(Cc1cccc(Cl)c1)[N+]([O-])=O Amb25160711 [0,1,0,0,0,0|2,0,1]=4 998 B13R1.148 CC(Cc1cccc(F)c1)C(C)O Amb18809755 [0,1,0,0,0,0|2,0,1]=4 999 B13R1.148 CC(Cc1cccc(N)c1)C(O)=O Amb24693893 [0,1,0,0,0,0|1,0,0]=2 1000 B13R1.148 CC(F)C(N)Cc1cccc(F)c1 Amb25246963 [0,1,0,0,0,0|2,0,1]=4 1001 B13R1.148 CC(F)C(N)Cc1cccc(O)c1 Amb25178160 [0,1,0,0,0,0|2,0,1]=4 1002 B13R1.148 CC(Nc1c[n]cc(Br)c1)C(O)=O Amb24769569 [0,1,0,0,0,0|3,0,0]=4 1003 B13R1.148 CC(Nc1cc(Cl)cc[n]1)C(O)=O Amb25142098 [0,1,0,0,0,0|3,0,0]=4 1004 B13R1.148 CC(Nc1cc(O)ccc1)C(O)=O Amb25035392 [0,1,0,0,0,0|2,0,0]=3 1005 B13R1.148 CC(Nc1cc[n]c(Cl)c1)C(O)=O Amb24534295 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.148 CC(Nc1cccc(Cl)[n]1)C(O)=O Amb25754974 [0,1,0,0,0,0|3,0,0]=4 1007 B13R1.148 CC(Nc1cccc(I)c1)C(O)=O Amb24455393 [0,1,0,0,0,0|2,0,0]=3 1008 B13R1.148 CC(O)C(O)Cc1cccc(Cl)c1 Amb25043039 [0,1,0,0,0,0|2,0,1]=4 1009 B13R1.148 CC(O)C(O)Cc1cccc(F)c1 Amb25266497 [0,1,0,0,0,0|2,0,1]=4 1010 B13R1.148 CC(Oc1cc(Cl)ccc1)C(=O)Cl Amb20224027 [0,1,0,0,0,0|3,0,0]=4 1011 B13R1.148 CC(Oc1cc(O)ccc1)C(O)=O Amb18192781 [0,1,0,0,0,0|2,0,0]=3 1012 B13R1.148 CC(Oc1cccc(I)c1)C(N)=O Amb25154807 [0,1,0,0,0,0|3,0,0]=4 1013 B13R1.148 CC(Sc1cc(Br)cc[n]1)C(O)=O Amb25355827 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.148 CC(Sc1cc(N)ccc1)C(N)=O Amb24443470 [0,1,0,0,0,0|3,0,0]=4 1015 B13R1.148 CC(Sc1cc[n]c(Cl)c1)C(O)=O Amb24502935 [0,1,0,0,0,0|3,0,0]=4 1016 B13R1.148 CC(Sc1cccc(Br)c1)C(N)=O Amb24525537 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.148 CN(Cc1cccc(Cl)c1)C(N)=O Amb18332180 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.148 CN(Cc1cccc(F)c1)C(=O)Cl Amb25785989 [0,1,0,0,0,0|3,0,0]=4 1019 B13R1.148 CN(Cc1cccc(O)c1)C(N)=O Amb25717390 [0,1,0,0,0,0|3,0,0]=4 1020 B13R1.148 C[C@@H](Nc1c[n]cc(Br)c1)C(O)=O Amb24769733 [0,1,0,0,0,0|3,0,0]=4 1021 B13R1.148 C[C@@H](Nc1cc(Br)cc[n]1)C(O)=O Amb24769731 [0,1,0,0,0,0|3,0,0]=4 1022 B13R1.148 C[C@@H](Nc1cc[n]c(Cl)c1)C(O)=O Amb24476368 [0,1,0,0,0,0|3,0,0]=4 1023 B13R1.148 C[C@@H](Nc1cccc(F)[n]1)C(O)=O Amb24474119 [0,1,0,0,0,0|3,0,0]=4 1024 B13R1.148 C[C@@H](Oc1cccc(Br)c1)C(O)=O Amb25720694 [0,1,0,0,0,0|2,0,0]=3 1025 B13R1.148 C[C@H](Nc1c[n]cc(Br)c1)C(O)=O Amb24769720 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.148 C[C@H](Nc1cc(Br)cc[n]1)C(O)=O Amb24769716 [0,1,0,0,0,0|3,0,0]=4 1027 B13R1.148 C[C@H](Nc1cc(Cl)cc[n]1)C(O)=O Amb24598268 [0,1,0,0,0,0|3,0,0]=4 1028 B13R1.148 C[C@H](Nc1cccc(Cl)[n]1)C(O)=O Amb25206942 [0,1,0,0,0,0|3,0,0]=4 1029 B13R1.148 C[C@H](Nc1cccc(F)c1)C(O)=O Amb24495647 [0,1,0,0,0,0|2,0,0]=3 1030 B13R1.148 C[C@H](Oc1c[n]cc(Cl)c1)C(O)=O Amb25715155 [0,1,0,0,0,0|3,0,0]=4 1031 B13R1.148 C[C@H](Oc1c[n]cc(F)c1)C(O)=O Amb24650371 [0,1,0,0,0,0|3,0,0]=4 1032 B13R1.148 C[C@H](Oc1cccc(Cl)c1)C(O)=O Amb24490477 [0,1,0,0,0,0|2,0,0]=3 1033 B13R1.148 C[C@H](Oc1cccc(I)c1)C(O)=O Amb24405462 [0,1,0,0,0,0|2,0,0]=3 1034 B13R1.148 C\C(=C/c1cccc(Br)c1)\C(O)=O Amb22339395 [0,1,0,0,0,0|1,0,2]=4 1035 B13R1.148 C\C(=C/c1cccc(F)c1)\C(O)=O Amb24745620 [0,1,0,0,0,0|1,0,2]=4 1036 B13R1.148 C\C(=C\c1cc(O)ccc1)\C(O)=O Amb24437242 [0,1,0,0,0,0|1,0,2]=4 1037 B13R1.148 C\C(=C\c1cccc(Cl)c1)\C(O)=O Amb25085710 [0,1,0,0,0,0|1,0,2]=4 1038 B13R1.148 C\C(=C\c1cccc(F)c1)\C(O)=O Amb25255814 [0,1,0,0,0,0|1,0,2]=4 1039 B13R1.148 C\C(=C\c1cccc(N)c1)\C(O)=O Amb25039479 [0,1,0,0,0,0|1,0,2]=4 1040 B13R1.148 Cc1[n]c(CC(N)C(O)=O)cc[n]1 Amb18302431 [0,1,0,0,0,0|2,0,0]=3 1041 B13R1.148 Cc1[n]c(CC(S)C(O)=O)cc[n]1 Amb25679618 [0,1,0,0,0,0|3,0,0]=4 1042 B13R1.148 Cc1c[n+](CC(=O)C(O)=O)ccc1 Amb24668931 [0,1,0,0,0,0|2,0,1]=4 1043 B13R1.148 Cc1c[n]cc(CC(Br)C(C)=O)c1 Amb25157462 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.148 Cc1cc(CC(Br)C(N)=O)ccc1 Amb25723490 [0,1,0,0,0,0|2,0,0]=3 1045 B13R1.148 Cc1cc(CC(Br)C(O)=O)ccc1 Amb23320585 [0,1,0,0,0,0|1,0,0]=2 1046 B13R1.148 Cc1cc(CC(Cl)C(N)=O)c[n]c1 Amb25772451 [0,1,0,0,0,0|3,0,0]=4 1047 B13R1.148 Cc1cc(CC(N)C(F)F)ccc1 Amb25077003 [0,1,0,0,0,0|2,0,1]=4 1048 B13R1.148 Cc1cc(CC(N)C(N)=O)ccc1 Amb25122272 [0,1,0,0,0,0|1,0,0]=2 1049 B13R1.148 Cc1cc(CC(N)C(O)=O)[n]cc1 Amb18193874 [0,1,0,0,0,0|1,0,0]=2 1050 B13R1.148 Cc1cc(CC(N)C(O)=O)c[n]c1 Amb18193896 [0,1,0,0,0,0|1,0,0]=2 1051 B13R1.148 Cc1cc(CC(N)C(O)=O)cc[n]1 Amb18824521 [0,1,0,0,0,0|1,0,0]=2 1052 B13R1.148 Cc1cc(CN(C)C(N)=O)ccc1 Amb18796022 [0,1,0,0,0,0|3,0,0]=4 1053 B13R1.148 Cc1cc(C[C@@H](N)C(O)=O)cc[n]1 Amb24409497 [0,1,0,0,0,0|1,0,0]=2 1054 B13R1.148 Cc1cc(C[C@@H](O)C(O)=O)ccc1 Amb25829025 [0,1,0,0,0,0|1,0,0]=2 1055 B13R1.148 Cc1cc(C[C@H](N)C(O)=O)[n]cc1 Amb24346939 [0,1,0,0,0,0|1,0,0]=2 1056 B13R1.148 Cc1cc(C[C@H](O)C(O)=O)ccc1 Amb25295495 [0,1,0,0,0,0|1,0,0]=2 1057 B13R1.148 Cc1cc(\C=C(\F)/C(O)=O)ccc1 Amb25273987 [0,1,0,0,0,0|1,0,2]=4 1058 B13R1.148 Cc1cc(\C=C(\N)/C(O)=O)cc[n]1 Amb25231390 [0,1,0,0,0,0|1,0,2]=4 1059 B13R1.148 Cc1cc(cc[n]1)NC(C)C(O)=O Amb25820497 [0,1,0,0,0,0|3,0,0]=4 1060 B13R1.148 Cc1cc(cc[n]1)N[C@H](C)C(O)=O Amb25334516 [0,1,0,0,0,0|3,0,0]=4 1061 B13R1.148 Cc1cc(ccc1)OC(=C)C(O)=O Amb24711260 [0,1,0,0,0,0|2,0,1]=4 1062 B13R1.148 Cc1cc(ccc1)O[C@@H](C)C(O)=O Amb24310391 [0,1,0,0,0,0|2,0,0]=3 1063 B13R1.148 Cc1cc[n]c(c1)N[C@@H](C)C(O)=O Amb25173680 [0,1,0,0,0,0|3,0,0]=4 1064 B13R1.148 Cc1cc[n]c(c1)N[C@H](C)C(O)=O Amb25115822 [0,1,0,0,0,0|3,0,0]=4 1065 B13R1.148 Cc1cc[n]c(c1)SC(C)C(O)=O Amb18981407 [0,1,0,0,0,0|3,0,0]=4 1066 B13R1.148 Cc1cccc(CC(C)C(C)=O)[n]1 Amb25282382 [0,1,0,0,0,0|3,0,0]=4 1067 B13R1.148 Cc1cccc(CC(C)C(O)=O)[n]1 Amb25761364 [0,1,0,0,0,0|2,0,0]=3 1068 B13R1.148 Cc1cccc(CC(N)C(C)=O)c1 Amb18195910 [0,1,0,0,0,0|1,0,0]=2 1069 B13R1.148 Cc1cccc(CC(N)C(C)F)c1 Amb25178537 [0,1,0,0,0,0|2,0,1]=4 1070 B13R1.148 Cc1cccc(CC(N)C(N)=O)[n]1 Amb25808216 [0,1,0,0,0,0|2,0,0]=3 1071 B13R1.148 Cc1cccc(CC(O)C(O)=O)[n]1 Amb24740737 [0,1,0,0,0,0|2,0,0]=3 1072 B13R1.148 Cc1cccc(C[C@@H](N)C(O)=O)[n]1 Amb25117997 [0,1,0,0,0,0|1,0,0]=2 1073 B13R1.148 Cc1cccc(C[C@H](C)C(C)=O)c1 Amb25839299 [0,1,0,0,0,0|2,0,0]=3 1074 B13R1.148 Cc1cccc(N[C@H](C)C(O)=O)[n]1 Amb24476367 [0,1,0,0,0,0|3,0,0]=4 1075 B13R1.148 Cc1cccc([n]1)SC(C)C(O)=O Amb18969401 [0,1,0,0,0,0|3,0,0]=4 1076 B13R1.148 Cc1cccc(c1)CC(=O)C(=O)O Amb1131949 [0,1,0,0,0,0|1,0,1]=3 1077 B13R1.148 Cc1cccc(c1)NC(C)C(C)=O Amb25268251 [0,1,0,0,0,0|3,0,0]=4 1078 B13R1.148 Cc1cccc(c1)SC(C)C(C)=O Amb18317877 [0,1,0,0,0,0|3,0,0]=4 1079 B13R1.148 ClC(=O)C(Oc1cccc(c1)Br)C Amb16230148 [0,1,0,0,0,0|3,0,0]=4 1080 B13R1.148 ClC(=O)C(Oc1cccc(c1)C)C Amb16230058 [0,1,0,0,0,0|3,0,0]=4 1081 B13R1.148 ClC(=O)C(Sc1cccc(c1)C)C Amb17143634 [0,1,0,0,0,0|3,0,0]=4 1082 B13R1.148 ClC(=O)C(Sc1cccc(c1)Cl)C Amb17144557 [0,1,0,0,0,0|3,0,0]=4 1083 B13R1.148 Clc1cccc(c1)CC(=O)C(=O)O Amb1135307 [0,1,0,0,0,0|1,0,1]=3 1084 B13R1.148 Fc1cccc(c1)CC(=O)C(=O)O Amb1126816 [0,1,0,0,0,0|1,0,1]=3 1085 B13R1.148 NC(=O)C(Br)Cc1c[n]cc(F)c1 Amb24409357 [0,1,0,0,0,0|3,0,0]=4 1086 B13R1.148 NC(=O)C(Br)Cc1cc(Br)ccc1 Amb25156077 [0,1,0,0,0,0|2,0,0]=3 1087 B13R1.148 NC(=O)C(Br)Cc1cccc(F)c1 Amb25129096 [0,1,0,0,0,0|2,0,0]=3 1088 B13R1.148 NC(=O)C(Cc1cccc(c1)Br)Cl Amb17204832 [0,1,0,0,0,0|2,0,0]=3 1089 B13R1.148 NC(=O)C(Cc1cccc(c1)C)Cl Amb17204372 [0,1,0,0,0,0|2,0,0]=3 1090 B13R1.148 NC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204474 [0,1,0,0,0,0|2,0,0]=3 1091 B13R1.148 NC(=O)C(Cc1cccc(c1)F)Cl Amb17204396 [0,1,0,0,0,0|2,0,0]=3 1092 B13R1.148 NC(=O)C(Cl)Cc1c[n]cc(Br)c1 Amb24495065 [0,1,0,0,0,0|3,0,0]=4 1093 B13R1.148 NC(=O)C(Cl)Cc1c[n]cc(F)c1 Amb25045092 [0,1,0,0,0,0|3,0,0]=4 1094 B13R1.148 NC(=O)C(N)Cc1c[n]cc(Br)c1 Amb25040763 [0,1,0,0,0,0|2,0,0]=3 1095 B13R1.148 NC(=O)C(N)Cc1cccc(Br)c1 Amb18136032 [0,1,0,0,0,0|1,0,0]=2 1096 B13R1.148 NC(=O)C(N)Cc1cccc(O)c1 Amb24660581 [0,1,0,0,0,0|1,0,0]=2 1097 B13R1.148 NC(=O)C(Oc1cccc(c1)Br)C Amb2085822 [0,1,0,0,0,0|3,0,0]=4 1098 B13R1.148 NC(=O)C(Sc1cccc(c1)C)C Amb17143161 [0,1,0,0,0,0|3,0,0]=4 1099 B13R1.148 NC(=O)C(Sc1cccc(c1)Cl)C Amb17143658 [0,1,0,0,0,0|3,0,0]=4 1100 B13R1.148 NC(=O)N(O)Cc1cccc(Cl)c1 Amb22433917 [0,1,0,0,0,0|3,0,0]=4 1101 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(Cl)c1 Amb25375986 [0,1,0,0,0,0|1,0,0]=2 1102 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(F)c1 Amb25367595 [0,1,0,0,0,0|1,0,0]=2 1103 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(O)c1 Amb24452434 [0,1,0,0,0,0|1,0,0]=2 1104 B13R1.148 NC(CC1=CC(=O)NC=C1)C(O)=O Amb25127065 [0,1,0,0,0,0|1,0,0]=2 1105 B13R1.148 NC(CC1=CC(=O)NC=N1)C(O)=O Amb25095191 [0,1,0,0,0,0|2,0,0]=3 1106 B13R1.148 NC(CC1=CC=NC(=O)N1)C(O)=O Amb25268309 [0,1,0,0,0,0|2,0,0]=3 1107 B13R1.148 NC(CC=1NC(=O)C=CN1)C(O)=O Amb25270760 [0,1,0,0,0,0|2,0,0]=3 1108 B13R1.148 NC(Cc1cc(Cl)cc[n]1)C(O)=O Amb25764479 [0,1,0,0,0,0|1,0,0]=2 1109 B13R1.148 NC(Cc1cc(O)c[n]c1)C(O)=O Amb24377085 [0,1,0,0,0,0|1,0,0]=2 1110 B13R1.148 NC(Cc1cc[n]c(Br)c1)C(O)=O Amb25068866 [0,1,0,0,0,0|1,0,0]=2 1111 B13R1.148 NC(Cc1cc[n]c(Cl)c1)C(O)=O Amb25301408 [0,1,0,0,0,0|1,0,0]=2 1112 B13R1.148 NC(Cc1cc[n]c(F)c1)C(O)=O Amb24453250 [0,1,0,0,0,0|1,0,0]=2 1113 B13R1.148 NC(Cc1cccc(Br)c1)C(F)F Amb24520759 [0,1,0,0,0,0|2,0,1]=4 1114 B13R1.148 NC(Cc1cccc(Cl)[n]1)C(O)=O Amb24342291 [0,1,0,0,0,0|1,0,0]=2 1115 B13R1.148 NC(Cc1cccc(Cl)c1)C(O)=O Amb20622650 [0,1,0,0,0,0|0,0,0]=1 1116 B13R1.148 NC(Cc1cccc(F)[n]1)C(O)=O Amb25371997 [0,1,0,0,0,0|1,0,0]=2 1117 B13R1.148 NC(Cc1cccc(F)c1)C(F)F Amb24413521 [0,1,0,0,0,0|2,0,1]=4 1118 B13R1.148 NC(Cc1cccc(O)[n]1)C(O)=O Amb24730470 [0,1,0,0,0,0|1,0,0]=2 1119 B13R1.148 NC(Cc1cccc(O)c1)C(F)F Amb25247330 [0,1,0,0,0,0|2,0,1]=4 1120 B13R1.148 N[C@@H](Cc1c[n]cc(Br)c1)C(O)=O Amb24418099 [0,1,0,0,0,0|1,0,0]=2 1121 B13R1.148 N[C@@H](Cc1cccc(I)c1)C(O)=O Amb22229331 [0,1,0,0,0,0|0,0,0]=1 1122 B13R1.148 N[C@@H](Cc1cccc(O)[n]1)C(O)=O Amb24346926 [0,1,0,0,0,0|1,0,0]=2 1123 B13R1.148 N[C@H](Cc1c[n]cc(F)c1)C(O)=O Amb25679683 [0,1,0,0,0,0|1,0,0]=2 1124 B13R1.148 N[C@H](Cc1cc(Br)cc[n]1)C(O)=O Amb25123413 [0,1,0,0,0,0|1,0,0]=2 1125 B13R1.148 N[C@H](Cc1cc[n]c(Br)c1)C(O)=O Amb24367239 [0,1,0,0,0,0|1,0,0]=2 1126 B13R1.148 N[C@H](Cc1cccc(I)c1)C(O)=O Amb22229329 [0,1,0,0,0,0|0,0,0]=1 1127 B13R1.148 N[C@H](Cc1cccc(S)c1)C(O)=O Amb24489876 [0,1,0,0,0,0|0,0,0]=1 1128 B13R1.148 N\C(=C\C1=CC=CC(=O)N1)\C(O)=O Amb25788285 [0,1,0,0,0,0|1,0,2]=4 1129 B13R1.148 N\C(=C\c1c[n]cc(F)c1)\C(O)=O Amb25206061 [0,1,0,0,0,0|1,0,2]=4 1130 B13R1.148 N\C(=C\c1cccc(F)c1)\C(O)=O Amb25794832 [0,1,0,0,0,0|0,0,2]=3 1131 B13R1.148 Nc1[n]c(CC(N)C(O)=O)cc[n]1 Amb25108145 [0,1,0,0,0,0|2,0,0]=3 1132 B13R1.148 Nc1[n]c(C[C@@H](N)C(O)=O)cc[n]1 Amb25065293 [0,1,0,0,0,0|2,0,0]=3 1133 B13R1.148 Nc1cc(CC(N)C(O)=O)ccc1 Amb21864824 [0,1,0,0,0,0|0,0,0]=1 1134 B13R1.148 Nc1cc(C[C@@H](N)C(O)=O)ccc1 Amb22229180 [0,1,0,0,0,0|0,0,0]=1 1135 B13R1.148 Nc1cc(C[C@H](N)C(O)=O)cc[n]1 Amb24374979 [0,1,0,0,0,0|1,0,0]=2 1136 B13R1.148 Nc1cc(C[C@H](N)C(O)=O)ccc1 Amb22229182 [0,1,0,0,0,0|0,0,0]=1 1137 B13R1.148 Nc1cc[n]c(C[C@@H](N)C(O)=O)c1 Amb24715726 [0,1,0,0,0,0|1,0,0]=2 1138 B13R1.148 Nc1cccc(C[C@@H](N)C(O)=O)[n]1 Amb24526602 [0,1,0,0,0,0|1,0,0]=2 1139 B13R1.148 OC(=O)C(=O)Nc1cc(O)ccc1 Amb25322073 [0,1,0,0,0,0|2,0,1]=4 1140 B13R1.148 OC(=O)C(Br)Cc1cc(Br)ccc1 Amb23320620 [0,1,0,0,0,0|1,0,0]=2 1141 B13R1.148 OC(=O)C(Br)Cc1cccc(Cl)c1 Amb22339430 [0,1,0,0,0,0|1,0,0]=2 1142 B13R1.148 OC(=O)C(Br)Cc1cccc(Cl)c1 Amb23320616 [0,1,0,0,0,0|1,0,0]=2 1143 B13R1.148 OC(=O)C(C[n+]1cccc(c1)C)Br Amb1030019 [0,1,0,0,0,0|2,0,0]=3 1144 B13R1.148 OC(=O)C(Cc1cccc(c1)Br)Cl Amb17204844 [0,1,0,0,0,0|1,0,0]=2 1145 B13R1.148 OC(=O)C(Cc1cccc(c1)Br)O Amb17159702 [0,1,0,0,0,0|1,0,0]=2 1146 B13R1.148 OC(=O)C(Cc1cccc(c1)C)Cl Amb17204375 [0,1,0,0,0,0|1,0,0]=2 1147 B13R1.148 OC(=O)C(Cc1cccc(c1)C)O Amb17138949 [0,1,0,0,0,0|1,0,0]=2 1148 B13R1.148 OC(=O)C(Cc1cccc(c1)C)S Amb2480724 [0,1,0,0,0,0|1,0,0]=2 1149 B13R1.148 OC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204491 [0,1,0,0,0,0|1,0,0]=2 1150 B13R1.148 OC(=O)C(Cc1cccc(c1)Cl)O Amb17139823 [0,1,0,0,0,0|1,0,0]=2 1151 B13R1.148 OC(=O)C(Cc1cccc(c1)F)C Amb13951302 [0,1,0,0,0,0|1,0,0]=2 1152 B13R1.148 OC(=O)C(Cc1cccc(c1)F)Cl Amb17204399 [0,1,0,0,0,0|1,0,0]=2 1153 B13R1.148 OC(=O)C(Cc1cccc(c1)O)C Amb10844220 [0,1,0,0,0,0|1,0,0]=2 1154 B13R1.148 OC(=O)C(F)Cc1cc(F)ccc1 Amb24674554 [0,1,0,0,0,0|1,0,0]=2 1155 B13R1.148 OC(=O)C(F)Cc1cccc(Br)c1 Amb25200828 [0,1,0,0,0,0|1,0,0]=2 1156 B13R1.148 OC(=O)C(F)Oc1c[n]cc(Cl)c1 Amb24489921 [0,1,0,0,0,0|3,0,0]=4 1157 B13R1.148 OC(=O)C(F)Oc1cc(F)c[n]c1 Amb25779455 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.148 OC(=O)C(F)Oc1cccc(Cl)c1 Amb25076043 [0,1,0,0,0,0|2,0,0]=3 1159 B13R1.148 OC(=O)C(F)Sc1cc(F)ccc1 Amb24753369 [0,1,0,0,0,0|2,0,0]=3 1160 B13R1.148 OC(=O)C(F)Sc1cccc(Br)c1 Amb24701849 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.148 OC(=O)C(O)Cc1c[n]cc(Br)c1 Amb24535360 [0,1,0,0,0,0|2,0,0]=3 1162 B13R1.148 OC(=O)C(Oc1cccc(c1)Br)C Amb2556137 [0,1,0,0,0,0|2,0,0]=3 1163 B13R1.148 OC(=O)C(Oc1cccc(c1)Cl)C Amb1212286 [0,1,0,0,0,0|2,0,0]=3 1164 B13R1.148 OC(=O)C(Oc1cccc(c1)F)C Amb1116562 [0,1,0,0,0,0|2,0,0]=3 1165 B13R1.148 OC(=O)[C@@H](Cc1cccc(c1)Cl)C Amb10844155 [0,1,0,0,0,0|1,0,0]=2 1166 B13R1.148 OC(=O)[C@@H](Nc1cccc(c1)C)C Amb16231733 [0,1,0,0,0,0|2,0,0]=3 1167 B13R1.148 OC(=O)[C@@H](O)Cc1cccc(F)c1 Amb24725523 [0,1,0,0,0,0|1,0,0]=2 1168 B13R1.148 OC(=O)[C@H](Cc1cccc(c1)C)C Amb10844169 [0,1,0,0,0,0|1,0,0]=2 1169 B13R1.148 OC(=O)[C@H](Cc1cccc(c1)Cl)C Amb10844156 [0,1,0,0,0,0|1,0,0]=2 1170 B13R1.148 OC(=O)\C(\Cl)=C\c1cc(Cl)ccc1 Amb25261768 [0,1,0,0,0,0|1,0,2]=4 1171 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Br)c1 Amb24520960 [0,1,0,0,0,0|1,0,2]=4 1172 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Cl)c1 Amb25085473 [0,1,0,0,0,0|1,0,2]=4 1173 B13R1.148 OC(=O)\C(\F)=C\c1cccc(I)c1 Amb25277060 [0,1,0,0,0,0|1,0,2]=4 1174 B13R1.148 OC(=O)\C(\S)=C\c1cccc(F)c1 Amb25177621 [0,1,0,0,0,0|1,0,2]=4 1175 B13R1.148 Oc1cc(\C=C(/S)\C(O)=O)ccc1 Amb24115515 [0,1,0,0,0,0|1,0,2]=4 1176 B13R1.148 Oc1cccc(CC(Br)C(O)=O)c1 Amb25280092 [0,1,0,0,0,0|1,0,0]=2 1177 B13R1.148 Oc1cccc(CC(S)C(O)=O)c1 Amb25210444 [0,1,0,0,0,0|1,0,0]=2 1178 B13R1.148 Oc1cccc(C[C@@H](O)C(O)=O)c1 Amb25219734 [0,1,0,0,0,0|1,0,0]=2 1179 B13R1.148 Oc1cccc(C[C@H](O)C(O)=O)c1 Amb25342679 [0,1,0,0,0,0|1,0,0]=2 1180 B13R1.148 Oc1cccc(c1)CC(=O)C(=O)O Amb1141341 [0,1,0,0,0,0|1,0,1]=3 1181 B13R1.148 Oc1cccc(c1)SC(F)C(O)=O Amb25804345 [0,1,0,0,0,0|2,0,0]=3 1182 B13R1.152 BrC(C(C(=O)O)O)c1ccccc1 Amb17596766 [0,1,0,0,0,0|1,0,0]=2 1183 B13R1.152 C=C(C(Cl)C(O)=O)c1ccccc1 Amb25227445 [0,1,0,0,0,0|1,0,1]=3 1184 B13R1.152 C=C(C(N)C(O)=O)c1ccccc1 Amb18127911 [0,1,0,0,0,0|0,0,1]=2 1185 B13R1.152 C=C(C(O)C(O)=O)c1ccccc1 Amb25273986 [0,1,0,0,0,0|1,0,1]=3 1186 B13R1.152 C=C(C(O)c1cccc[n]1)C(O)=O Amb25760297 [0,1,0,0,0,0|2,0,1]=4 1187 B13R1.152 C=C(C(O)c1ccccc1)C(N)=O Amb24692881 [0,1,0,0,0,0|2,0,1]=4 1188 B13R1.152 C=C([C@H](N)c1ccccc1)C(O)=O Amb25697157 [0,1,0,0,0,0|1,0,1]=3 1189 B13R1.152 CC(=C)C(C)C(O)c1ccccc1 Amb24495101 [0,1,0,0,0,0|3,0,0]=4 1190 B13R1.152 CC(=C)C(N)C(C)c1ccccc1 Amb25180112 [0,1,0,0,0,0|2,0,0]=3 1191 B13R1.152 CC(=C)[C@@H](O)[C@@H](C)c1ccccc1 Amb25092087 [0,1,0,0,0,0|3,0,0]=4 1192 B13R1.152 CC(=O)C(=C)[C@@H](O)c1ccccc1 Amb24370174 [0,1,0,0,0,0|2,0,1]=4 1193 B13R1.152 CC(=O)C(=O)C(C)c1ccccc1 Amb24492525 [0,1,0,0,0,0|2,0,1]=4 1194 B13R1.152 CC(=O)C(C)C(=C)c1ccccc1 Amb24492728 [0,1,0,0,0,0|2,0,1]=4 1195 B13R1.152 CC(=O)C(C)C(C)c1ccccc1 Amb25087204 [0,1,0,0,0,0|2,0,0]=3 1196 B13R1.152 CC(=O)C(C)C(N)c1ccccc1 Amb25041504 [0,1,0,0,0,0|2,0,0]=3 1197 B13R1.152 CC(=O)C(C)C(O)c1c[n]ccc1 Amb25729242 [0,1,0,0,0,0|3,0,0]=4 1198 B13R1.152 CC(=O)C(C)N(O)c1ccccc1 Amb25838746 [0,1,0,0,0,0|3,0,0]=4 1199 B13R1.152 CC(=O)C(Cl)C(=O)c1ccccc1 Amb25210855 [0,1,0,0,0,0|2,0,1]=4 1200 B13R1.152 CC(=O)C(Cl)C(N)c1ccccc1 Amb25300345 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.152 CC(=O)C(F)C(=O)c1ccccc1 Amb25816142 [0,1,0,0,0,0|2,0,1]=4 1202 B13R1.152 CC(=O)C(N)C(O)c1ccccc1 Amb25066908 [0,1,0,0,0,0|1,0,0]=2 1203 B13R1.152 CC(=O)C(O)C(=O)c1ccccc1 Amb24467013 [0,1,0,0,0,0|2,0,1]=4 1204 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 Amb25731265 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.152 CC(=O)N(C)C(Cl)c1ccccc1 Amb25772765 [0,1,0,0,0,0|3,0,0]=4 1206 B13R1.152 CC(=O)[C@@H](C)C(=O)c1ccccc1 Amb25729157 [0,1,0,0,0,0|2,0,1]=4 1207 B13R1.152 CC(=O)[C@@H](C)[C@@H](C)c1ccccc1 Amb25086639 [0,1,0,0,0,0|2,0,0]=3 1208 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1cccc[n]1 Amb24432173 [0,1,0,0,0,0|3,0,0]=4 1209 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24467544 [0,1,0,0,0,0|2,0,0]=3 1210 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb25290208 [0,1,0,0,0,0|2,0,0]=3 1211 B13R1.152 CC(=O)[C@@H](O)[C@@H](O)c1ccccc1 Amb24704823 [0,1,0,0,0,0|2,0,0]=3 1212 B13R1.152 CC(=O)[C@H](C)[C@H](O)c1ccccc1 Amb24492637 [0,1,0,0,0,0|2,0,0]=3 1213 B13R1.152 CC(=O)[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb24574713 [0,1,0,0,0,0|2,0,0]=3 1214 B13R1.152 CC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb24652637 [0,1,0,0,0,0|2,0,0]=3 1215 B13R1.152 CC(=O)[C@H](O)[C@H](O)c1ccccc1 Amb24752230 [0,1,0,0,0,0|2,0,0]=3 1216 B13R1.152 CC(C(=C)C(O)=O)c1ccccc1 Amb24634053 [0,1,0,0,0,0|1,0,1]=3 1217 B13R1.152 CC(C(=C)c1ccccc1)C(O)=O Amb18127713 [0,1,0,0,0,0|1,0,1]=3 1218 B13R1.152 CC(C(=O)c1ccccc1)C(=O)N Amb17594504 [0,1,0,0,0,0|2,0,1]=4 1219 B13R1.152 CC(C(Br)C(O)=O)c1ccccc1 Amb24396296 [0,1,0,0,0,0|1,0,0]=2 1220 B13R1.152 CC(C(C(=O)O)N)c1ccccc1 Amb10072242 [0,1,0,0,0,0|0,0,0]=1 1221 B13R1.152 CC(C(C(=O)O)O)c1ccccc1 Amb10549583 [0,1,0,0,0,0|1,0,0]=2 1222 B13R1.152 CC(C(C)c1c[n]cc[n]1)C(O)=O Amb25355225 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.152 CC(C(C)c1cc[n]c[n]1)C(O)=O Amb24649168 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.152 CC(C(C)c1cccc[n]1)C(O)=O Amb18824717 [0,1,0,0,0,0|2,0,0]=3 1225 B13R1.152 CC(C(C)c1ccccc1)C(=O)Cl Amb25197974 [0,1,0,0,0,0|2,0,0]=3 1226 B13R1.152 CC(C(Cl)C(N)=O)c1ccccc1 Amb18330991 [0,1,0,0,0,0|2,0,0]=3 1227 B13R1.152 CC(C(Cl)C(O)=O)c1ccccc1 Amb25773999 [0,1,0,0,0,0|1,0,0]=2 1228 B13R1.152 CC(C(Cl)c1ccccc1)C(=O)Cl Amb24418080 [0,1,0,0,0,0|2,0,0]=3 1229 B13R1.152 CC(C(Cl)c1ccccc1)C(O)=O Amb18130574 [0,1,0,0,0,0|1,0,0]=2 1230 B13R1.152 CC(C(F)C(O)=O)c1cc[n]cc1 Amb25119011 [0,1,0,0,0,0|2,0,0]=3 1231 B13R1.152 CC(C(F)C(O)=O)c1ccc[n]c1 Amb24583873 [0,1,0,0,0,0|2,0,0]=3 1232 B13R1.152 CC(C(F)C(O)=O)c1ccccc1 Amb24674555 [0,1,0,0,0,0|1,0,0]=2 1233 B13R1.152 CC(C(N)C(N)=O)c1ccccc1 Amb18975500 [0,1,0,0,0,0|1,0,0]=2 1234 B13R1.152 CC(C(N)c1ccccc1)C(O)=O Amb19375481 [0,1,0,0,0,0|1,0,0]=2 1235 B13R1.152 CC(C(N)c1ccccc1)[N+]([O-])=O Amb22487244 [0,1,0,0,0,0|2,0,1]=4 1236 B13R1.152 CC(C(O)=O)C(=O)c1ccccc1 Amb18128110 [0,1,0,0,0,0|1,0,1]=3 1237 B13R1.152 CC(C(O)=O)S(=O)c1ccccc1 Amb18292847 [0,1,0,0,0,0|2,0,0]=3 1238 B13R1.152 CC(C(O)C(N)=O)c1ccccc1 Amb18809180 [0,1,0,0,0,0|2,0,0]=3 1239 B13R1.152 CC(C)C(N)C(C)c1ccccc1 Amb23536663 [0,1,0,0,0,0|2,0,1]=4 1240 B13R1.152 CC(C)C(N)C(F)c1ccccc1 Amb24459748 [0,1,0,0,0,0|2,0,1]=4 1241 B13R1.152 CC(C)[C@@H](N)[C@H](N)c1ccccc1 Amb24491912 [0,1,0,0,0,0|2,0,1]=4 1242 B13R1.152 CC(C)[C@H](N)[C@@H](N)c1ccccc1 Amb25142135 [0,1,0,0,0,0|2,0,1]=4 1243 B13R1.152 CC(N(c1ccccc1)C)C(=O)Cl Amb17143180 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,1,0,0,0,0|2,0,1]=4 1245 B13R1.152 CC(O)C(C)C(C)c1ccccc1 Amb25332510 [0,1,0,0,0,0|2,0,1]=4 1246 B13R1.152 CC(O)C(C)C(O)c1ccccc1 Amb25741415 [0,1,0,0,0,0|2,0,1]=4 1247 B13R1.152 CC(O)C(N)C(=O)c1ccccc1 Amb24106078 [0,1,0,0,0,0|1,0,2]=4 1248 B13R1.152 CC(O)C(N)C(O)c1ccccc1 Amb25276453 [0,1,0,0,0,0|1,0,1]=3 1249 B13R1.152 CC(O)C(O)C(N)c1ccccc1 Amb25264393 [0,1,0,0,0,0|2,0,1]=4 1250 B13R1.152 CC(O)[C@H](N)[C@@H](O)c1ccccc1 Amb24431996 [0,1,0,0,0,0|1,0,1]=3 1251 B13R1.152 CC(S(=O)c1ccccc1)C(=O)C Amb17595198 [0,1,0,0,0,0|3,0,0]=4 1252 B13R1.152 CC([C@@H](N)C(O)=O)c1ccccc1 Amb24107545 [0,1,0,0,0,0|0,0,0]=1 1253 B13R1.152 CC([C@H](O)c1ccccc1)C(O)=O Amb25258355 [0,1,0,0,0,0|1,0,0]=2 1254 B13R1.152 CC(c1ccccc1)C(=O)C(O)=O Amb18648106 [0,1,0,0,0,0|1,0,1]=3 1255 B13R1.152 CC(c1ccccc1)N(O)C(N)=O Amb25321876 [0,1,0,0,0,0|3,0,0]=4 1256 B13R1.152 CN(C(C)C(O)=O)c1cc[n]cc1 Amb18993802 [0,1,0,0,0,0|3,0,0]=4 1257 B13R1.152 CN(C)C(N)C(O)c1ccccc1 Amb25266702 [0,1,0,0,0,0|3,0,0]=4 1258 B13R1.152 CN(C)[C@@H](N)[C@H](O)c1ccccc1 Amb25769450 [0,1,0,0,0,0|3,0,0]=4 1259 B13R1.152 CN([C@@H](C)C(O)=O)c1ccccc1 Amb24424138 [0,1,0,0,0,0|2,0,0]=3 1260 B13R1.152 C[C@@H](C(N)c1ccccc1)[C@H](C)O Amb25374921 [0,1,0,0,0,0|2,0,1]=4 1261 B13R1.152 C[C@@H](C(O)=O)S(=O)c1ccccc1 Amb25761325 [0,1,0,0,0,0|2,0,0]=3 1262 B13R1.152 C[C@@H]([C@@H](C)c1ccccc1)C(N)=O Amb25765701 [0,1,0,0,0,0|2,0,0]=3 1263 B13R1.152 C[C@@H]([C@@H](N)C(O)=O)c1ccccc1 Amb22801136 [0,1,0,0,0,0|0,0,0]=1 1264 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(N)=O Amb24590220 [0,1,0,0,0,0|2,0,0]=3 1265 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(O)=O Amb19929625 [0,1,0,0,0,0|1,0,0]=2 1266 B13R1.152 C[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25697174 [0,1,0,0,0,0|1,0,0]=2 1267 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)C(O)=O Amb24429060 [0,1,0,0,0,0|1,0,0]=2 1268 B13R1.152 C[C@@H]([C@H](N)c1ccccc1)C(O)=O Amb19929623 [0,1,0,0,0,0|1,0,0]=2 1269 B13R1.152 C[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb25708376 [0,1,0,0,0,0|1,0,0]=2 1270 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)C(O)=O Amb25689703 [0,1,0,0,0,0|1,0,0]=2 1271 B13R1.152 C[C@@H](c1ccccc1)N(O)C(N)=O Amb25040134 [0,1,0,0,0,0|3,0,0]=4 1272 B13R1.152 C[C@H](C(N)c1ccccc1)[C@H](C)O Amb24428937 [0,1,0,0,0,0|2,0,1]=4 1273 B13R1.152 C[C@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24420803 [0,1,0,0,0,0|2,0,1]=4 1274 B13R1.152 C[C@H](O)[C@H](Br)[C@H](O)c1ccccc1 Amb25722160 [0,1,0,0,0,0|2,0,1]=4 1275 B13R1.152 C[C@H](O)[C@H](C)[C@H](O)c1ccccc1 Amb25058514 [0,1,0,0,0,0|2,0,1]=4 1276 B13R1.152 C[C@H]([C@@H](C(=O)O)C)c1ccccc1 Amb10844123 [0,1,0,0,0,0|1,0,0]=2 1277 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb19890909 [0,1,0,0,0,0|0,0,0]=1 1278 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb25101600 [0,1,0,0,0,0|0,0,0]=1 1279 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)C(O)=O Amb25111224 [0,1,0,0,0,0|1,0,0]=2 1280 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)[C@@H](C)O Amb24366647 [0,1,0,0,0,0|2,0,1]=4 1281 B13R1.152 C[C@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25363181 [0,1,0,0,0,0|1,0,0]=2 1282 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)C(N)=O Amb25708390 [0,1,0,0,0,0|2,0,0]=3 1283 B13R1.152 C[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24552403 [0,1,0,0,0,0|1,0,0]=2 1284 B13R1.152 C\C(=C(\F)/C(O)=O)\c1ccccc1 Amb18128594 [0,1,0,0,0,0|1,0,2]=4 1285 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccccc1 Amb18127724 [0,1,0,0,0,0|1,0,2]=4 1286 B13R1.152 ClC(C(C(=O)O)O)c1ccccc1 Amb17595327 [0,1,0,0,0,0|1,0,0]=2 1287 B13R1.152 NC(=O)C(Br)C(=O)c1ccccc1 Amb25221896 [0,1,0,0,0,0|2,0,1]=4 1288 B13R1.152 NC(=O)C(Cl)C(O)c1ccccc1 Amb25772867 [0,1,0,0,0,0|2,0,0]=3 1289 B13R1.152 NC(=O)C(N)C(F)c1ccccc1 Amb25322105 [0,1,0,0,0,0|1,0,0]=2 1290 B13R1.152 NC(=O)C(O)C(F)c1ccccc1 Amb24400168 [0,1,0,0,0,0|2,0,0]=3 1291 B13R1.152 NC(=O)[C@@H](N)[C@@H](O)c1ccccc1 Amb25138644 [0,1,0,0,0,0|1,0,0]=2 1292 B13R1.152 NC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb24426182 [0,1,0,0,0,0|2,0,0]=3 1293 B13R1.152 NC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb25363147 [0,1,0,0,0,0|2,0,0]=3 1294 B13R1.152 NC(=O)[C@H](F)[C@@H](O)c1ccccc1 Amb24429111 [0,1,0,0,0,0|2,0,0]=3 1295 B13R1.152 NC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb24552423 [0,1,0,0,0,0|2,0,0]=3 1296 B13R1.152 NC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb24741670 [0,1,0,0,0,0|2,0,0]=3 1297 B13R1.152 NC(C(=O)c1ccccc1)[N+]([O-])=O Amb24105891 [0,1,0,0,0,0|1,0,2]=4 1298 B13R1.152 NC(C(C(=O)O)C)c1ccccc1 Amb17470593 [0,1,0,0,0,0|1,0,0]=2 1299 B13R1.152 NC(C(C(=O)O)C)c1ccncc1 Amb17470632 [0,1,0,0,0,0|2,0,0]=3 1300 B13R1.152 NC(C(N)c1ccccc1)C(O)=O Amb18128694 [0,1,0,0,0,0|0,0,0]=1 1301 B13R1.152 NC(C(O)C(O)=O)c1cccc[n]1 Amb25288335 [0,1,0,0,0,0|2,0,0]=3 1302 B13R1.152 NC(C(O)C(O)=O)c1ccccc1 Amb22552502 [0,1,0,0,0,0|1,0,0]=2 1303 B13R1.152 NC(C(O)c1c[n]c[n]c1)C(O)=O Amb25362434 [0,1,0,0,0,0|2,0,0]=3 1304 B13R1.152 NC(C(O)c1cc[n]c[n]1)C(O)=O Amb25359555 [0,1,0,0,0,0|2,0,0]=3 1305 B13R1.152 NC(C(O)c1cc[n]cc1)C(O)=O Amb18192714 [0,1,0,0,0,0|1,0,0]=2 1306 B13R1.152 NC(C(O)c1cccc[n]1)C(O)=O Amb18192715 [0,1,0,0,0,0|1,0,0]=2 1307 B13R1.152 NC([C@H](O)c1ccccc1)C(O)=O Amb25848582 [0,1,0,0,0,0|0,0,0]=1 1308 B13R1.152 NC(c1ccccc1)C(=O)C(O)=O Amb24693899 [0,1,0,0,0,0|1,0,1]=3 1309 B13R1.152 N[C@@H](C(Cl)c1ccccc1)C(O)=O Amb25765693 [0,1,0,0,0,0|0,0,0]=1 1310 B13R1.152 N[C@@H](C(O)C(O)=O)c1ccccc1 Amb24677811 [0,1,0,0,0,0|1,0,0]=2 1311 B13R1.152 N[C@@H]([C@@H](C(=O)O)O)c1ccccc1 Amb17619345 [0,1,0,0,0,0|1,0,0]=2 1312 B13R1.152 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb17779638 [0,1,0,0,0,0|1,0,0]=2 1313 B13R1.152 N[C@@H]([C@@H](O)c1ccccc1)C(F)F Amb25137940 [0,1,0,0,0,0|2,0,1]=4 1314 B13R1.152 N[C@@H]([C@@H](S)c1ccccc1)C(O)=O Amb24677701 [0,1,0,0,0,0|0,0,0]=1 1315 B13R1.152 N[C@@H]([C@H](C(=O)O)O)c1ccccc1 Amb17619344 [0,1,0,0,0,0|1,0,0]=2 1316 B13R1.152 N[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb22745018 [0,1,0,0,0,0|1,0,0]=2 1317 B13R1.152 N[C@H]([C@@H](O)c1ccccc1)C(F)F Amb24647183 [0,1,0,0,0,0|2,0,1]=4 1318 B13R1.152 N[C@H]([C@@H](S)c1ccccc1)C(O)=O Amb24346854 [0,1,0,0,0,0|0,0,0]=1 1319 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb10601661 [0,1,0,0,0,0|1,0,0]=2 1320 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb16231605 [0,1,0,0,0,0|1,0,0]=2 1321 B13R1.152 N[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24442986 [0,1,0,0,0,0|0,0,0]=1 1322 B13R1.152 N[C@H]([C@H](O)C(O)=O)c1ccc[n]c1 Amb24737746 [0,1,0,0,0,0|2,0,0]=3 1323 B13R1.152 O=C(Cl)C(Br)C(Br)c1ccccc1 Amb22366166 [0,1,0,0,0,0|2,0,0]=3 1324 B13R1.152 OC(=O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,1,0,0,0,0|1,0,1]=3 1325 B13R1.152 OC(=O)C(=O)C(Cl)c1ccccc1 Amb25292830 [0,1,0,0,0,0|1,0,1]=3 1326 B13R1.152 OC(=O)C(C(c1ccccn1)N)C Amb17470626 [0,1,0,0,0,0|2,0,0]=3 1327 B13R1.152 OC(=O)C(C(c1cccnc1)N)C Amb17470629 [0,1,0,0,0,0|2,0,0]=3 1328 B13R1.152 OC(=O)C(Cl)C(Cl)c1ccccc1 Amb18132697 [0,1,0,0,0,0|1,0,0]=2 1329 B13R1.152 OC(=O)C(Cl)C(O)c1ccccc1 Amb25366171 [0,1,0,0,0,0|1,0,0]=2 1330 B13R1.152 OC(=O)C(Cl)S(=O)c1ccccc1 Amb25195918 [0,1,0,0,0,0|2,0,0]=3 1331 B13R1.152 OC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb24640317 [0,1,0,0,0,0|1,0,0]=2 1332 B13R1.152 OC(=O)\C(\Cl)=C(\Cl)/c1ccccc1 Amb18658046 [0,1,0,0,0,0|1,0,2]=4 1333 B13R1.152 OC(=O)\C(\F)=C(/F)\c1ccccc1 Amb18129295 [0,1,0,0,0,0|1,0,2]=4 1334 B13R1.152 OC(=O)\C(\F)=C(\F)/c1ccccc1 Amb25173140 [0,1,0,0,0,0|1,0,2]=4 1335 B13R1.152 OC(=O)\C(\I)=C(/I)\c1ccccc1 Amb22438965 [0,1,0,0,0,0|1,0,2]=4 1336 B13R1.152 OC(C(C(=O)C)C)c1ccccc1 Amb17594547 [0,1,0,0,0,0|2,0,0]=3 1337 B13R1.152 OC(C(C(=O)O)N)c1ccccc1 Amb2228459 [0,1,0,0,0,0|0,0,0]=1 1338 B13R1.152 OC(C(C(=O)[O-])N)c1ccccc1 Amb15772286 [0,1,0,0,0,0|0,0,1]=2 1339 B13R1.152 OC(c1ccccc1)C(C(C)C)N Amb17138913 [0,1,0,0,0,0|2,0,1]=4 1340 B13R1.152 O[C@H]([C@H](C(=O)O)C)c1ccccc1 Amb10844122 [0,1,0,0,0,0|1,0,0]=2 1341 B13R1.152 SC(C(C(=O)O)N)c1ccccc1 Amb17595234 [0,1,0,0,0,0|0,0,0]=1 1342 B13R1.152 [O-][N+](=O)C(F)C(O)c1ccccc1 Amb24084162 [0,1,0,0,0,0|2,0,1]=4 1343 B13R1.202 C=C(CN1C=CC=CC1=O)C(O)=O Amb25367283 [0,1,0,0,0,0|2,0,1]=4 1344 B13R1.202 C=C(Cc1ccccc1Cl)C(O)=O Amb24426262 [0,1,0,0,0,0|1,0,1]=3 1345 B13R1.202 C=C(Cc1ccccc1O)C(O)=O Amb18128088 [0,1,0,0,0,0|1,0,1]=3 1346 B13R1.202 C=C(Oc1ccccc1O)C(O)=O Amb18128536 [0,1,0,0,0,0|2,0,1]=4 1347 B13R1.202 CC(=C)C(N)Cc1ccccc1Br Amb24350448 [0,1,0,0,0,0|2,0,0]=3 1348 B13R1.202 CC(=C)C(N)Cc1ccccc1Cl Amb24394895 [0,1,0,0,0,0|2,0,0]=3 1349 B13R1.202 CC(=C)C(O)Cc1ccccc1F Amb25038968 [0,1,0,0,0,0|3,0,0]=4 1350 B13R1.202 CC(=O)C(=O)Cc1ccccc1C Amb25158383 [0,1,0,0,0,0|2,0,1]=4 1351 B13R1.202 CC(=O)C(=O)Cc1ccccc1F Amb23603624 [0,1,0,0,0,0|2,0,1]=4 1352 B13R1.202 CC(=O)C(Br)Cc1ccccc1Br Amb18601676 [0,1,0,0,0,0|2,0,0]=3 1353 B13R1.202 CC(=O)C(Br)Cc1ccccc1Cl Amb18589744 [0,1,0,0,0,0|2,0,0]=3 1354 B13R1.202 CC(=O)C(Br)Cc1ccccc1F Amb25142912 [0,1,0,0,0,0|2,0,0]=3 1355 B13R1.202 CC(=O)C(C)Cc1[n]cccc1Br Amb25313956 [0,1,0,0,0,0|3,0,0]=4 1356 B13R1.202 CC(=O)C(C)Cc1cc[n]cc1Cl Amb25209412 [0,1,0,0,0,0|3,0,0]=4 1357 B13R1.202 CC(=O)C(C)Cc1ccccc1Br Amb25857289 [0,1,0,0,0,0|2,0,0]=3 1358 B13R1.202 CC(=O)C(C)Oc1ccccc1Br Amb25282458 [0,1,0,0,0,0|3,0,0]=4 1359 B13R1.202 CC(=O)C(C)Oc1ccccc1I Amb25330401 [0,1,0,0,0,0|3,0,0]=4 1360 B13R1.202 CC(=O)C(Cc1ccccc1Br)Cl Amb17204824 [0,1,0,0,0,0|2,0,0]=3 1361 B13R1.202 CC(=O)C(Cc1ccccc1C)C Amb17233203 [0,1,0,0,0,0|2,0,0]=3 1362 B13R1.202 CC(=O)C(Cc1ccccc1C)Cl Amb17204368 [0,1,0,0,0,0|2,0,0]=3 1363 B13R1.202 CC(=O)C(Cc1ccccc1Cl)C Amb17236507 [0,1,0,0,0,0|2,0,0]=3 1364 B13R1.202 CC(=O)C(Cc1ccccc1F)C Amb17233678 [0,1,0,0,0,0|2,0,0]=3 1365 B13R1.202 CC(=O)C(Cc1ccccc1F)Cl Amb17204389 [0,1,0,0,0,0|2,0,0]=3 1366 B13R1.202 CC(=O)C(Cc1ccccc1O)Br Amb17507801 [0,1,0,0,0,0|2,0,0]=3 1367 B13R1.202 CC(=O)C(N)Cc1ccccc1Br Amb18726733 [0,1,0,0,0,0|1,0,0]=2 1368 B13R1.202 CC(=O)C(N)Cc1ccccc1F Amb25079181 [0,1,0,0,0,0|1,0,0]=2 1369 B13R1.202 CC(=O)C(Oc1ccccc1Cl)C Amb2412507 [0,1,0,0,0,0|3,0,0]=4 1370 B13R1.202 CC(=O)C(Oc1ccccc1F)C Amb2412550 [0,1,0,0,0,0|3,0,0]=4 1371 B13R1.202 CC(=O)C(Oc1ccccc1N)C Amb17110088 [0,1,0,0,0,0|3,0,0]=4 1372 B13R1.202 CC(=O)C(Oc1ccccc1O)C Amb2418519 [0,1,0,0,0,0|3,0,0]=4 1373 B13R1.202 CC(=O)C(Sc1ccccc1N)C Amb17305641 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.202 CC(=O)N(C)Cc1ccccc1Br Amb25733182 [0,1,0,0,0,0|3,0,0]=4 1375 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl Amb25734688 [0,1,0,0,0,0|3,0,0]=4 1376 B13R1.202 CC(=O)N(O)Cc1ccccc1Cl Amb24450252 [0,1,0,0,0,0|3,0,0]=4 1377 B13R1.202 CC(=O)[C@@H](C)Cc1ccccc1Cl Amb24733929 [0,1,0,0,0,0|2,0,0]=3 1378 B13R1.202 CC(C(Cc1ccccc1C)C)O Amb17233449 [0,1,0,0,0,0|2,0,1]=4 1379 B13R1.202 CC(C(Cc1ccccc1C)N)C Amb17138831 [0,1,0,0,0,0|2,0,1]=4 1380 B13R1.202 CC(C(Cc1ccccc1Cl)C)O Amb17236857 [0,1,0,0,0,0|2,0,1]=4 1381 B13R1.202 CC(C(Cc1ccccc1Cl)N)C Amb17139687 [0,1,0,0,0,0|2,0,1]=4 1382 B13R1.202 CC(C(Cc1ccccc1F)C)O Amb17233912 [0,1,0,0,0,0|2,0,1]=4 1383 B13R1.202 CC(C(Cc1ccccc1F)N)C Amb17139010 [0,1,0,0,0,0|2,0,1]=4 1384 B13R1.202 CC(C)C(N)Cc1ccccc1O Amb18194385 [0,1,0,0,0,0|2,0,1]=4 1385 B13R1.202 CC(CN1C=CC=CC1=O)C(O)=O Amb19001379 [0,1,0,0,0,0|2,0,0]=3 1386 B13R1.202 CC(CN1C=CC=NC1=O)C(O)=O Amb18303246 [0,1,0,0,0,0|3,0,0]=4 1387 B13R1.202 CC(CN1N=CC=CC1=O)C(O)=O Amb18302697 [0,1,0,0,0,0|3,0,0]=4 1388 B13R1.202 CC(C[n+]1ccccc1N)C([O-])=O Amb25839857 [0,1,0,0,0,0|2,0,1]=4 1389 B13R1.202 CC(Cc1[n]cccc1Br)C(O)=O Amb24428877 [0,1,0,0,0,0|2,0,0]=3 1390 B13R1.202 CC(Cc1cc[n]cc1F)C(O)=O Amb25039005 [0,1,0,0,0,0|2,0,0]=3 1391 B13R1.202 CC(Cc1ccccc1Br)C(=O)Cl Amb24664137 [0,1,0,0,0,0|2,0,0]=3 1392 B13R1.202 CC(Cc1ccccc1Br)C(C)O Amb24430235 [0,1,0,0,0,0|2,0,1]=4 1393 B13R1.202 CC(Cc1ccccc1Cl)[N+]([O-])=O Amb25339394 [0,1,0,0,0,0|2,0,1]=4 1394 B13R1.202 CC(Cc1ccccc1F)C(N)=O Amb24362533 [0,1,0,0,0,0|2,0,0]=3 1395 B13R1.202 CC(F)C(N)Cc1ccccc1Cl Amb24663569 [0,1,0,0,0,0|2,0,1]=4 1396 B13R1.202 CC(Nc1ccc[n]c1Br)C(O)=O Amb25300114 [0,1,0,0,0,0|3,0,0]=4 1397 B13R1.202 CC(Nc1ccc[n]c1Cl)C(O)=O Amb24654242 [0,1,0,0,0,0|3,0,0]=4 1398 B13R1.202 CC(O)C(N)Cc1ccccc1Br Amb18155747 [0,1,0,0,0,0|1,0,1]=3 1399 B13R1.202 CC(O)C(O)Cc1ccccc1Br Amb24397318 [0,1,0,0,0,0|2,0,1]=4 1400 B13R1.202 CC(O)C(O)Cc1ccccc1Cl Amb24704687 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.202 CC(O)C(O)Cc1ccccc1F Amb24362019 [0,1,0,0,0,0|2,0,1]=4 1402 B13R1.202 CC(Oc1ccc[n]c1N)C(O)=O Amb18293670 [0,1,0,0,0,0|3,0,0]=4 1403 B13R1.202 CC(Oc1ccccc1N)C(N)=O Amb18971061 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.202 CC(Sc1[n]cccc1F)C(O)=O Amb18996003 [0,1,0,0,0,0|3,0,0]=4 1405 B13R1.202 CC(Sc1[n]cccc1N)C(O)=O Amb18291281 [0,1,0,0,0,0|3,0,0]=4 1406 B13R1.202 CC(Sc1[n]cccc1O)C(O)=O Amb24102034 [0,1,0,0,0,0|3,0,0]=4 1407 B13R1.202 CC(Sc1cc[n]cc1Cl)C(O)=O Amb25718494 [0,1,0,0,0,0|3,0,0]=4 1408 B13R1.202 CC(Sc1cc[n]cc1N)C(O)=O Amb18975669 [0,1,0,0,0,0|3,0,0]=4 1409 B13R1.202 CC(Sc1ccccc1O)C(N)=O Amb18318228 [0,1,0,0,0,0|3,0,0]=4 1410 B13R1.202 CC(Sc1ccccc1O)C(O)=O Amb18984793 [0,1,0,0,0,0|2,0,0]=3 1411 B13R1.202 CN(Cc1ccccc1Br)C(=O)Cl Amb24641133 [0,1,0,0,0,0|3,0,0]=4 1412 B13R1.202 CN(Cc1ccccc1Br)C(N)=O Amb25785330 [0,1,0,0,0,0|3,0,0]=4 1413 B13R1.202 CN(Cc1ccccc1Cl)C(=O)Cl Amb25857704 [0,1,0,0,0,0|3,0,0]=4 1414 B13R1.202 CN(Cc1ccccc1Cl)C(N)=O Amb18332179 [0,1,0,0,0,0|3,0,0]=4 1415 B13R1.202 CN(Cc1ccccc1F)C(N)=O Amb18187071 [0,1,0,0,0,0|3,0,0]=4 1416 B13R1.202 CN(Cc1ccccc1O)C(N)=O Amb24387696 [0,1,0,0,0,0|3,0,0]=4 1417 B13R1.202 C[C@@H](Nc1[n]cccc1Br)C(O)=O Amb24769737 [0,1,0,0,0,0|3,0,0]=4 1418 B13R1.202 C[C@@H](Nc1[n]cccc1Cl)C(O)=O Amb24768993 [0,1,0,0,0,0|3,0,0]=4 1419 B13R1.202 C[C@@H](Nc1[n]cccc1F)C(O)=O Amb24525421 [0,1,0,0,0,0|3,0,0]=4 1420 B13R1.202 C[C@@H](Nc1[n]cccc1I)C(O)=O Amb25645232 [0,1,0,0,0,0|3,0,0]=4 1421 B13R1.202 C[C@@H](Nc1cc[n]cc1Br)C(O)=O Amb25645152 [0,1,0,0,0,0|3,0,0]=4 1422 B13R1.202 C[C@@H](Nc1cc[n]cc1Cl)C(O)=O Amb24459108 [0,1,0,0,0,0|3,0,0]=4 1423 B13R1.202 C[C@@H](Oc1ccccc1Br)C(O)=O Amb25156999 [0,1,0,0,0,0|2,0,0]=3 1424 B13R1.202 C[C@@H](Oc1ccccc1I)C(O)=O Amb22746581 [0,1,0,0,0,0|2,0,0]=3 1425 B13R1.202 C[C@H](Nc1[n]cccc1Br)C(O)=O Amb24612534 [0,1,0,0,0,0|3,0,0]=4 1426 B13R1.202 C[C@H](Nc1[n]cccc1Cl)C(O)=O Amb24695449 [0,1,0,0,0,0|3,0,0]=4 1427 B13R1.202 C[C@H](Nc1[n]cccc1F)C(O)=O Amb25728761 [0,1,0,0,0,0|3,0,0]=4 1428 B13R1.202 C[C@H](Nc1[n]cccc1I)C(O)=O Amb25644671 [0,1,0,0,0,0|3,0,0]=4 1429 B13R1.202 C[C@H](Nc1[n]cccc1O)C(O)=O Amb25234234 [0,1,0,0,0,0|3,0,0]=4 1430 B13R1.202 C[C@H](Nc1cc[n]cc1Cl)C(O)=O Amb24769719 [0,1,0,0,0,0|3,0,0]=4 1431 B13R1.202 C[C@H](Oc1ccccc1Br)C(O)=O Amb25775704 [0,1,0,0,0,0|2,0,0]=3 1432 B13R1.202 C[C@H](Oc1ccccc1Cl)C(O)=O Amb24434851 [0,1,0,0,0,0|2,0,0]=3 1433 B13R1.202 C[C@H](Oc1ccccc1I)C(O)=O Amb25783514 [0,1,0,0,0,0|2,0,0]=3 1434 B13R1.202 C\C(=C/c1ccccc1I)\C(O)=O Amb25755911 [0,1,0,0,0,0|1,0,2]=4 1435 B13R1.202 C\C(=C\c1ccccc1Cl)\C(O)=O Amb25696241 [0,1,0,0,0,0|1,0,2]=4 1436 B13R1.202 C\C(=C\c1ccccc1O)\C(O)=O Amb24710649 [0,1,0,0,0,0|1,0,2]=4 1437 B13R1.202 C\C(=N\c1ccccc1C)\C(O)=O Amb24567996 [0,1,0,0,0,0|2,0,1]=4 1438 B13R1.202 Cc1[n]cccc1CC(Br)C(N)=O Amb24530156 [0,1,0,0,0,0|3,0,0]=4 1439 B13R1.202 Cc1[n]cccc1CC(C)C(O)=O Amb25773491 [0,1,0,0,0,0|2,0,0]=3 1440 B13R1.202 Cc1[n]cccc1NC(C)C(O)=O Amb24677203 [0,1,0,0,0,0|3,0,0]=4 1441 B13R1.202 Cc1c[n]ccc1C[C@@H](N)C(O)=O Amb25063835 [0,1,0,0,0,0|1,0,0]=2 1442 B13R1.202 Cc1c[n]ccc1C[C@H](N)C(O)=O Amb24390165 [0,1,0,0,0,0|1,0,0]=2 1443 B13R1.202 Cc1c[n]ccc1NC(C)C(O)=O Amb25085437 [0,1,0,0,0,0|3,0,0]=4 1444 B13R1.202 Cc1cc[n]cc1CC(C)C(O)=O Amb25696863 [0,1,0,0,0,0|2,0,0]=3 1445 B13R1.202 Cc1cc[n]cc1CC(F)C(O)=O Amb25691783 [0,1,0,0,0,0|2,0,0]=3 1446 B13R1.202 Cc1cc[n]cc1C[C@@H](N)C(O)=O Amb25160627 [0,1,0,0,0,0|1,0,0]=2 1447 B13R1.202 Cc1cc[n]cc1C[C@H](N)C(O)=O Amb25791119 [0,1,0,0,0,0|1,0,0]=2 1448 B13R1.202 Cc1ccc[n]c1CC(C)C(C)=O Amb24455848 [0,1,0,0,0,0|3,0,0]=4 1449 B13R1.202 Cc1ccc[n]c1C[C@@H](N)C(O)=O Amb19149167 [0,1,0,0,0,0|1,0,0]=2 1450 B13R1.202 Cc1ccc[n]c1C[C@H](N)C(O)=O Amb24727924 [0,1,0,0,0,0|1,0,0]=2 1451 B13R1.202 Cc1ccc[n]c1SC(C)C(O)=O Amb18987727 [0,1,0,0,0,0|3,0,0]=4 1452 B13R1.202 Cc1ccccc1CC(Br)C(C)=O Amb25154824 [0,1,0,0,0,0|2,0,0]=3 1453 B13R1.202 Cc1ccccc1CC(Br)C(N)=O Amb25807893 [0,1,0,0,0,0|2,0,0]=3 1454 B13R1.202 Cc1ccccc1CC(Br)C(O)=O Amb23320597 [0,1,0,0,0,0|1,0,0]=2 1455 B13R1.202 Cc1ccccc1CC(C)C(N)=O Amb25363287 [0,1,0,0,0,0|2,0,0]=3 1456 B13R1.202 Cc1ccccc1CC(F)C(O)=O Amb24371582 [0,1,0,0,0,0|1,0,0]=2 1457 B13R1.202 Cc1ccccc1CC(N)C(C)F Amb25178536 [0,1,0,0,0,0|2,0,1]=4 1458 B13R1.202 Cc1ccccc1CC(N)C(F)F Amb25369105 [0,1,0,0,0,0|2,0,1]=4 1459 B13R1.202 Cc1ccccc1CC(O)C(C)=C Amb25316488 [0,1,0,0,0,0|3,0,0]=4 1460 B13R1.202 Cc1ccccc1CC(S)C(O)=O Amb18968267 [0,1,0,0,0,0|1,0,0]=2 1461 B13R1.202 Cc1ccccc1CN(C)C(N)=O Amb18186203 [0,1,0,0,0,0|3,0,0]=4 1462 B13R1.202 Cc1ccccc1C[C@@H](N)C(O)=O Amb22745584 [0,1,0,0,0,0|0,0,0]=1 1463 B13R1.202 Cc1ccccc1C[C@@H](O)C(O)=O Amb24355345 [0,1,0,0,0,0|1,0,0]=2 1464 B13R1.202 Cc1ccccc1C[C@H](N)C(O)=O Amb22262944 [0,1,0,0,0,0|0,0,0]=1 1465 B13R1.202 Cc1ccccc1C[C@H](O)C(O)=O Amb24726327 [0,1,0,0,0,0|1,0,0]=2 1466 B13R1.202 Cc1ccccc1NC(=N)C(O)=O Amb25210557 [0,1,0,0,0,0|1,0,2]=4 1467 B13R1.202 Cc1ccccc1NC(C)C(C)=O Amb24610623 [0,1,0,0,0,0|3,0,0]=4 1468 B13R1.202 Cc1ccccc1O[C@H](C)C(O)=O Amb25189815 [0,1,0,0,0,0|2,0,0]=3 1469 B13R1.202 Cc1ccccc1SC(C)C(C)=O Amb19051953 [0,1,0,0,0,0|3,0,0]=4 1470 B13R1.202 Cc1ccccc1\C=C(/S)\C(O)=O Amb24115487 [0,1,0,0,0,0|1,0,2]=4 1471 B13R1.202 ClC(=O)C(Oc1ccccc1Br)C Amb16230147 [0,1,0,0,0,0|3,0,0]=4 1472 B13R1.202 ClC(=O)C(Oc1ccccc1C)C Amb16230057 [0,1,0,0,0,0|3,0,0]=4 1473 B13R1.202 ClC(=O)C(Oc1ccccc1Cl)C Amb16230065 [0,1,0,0,0,0|3,0,0]=4 1474 B13R1.202 ClC(=O)C(Sc1ccccc1C)C Amb17143633 [0,1,0,0,0,0|3,0,0]=4 1475 B13R1.202 ClC(=O)C(Sc1ccccc1Cl)C Amb17144556 [0,1,0,0,0,0|3,0,0]=4 1476 B13R1.202 NC(=O)C(Br)Cc1ccccc1Br Amb24736819 [0,1,0,0,0,0|2,0,0]=3 1477 B13R1.202 NC(=O)C(Br)Cc1ccccc1Cl Amb25233847 [0,1,0,0,0,0|2,0,0]=3 1478 B13R1.202 NC(=O)C(Br)Cc1ccccc1F Amb24665254 [0,1,0,0,0,0|2,0,0]=3 1479 B13R1.202 NC(=O)C(Br)Cc1ccccc1I Amb25156078 [0,1,0,0,0,0|2,0,0]=3 1480 B13R1.202 NC(=O)C(Cc1ccccc1Br)Cl Amb17204831 [0,1,0,0,0,0|2,0,0]=3 1481 B13R1.202 NC(=O)C(Cc1ccccc1C)Cl Amb17204371 [0,1,0,0,0,0|2,0,0]=3 1482 B13R1.202 NC(=O)C(Cc1ccccc1Cl)Cl Amb17204473 [0,1,0,0,0,0|2,0,0]=3 1483 B13R1.202 NC(=O)C(Cc1ccccc1F)Cl Amb17204394 [0,1,0,0,0,0|2,0,0]=3 1484 B13R1.202 NC(=O)C(N)CN1C=CC=NC1=O Amb25073884 [0,1,0,0,0,0|3,0,0]=4 1485 B13R1.202 NC(=O)C(N)CN1C=CN=CC1=O Amb25740875 [0,1,0,0,0,0|3,0,0]=4 1486 B13R1.202 NC(=O)C(N)CN1C=NC=CC1=O Amb24492292 [0,1,0,0,0,0|3,0,0]=4 1487 B13R1.202 NC(=O)C(N)Cc1cc[n]cc1Cl Amb25109764 [0,1,0,0,0,0|2,0,0]=3 1488 B13R1.202 NC(=O)C(N)Cc1ccccc1Cl Amb25239223 [0,1,0,0,0,0|1,0,0]=2 1489 B13R1.202 NC(=O)C(O)Cc1ccccc1Cl Amb24425547 [0,1,0,0,0,0|2,0,0]=3 1490 B13R1.202 NC(=O)C(Sc1ccccc1C)C Amb17143160 [0,1,0,0,0,0|3,0,0]=4 1491 B13R1.202 NC(=O)C(Sc1ccccc1Cl)C Amb10363782 [0,1,0,0,0,0|3,0,0]=4 1492 B13R1.202 NC(=O)C(Sc1ccccc1F)C Amb10665503 [0,1,0,0,0,0|3,0,0]=4 1493 B13R1.202 NC(CC1=CN=CNC1=O)C(O)=O Amb24654941 [0,1,0,0,0,0|2,0,0]=3 1494 B13R1.202 NC(CN1C=CC=NC1=O)C(O)=O Amb24633901 [0,1,0,0,0,0|2,0,0]=3 1495 B13R1.202 NC(CN1C=CN=CC1=O)C(O)=O Amb24673866 [0,1,0,0,0,0|2,0,0]=3 1496 B13R1.202 NC(Cc1[n]cccc1Br)C(O)=O Amb25732428 [0,1,0,0,0,0|1,0,0]=2 1497 B13R1.202 NC(Cc1[n]cccc1Cl)C(O)=O Amb25778279 [0,1,0,0,0,0|1,0,0]=2 1498 B13R1.202 NC(Cc1[n]cccc1F)C(O)=O Amb24700457 [0,1,0,0,0,0|1,0,0]=2 1499 B13R1.202 NC(Cc1c[n]ccc1Br)C(O)=O Amb24697543 [0,1,0,0,0,0|1,0,0]=2 1500 B13R1.202 NC(Cc1cc[n]cc1O)C(O)=O Amb25703073 [0,1,0,0,0,0|1,0,0]=2 1501 B13R1.202 NC(Cc1ccccc1Br)C(F)F Amb25238069 [0,1,0,0,0,0|2,0,1]=4 1502 B13R1.202 NC(Cc1ccccc1Cl)C(O)=O Amb22723318 [0,1,0,0,0,0|0,0,0]=1 1503 B13R1.202 NC(Cc1ccccc1O)C(F)F Amb25350810 [0,1,0,0,0,0|2,0,1]=4 1504 B13R1.202 N[C@@H](CC1CCC=CC1=O)C(O)=O Amb24350487 [0,1,0,0,0,0|0,0,3]=4 1505 B13R1.202 N[C@@H](Cc1c[n]ccc1Br)C(O)=O Amb24342447 [0,1,0,0,0,0|1,0,0]=2 1506 B13R1.202 N[C@@H](Cc1cc[n]cc1Cl)C(O)=O Amb24655759 [0,1,0,0,0,0|1,0,0]=2 1507 B13R1.202 N[C@@H](Cc1cc[n]cc1F)C(O)=O Amb25836888 [0,1,0,0,0,0|1,0,0]=2 1508 B13R1.202 N[C@@H](Cc1cc[n]cc1O)C(O)=O Amb25789561 [0,1,0,0,0,0|1,0,0]=2 1509 B13R1.202 N[C@@H](Cc1ccc[n]c1Br)C(O)=O Amb24669163 [0,1,0,0,0,0|1,0,0]=2 1510 B13R1.202 N[C@@H](Cc1ccc[n]c1Cl)C(O)=O Amb25691465 [0,1,0,0,0,0|1,0,0]=2 1511 B13R1.202 N[C@@H](Cc1ccc[n]c1F)C(O)=O Amb25843771 [0,1,0,0,0,0|1,0,0]=2 1512 B13R1.202 N[C@@H](Cc1ccccc1Cl)C(O)=O Amb19930753 [0,1,0,0,0,0|0,0,0]=1 1513 B13R1.202 N[C@@H](Cc1ccccc1F)C(O)=O Amb22747108 [0,1,0,0,0,0|0,0,0]=1 1514 B13R1.202 N[C@@H](Cc1ccccc1I)C(O)=O Amb22228856 [0,1,0,0,0,0|0,0,0]=1 1515 B13R1.202 N[C@@H](Cc1ccccc1O)C(O)=O Amb23440357 [0,1,0,0,0,0|0,0,0]=1 1516 B13R1.202 N[C@@H](Cc1ccccc1S)C(O)=O Amb24535355 [0,1,0,0,0,0|0,0,0]=1 1517 B13R1.202 N[C@H](Cc1[n]cccc1F)C(O)=O Amb24670299 [0,1,0,0,0,0|1,0,0]=2 1518 B13R1.202 N[C@H](Cc1ccc[n]c1S)C(O)=O Amb24657292 [0,1,0,0,0,0|1,0,0]=2 1519 B13R1.202 N[C@H](Cc1ccccc1Cl)C(O)=O Amb19930752 [0,1,0,0,0,0|0,0,0]=1 1520 B13R1.202 N[C@H](Cc1ccccc1I)C(O)=O Amb22228855 [0,1,0,0,0,0|0,0,0]=1 1521 B13R1.202 N\C(=C\c1cc[n]cc1F)\C(O)=O Amb24644675 [0,1,0,0,0,0|1,0,2]=4 1522 B13R1.202 N\C(=C\c1ccccc1F)\C(O)=O Amb24353633 [0,1,0,0,0,0|0,0,2]=3 1523 B13R1.202 Nc1[n]cccc1CC(O)C(O)=O Amb25346691 [0,1,0,0,0,0|2,0,0]=3 1524 B13R1.202 Nc1[n]cccc1C[C@H](N)C(O)=O Amb24700456 [0,1,0,0,0,0|1,0,0]=2 1525 B13R1.202 Nc1c[n]ccc1CC(N)C(O)=O Amb25789484 [0,1,0,0,0,0|1,0,0]=2 1526 B13R1.202 Nc1cc[n]cc1CC(N)C(O)=O Amb24460737 [0,1,0,0,0,0|1,0,0]=2 1527 B13R1.202 Nc1cc[n]cc1C[C@H](N)C(O)=O Amb25744618 [0,1,0,0,0,0|1,0,0]=2 1528 B13R1.202 Nc1ccc[n]c1CC(N)C(O)=O Amb25128056 [0,1,0,0,0,0|1,0,0]=2 1529 B13R1.202 Nc1ccc[n]c1C[C@H](N)C(O)=O Amb24399638 [0,1,0,0,0,0|1,0,0]=2 1530 B13R1.202 Nc1ccc[n]c1SC(F)C(O)=O Amb24533937 [0,1,0,0,0,0|3,0,0]=4 1531 B13R1.202 Nc1ccccc1CC(N)C(O)=O Amb22002697 [0,1,0,0,0,0|0,0,0]=1 1532 B13R1.202 Nc1ccccc1C[C@@H](N)C(O)=O Amb22228579 [0,1,0,0,0,0|0,0,0]=1 1533 B13R1.202 Nc1ccccc1C[C@@H](N)C(O)=O Amb22757212 [0,1,0,0,0,0|0,0,0]=1 1534 B13R1.202 Nc1ccccc1C[C@H](N)C(O)=O Amb22228581 [0,1,0,0,0,0|0,0,0]=1 1535 B13R1.202 Nc1ccccc1NC(=O)C(O)=O Amb18954495 [0,1,0,0,0,0|2,0,1]=4 1536 B13R1.202 Nc1ccccc1SC(F)C(O)=O Amb25699447 [0,1,0,0,0,0|2,0,0]=3 1537 B13R1.202 OC(=O)C(=O)Cc1[n]cccc1Br Amb24547998 [0,1,0,0,0,0|2,0,1]=4 1538 B13R1.202 OC(=O)C(=O)Cc1ccccc1C Amb1125804 [0,1,0,0,0,0|1,0,1]=3 1539 B13R1.202 OC(=O)C(=O)Cc1ccccc1Cl Amb1135873 [0,1,0,0,0,0|1,0,1]=3 1540 B13R1.202 OC(=O)C(=O)Nc1ccccc1O Amb18128783 [0,1,0,0,0,0|2,0,1]=4 1541 B13R1.202 OC(=O)C(Br)Cc1ccccc1Br Amb22549389 [0,1,0,0,0,0|1,0,0]=2 1542 B13R1.202 OC(=O)C(Br)Cc1ccccc1F Amb22049841 [0,1,0,0,0,0|1,0,0]=2 1543 B13R1.202 OC(=O)C(Cc1ccccc1Br)C Amb17605816 [0,1,0,0,0,0|1,0,0]=2 1544 B13R1.202 OC(=O)C(Cc1ccccc1Br)Cl Amb17204843 [0,1,0,0,0,0|1,0,0]=2 1545 B13R1.202 OC(=O)C(Cc1ccccc1C)Cl Amb17204374 [0,1,0,0,0,0|1,0,0]=2 1546 B13R1.202 OC(=O)C(Cc1ccccc1C)O Amb17138948 [0,1,0,0,0,0|1,0,0]=2 1547 B13R1.202 OC(=O)C(Cc1ccccc1Cl)Br Amb2228490 [0,1,0,0,0,0|1,0,0]=2 1548 B13R1.202 OC(=O)C(Cc1ccccc1Cl)Cl Amb17204490 [0,1,0,0,0,0|1,0,0]=2 1549 B13R1.202 OC(=O)C(Cc1ccccc1Cl)O Amb17139822 [0,1,0,0,0,0|1,0,0]=2 1550 B13R1.202 OC(=O)C(Cc1ccccc1F)Cl Amb17204397 [0,1,0,0,0,0|1,0,0]=2 1551 B13R1.202 OC(=O)C(Cc1ccccc1F)O Amb17139079 [0,1,0,0,0,0|1,0,0]=2 1552 B13R1.202 OC(=O)C(Cc1ccccc1O)C Amb10844200 [0,1,0,0,0,0|1,0,0]=2 1553 B13R1.202 OC(=O)C(Cl)CN1C=CC=CC1=O Amb25156207 [0,1,0,0,0,0|2,0,0]=3 1554 B13R1.202 OC(=O)C(Cl)CN1C=NC=CC1=O Amb25190598 [0,1,0,0,0,0|3,0,0]=4 1555 B13R1.202 OC(=O)C(Cl)CN1N=CC=CC1=O Amb25039010 [0,1,0,0,0,0|3,0,0]=4 1556 B13R1.202 OC(=O)C(F)Oc1ccccc1Br Amb25694498 [0,1,0,0,0,0|2,0,0]=3 1557 B13R1.202 OC(=O)C(F)Oc1ccccc1I Amb25137575 [0,1,0,0,0,0|2,0,0]=3 1558 B13R1.202 OC(=O)C(F)Sc1ccccc1Br Amb24685422 [0,1,0,0,0,0|2,0,0]=3 1559 B13R1.202 OC(=O)C(F)Sc1ccccc1F Amb24759857 [0,1,0,0,0,0|2,0,0]=3 1560 B13R1.202 OC(=O)C(Nc1ncccc1Cl)C Amb1109673 [0,1,0,0,0,0|3,0,0]=4 1561 B13R1.202 OC(=O)C(O)Cc1[n]cccc1Br Amb24669896 [0,1,0,0,0,0|2,0,0]=3 1562 B13R1.202 OC(=O)C(O)Cc1cc[n]cc1Cl Amb25718576 [0,1,0,0,0,0|2,0,0]=3 1563 B13R1.202 OC(=O)C(O)Cc1ccc[n]c1F Amb25266041 [0,1,0,0,0,0|2,0,0]=3 1564 B13R1.202 OC(=O)C(Oc1ccccc1F)C Amb1115526 [0,1,0,0,0,0|2,0,0]=3 1565 B13R1.202 OC(=O)C(Oc1ccccc1N)C Amb17110011 [0,1,0,0,0,0|2,0,0]=3 1566 B13R1.202 OC(=O)C(S)Cc1ccccc1Cl Amb25790557 [0,1,0,0,0,0|1,0,0]=2 1567 B13R1.202 OC(=O)C(Sc1ccccc1Br)C Amb1115761 [0,1,0,0,0,0|2,0,0]=3 1568 B13R1.202 OC(=O)C(Sc1ccccc1Cl)C Amb1126189 [0,1,0,0,0,0|2,0,0]=3 1569 B13R1.202 OC(=O)C(Sc1ccccc1F)C Amb1112319 [0,1,0,0,0,0|2,0,0]=3 1570 B13R1.202 OC(=O)C(Sc1ccccc1N)C Amb17305614 [0,1,0,0,0,0|2,0,0]=3 1571 B13R1.202 OC(=O)C([SeH])Cc1ccccc1Cl Amb24192807 [0,1,0,0,0,0|1,0,0]=2 1572 B13R1.202 OC(=O)[C@@H](Cc1ccccc1C)C Amb10844135 [0,1,0,0,0,0|1,0,0]=2 1573 B13R1.202 OC(=O)[C@@H](Cc1ccccc1Cl)C Amb10844130 [0,1,0,0,0,0|1,0,0]=2 1574 B13R1.202 OC(=O)[C@@H](Nc1ccccc1C)C Amb16231747 [0,1,0,0,0,0|2,0,0]=3 1575 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1Cl Amb24469361 [0,1,0,0,0,0|1,0,0]=2 1576 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1F Amb25708392 [0,1,0,0,0,0|1,0,0]=2 1577 B13R1.202 OC(=O)[C@H](Cc1ccccc1C)C Amb10844136 [0,1,0,0,0,0|1,0,0]=2 1578 B13R1.202 OC(=O)[C@H](Cc1ccccc1Cl)C Amb10844213 [0,1,0,0,0,0|1,0,0]=2 1579 B13R1.202 OC(=O)\C(=C/c1ccccc1Cl)\S Amb2550971 [0,1,0,0,0,0|1,0,2]=4 1580 B13R1.202 OC(=O)\C(\Cl)=C\c1ccccc1Cl Amb25063158 [0,1,0,0,0,0|1,0,2]=4 1581 B13R1.202 OC(=O)\C(\F)=C\c1ccccc1Cl Amb25256125 [0,1,0,0,0,0|1,0,2]=4 1582 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1Cl Amb18657758 [0,1,0,0,0,0|1,0,2]=4 1583 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1F Amb24495340 [0,1,0,0,0,0|1,0,2]=4 1584 B13R1.202 Oc1ccccc1CC(Cl)C(O)=O Amb25819837 [0,1,0,0,0,0|1,0,0]=2 1585 B13R1.202 Oc1ccccc1CC(F)C(O)=O Amb24518926 [0,1,0,0,0,0|1,0,0]=2 1586 B13R1.202 Oc1ccccc1CC(O)C(O)=O Amb24692674 [0,1,0,0,0,0|1,0,0]=2 1587 B13R1.202 Oc1ccccc1CC(S)C(O)=O Amb25805650 [0,1,0,0,0,0|1,0,0]=2 1588 B13R1.202 Oc1ccccc1C[C@H](O)C(O)=O Amb25065347 [0,1,0,0,0,0|1,0,0]=2 1589 B13R1.202 Oc1ccccc1\C=C(/Cl)\C(O)=O Amb25701738 [0,1,0,0,0,0|1,0,2]=4 1590 B13R1.353 C=C(Cc1ccccc1)S(O)(=O)=O Amb22364611 [0,1,0,0,0,0|2,0,1]=4 1591 B13R1.353 CC(C)(C)C(N)Cc1ccccc1 Amb18968296 [0,1,0,0,0,0|2,0,1]=4 1592 B13R1.353 CC(C)(C)C(N)Cc1ccccc1 Amb19374190 [0,1,0,0,0,0|2,0,1]=4 1593 B13R1.353 CC(C)(F)[C@@H](N)Cc1ccccc1 Amb25158564 [0,1,0,0,0,0|2,0,1]=4 1594 B13R1.353 CC(C)(O)C(O)Cc1ccccc1 Amb25330272 [0,1,0,0,0,0|2,0,1]=4 1595 B13R1.353 CC(C)(O)[C@@H](N)Cc1ccccc1 Amb24652643 [0,1,0,0,0,0|1,0,1]=3 1596 B13R1.353 CC(C)(O)[C@@H](O)Cc1ccccc1 Amb24495857 [0,1,0,0,0,0|2,0,1]=4 1597 B13R1.353 CC(C)(O)[C@H](N)Cc1ccccc1 Amb24359085 [0,1,0,0,0,0|1,0,1]=3 1598 B13R1.353 CC(C)(O)[C@H](O)Cc1ccccc1 Amb25306390 [0,1,0,0,0,0|2,0,1]=4 1599 B13R1.353 CC(Cc1ccccc1)S(N)(=O)=O Amb18316776 [0,1,0,0,0,0|2,0,1]=4 1600 B13R1.353 CC(F)(F)[C@@H](N)Cc1ccccc1 Amb25798240 [0,1,0,0,0,0|2,0,1]=4 1601 B13R1.353 CP(O)(=O)C(N)Cc1ccccc1 Amb22450960 [0,1,0,0,0,0|1,0,0]=2 1602 B13R1.353 CS(=O)(=O)N(N)Cc1ccccc1 Amb24530171 [0,1,0,0,0,0|2,0,1]=4 1603 B13R1.353 NC(C(F)(F)F)Cc1ccccc1 Amb10839109 [0,1,0,0,0,0|2,0,1]=4 1604 B13R1.353 NC(Cc1c[n]ccc1)P(O)(O)=O Amb25267553 [0,1,0,0,0,0|2,0,0]=3 1605 B13R1.353 NC(Cc1ccccc1)C(F)(F)F Amb22343154 [0,1,0,0,0,0|2,0,1]=4 1606 B13R1.353 NC(Cc1ccccc1)S(O)(=O)=O Amb25103708 [0,1,0,0,0,0|1,0,0]=2 1607 B13R1.353 N[C@@H](Cc1ccccc1)C(F)(F)F Amb19889267 [0,1,0,0,0,0|2,0,1]=4 1608 B13R1.353 N[C@@H](P(=O)(O)O)Cc1ccccc1 Amb10069963 [0,1,0,0,0,0|1,0,0]=2 1609 B13R1.353 N[C@H](Cc1ccccc1)C(F)(F)F Amb19889268 [0,1,0,0,0,0|2,0,1]=4 1610 B13R1.353 N[C@H](P(=O)(O)O)Cc1ccccc1 Amb10069962 [0,1,0,0,0,0|1,0,0]=2 1611 B13R1.353 N\C(=N/c1ccccc1)\S(O)(=O)=O Amb24399284 [0,1,0,0,0,0|2,0,1]=4 1612 B13R1.353 [2H]C([2H])([2H])[C@@H](N)Cc1ccccc1 Amb19130511 [0,1,0,0,0,0|2,0,1]=4 1613 B13R1.353 [O-]S(=O)(=O)C(O)Cc1ccccc1 Amb22475703 [0,1,0,0,0,0|2,0,1]=4 1614 B13R1.418 C=CC(Nc1ccccc1)C(O)=O Amb24361245 [0,1,0,0,0,0|2,0,0]=3 1615 B13R1.418 C=C\C(=C/c1ccccc1)\C(O)=O Amb18127222 [0,1,0,0,0,0|1,0,2]=4 1616 B13R1.418 CC(=O)C(=[N+]=[N-])Cc1ccccc1 Amb17594403 [0,1,0,0,0,0|1,0,2]=4 1617 B13R1.418 CC(=O)C(Cc1ccccc1)=CN Amb17777847 [0,1,0,0,0,0|1,0,1]=3 1618 B13R1.418 CC(=O)C(Cc1ccccc1)C#N Amb24492583 [0,1,0,0,0,0|1,0,1]=3 1619 B13R1.418 CC(=O)[C@@H](CC)Nc1ccccc1 Amb25690329 [0,1,0,0,0,0|3,0,0]=4 1620 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947890 [0,1,0,0,0,0|2,0,1]=4 1621 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947891 [0,1,0,0,0,0|2,0,1]=4 1622 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\C Amb24364205 [0,1,0,0,0,0|2,0,1]=4 1623 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\N Amb25273959 [0,1,0,0,0,0|1,0,1]=3 1624 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\O Amb24752497 [0,1,0,0,0,0|2,0,1]=4 1625 B13R1.418 CC(=O)\C(\Cc1ccccc1)=N\O Amb24620100 [0,1,0,0,0,0|1,0,2]=4 1626 B13R1.418 CCC(C(=O)C)Cc1ccccc1 Amb17233201 [0,1,0,0,0,0|2,0,0]=3 1627 B13R1.418 CCC(Nc1ccc[n]c1)C(O)=O Amb24400047 [0,1,0,0,0,0|3,0,0]=4 1628 B13R1.418 CCC(Nc1ccccc1)C(N)=O Amb19007446 [0,1,0,0,0,0|3,0,0]=4 1629 B13R1.418 CCC(Oc1ccccc1)C(=O)Cl Amb22274837 [0,1,0,0,0,0|3,0,0]=4 1630 B13R1.418 CCN(C(=O)Cl)Cc1ccccc1 Amb17563084 [0,1,0,0,0,0|3,0,0]=4 1631 B13R1.418 CC\C(=C\c1ccccc1)\C(O)=O Amb24702993 [0,1,0,0,0,0|1,0,2]=4 1632 B13R1.418 CN[C@@H](C(=O)O)Cc1ccccc1 Amb16183857 [0,1,0,0,0,0|0,0,0]=1 1633 B13R1.418 CN[C@@H](Cc1ccccc1)C(O)=O Amb22744994 [0,1,0,0,0,0|0,0,0]=1 1634 B13R1.418 CN[C@H](C(=O)O)Cc1ccccc1 Amb10604038 [0,1,0,0,0,0|0,0,0]=1 1635 B13R1.418 COC(Cc1ccccc1)C(O)=O Amb18128650 [0,1,0,0,0,0|1,0,0]=2 1636 B13R1.418 CON(Cc1ccccc1)C(=O)Cl Amb24564167 [0,1,0,0,0,0|3,0,0]=4 1637 B13R1.418 CON(Cc1ccccc1)C(N)=O Amb24529724 [0,1,0,0,0,0|3,0,0]=4 1638 B13R1.418 CO[C@@H](Cc1ccccc1)C(O)=O Amb22747352 [0,1,0,0,0,0|1,0,0]=2 1639 B13R1.418 CO\C(=C/c1ccccc1)\C(=O)O Amb1945718 [0,1,0,0,0,0|1,0,2]=4 1640 B13R1.418 CS\C(=C\c1ccccc1)\C(O)=O Amb18130097 [0,1,0,0,0,0|1,0,2]=4 1641 B13R1.418 C\C=C(/Sc1ccccc1)\C(O)=O Amb18651957 [0,1,0,0,0,0|2,0,1]=4 1642 B13R1.418 C\C=C(\Cc1ccccc1)/C(N)=O Amb25268913 [0,1,0,0,0,0|2,0,1]=4 1643 B13R1.418 C\C=C(\Cc1ccccc1)/C(O)=O Amb24711241 [0,1,0,0,0,0|1,0,1]=3 1644 B13R1.418 N#CC(=Cc1ccccc1)C(=O)O Amb17224284 [0,1,0,0,0,0|0,0,3]=4 1645 B13R1.418 N#CC(C(=O)O)Cc1ccccn1 Amb17090107 [0,1,0,0,0,0|1,0,1]=3 1646 B13R1.418 N#CC(C(=O)O)Cc1cccnc1 Amb17090108 [0,1,0,0,0,0|1,0,1]=3 1647 B13R1.418 N#CC(C(=O)O)Cc1ccncc1 Amb17090109 [0,1,0,0,0,0|1,0,1]=3 1648 B13R1.418 N#CC(C(=S)N)Cc1ccccc1 Amb10789421 [0,1,0,0,0,0|1,1,1]=4 1649 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb1207396 [0,1,0,0,0,0|0,0,3]=4 1650 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb16205839 [0,1,0,0,0,0|0,0,3]=4 1651 B13R1.418 NC(=O)C(C#N)Sc1ccccc1 Amb25264438 [0,1,0,0,0,0|2,0,1]=4 1652 B13R1.418 NC(=O)C(Cc1ccc[n]c1)C#N Amb24470020 [0,1,0,0,0,0|2,0,1]=4 1653 B13R1.418 NC(=O)C(Cc1ccccc1)C#N Amb18795265 [0,1,0,0,0,0|1,0,1]=3 1654 B13R1.418 NC(=O)N(Cc1ccccc1)N=O Amb24710298 [0,1,0,0,0,0|2,0,1]=4 1655 B13R1.418 NC(=O)\C(\Cc1ccccc1)=C\Cl Amb25300288 [0,1,0,0,0,0|2,0,1]=4 1656 B13R1.418 NCC(C(C)C)Cc1ccccc1 Amb17233325 [0,1,0,0,0,0|2,0,1]=4 1657 B13R1.418 NCC(Cc1c[n]ccc1)C(O)=O Amb19373762 [0,1,0,0,0,0|1,0,0]=2 1658 B13R1.418 NCC(Cc1cccc[n]1)C(O)=O Amb19343541 [0,1,0,0,0,0|1,0,0]=2 1659 B13R1.418 NCC(Cc1ccccc1)=C(F)F Amb25696506 [0,1,0,0,0,0|2,0,1]=4 1660 B13R1.418 NCC(Cc1ccccc1)C(O)=O Amb19148058 [0,1,0,0,0,0|0,0,0]=1 1661 B13R1.418 NCC(Nc1ccccc1)C(O)=O Amb25698485 [0,1,0,0,0,0|1,0,0]=2 1662 B13R1.418 NC[C@@H](Cc1ccccc1)C(O)=O Amb22745974 [0,1,0,0,0,0|0,0,0]=1 1663 B13R1.418 NC[C@@H](Cc1ccccc1)C(O)=O Amb22745975 [0,1,0,0,0,0|0,0,0]=1 1664 B13R1.418 NC\C(=C/c1ccccc1)\C(O)=O Amb24526933 [0,1,0,0,0,0|0,0,2]=3 1665 B13R1.418 NC\C(=C\c1cc[n]cc1)\C(O)=O Amb25322106 [0,1,0,0,0,0|1,0,2]=4 1666 B13R1.418 NO[C@@H](C(=O)O)Cc1ccccc1 Amb10070584 [0,1,0,0,0,0|0,0,0]=1 1667 B13R1.418 NO[C@H](C(=O)O)Cc1ccccc1 Amb10070583 [0,1,0,0,0,0|0,0,0]=1 1668 B13R1.418 OC(=O)C(CO)Nc1cccc[n]1 Amb25256223 [0,1,0,0,0,0|3,0,0]=4 1669 B13R1.418 OC(=O)C(CO)Nc1ccccc1 Amb25684833 [0,1,0,0,0,0|2,0,0]=3 1670 B13R1.418 OC(=O)[C@H](CS)Nc1cccc[n]1 Amb25189963 [0,1,0,0,0,0|3,0,0]=4 1671 B13R1.418 OC(=O)\C(=C\Cl)\Oc1ccccc1 Amb24627055 [0,1,0,0,0,0|2,0,1]=4 1672 B13R1.418 OC(=O)\C(\CBr)=C\c1ccccc1 Amb22360134 [0,1,0,0,0,0|1,0,2]=4 1673 B13R1.418 OC(=O)\C(\CCl)=C\c1ccccc1 Amb24635754 [0,1,0,0,0,0|1,0,2]=4 1674 B13R1.418 OC(=O)\C(\CO)=C/c1ccccc1 Amb20671516 [0,1,0,0,0,0|1,0,2]=4 1675 B13R1.418 OC(=O)\C(\Cc1cc[n]cc1)=N/O Amb23603652 [0,1,0,0,0,0|1,0,2]=4 1676 B13R1.418 OC(=O)\C(\Cc1ccc[n]c1)=N/O Amb23603650 [0,1,0,0,0,0|1,0,2]=4 1677 B13R1.418 OC(=O)\C(\Cc1cccc[n]1)=N/O Amb23603651 [0,1,0,0,0,0|1,0,2]=4 1678 B13R1.418 [NH3+]OC(Cc1ccccc1)C(O)=O Amb22471708 [0,1,0,0,0,0|0,0,1]=2 1679 B13R1.1073 CC(=C)C(C)(O)Cc1ccccc1 Amb25244657 [0,1,0,0,0,0|3,0,0]=4 1680 B13R1.1073 CC(=O)C(C)(C)Nc1ccccc1 Amb25293761 [0,1,0,0,0,0|3,0,0]=4 1681 B13R1.1073 CC(=O)C(C)(O)Cc1ccccc1 Amb22641853 [0,1,0,0,0,0|2,0,0]=3 1682 B13R1.1073 CC(=O)[C@](C)(N)Cc1ccccc1 Amb25732573 [0,1,0,0,0,0|1,0,0]=2 1683 B13R1.1073 CC(C)(C[n+]1ccccc1)C(O)=O Amb25326073 [0,1,0,0,0,0|2,0,0]=3 1684 B13R1.1073 CC(C)(Cc1[n]ccc[n]1)C(O)=O Amb24489880 [0,1,0,0,0,0|3,0,0]=4 1685 B13R1.1073 CC(C)(Cc1cc[n]cc1)C(O)=O Amb18065826 [0,1,0,0,0,0|2,0,0]=3 1686 B13R1.1073 CC(C)(Cc1ccc[n]c1)C(O)=O Amb18065825 [0,1,0,0,0,0|2,0,0]=3 1687 B13R1.1073 CC(C)(Cc1cccc[n]1)C(O)=O Amb18065824 [0,1,0,0,0,0|2,0,0]=3 1688 B13R1.1073 CC(C)(Nc1cc[n]cc1)C(O)=O Amb18974106 [0,1,0,0,0,0|3,0,0]=4 1689 B13R1.1073 CC(C)(Nc1ccc[n]c1)C(O)=O Amb23559812 [0,1,0,0,0,0|3,0,0]=4 1690 B13R1.1073 CC(C)(Nc1cccc[n]1)C(O)=O Amb18254760 [0,1,0,0,0,0|3,0,0]=4 1691 B13R1.1073 CC(C)(Nc1ccccc1)P(O)=O Amb24648751 [0,1,0,0,0,0|3,0,0]=4 1692 B13R1.1073 CC(C)(Oc1ccccc1)C([O-])=O Amb17934254 [0,1,0,0,0,0|2,0,1]=4 1693 B13R1.1073 CC(C)(Sc1cc[n]cc1)C(O)=O Amb25765775 [0,1,0,0,0,0|3,0,0]=4 1694 B13R1.1073 CC(C)(Sc1cccc[n]1)C(O)=O Amb18976793 [0,1,0,0,0,0|3,0,0]=4 1695 B13R1.1073 CC(Cl)(Oc1ccccc1)C(O)=O Amb25289059 [0,1,0,0,0,0|2,0,0]=3 1696 B13R1.1073 CC(N)(Cc1c[n]cc[n]1)C(O)=O Amb24492308 [0,1,0,0,0,0|2,0,0]=3 1697 B13R1.1073 CC(N)(Cc1ccccc1)C(N)=O Amb19001791 [0,1,0,0,0,0|1,0,0]=2 1698 B13R1.1073 CC(O)(Cc1ccccc1)C(N)=O Amb18791028 [0,1,0,0,0,0|2,0,0]=3 1699 B13R1.1073 CC(O)(Oc1ccccc1)C(O)=O Amb24563350 [0,1,0,0,0,0|2,0,0]=3 1700 B13R1.1073 CC(O)C(C)(O)Cc1ccccc1 Amb25220957 [0,1,0,0,0,0|2,0,1]=4 1701 B13R1.1073 CC(S)(Cc1ccccc1)C(O)=O Amb24739779 [0,1,0,0,0,0|1,0,0]=2 1702 B13R1.1073 C[C@@](O)(Cc1ccccc1)C(N)=O Amb24727083 [0,1,0,0,0,0|2,0,0]=3 1703 B13R1.1073 C[C@@](S)(Cc1ccccc1)C(O)=O Amb25697193 [0,1,0,0,0,0|1,0,0]=2 1704 B13R1.1073 C[C@H](O)C(C)(C)Cc1ccccc1 Amb25831883 [0,1,0,0,0,0|2,0,1]=4 1705 B13R1.1073 C[C@](N)(Cc1ccccc1)C(N)=O Amb25108507 [0,1,0,0,0,0|1,0,0]=2 1706 B13R1.1073 ClC(=O)C(Oc1ccccc1)(C)C Amb16230100 [0,1,0,0,0,0|3,0,0]=4 1707 B13R1.1073 ClC(=O)C(Sc1ccccc1)(C)C Amb17143637 [0,1,0,0,0,0|3,0,0]=4 1708 B13R1.1073 NC(=O)C(Cc1ccccc1)(C)C Amb16939814 [0,1,0,0,0,0|2,0,0]=3 1709 B13R1.1073 NC(=O)C(Cl)(Cl)Cc1ccccc1 Amb25084603 [0,1,0,0,0,0|2,0,0]=3 1710 B13R1.1073 NC(=O)C(F)(F)Cc1ccc[n]c1 Amb22284726 [0,1,0,0,0,0|3,0,0]=4 1711 B13R1.1073 NC(=O)C(F)(F)Cc1ccccc1 Amb24440135 [0,1,0,0,0,0|2,0,0]=3 1712 B13R1.1073 NC(=O)C(F)(F)Oc1ccccc1 Amb25101676 [0,1,0,0,0,0|3,0,0]=4 1713 B13R1.1073 NC(=O)C(F)(F)Sc1ccccc1 Amb24568957 [0,1,0,0,0,0|3,0,0]=4 1714 B13R1.1073 NC(=O)C(Nc1ccccc1)(C)C Amb1394882 [0,1,0,0,0,0|3,0,0]=4 1715 B13R1.1073 NC(=O)C(Oc1ccccc1)(C)C Amb17142977 [0,1,0,0,0,0|3,0,0]=4 1716 B13R1.1073 NC(=O)C(Sc1ccccc1)(C)C Amb17143164 [0,1,0,0,0,0|3,0,0]=4 1717 B13R1.1073 NC(=S)C(Cc1ccccc1)(C)C Amb17466450 [0,1,0,0,0,0|2,1,0]=4 1718 B13R1.1073 NC(N)(Cc1ccccc1)C(O)=O Amb25779175 [0,1,0,0,0,0|0,0,0]=1 1719 B13R1.1073 O=C(Cl)C(F)(F)Cc1ccccc1 Amb25071235 [0,1,0,0,0,0|2,0,0]=3 1720 B13R1.1073 OC(=O)C(Cc1ccccc1)(O)C Amb10067052 [0,1,0,0,0,0|1,0,0]=2 1721 B13R1.1073 OC(=O)C(Cc1ccccn1)(N)C Amb17400758 [0,1,0,0,0,0|1,0,0]=2 1722 B13R1.1073 OC(=O)C(Cc1cccnc1)(N)C Amb17233667 [0,1,0,0,0,0|1,0,0]=2 1723 B13R1.1073 OC(=O)C(Cc1ccncc1)(N)C Amb17400763 [0,1,0,0,0,0|1,0,0]=2 1724 B13R1.1073 OC(=O)C(F)(F)Cc1cc[n]cc1 Amb24586446 [0,1,0,0,0,0|2,0,0]=3 1725 B13R1.1073 OC(=O)C(F)(F)Oc1ccc[n]c1 Amb18294830 [0,1,0,0,0,0|3,0,0]=4 1726 B13R1.1073 OC(=O)C(F)(F)Sc1cccc[n]1 Amb23586510 [0,1,0,0,0,0|3,0,0]=4 1727 B13R1.1073 OC(=O)C(O)(O)Cc1ccccc1 Amb25100992 [0,1,0,0,0,0|1,0,0]=2 1728 B13R1.1073 OC(=O)C(S)(S)Cc1cccc[n]1 Amb25289205 [0,1,0,0,0,0|2,0,0]=3 1729 B13R1.1073 OC(=O)C(S)(S)Cc1ccccc1 Amb24087878 [0,1,0,0,0,0|1,0,0]=2 1730 B13R1.1073 OC(=O)[C@@](Cc1ccccc1)(O)C Amb10067053 [0,1,0,0,0,0|1,0,0]=2 1731 B13R1.6154 N[C@@H](CC1(O)CC=CC=C1)C(O)=O Amb24651040 [0,1,0,0,0,0|0,0,2]=3 1732 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [0,0,0,1,0,0|3,0,0]=4 1733 B13R2.27 O=C1CC[C@@H]1Cc2ccccc2 Amb25792997 [0,0,0,1,0,0|2,0,0]=3 1734 B13R2.27 O=C1NCC1Sc2ccccc2 Amb25084609 [0,0,0,1,0,0|3,0,0]=4 1735 B13R2.27 O=C1NC[C@@H]1Cc2ccccc2 Amb24711591 [0,0,0,1,0,0|2,0,0]=3 1736 B13R2.27 O=C1NC[C@H]1Sc2ccccc2 Amb24497005 [0,0,0,1,0,0|3,0,0]=4 1737 B13R2.197 C[C@]1(Cc2ccccc2)OC1Cl Amb25238350 [0,0,0,1,0,0|2,0,1]=4 1738 B13R2.359 OC1(O)C(O)Cc2ccccc12 Amb25077985 [0,0,0,1,0,0|1,0,2]=4 1739 B13R2.369 C=C1Cc2ccccc2NC1=O Amb25263953 [0,0,0,1,0,0|2,0,1]=4 1740 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,0,0,1,0,0|1,0,2]=4 1741 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,0,0,1,0,0|2,0,1]=4 1742 B13R2.369 CC1Cc2ccc[n]c2NC1=O Amb24596349 [0,0,0,1,0,0|3,0,0]=4 1743 B13R2.369 CC1Cc2ccccc2OC1=O Amb24484179 [0,0,0,1,0,0|1,0,0]=2 1744 B13R2.369 CC1N=C2C=CC=CC2=CC1=O Amb24061572 [0,0,0,1,0,0|3,0,0]=4 1745 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,0,0,1,0,0|3,0,0]=4 1746 B13R2.369 CC1Oc2ccccc2CC1=O Amb24583554 [0,0,0,1,0,0|3,0,0]=4 1747 B13R2.369 CC1Oc2ccccc2CC1N Amb18645891 [0,0,0,1,0,0|1,0,1]=3 1748 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,0,0,1,0,0|3,0,0]=4 1749 B13R2.369 C[C@@H]1Cc2ccccc2NC1=O Amb25795819 [0,0,0,1,0,0|2,0,0]=3 1750 B13R2.369 C[C@@H]1Nc2ccccc2NC1=O Amb24382630 [0,0,0,1,0,0|3,0,0]=4 1751 B13R2.369 C[C@H]1Cc2ccccc2NC1=O Amb25707457 [0,0,0,1,0,0|2,0,0]=3 1752 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,0,0,1,0,0|3,0,0]=4 1753 B13R2.369 C[C@H]1Nc2ccccc2OC1=O Amb25152544 [0,0,0,1,0,0|2,0,0]=3 1754 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,0,0,1,0,0|1,0,2]=4 1755 B13R2.369 NC1=Cc2ccccc2NC1=O Amb18563072 [0,0,0,1,0,0|1,0,2]=4 1756 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,0,0,1,0,0|0,0,2]=3 1757 B13R2.369 NC1=Nc2ccccc2OC1=N Amb25373848 [0,0,0,1,0,0|2,0,1]=4 1758 B13R2.369 NC1=Nc2ccccc2OC1=O Amb18645599 [0,0,0,1,0,0|1,0,1]=3 1759 B13R2.369 NC1=Nc2ccccc2SC1=O Amb25150924 [0,0,0,1,0,0|1,1,1]=4 1760 B13R2.369 NC1Cc2[n]cccc2NC1=O Amb20241349 [0,0,0,1,0,0|2,0,0]=3 1761 B13R2.369 NC1Cc2c[n]ccc2NC1=O Amb20241350 [0,0,0,1,0,0|2,0,0]=3 1762 B13R2.369 NC1Cc2ccc[n]c2NC1=O Amb23571829 [0,0,0,1,0,0|2,0,0]=3 1763 B13R2.369 NC1Cc2ccccc2CC1N Amb24537649 [0,0,0,1,0,0|2,0,1]=4 1764 B13R2.369 NC1Cc2ccccc2CC1O Amb18645890 [0,0,0,1,0,0|1,0,1]=3 1765 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,0,0,1,0,0|0,0,0]=1 1766 B13R2.369 NC1Nc2ccccc2NC1=O Amb24085791 [0,0,0,1,0,0|2,0,0]=3 1767 B13R2.369 NN1Cc2ccccc2CC1=O Amb18645670 [0,0,0,1,0,0|2,0,0]=3 1768 B13R2.369 N[C@@H]1Cc2ccccc2C[C@@H]1O Amb24634303 [0,0,0,1,0,0|1,0,1]=3 1769 B13R2.369 N[C@H]1Cc2ccccc2C[C@@H]1O Amb24692977 [0,0,0,1,0,0|1,0,1]=3 1770 B13R2.369 N[C@H]1Cc2ccccc2NC1=O Amb25212947 [0,0,0,1,0,0|1,0,0]=2 1771 B13R2.369 N[C@H]1Oc2ccccc2C[C@H]1O Amb25179222 [0,0,0,1,0,0|2,0,1]=4 1772 B13R2.369 Nc1cc2ccccc2[n]c1O Amb18645300 [0,0,0,1,0,0|1,0,2]=4 1773 B13R2.369 Nc1nc2ccccc2nc1O Amb1086511 [0,0,0,1,0,0|2,0,1]=4 1774 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,0,0,1,0,0|2,0,1]=4 1775 B13R2.369 O=C1Nc2ccccc2CC1=O Amb24497058 [0,0,0,1,0,0|2,0,1]=4 1776 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,0,0,1,0,0|2,0,0]=3 1777 B13R2.369 O=C1Nc2ccccc2CC1C Amb10604462 [0,0,0,1,0,0|2,0,0]=3 1778 B13R2.369 O=C1Nc2ccccc2CC1Cl Amb22739973 [0,0,0,1,0,0|2,0,0]=3 1779 B13R2.369 O=C1Nc2ccccc2CC1N Amb10975380 [0,0,0,1,0,0|1,0,0]=2 1780 B13R2.369 O=C1Nc2ccccc2CC1N Amb2196732 [0,0,0,1,0,0|1,0,0]=2 1781 B13R2.369 O=C1Nc2ccccc2OC1C Amb2568450 [0,0,0,1,0,0|3,0,0]=4 1782 B13R2.369 O=C1Nc2ccccc2SC1Cl Amb25751175 [0,0,0,1,0,0|3,0,0]=4 1783 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,0,0,1,0,0|1,0,2]=4 1784 B13R2.369 O=C1Oc2ccccc2C=C1Cl Amb19517278 [0,0,0,1,0,0|1,0,2]=4 1785 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,0,0,1,0,0|1,0,2]=4 1786 B13R2.369 O=C1Oc2ccccc2CC1=O Amb22755081 [0,0,0,1,0,0|1,0,1]=3 1787 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,0,0,1,0,0|2,0,1]=4 1788 B13R2.369 O=C1Oc2ccccc2NC1=O Amb19650977 [0,0,0,1,0,0|2,0,1]=4 1789 B13R2.369 O=C1Oc2ccccc2NC1C Amb17217247 [0,0,0,1,0,0|2,0,0]=3 1790 B13R2.369 O=C1Oc2ccccc2OC1=O Amb20663468 [0,0,0,1,0,0|2,0,1]=4 1791 B13R2.369 O=C1Sc2ccccc2CC1=O Amb24497321 [0,0,0,1,0,0|1,1,1]=4 1792 B13R2.369 O=c1oc2ccccc2cc1N Amb1967145 [0,0,0,1,0,0|0,0,2]=3 1793 B13R2.369 OC1=Cc2ccccc2OC1=O Amb18511465 [0,0,0,1,0,0|1,0,2]=4 1794 B13R2.369 OC1=Nc2ccccc2OC1=O Amb22494623 [0,0,0,1,0,0|2,0,1]=4 1795 B13R2.369 OC1CN2C=CC=CC2=NC1=O Amb24649897 [0,0,0,1,0,0|3,0,0]=4 1796 B13R2.369 OC1Cc2ccccc2CC1S Amb25080268 [0,0,0,1,0,0|2,0,1]=4 1797 B13R2.369 OC1Cc2ccccc2NC1=O Amb22899290 [0,0,0,1,0,0|2,0,0]=3 1798 B13R2.369 OC1Cc2ccccc2NC1=S Amb25764408 [0,0,0,1,0,0|2,1,0]=4 1799 B13R2.369 OC1Cc2ccccc2OC1=O Amb25158158 [0,0,0,1,0,0|1,0,0]=2 1800 B13R2.369 OC1Oc2ccccc2CC1Cl Amb25804027 [0,0,0,1,0,0|1,0,2]=4 1801 B13R2.369 O[C@@H]1Cc2ccccc2C[C@@H]1O Amb24733320 [0,0,0,1,0,0|2,0,1]=4 1802 B13R2.369 O[C@@H]1Cc2ccccc2C[C@H]1O Amb25222561 [0,0,0,1,0,0|2,0,1]=4 1803 B13R2.369 O[C@@H]1Cc2ccccc2NC1=O Amb25097865 [0,0,0,1,0,0|2,0,0]=3 1804 B13R2.369 O[C@H]1Cc2ccccc2C[C@@H]1O Amb25204307 [0,0,0,1,0,0|2,0,1]=4 1805 B13R2.373 C=C1C(NC1=O)c2ccccc2 Amb25770081 [0,0,0,1,0,0|2,0,1]=4 1806 B13R2.373 C=C1[C@H](NC1=O)c2ccccc2 Amb25159312 [0,0,0,1,0,0|2,0,1]=4 1807 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,0,0,1,0,0|2,0,0]=3 1808 B13R2.373 CC1C(NC1=O)c2ccccc2 Amb19149073 [0,0,0,1,0,0|2,0,0]=3 1809 B13R2.373 C[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25206665 [0,0,0,1,0,0|2,0,0]=3 1810 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,0,0,1,0,0|2,0,0]=3 1811 B13R2.373 NC1C(NC1=O)c2ccccc2 Amb18829732 [0,0,0,1,0,0|1,0,0]=2 1812 B13R2.373 NC=1C(=O)OC1c2ccccc2 Amb25360814 [0,0,0,1,0,0|0,0,2]=3 1813 B13R2.373 N[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25247209 [0,0,0,1,0,0|1,0,0]=2 1814 B13R2.373 O=C1NC(C1Cl)c2ccccc2 Amb25159285 [0,0,0,1,0,0|2,0,0]=3 1815 B13R2.373 O=C1N[C@@H]([C@H]1F)c2ccccc2 Amb24513256 [0,0,0,1,0,0|2,0,0]=3 1816 B13R2.373 O=C1N[C@H]([C@@H]1F)c2ccccc2 Amb24617812 [0,0,0,1,0,0|2,0,0]=3 1817 B13R2.373 OC1C(NC1=O)c2c[n]ccc2 Amb25148534 [0,0,0,1,0,0|3,0,0]=4 1818 B13R2.373 OC1C(NC1=O)c2ccccc2 Amb25272921 [0,0,0,1,0,0|2,0,0]=3 1819 B13R2.373 OC1CC(C1Cl)c2ccccc2 Amb24391695 [0,0,0,1,0,0|2,0,1]=4 1820 B13R2.373 O[C@H]1C(=O)N[C@H]1c2ccccc2 Amb17615687 [0,0,0,1,0,0|2,0,0]=3 1821 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [0,0,0,1,0,0|2,0,0]=3 1822 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [0,0,0,1,0,0|2,0,0]=3 1823 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,0,0|2,0,0]=3 1824 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cc[n]cc2 Amb25375191 [0,0,0,1,0,0|3,0,0]=4 1825 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,0,0|2,0,0]=3 1826 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,0,0|2,0,0]=3 1827 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2cc[n]cc2 Amb25174919 [0,0,0,1,0,0|3,0,0]=4 1828 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccc[n]c2 Amb24649931 [0,0,0,1,0,0|3,0,0]=4 1829 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,0,0|2,0,0]=3 1830 B13R2.423 CC(C1CC1c2ccccc2)O Amb17605479 [0,0,0,1,0,0|2,0,1]=4 1831 B13R2.423 CC(O)[C@@H]1C[C@@H]1c2ccccc2 Amb25306520 [0,0,0,1,0,0|2,0,1]=4 1832 B13R2.423 C[C@@H](O)C1OC1c2ccccc2 Amb25817089 [0,0,0,1,0,0|2,0,1]=4 1833 B13R2.423 C[C@@H](O)[C@@H]1O[C@@H]1c2ccccc2 Amb24519692 [0,0,0,1,0,0|2,0,1]=4 1834 B13R2.423 C[C@@H](O)[C@H]1O[C@@H]1c2ccccc2 Amb24576520 [0,0,0,1,0,0|2,0,1]=4 1835 B13R2.423 C[C@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520371 [0,0,0,1,0,0|2,0,1]=4 1836 B13R2.423 C[C@H](O)[C@@H]1O[C@H]1c2ccccc2 Amb25176782 [0,0,0,1,0,0|2,0,1]=4 1837 B13R2.423 C[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24583667 [0,0,0,1,0,0|2,0,1]=4 1838 B13R2.423 C[C@H](O)[C@H]1O[C@@H]1c2ccccc2 Amb24555494 [0,0,0,1,0,0|2,0,1]=4 1839 B13R2.423 NC(=N)C1CC1c2ccccc2 Amb25242569 [0,0,0,1,0,0|3,0,0]=4 1840 B13R2.423 NC(=O)C1CC1c2ccc[n]c2 Amb25701875 [0,0,0,1,0,0|3,0,0]=4 1841 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [0,0,0,1,0,0|2,0,0]=3 1842 B13R2.423 NC(=O)C1N=C1c2ccccc2 Amb25123969 [0,0,0,1,0,0|1,0,2]=4 1843 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24678885 [0,0,0,1,0,0|3,0,0]=4 1844 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccc[n]c2 Amb24709317 [0,0,0,1,0,0|3,0,0]=4 1845 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25294667 [0,0,0,1,0,0|3,0,0]=4 1846 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,0,0|2,0,0]=3 1847 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24724910 [0,0,0,1,0,0|3,0,0]=4 1848 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [0,0,0,1,0,0|2,0,0]=3 1849 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [0,0,0,1,0,0|2,0,0]=3 1850 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,0,0|2,0,0]=3 1851 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [0,0,0,1,0,0|2,0,0]=3 1852 B13R2.423 O=C(Cl)C1OC1c2ccccc2 Amb25275213 [0,0,0,1,0,0|2,0,0]=3 1853 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,0,0|2,0,0]=3 1854 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [0,0,0,1,0,0|2,0,0]=3 1855 B13R2.423 O=C(Cl)[C@H]1O[C@H]1c2ccccc2 Amb24621250 [0,0,0,1,0,0|2,0,0]=3 1856 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [0,0,0,1,0,0|2,0,1]=4 1857 B13R2.423 OC(=O)C1CC1c2c[n]c[n]c2 Amb23571328 [0,0,0,1,0,0|3,0,0]=4 1858 B13R2.423 OC(=O)C1CC1c2cc[n]c[n]2 Amb24662852 [0,0,0,1,0,0|3,0,0]=4 1859 B13R2.423 OC(=O)C1CC1c2cc[n]cc2 Amb19514911 [0,0,0,1,0,0|2,0,0]=3 1860 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2cccc[n]2 Amb25209805 [0,0,0,1,0,0|2,0,0]=3 1861 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,0,0|1,0,0]=2 1862 B13R2.423 OC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25299768 [0,0,0,1,0,0|2,0,0]=3 1863 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [0,0,0,1,0,0|1,0,0]=2 1864 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [0,0,0,1,0,0|1,0,0]=2 1865 B13R2.423 OC(=O)[C@@H]1S[C@H]1c2ccccc2 Amb25286929 [0,0,0,1,0,0|1,0,0]=2 1866 B13R2.423 OC(=O)[C@H]1CC1c2cc[n]cc2 Amb24685293 [0,0,0,1,0,0|2,0,0]=3 1867 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,0,0|1,0,0]=2 1868 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,0,0|1,0,0]=2 1869 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [0,0,0,1,0,0|1,0,0]=2 1870 B13R2.423 OC(O)C1OC1c2ccccc2 Amb25802067 [0,0,0,1,0,0|1,0,2]=4 1871 B13R2.423 OC(O)[C@H]1O[C@@H]1c2ccccc2 Amb25204716 [0,0,0,1,0,0|1,0,2]=4 1872 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [0,0,0,1,0,0|2,0,0]=3 1873 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,0,0,1,0,0|2,0,1]=4 1874 B13R2.435 CC(=O)C1Cc2c(C1)cccc2 Amb10071756 [0,0,0,1,0,0|2,0,0]=3 1875 B13R2.435 CC(=O)C1Cc2ccc[n]c2C1 Amb25232818 [0,0,0,1,0,0|3,0,0]=4 1876 B13R2.435 CC(=O)C1Cc2ccccc2O1 Amb23586288 [0,0,0,1,0,0|2,0,0]=3 1877 B13R2.435 CC(=O)C1Cc2ccccc2S1 Amb25771359 [0,0,0,1,0,0|2,0,0]=3 1878 B13R2.435 CC(=O)C1Nc2ccccc2S1 Amb24756924 [0,0,0,1,0,0|2,0,0]=3 1879 B13R2.435 CC(=O)[C@H]1Cc2ccccc2O1 Amb25276988 [0,0,0,1,0,0|2,0,0]=3 1880 B13R2.435 CC(=O)c1cc2c([nH]1)cccc2 Amb10576614 [0,0,0,1,0,0|1,0,2]=4 1881 B13R2.435 CC(C)C1Cc2ccccc2N1 Amb18560784 [0,0,0,1,0,0|2,0,1]=4 1882 B13R2.435 CC(N)C1Cc2ccccc2N1 Amb25800962 [0,0,0,1,0,0|2,0,1]=4 1883 B13R2.435 CC(O)C1Cc2ccccc2C1 Amb25772134 [0,0,0,1,0,0|2,0,1]=4 1884 B13R2.435 CC(O)C1Cc2ccccc2N1 Amb24485510 [0,0,0,1,0,0|1,0,1]=3 1885 B13R2.435 CS(=O)C1Cc2ccccc2C1 Amb24352088 [0,0,0,1,0,0|3,0,0]=4 1886 B13R2.435 C[C@@H](O)C1Cc2ccccc2O1 Amb24746470 [0,0,0,1,0,0|2,0,1]=4 1887 B13R2.435 C[C@@H](O)[C@@H]1Cc2ccccc2O1 Amb25332261 [0,0,0,1,0,0|2,0,1]=4 1888 B13R2.435 C[C@H](O)C1Cc2ccccc2C1 Amb24377688 [0,0,0,1,0,0|2,0,1]=4 1889 B13R2.435 ClC(=O)C1=Cc2c(C1)cccc2 Amb10553797 [0,0,0,1,0,0|2,0,1]=4 1890 B13R2.435 FC(F)C1Cc2ccccc2N1 Amb24726995 [0,0,0,1,0,0|2,0,1]=4 1891 B13R2.435 NC(=O)C1Cc2c[n]ccc2C1 Amb25297350 [0,0,0,1,0,0|3,0,0]=4 1892 B13R2.435 NC(=O)C1Cc2ccc[n]c2C1 Amb24071777 [0,0,0,1,0,0|3,0,0]=4 1893 B13R2.435 NC(=O)C=1Cc2ccccc2C1 Amb22227964 [0,0,0,1,0,0|2,0,1]=4 1894 B13R2.435 NC(=O)N1Cc2ccccc2C1 Amb18800622 [0,0,0,1,0,0|3,0,0]=4 1895 B13R2.435 NC(=O)c1[nH]c2ccccc2[n]1 Amb21964182 [0,0,0,1,0,0|2,0,1]=4 1896 B13R2.435 NC(=S)[C@@H]1Cc2ccccc2N1 Amb24396241 [0,0,0,1,0,0|1,1,0]=3 1897 B13R2.435 O=C(Cl)C1Cc2ccccc2N1 Amb25276516 [0,0,0,1,0,0|1,0,0]=2 1898 B13R2.435 O=C(Cl)C1Cc2ccccc2S1 Amb25101163 [0,0,0,1,0,0|2,0,0]=3 1899 B13R2.435 O=C(Cl)C1Oc2ccccc2O1 Amb24060643 [0,0,0,1,0,0|3,0,0]=4 1900 B13R2.435 O=C(Cl)N1Cc2ccccc2C1 Amb24061265 [0,0,0,1,0,0|3,0,0]=4 1901 B13R2.435 O=C(Cl)[C@@H]1Cc2ccccc2N1 Amb25684645 [0,0,0,1,0,0|1,0,0]=2 1902 B13R2.435 O=C(Cl)c1[nH]c2ccccc2[n]1 Amb21961752 [0,0,0,1,0,0|2,0,1]=4 1903 B13R2.435 O=C(F)c1cc2ccccc2[nH]1 Amb24089088 [0,0,0,1,0,0|1,0,2]=4 1904 B13R2.435 OB(O)C1Cc2ccccc2C1 Amb25793713 [0,0,0,1,0,0|2,0,1]=4 1905 B13R2.435 OB(O)C1Cc2ccccc2S1 Amb24723610 [0,0,0,1,0,0|2,0,1]=4 1906 B13R2.435 OC(=O)C1=Cc2c(C1)cccc2 Amb10553818 [0,0,0,1,0,0|1,0,1]=3 1907 B13R2.435 OC(=O)C1CN2C=CC=CC2=N1 Amb24101572 [0,0,0,1,0,0|1,0,1]=3 1908 B13R2.435 OC(=O)C1Cc2[n]cc[n]c2C1 Amb18829015 [0,0,0,1,0,0|3,0,0]=4 1909 B13R2.435 OC(=O)C1Cc2c(C1)cccc2 Amb1083109 [0,0,0,1,0,0|1,0,0]=2 1910 B13R2.435 OC(=O)C1Cc2c(N1)cccc2 Amb1914079 [0,0,0,1,0,0|0,0,0]=1 1911 B13R2.435 OC(=O)C1Cc2c(O1)cccc2 Amb1154832 [0,0,0,1,0,0|1,0,0]=2 1912 B13R2.435 OC(=O)C1Cc2c(S1)cccc2 Amb1106305 [0,0,0,1,0,0|1,0,0]=2 1913 B13R2.435 OC(=O)C1Cc2c[n]c[n]c2C1 Amb18829042 [0,0,0,1,0,0|3,0,0]=4 1914 B13R2.435 OC(=O)C1Cc2c[n]ccc2C1 Amb24113166 [0,0,0,1,0,0|2,0,0]=3 1915 B13R2.435 OC(=O)C1Cc2c[n]ccc2C1 Amb24563347 [0,0,0,1,0,0|2,0,0]=3 1916 B13R2.435 OC(=O)C1Cc2cc[n]cc2O1 Amb24654010 [0,0,0,1,0,0|2,0,0]=3 1917 B13R2.435 OC(=O)C1Cc2ccc[n]c2C1 Amb18829466 [0,0,0,1,0,0|2,0,0]=3 1918 B13R2.435 OC(=O)C1Cc2ccc[n]c2O1 Amb25276744 [0,0,0,1,0,0|2,0,0]=3 1919 B13R2.435 OC(=O)C=1Cc2ccccc2N1 Amb24078944 [0,0,0,1,0,0|0,0,2]=3 1920 B13R2.435 OC(=O)[C@@H]1Cc2ccc[n]c2C1 Amb25685295 [0,0,0,1,0,0|2,0,0]=3 1921 B13R2.435 OC(=O)[C@@H]1Cc2ccc[n]c2N1 Amb22746980 [0,0,0,1,0,0|1,0,0]=2 1922 B13R2.435 OC(=O)[C@H]1Cc2ccccc2O1 Amb25210803 [0,0,0,1,0,0|1,0,0]=2 1923 B13R2.435 OC(=O)[C@H]1Cc2ccccc2S1 Amb25783934 [0,0,0,1,0,0|1,0,0]=2 1924 B13R2.435 OC(=O)c1[nH]c2[n]cccc2[n]1 Amb18829544 [0,0,0,1,0,0|2,0,1]=4 1925 B13R2.435 OC(=O)c1[nH]c2[n]cccc2[n]1 Amb24178945 [0,0,0,1,0,0|2,0,1]=4 1926 B13R2.435 OC(=O)c1[nH]c2cc[n]cc2[n]1 Amb18829516 [0,0,0,1,0,0|2,0,1]=4 1927 B13R2.435 OC(=O)c1[nH]c2ccccc2[n]1 Amb22499360 [0,0,0,1,0,0|1,0,1]=3 1928 B13R2.435 OC(=O)c1cc2c([nH]1)cccc2 Amb1211920 [0,0,0,1,0,0|0,0,2]=3 1929 B13R2.435 OC(=O)c1cc2c([nH]1)cncc2 Amb16233678 [0,0,0,1,0,0|1,0,2]=4 1930 B13R2.435 OC(=O)c1cc2c([nH]1)nccc2 Amb1141884 [0,0,0,1,0,0|1,0,2]=4 1931 B13R2.435 OC(=O)c1cc2c(o1)cccc2 Amb1203290 [0,0,0,1,0,0|1,0,2]=4 1932 B13R2.435 OC(=O)c1cc2cc[n]cc2[nH]1 Amb24179200 [0,0,0,1,0,0|1,0,2]=4 1933 B13R2.435 OC(=O)c1cc2ccc[n]c2[nH]1 Amb21857766 [0,0,0,1,0,0|1,0,2]=4 1934 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb17622300 [0,0,0,1,0,0|1,0,1]=3 1935 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb1797073 [0,0,0,1,0,0|1,0,1]=3 1936 B13R2.435 OC(=O)c1nc2c(o1)cccc2 Amb10066905 [0,0,0,1,0,0|1,0,2]=4 1937 B13R2.435 OC(=O)c1nc2c(s1)cccc2 Amb17622301 [0,0,0,1,0,0|1,0,2]=4 1938 B13R2.435 OC(O)C1Cc2ccccc2O1 Amb24497584 [0,0,0,1,0,0|1,0,2]=4 1939 B13R2.435 OS(=O)c1[nH]c2ccccc2[n]1 Amb25373910 [0,0,0,1,0,0|2,0,1]=4 1940 B13R2.435 O[13C](=O)c1cc2c([nH]1)cccc2 Amb17616073 [0,0,0,1,0,0|0,0,2]=3 1941 B13R2.435 [O-]C(=O)c1[nH]c2ccccc2[n]1 Amb23469767 [0,0,0,1,0,0|1,0,2]=4 1942 B13R2.435 [O-]P(=O)C1Cc2ccccc2C1 Amb22334922 [0,0,0,1,0,0|2,0,1]=4 1943 B13R2.444 NC(C1CC1)Cc2ccccc2 Amb17138534 [0,0,0,1,0,0|2,0,1]=4 1944 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb19515578 [0,0,0,1,0,0|2,0,1]=4 1945 B13R2.444 N[C@@H](Cc1ccccc1)[C@H]2CO2 Amb24578801 [0,0,0,1,0,0|1,0,1]=3 1946 B13R2.444 OC(Cc1ccccc1)C2CO2 Amb24497698 [0,0,0,1,0,0|2,0,1]=4 1947 B13R2.444 O[C@@H](Cc1ccccc1)[C@@H]2CO2 Amb24661121 [0,0,0,1,0,0|2,0,1]=4 1948 B13R2.444 O[C@H](Cc1ccccc1)[C@@H]2CO2 Amb24558598 [0,0,0,1,0,0|2,0,1]=4 1949 B13R2.444 O[C@H](Cc1ccccc1)[C@H]2CO2 Amb24752264 [0,0,0,1,0,0|2,0,1]=4 1950 B13R2.3080 CC1(C)C(N)C1c2ccccc2 Amb25351441 [0,0,0,1,0,0|2,0,1]=4 1951 B13R2.5517 CC(C)C1(N)Cc2ccccc12 Amb24592605 [0,0,0,1,0,0|2,0,1]=4 1952 B13R2.5517 CC1(Cc2ccccc12)C(O)=O Amb17778872 [0,0,0,1,0,0|1,0,0]=2 1953 B13R2.5517 NC(=O)C1(Cl)Cc2ccccc12 Amb25767195 [0,0,0,1,0,0|2,0,0]=3 1954 B11R1.35 C=C(Cc1ccc[s]1)C(O)=O Amb24558176 [0,0,0,0,1,0|2,0,1]=4 1955 B11R1.35 CC(=C)C(N)Cc1cc[s]c1 Amb25068054 [0,0,0,0,1,0|3,0,0]=4 1956 B11R1.35 CC(=O)C(C)Cc1c[nH]cc1 Amb18862485 [0,0,0,0,1,0|3,0,0]=4 1957 B11R1.35 CC(=O)C(C)Cc1c[s]cc1 Amb18793197 [0,0,0,0,1,0|3,0,0]=4 1958 B11R1.35 CC(=O)C(C)Cc1ccc[s]1 Amb18180158 [0,0,0,0,1,0|3,0,0]=4 1959 B11R1.35 CC(=O)C(Cc1cccs1)Br Amb17507811 [0,0,0,0,1,0|3,0,0]=4 1960 B11R1.35 CC(=O)C(Cc1cccs1)Cl Amb17507765 [0,0,0,0,1,0|3,0,0]=4 1961 B11R1.35 CC(=O)C(N)Cc1c[nH]c[n]1 Amb18125568 [0,0,0,0,1,0|3,0,0]=4 1962 B11R1.35 CC(=O)[C@H](C)Cc1ccco1 Amb25334926 [0,0,0,0,1,0|3,0,0]=4 1963 B11R1.35 CC(C[n]1cccc1)C(N)=O Amb25145757 [0,0,0,0,1,0|3,0,0]=4 1964 B11R1.35 CC(C[n]1cccc1)C(O)=O Amb18994454 [0,0,0,0,1,0|2,0,0]=3 1965 B11R1.35 CC(Cc1c[nH]c[n]1)C(O)=O Amb25150709 [0,0,0,0,1,0|3,0,0]=4 1966 B11R1.35 CC(Cc1c[s]c[n]1)C(O)=O Amb18292876 [0,0,0,0,1,0|3,0,0]=4 1967 B11R1.35 CC(Cc1cc[n]o1)C(O)=O Amb25241848 [0,0,0,0,1,0|3,0,0]=4 1968 B11R1.35 CC(Cc1cc[s]c1)C(N)=O Amb25027885 [0,0,0,0,1,0|3,0,0]=4 1969 B11R1.35 CC(Cc1ccco1)C(C)=O Amb17939894 [0,0,0,0,1,0|3,0,0]=4 1970 B11R1.35 CC(Nc1cc[s]c1)C(O)=O Amb25783888 [0,0,0,0,1,0|3,0,0]=4 1971 B11R1.35 CC(Nc1ccco1)C(O)=O Amb25027900 [0,0,0,0,1,0|3,0,0]=4 1972 B11R1.35 CC(O)C(N)C[n]1cccc1 Amb25691173 [0,0,0,0,1,0|2,0,1]=4 1973 B11R1.35 C[C@@H](Cc1c[nH]c[n]1)C(O)=O Amb25320661 [0,0,0,0,1,0|3,0,0]=4 1974 B11R1.35 C[C@H](Nc1ccsc1)C(O)=O Amb17912732 [0,0,0,0,1,0|3,0,0]=4 1975 B11R1.35 NC(=O)C(N)Cc1[nH]cc[n]1 Amb25189145 [0,0,0,0,1,0|3,0,0]=4 1976 B11R1.35 NC(=O)C(N)Cc1[n]cc[s]1 Amb24533629 [0,0,0,0,1,0|3,0,0]=4 1977 B11R1.35 NC(=O)C(N)Cc1c[n]c[s]1 Amb24413255 [0,0,0,0,1,0|3,0,0]=4 1978 B11R1.35 NC(=O)C(N)Cc1c[s]cc1 Amb25092321 [0,0,0,0,1,0|2,0,0]=3 1979 B11R1.35 NC(=O)C(N)Cc1ccc[s]1 Amb24487730 [0,0,0,0,1,0|2,0,0]=3 1980 B11R1.35 NC(=O)C(O)C[n]1cccc1 Amb25139051 [0,0,0,0,1,0|3,0,0]=4 1981 B11R1.35 NC(=O)[C@@H](N)Cc1[nH]cc[n]1 Amb24697794 [0,0,0,0,1,0|3,0,0]=4 1982 B11R1.35 NC(=O)[C@@H](N)Cc1c[n]c[nH]1 Amb22801500 [0,0,0,0,1,0|3,0,0]=4 1983 B11R1.35 NC(=O)[C@H](N)Cc1c[nH]c[n]1 Amb22886959 [0,0,0,0,1,0|3,0,0]=4 1984 B11R1.35 NC(C(=O)N)Cc1c[nH]cn1 Amb17593848 [0,0,0,0,1,0|3,0,0]=4 1985 B11R1.35 NC(CC=1C=NCN1)C(O)=O Amb25061275 [0,0,0,0,1,0|2,0,1]=4 1986 B11R1.35 NC(C[n]1[n]cc[n]1)C(O)=O Amb18200241 [0,0,0,0,1,0|3,0,0]=4 1987 B11R1.35 NC(C[n]1c[n]c[n]1)C(O)=O Amb18982288 [0,0,0,0,1,0|3,0,0]=4 1988 B11R1.35 NC(C[n]1c[n]cc1)C(N)=O Amb18293875 [0,0,0,0,1,0|3,0,0]=4 1989 B11R1.35 NC(C[n]1c[n]cc1)C(O)=O Amb18294042 [0,0,0,0,1,0|2,0,0]=3 1990 B11R1.35 NC(C[n]1cc[n][n]1)C(O)=O Amb18200242 [0,0,0,0,1,0|3,0,0]=4 1991 B11R1.35 NC(C[n]1ccc[n]1)C(N)=O Amb18984349 [0,0,0,0,1,0|3,0,0]=4 1992 B11R1.35 NC(C[n]1ccc[n]1)C(O)=O Amb18982290 [0,0,0,0,1,0|2,0,0]=3 1993 B11R1.35 NC(C[n]1cccc1)C(O)=O Amb18200839 [0,0,0,0,1,0|1,0,0]=2 1994 B11R1.35 NC(Cc1[nH]cc[n]1)C(O)=O Amb18200494 [0,0,0,0,1,0|2,0,0]=3 1995 B11R1.35 NC(Cc1[n]cco1)C(O)=O Amb18200255 [0,0,0,0,1,0|2,0,0]=3 1996 B11R1.35 NC(Cc1c[15nH]c[15n]1)C(O)=O Amb22367418 [0,0,0,0,1,0|2,0,0]=3 1997 B11R1.35 NC(Cc1c[nH][n]c1)C(O)=O Amb18830910 [0,0,0,0,1,0|2,0,0]=3 1998 B11R1.35 NC(Cc1c[nH]c[n]1)C(=O)Cl Amb25779249 [0,0,0,0,1,0|3,0,0]=4 1999 B11R1.35 NC(Cc1c[nH]c[n]1)P(O)=O Amb25364542 [0,0,0,0,1,0|3,0,0]=4 2000 B11R1.35 NC(Cc1c[nH]c[n]1)[13C](O)=O Amb22367519 [0,0,0,0,1,0|2,0,0]=3 2001 B11R1.35 NC(Cc1c[n][s][n]1)C(O)=O Amb24471428 [0,0,0,0,1,0|3,0,0]=4 2002 B11R1.35 NC(Cc1c[n]c[s]1)C(O)=O Amb18301833 [0,0,0,0,1,0|2,0,0]=3 2003 B11R1.35 NC(Cc1c[n]o[n]1)C(O)=O Amb18200030 [0,0,0,0,1,0|3,0,0]=4 2004 B11R1.35 NC(Cc1c[n]oc1)C(O)=O Amb18830802 [0,0,0,0,1,0|2,0,0]=3 2005 B11R1.35 NC(Cc1c[s][n][n]1)C(O)=O Amb24674512 [0,0,0,0,1,0|3,0,0]=4 2006 B11R1.35 NC(Cc1cc[nH]c1)C(O)=O Amb18065409 [0,0,0,0,1,0|1,0,0]=2 2007 B11R1.35 NC(Cc1cc[n][nH]1)C(O)=O Amb18200498 [0,0,0,0,1,0|2,0,0]=3 2008 B11R1.35 NC(Cc1cc[n][s]1)C(O)=O Amb18198297 [0,0,0,0,1,0|2,0,0]=3 2009 B11R1.35 NC(Cc1cc[s][n]1)C(O)=O Amb18198296 [0,0,0,0,1,0|2,0,0]=3 2010 B11R1.35 NC(Cc1ccc[nH]1)C(O)=O Amb18302277 [0,0,0,0,1,0|1,0,0]=2 2011 B11R1.35 NC(Cc1ccoc1)C(O)=O Amb21858415 [0,0,0,0,1,0|1,0,0]=2 2012 B11R1.35 NC(Cc1coc[n]1)C(O)=O Amb24409031 [0,0,0,0,1,0|2,0,0]=3 2013 B11R1.35 N[C@@H](C(=O)O)Cc1cscn1 Amb10069174 [0,0,0,0,1,0|2,0,0]=3 2014 B11R1.35 N[C@@H](C[n]1c[n]cc1)C(O)=O Amb22750678 [0,0,0,0,1,0|2,0,0]=3 2015 B11R1.35 N[C@@H](C[n]1c[n]cc1)C(O)=O Amb22754492 [0,0,0,0,1,0|2,0,0]=3 2016 B11R1.35 N[C@@H](Cc1[nH]cc[n]1)C(O)=O Amb24571753 [0,0,0,0,1,0|2,0,0]=3 2017 B11R1.35 N[C@@H](Cc1[n]cc[s]1)C(O)=O Amb19149166 [0,0,0,0,1,0|2,0,0]=3 2018 B11R1.35 N[C@@H](Cc1c[nH]c[n]1)C(=O)Cl Amb25109967 [0,0,0,0,1,0|3,0,0]=4 2019 B11R1.35 N[C@@H](Cc1c[nH]c[n]1)C(O)=O Amb22750687 [0,0,0,0,1,0|2,0,0]=3 2020 B11R1.35 N[C@@H](Cc1c[n][n][nH]1)C(O)=O Amb25721932 [0,0,0,0,1,0|3,0,0]=4 2021 B11R1.35 N[C@@H](Cc1c[n]c[s]1)C(O)=O Amb22745840 [0,0,0,0,1,0|2,0,0]=3 2022 B11R1.35 N[C@@H](Cc1cc[nH]c1)C(O)=O Amb22746047 [0,0,0,0,1,0|1,0,0]=2 2023 B11R1.35 N[C@@H](Cc1cc[n][nH]1)C(O)=O Amb24718311 [0,0,0,0,1,0|2,0,0]=3 2024 B11R1.35 N[C@@H](Cc1ccc[nH]1)C(O)=O Amb22750710 [0,0,0,0,1,0|1,0,0]=2 2025 B11R1.35 N[C@@H](Cc1ccc[s]1)C(O)=O Amb22747410 [0,0,0,0,1,0|1,0,0]=2 2026 B11R1.35 N[C@@H](Cc1ccoc1)C(O)=O Amb22228970 [0,0,0,0,1,0|1,0,0]=2 2027 B11R1.35 N[C@H](C(=O)N)Cc1c[nH]cn1 Amb16183883 [0,0,0,0,1,0|3,0,0]=4 2028 B11R1.35 N[C@H](C(=O)O)Cc1cnc[nH]1 Amb16233144 [0,0,0,0,1,0|2,0,0]=3 2029 B11R1.35 N[C@H](C(=O)O)Cc1cscn1 Amb10069175 [0,0,0,0,1,0|2,0,0]=3 2030 B11R1.35 N[C@H](C(=O)O)Cn1cncn1 Amb17620828 [0,0,0,0,1,0|3,0,0]=4 2031 B11R1.35 N[C@H](C[n]1c[n]c[n]1)C(O)=O Amb25843184 [0,0,0,0,1,0|3,0,0]=4 2032 B11R1.35 N[C@H](Cc1[n]cc[s]1)C(O)=O Amb24350666 [0,0,0,0,1,0|2,0,0]=3 2033 B11R1.35 N[C@H](Cc1c[n][s][n]1)C(O)=O Amb25260240 [0,0,0,0,1,0|3,0,0]=4 2034 B11R1.35 N[C@H](Cc1cc[nH][n]1)C(O)=O Amb24700701 [0,0,0,0,1,0|2,0,0]=3 2035 B11R1.35 N[C@H](Cc1cc[nH]c1)C(O)=O Amb24056486 [0,0,0,0,1,0|1,0,0]=2 2036 B11R1.35 N[C@H](Cc1ccc[nH]1)C(O)=O Amb24082124 [0,0,0,0,1,0|1,0,0]=2 2037 B11R1.35 N[C@H](Cc1ccoc1)C(O)=O Amb22228969 [0,0,0,0,1,0|1,0,0]=2 2038 B11R1.35 N\C(=C\c1cc[s]c1)\C(O)=O Amb24729838 [0,0,0,0,1,0|1,0,2]=4 2039 B11R1.35 N\C(=C\c1ccc[nH]1)\C(O)=O Amb24438740 [0,0,0,0,1,0|1,0,2]=4 2040 B11R1.35 N\C(=C\c1ccoc1)\C(O)=O Amb24549139 [0,0,0,0,1,0|1,0,2]=4 2041 B11R1.35 OC(=O)C(=O)Cc1ccco1 Amb1137668 [0,0,0,0,1,0|2,0,1]=4 2042 B11R1.35 OC(=O)C(=O)Cc1cccs1 Amb1135982 [0,0,0,0,1,0|2,0,1]=4 2043 B11R1.35 OC(=O)C(=O)Cc1cscc1 Amb1133942 [0,0,0,0,1,0|2,0,1]=4 2044 B11R1.35 OC(=O)C(=S)Cc1ccc[s]1 Amb22472986 [0,0,0,0,1,0|2,0,1]=4 2045 B11R1.35 OC(=O)C(Br)Cc1[nH]cc[n]1 Amb24519091 [0,0,0,0,1,0|3,0,0]=4 2046 B11R1.35 OC(=O)C(Cc1ccco1)O Amb17138461 [0,0,0,0,1,0|2,0,0]=3 2047 B11R1.35 OC(=O)C(Cc1cccs1)O Amb17138686 [0,0,0,0,1,0|2,0,0]=3 2048 B11R1.35 OC(=O)C(Cc1cnc[nH]1)Br Amb10072271 [0,0,0,0,1,0|3,0,0]=4 2049 B11R1.35 OC(=O)C(Cc1cscc1)C Amb17605844 [0,0,0,0,1,0|2,0,0]=3 2050 B11R1.35 OC(=O)C(Cc1nccs1)C Amb17334845 [0,0,0,0,1,0|3,0,0]=4 2051 B11R1.35 OC(=O)C(Cc1nccs1)N Amb16227038 [0,0,0,0,1,0|2,0,0]=3 2052 B11R1.35 OC(=O)C(Cl)C[n]1c[n]cc1 Amb24486763 [0,0,0,0,1,0|3,0,0]=4 2053 B11R1.35 OC(=O)C(Cl)Cc1c[nH]c[n]1 Amb18127345 [0,0,0,0,1,0|3,0,0]=4 2054 B11R1.35 OC(=O)C(Cn1cccn1)C Amb2569108 [0,0,0,0,1,0|3,0,0]=4 2055 B11R1.35 OC(=O)C(F)Cc1c[s]c[n]1 Amb25200759 [0,0,0,0,1,0|3,0,0]=4 2056 B11R1.35 OC(=O)C(F)Cc1cc[s]c1 Amb24568962 [0,0,0,0,1,0|2,0,0]=3 2057 B11R1.35 OC(=O)C(F)Cc1ccco1 Amb25042990 [0,0,0,0,1,0|2,0,0]=3 2058 B11R1.35 OC(=O)C(F)Sc1ccc[s]1 Amb25149141 [0,0,0,0,1,0|3,0,0]=4 2059 B11R1.35 OC(=O)C(O)Cc1[nH]cc[n]1 Amb24358972 [0,0,0,0,1,0|3,0,0]=4 2060 B11R1.35 OC(=O)C(O)Cc1c[nH][n]c1 Amb24439315 [0,0,0,0,1,0|3,0,0]=4 2061 B11R1.35 OC(=O)C(O)Cc1c[n]c[nH]1 Amb24487803 [0,0,0,0,1,0|3,0,0]=4 2062 B11R1.35 OC(=O)C(S)Cc1c[n]c[nH]1 Amb24340448 [0,0,0,0,1,0|3,0,0]=4 2063 B11R1.35 OC(=O)C(S)Cc1c[n]c[s]1 Amb25341723 [0,0,0,0,1,0|3,0,0]=4 2064 B11R1.35 OC(=O)C(S)Cc1c[s]c[n]1 Amb24488369 [0,0,0,0,1,0|3,0,0]=4 2065 B11R1.35 OC(=O)C(S)Cc1cc[s]c1 Amb18288888 [0,0,0,0,1,0|2,0,0]=3 2066 B11R1.35 OC(=O)C(S)Cc1ccc[s]1 Amb18968268 [0,0,0,0,1,0|2,0,0]=3 2067 B11R1.35 OC(=O)C(S)Cc1ccco1 Amb18968270 [0,0,0,0,1,0|2,0,0]=3 2068 B11R1.35 OC(=O)C([NH3+])Cc1c[nH]cn1 Amb16187387 [0,0,0,0,1,0|2,0,1]=4 2069 B11R1.35 OC(=O)[C@@H](Br)Cc1c[n]c[nH]1 Amb25237615 [0,0,0,0,1,0|3,0,0]=4 2070 B11R1.35 OC(=O)[C@@H](Cc1c[nH]cn1)Cl Amb17610932 [0,0,0,0,1,0|3,0,0]=4 2071 B11R1.35 OC(=O)[C@@H](Cc1ccco1)N Amb10068215 [0,0,0,0,1,0|1,0,0]=2 2072 B11R1.35 OC(=O)[C@@H](Cc1cccs1)C Amb10844000 [0,0,0,0,1,0|2,0,0]=3 2073 B11R1.35 OC(=O)[C@@H](Cc1cccs1)N Amb10068211 [0,0,0,0,1,0|1,0,0]=2 2074 B11R1.35 OC(=O)[C@@H](Cc1cscc1)N Amb10068213 [0,0,0,0,1,0|1,0,0]=2 2075 B11R1.35 OC(=O)[C@@H](Nc1cccs1)C Amb10603707 [0,0,0,0,1,0|3,0,0]=4 2076 B11R1.35 OC(=O)[C@@H](O)Cc1c[s]cc1 Amb24739592 [0,0,0,0,1,0|2,0,0]=3 2077 B11R1.35 OC(=O)[C@@H](O)Cc1ccc[s]1 Amb25074591 [0,0,0,0,1,0|2,0,0]=3 2078 B11R1.35 OC(=O)[C@H](Cc1c[nH]cn1)Cl Amb17610931 [0,0,0,0,1,0|3,0,0]=4 2079 B11R1.35 OC(=O)[C@H](Cc1ccco1)N Amb10068214 [0,0,0,0,1,0|1,0,0]=2 2080 B11R1.35 OC(=O)[C@H](Cc1cccs1)C Amb10844001 [0,0,0,0,1,0|2,0,0]=3 2081 B11R1.35 OC(=O)[C@H](Cc1cccs1)N Amb10068210 [0,0,0,0,1,0|1,0,0]=2 2082 B11R1.35 OC(=O)[C@H](Cc1cscc1)N Amb10068212 [0,0,0,0,1,0|1,0,0]=2 2083 B11R1.35 OC(=O)[C@H](F)Cc1cc[s]c1 Amb25103346 [0,0,0,0,1,0|2,0,0]=3 2084 B11R1.35 OC(=O)[C@H](F)Cc1ccc[s]1 Amb25724921 [0,0,0,0,1,0|2,0,0]=3 2085 B11R1.35 OC(=O)[C@H](O)Cc1c[n]c[nH]1 Amb25291005 [0,0,0,0,1,0|3,0,0]=4 2086 B11R1.35 OC(C[n]1c[n]cc1)C(O)=O Amb25143971 [0,0,0,0,1,0|3,0,0]=4 2087 B11R1.35 O[C@H](C(=O)O)Cc1cnc[nH]1 Amb17616036 [0,0,0,0,1,0|3,0,0]=4 2088 B11R1.35 [15NH2]C(Cc1c[nH]c[n]1)C(O)=O Amb22367419 [0,0,0,0,1,0|2,0,0]=3 2089 B11R1.35 [15NH2][13C@@H]([13CH2][13c]1[13cH][15nH][13cH][15n]1)[13C](O)=O Amb22353557 [0,0,0,0,1,0|2,0,0]=3 2090 B11R1.35 [15NH2][13C@@H]([13CH2][13c]1[13cH][nH][13cH][n]1)[13C](O)=O Amb22338897 [0,0,0,0,1,0|2,0,0]=3 2091 B11R1.35 [15NH2][13CH]([13C](=O)O)[13CH2][13c]1[13cH][15n][13cH][15nH]1 Amb17614974 [0,0,0,0,1,0|2,0,0]=3 2092 B11R1.35 [15NH2][C@@H](Cc1c[15nH]c[15n]1)C(O)=O Amb22362613 [0,0,0,0,1,0|2,0,0]=3 2093 B11R1.35 [15NH2][C@@H](Cc1c[nH]c[n]1)C(O)=O Amb22339013 [0,0,0,0,1,0|2,0,0]=3 2094 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [0,0,0,0,1,0|2,0,0]=3 2095 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,0,0,0,1,0|2,0,1]=4 2096 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [0,0,0,0,1,0|2,0,1]=4 2097 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [0,0,0,0,1,0|2,0,1]=4 2098 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [0,0,0,0,1,0|2,0,1]=4 2099 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [0,0,0,0,1,0|3,0,0]=4 2100 B11R1.36 CC(=C)C(N)c1cc[n]cc1 Amb25149238 [0,0,0,0,1,0|3,0,0]=4 2101 B11R1.36 CC(=C)C(N)c1ccc[n]c1 Amb25297470 [0,0,0,0,1,0|3,0,0]=4 2102 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [0,0,0,0,1,0|2,0,0]=3 2103 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,0,0,0,1,0|2,0,1]=4 2104 B11R1.36 CC(=O)C(F)c1cc[n]cc1 Amb25739565 [0,0,0,0,1,0|3,0,0]=4 2105 B11R1.36 CC(=O)C(N)c1cccc[n]1 Amb25082427 [0,0,0,0,1,0|2,0,0]=3 2106 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,0,0,0,1,0|1,0,0]=2 2107 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [0,0,0,0,1,0|3,0,0]=4 2108 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [0,0,0,0,1,0|3,0,0]=4 2109 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [0,0,0,0,1,0|3,0,0]=4 2110 B11R1.36 CC(=O)C(c1ccccn1)Cl Amb17477809 [0,0,0,0,1,0|3,0,0]=4 2111 B11R1.36 CC(=O)C(c1cccnc1)Cl Amb17477811 [0,0,0,0,1,0|3,0,0]=4 2112 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,0,0,0,1,0|3,0,0]=4 2113 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [0,0,0,0,1,0|2,0,0]=3 2114 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,0,0,0,1,0|2,0,0]=3 2115 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [0,0,0,0,1,0|2,0,1]=4 2116 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [0,0,0,0,1,0|3,0,0]=4 2117 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [0,0,0,0,1,0|3,0,0]=4 2118 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,0,0,0,1,0|2,0,0]=3 2119 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [0,0,0,0,1,0|2,0,0]=3 2120 B11R1.36 CC(C(O)=O)c1c[n]c[n]c1 Amb18962092 [0,0,0,0,1,0|3,0,0]=4 2121 B11R1.36 CC(C(O)=O)c1c[n]cc[n]1 Amb24070205 [0,0,0,0,1,0|3,0,0]=4 2122 B11R1.36 CC(C(O)=O)c1cc[n]c[n]1 Amb18201427 [0,0,0,0,1,0|3,0,0]=4 2123 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [0,0,0,0,1,0|2,0,0]=3 2124 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [0,0,0,0,1,0|2,0,0]=3 2125 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [0,0,0,0,1,0|2,0,0]=3 2126 B11R1.36 CC(C(c1cccnc1)N)O Amb17232102 [0,0,0,0,1,0|2,0,1]=4 2127 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [0,0,0,0,1,0|2,0,1]=4 2128 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [0,0,0,0,1,0|2,0,1]=4 2129 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [0,0,0,0,1,0|2,0,1]=4 2130 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [0,0,0,0,1,0|2,0,1]=4 2131 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [0,0,0,0,1,0|2,0,1]=4 2132 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [0,0,0,0,1,0|2,0,1]=4 2133 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [0,0,0,0,1,0|2,0,1]=4 2134 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [0,0,0,0,1,0|2,0,1]=4 2135 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [0,0,0,0,1,0|2,0,1]=4 2136 B11R1.36 CC(O)[C@@H](N)c1ccc[n]c1 Amb24659692 [0,0,0,0,1,0|2,0,1]=4 2137 B11R1.36 CC(O)[C@@H](N)c1cccc[n]1 Amb24470743 [0,0,0,0,1,0|2,0,1]=4 2138 B11R1.36 CC(O)[C@H](N)c1cc[n]cc1 Amb25126570 [0,0,0,0,1,0|2,0,1]=4 2139 B11R1.36 CC(O)[C@H](N)c1cccc[n]1 Amb24486964 [0,0,0,0,1,0|2,0,1]=4 2140 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [0,0,0,0,1,0|1,0,1]=3 2141 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [0,0,0,0,1,0|2,0,0]=3 2142 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [0,0,0,0,1,0|2,1,0]=4 2143 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [0,0,0,0,1,0|3,0,0]=4 2144 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [0,0,0,0,1,0|3,0,0]=4 2145 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [0,0,0,0,1,0|3,0,0]=4 2146 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [0,0,0,0,1,0|2,0,1]=4 2147 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [0,0,0,0,1,0|2,1,0]=4 2148 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [0,0,0,0,1,0|2,0,1]=4 2149 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [0,0,0,0,1,0|2,0,1]=4 2150 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [0,0,0,0,1,0|1,0,1]=3 2151 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [0,0,0,0,1,0|2,0,1]=4 2152 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [0,0,0,0,1,0|2,0,1]=4 2153 B11R1.36 C[C@@H](O)[C@H](N)c1cc[n]cc1 Amb24665797 [0,0,0,0,1,0|2,0,1]=4 2154 B11R1.36 C[C@@H](O)[C@H](N)c1cccc[n]1 Amb25794058 [0,0,0,0,1,0|2,0,1]=4 2155 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [0,0,0,0,1,0|1,0,1]=3 2156 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [0,0,0,0,1,0|2,0,1]=4 2157 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [0,0,0,0,1,0|2,0,1]=4 2158 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [0,0,0,0,1,0|2,0,1]=4 2159 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [0,0,0,0,1,0|2,0,1]=4 2160 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [0,0,0,0,1,0|2,0,1]=4 2161 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [0,0,0,0,1,0|2,0,1]=4 2162 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [0,0,0,0,1,0|2,0,1]=4 2163 B11R1.36 C[C@H](O)[C@@H](N)c1cc[n]cc1 Amb24485782 [0,0,0,0,1,0|2,0,1]=4 2164 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [0,0,0,0,1,0|1,0,1]=3 2165 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [0,0,0,0,1,0|2,0,1]=4 2166 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [0,0,0,0,1,0|2,0,1]=4 2167 B11R1.36 C[C@H](O)[C@H](N)c1ccc[n]c1 Amb24654822 [0,0,0,0,1,0|2,0,1]=4 2168 B11R1.36 C[C@H](O)[C@H](N)c1cccc[n]1 Amb25189265 [0,0,0,0,1,0|2,0,1]=4 2169 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,0,0,0,1,0|2,0,1]=4 2170 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [0,0,0,0,1,0|2,0,0]=3 2171 B11R1.36 ClC(c1ccncc1)C(=O)C Amb17477810 [0,0,0,0,1,0|3,0,0]=4 2172 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,0,0,0,1,0|0,0,2]=3 2173 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [0,0,0,0,1,0|3,0,0]=4 2174 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [0,0,0,0,1,0|3,0,0]=4 2175 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [0,0,0,0,1,0|3,0,0]=4 2176 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [0,0,0,0,1,0|3,0,0]=4 2177 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [0,0,0,0,1,0|3,0,0]=4 2178 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,0,0,0,1,0|1,0,2]=4 2179 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,0,0,1,0|2,0,1]=4 2180 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,0,0,0,1,0|2,0,0]=3 2181 B11R1.36 NC(=O)C(Cl)c1ccc[n]c1 Amb18185667 [0,0,0,0,1,0|3,0,0]=4 2182 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [0,0,0,0,1,0|1,0,0]=2 2183 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [0,0,0,0,1,0|3,0,0]=4 2184 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [0,0,0,0,1,0|3,0,0]=4 2185 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [0,0,0,0,1,0|3,0,0]=4 2186 B11R1.36 NC(=O)C(c1ccccn1)N Amb17334311 [0,0,0,0,1,0|2,0,0]=3 2187 B11R1.36 NC(=O)C(c1cccnc1)N Amb17334312 [0,0,0,0,1,0|2,0,0]=3 2188 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [0,0,0,0,1,0|2,0,0]=3 2189 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,0,0,0,1,0|3,0,0]=4 2190 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [0,0,0,0,1,0|2,0,0]=3 2191 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,0,0,0,1,0|1,0,0]=2 2192 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,0,0,1,0|2,0,0]=3 2193 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [0,0,0,0,1,0|2,0,0]=3 2194 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [0,0,0,0,1,0|2,0,0]=3 2195 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,0,0,0,1,0|1,0,0]=2 2196 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,0,0,1,0|2,0,0]=3 2197 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [0,0,0,0,1,0|1,1,0]=3 2198 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,0,0,0,1,0|1,0,0]=2 2199 B11R1.36 NC(C(Cl)Cl)c1ccccc1 Amb25299414 [0,0,0,0,1,0|2,0,1]=4 2200 B11R1.36 NC(C(O)=O)c1[n]ccc[n]1 Amb24738404 [0,0,0,0,1,0|2,0,0]=3 2201 B11R1.36 NC(C(O)=O)c1c[n]c[n][n]1 Amb24697045 [0,0,0,0,1,0|3,0,0]=4 2202 B11R1.36 NC(C(O)=O)c1c[n]c[n]c1 Amb24485788 [0,0,0,0,1,0|2,0,0]=3 2203 B11R1.36 NC(C(O)=O)c1c[n]cc[n]1 Amb22899538 [0,0,0,0,1,0|2,0,0]=3 2204 B11R1.36 NC(C(O)=O)c1ccc[n][n]1 Amb18201157 [0,0,0,0,1,0|2,0,0]=3 2205 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [0,0,0,0,1,0|1,0,0]=2 2206 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [0,0,0,0,1,0|1,0,0]=2 2207 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [0,0,0,0,1,0|1,0,0]=2 2208 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,0,0,0,1,0|0,0,0]=1 2209 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [0,0,0,0,1,0|2,0,1]=4 2210 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [0,0,0,0,1,0|1,0,0]=2 2211 B11R1.36 NC(c1ccncc1)C(=O)N Amb17334313 [0,0,0,0,1,0|2,0,0]=3 2212 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,0,0,0,1,0|1,0,0]=2 2213 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,0,0,0,1,0|0,0,0]=1 2214 B11R1.36 N[C@@H](C(O)=O)c1c[n]c[n]c1 Amb24485751 [0,0,0,0,1,0|2,0,0]=3 2215 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [0,0,0,0,1,0|1,0,0]=2 2216 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,0,0,0,1,0|0,0,0]=1 2217 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [0,0,0,0,1,0|1,0,0]=2 2218 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [0,0,0,0,1,0|2,0,1]=4 2219 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [0,0,0,0,1,0|1,0,0]=2 2220 B11R1.36 N[C@H](C(F)F)c1ccccc1 Amb24485821 [0,0,0,0,1,0|2,0,1]=4 2221 B11R1.36 N[C@H](C(O)=O)c1c[n]c[n]c1 Amb24484501 [0,0,0,0,1,0|2,0,0]=3 2222 B11R1.36 N[C@H](c1ccccc1)P(O)O Amb25301291 [0,0,0,0,1,0|1,0,1]=3 2223 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [0,0,0,0,1,0|2,0,0]=3 2224 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,0,0,0,1,0|2,0,1]=4 2225 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,0,0,0,1,0|2,0,1]=4 2226 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,0,0,0,1,0|2,0,1]=4 2227 B11R1.36 OB(O)C(Cl)c1ccccc1 Amb24468112 [0,0,0,0,1,0|2,0,1]=4 2228 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [0,0,0,0,1,0|2,0,1]=4 2229 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [0,0,0,0,1,0|2,0,1]=4 2230 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [0,0,0,0,1,0|2,0,1]=4 2231 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [0,0,0,0,1,0|2,0,1]=4 2232 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [0,0,0,0,1,0|2,0,0]=3 2233 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [0,0,0,0,1,0|2,0,0]=3 2234 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [0,0,0,0,1,0|2,0,0]=3 2235 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [0,0,0,0,1,0|2,0,0]=3 2236 B11R1.36 OC(=O)C(F)c1c[n]cc[n]1 Amb25358269 [0,0,0,0,1,0|3,0,0]=4 2237 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [0,0,0,0,1,0|2,0,0]=3 2238 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [0,0,0,0,1,0|2,0,0]=3 2239 B11R1.36 OC(=O)C(O)c1c[n]cc[n]1 Amb18200877 [0,0,0,0,1,0|3,0,0]=4 2240 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,0,0,0,1,0|2,0,0]=3 2241 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,0,0,0,1,0|2,0,0]=3 2242 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,0,0,0,1,0|2,0,0]=3 2243 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,0,0,0,1,0|2,0,0]=3 2244 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,0,0,0,1,0|1,0,0]=2 2245 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,0,0,0,1,0|1,0,0]=2 2246 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,0,0,0,1,0|0,0,0]=1 2247 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [0,0,0,0,1,0|1,0,0]=2 2248 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,0,0,0,1,0|1,0,0]=2 2249 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,0,0,0,1,0|2,0,0]=3 2250 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,0,0,0,1,0|1,0,0]=2 2251 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,0,0,0,1,0|2,0,0]=3 2252 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,0,0,0,1,0|2,0,0]=3 2253 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,0,0,0,1,0|1,1,0]=3 2254 B11R1.36 OC(c1c[n]ccc1)P(O)=O Amb24502009 [0,0,0,0,1,0|3,0,0]=4 2255 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [0,0,0,0,1,0|3,0,0]=4 2256 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,0,0,0,1,0|2,0,0]=3 2257 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,0,0,0,1,0|2,0,0]=3 2258 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,0,0,0,1,0|2,0,0]=3 2259 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,0,0,0,1,0|2,0,0]=3 2260 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [0,0,0,0,1,0|2,0,0]=3 2261 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,0,0,0,1,0|0,0,1]=2 2262 B11R1.36 [O-]C(=O)C(O)c1cccc[n]1 Amb23452663 [0,0,0,0,1,0|2,0,1]=4 2263 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,0,0,0,1,0|1,0,1]=3 2264 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,0,0,0,1,0|1,0,1]=3 2265 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [0,0,0,0,1,0|2,0,0]=3 2266 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [0,0,0,0,0,1|2,0,1]=4 2267 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,0,0,0,0,1|3,0,0]=4 2268 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,0,0,0,0,1|2,0,1]=4 2269 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [0,0,0,0,0,1|2,0,1]=4 2270 B13R1.348 CC(=O)NC(C)Cc1c[n]ccc1 Amb25095297 [0,0,0,0,0,1|3,0,0]=4 2271 B13R1.348 CC(=O)NC(C)Cc1cc[n]cc1 Amb24705489 [0,0,0,0,0,1|3,0,0]=4 2272 B13R1.348 CC(=O)NC(N)Cc1ccccc1 Amb25322191 [0,0,0,0,0,1|1,0,0]=2 2273 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [0,0,0,0,0,1|2,0,0]=3 2274 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,0,0,0,0,1|2,0,0]=3 2275 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [0,0,0,0,0,1|1,0,1]=3 2276 B13R1.348 CC(Cc1cc[n]cc1)NC(N)=O Amb24380353 [0,0,0,0,0,1|3,0,0]=4 2277 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [0,0,0,0,0,1|1,0,0]=2 2278 B13R1.348 CC(Cc1ccccc1)NC(N)=N Amb18178447 [0,0,0,0,0,1|3,0,0]=4 2279 B13R1.348 CC(Cc1ccccn1)CC(=O)O Amb17335285 [0,0,0,0,0,1|2,0,0]=3 2280 B13R1.348 CC(Cc1cccnc1)CC(=O)O Amb17335287 [0,0,0,0,0,1|2,0,0]=3 2281 B13R1.348 CC(Cc1ccncc1)CC(=O)O Amb17335288 [0,0,0,0,0,1|2,0,0]=3 2282 B13R1.348 CC(Nc1ccccc1)CC(=O)N Amb17233441 [0,0,0,0,0,1|3,0,0]=4 2283 B13R1.348 CC(O)CN(N)Cc1ccccc1 Amb18128771 [0,0,0,0,0,1|2,0,1]=4 2284 B13R1.348 CC(Oc1ccccc1)CC(=O)N Amb17233539 [0,0,0,0,0,1|3,0,0]=4 2285 B13R1.348 CN(Cc1cc[n]cc1)CC(O)=O Amb22586727 [0,0,0,0,0,1|3,0,0]=4 2286 B13R1.348 CN(Cc1ccc[n]c1)CC(O)=O Amb21955498 [0,0,0,0,0,1|3,0,0]=4 2287 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb21955225 [0,0,0,0,0,1|3,0,0]=4 2288 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb22586726 [0,0,0,0,0,1|3,0,0]=4 2289 B13R1.348 CN(Cc1ccccc1)CC(=O)Cl Amb17143178 [0,0,0,0,0,1|3,0,0]=4 2290 B13R1.348 CN(Cc1ccccc1)CC(=O)N Amb17142972 [0,0,0,0,0,1|3,0,0]=4 2291 B13R1.348 CN(Cc1ccccc1)CC(=O)O Amb10610460 [0,0,0,0,0,1|2,0,0]=3 2292 B13R1.348 C[C@@H](CC(N)=O)Nc1ccccc1 Amb24727147 [0,0,0,0,0,1|3,0,0]=4 2293 B13R1.348 C[C@H](CC(N)=O)Nc1ccccc1 Amb25707756 [0,0,0,0,0,1|3,0,0]=4 2294 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,0,0,0,0,1|2,0,0]=3 2295 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [0,0,0,0,0,1|1,0,1]=3 2296 B13R1.348 C\C(=C/C(O)=O)\Sc1ccccc1 Amb18130094 [0,0,0,0,0,1|2,0,1]=4 2297 B13R1.348 C\C(=C/c1ccccc1)\CC(=O)O Amb17594482 [0,0,0,0,0,1|1,0,2]=4 2298 B13R1.348 C\C(\CC(O)=O)=C\c1ccccc1 Amb25229524 [0,0,0,0,0,1|1,0,2]=4 2299 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,0,0,0,0,1|2,0,1]=4 2300 B13R1.348 NC(Cc1ccccc1)CC(O)=O Amb20623358 [0,0,0,0,0,1|0,0,0]=1 2301 B13R1.348 NC(Cc1ccccn1)CC(=O)O Amb17470627 [0,0,0,0,0,1|1,0,0]=2 2302 B13R1.348 NC(Cc1cccnc1)CC(=O)O Amb17470630 [0,0,0,0,0,1|1,0,0]=2 2303 B13R1.348 NC(Cc1ccncc1)CC(=O)O Amb17470634 [0,0,0,0,0,1|1,0,0]=2 2304 B13R1.348 N[C@@H](Cc1cc[n]cc1)CC(O)=O Amb22746344 [0,0,0,0,0,1|1,0,0]=2 2305 B13R1.348 N[C@@H](Cc1ccc[n]c1)CC(O)=O Amb22746342 [0,0,0,0,0,1|1,0,0]=2 2306 B13R1.348 N\C(=C\C(O)=O)\Oc1ccccc1 Amb24655097 [0,0,0,0,0,1|1,0,1]=3 2307 B13R1.348 N\C(\Cc1ccccc1)=C\C(N)=O Amb24602390 [0,0,0,0,0,1|1,0,1]=3 2308 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,0,0,0,0,1|2,0,1]=4 2309 B13R1.348 O=C(Nc1ccccc1)CC(=O)O Amb2436726 [0,0,0,0,0,1|2,0,1]=4 2310 B13R1.348 O=C(Oc1ccccc1)CC(=O)O Amb2417322 [0,0,0,0,0,1|2,0,1]=4 2311 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [0,0,0,0,0,1|1,0,1]=3 2312 B13R1.348 OC(=O)CC(=S)Nc1ccccc1 Amb24470037 [0,0,0,0,0,1|2,0,1]=4 2313 B13R1.348 OC(=O)CC(Br)Cc1ccccc1 Amb18111137 [0,0,0,0,0,1|1,0,0]=2 2314 B13R1.348 OC(=O)CC(Cl)Cc1ccccc1 Amb18111136 [0,0,0,0,0,1|1,0,0]=2 2315 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [0,0,0,0,0,1|1,0,0]=2 2316 B13R1.348 [2H]C(Cc1ccccc1)C=C(C)C Amb22546630 [0,0,0,0,0,1|3,0,0]=4 2317 B13R1.351 C=C(CSc1ccccc1)C(O)=O Amb18130089 [0,0,0,0,0,1|1,0,1]=3 2318 B13R1.351 C=C(OCc1ccccc1)C(O)=O Amb24626599 [0,0,0,0,0,1|1,0,1]=3 2319 B13R1.351 CC(=C)C(C)CNc1ccccc1 Amb25192041 [0,0,0,0,0,1|3,0,0]=4 2320 B13R1.351 CC(=C)C(C)NCc1ccccc1 Amb25101597 [0,0,0,0,0,1|3,0,0]=4 2321 B13R1.351 CC(=C=Cc1ccccc1)C(O)=O Amb25337779 [0,0,0,0,0,1|1,0,2]=4 2322 B13R1.351 CC(=O)C(=O)CNc1ccccc1 Amb25123358 [0,0,0,0,0,1|2,0,1]=4 2323 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,0,0,0,0,1|2,0,1]=4 2324 B13R1.351 CC(=O)C(C)C#Cc1ccccc1 Amb24492361 [0,0,0,0,0,1|2,0,1]=4 2325 B13R1.351 CC(=O)C(C)CNc1ccccc1 Amb25325974 [0,0,0,0,0,1|2,0,0]=3 2326 B13R1.351 CC(=O)C(C)NCc1ccccc1 Amb18127991 [0,0,0,0,0,1|2,0,0]=3 2327 B13R1.351 CC(=O)C(C)ONc1ccccc1 Amb24495021 [0,0,0,0,0,1|3,0,0]=4 2328 B13R1.351 CC(=O)C(C)\C=C/c1ccccc1 Amb25735093 [0,0,0,0,0,1|2,0,1]=4 2329 B13R1.351 CC(=O)C(C)\C=C\c1ccccc1 Amb24655091 [0,0,0,0,0,1|2,0,1]=4 2330 B13R1.351 CC(=O)C(Cl)ONc1ccccc1 Amb25858083 [0,0,0,0,0,1|3,0,0]=4 2331 B13R1.351 CC(=O)N(C)OCc1ccccc1 Amb25829924 [0,0,0,0,0,1|3,0,0]=4 2332 B13R1.351 CC(=O)[C@@H](C)\C=C\c1ccccc1 Amb24752492 [0,0,0,0,0,1|2,0,1]=4 2333 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,0,0,0,0,1|2,0,0]=3 2334 B13R1.351 CC(=O)[C@H](C)ONc1ccccc1 Amb24492768 [0,0,0,0,0,1|3,0,0]=4 2335 B13R1.351 CC(=O)[C@H](C)\C=C\c1ccccc1 Amb24602920 [0,0,0,0,0,1|2,0,1]=4 2336 B13R1.351 CC(C(=O)C)OCc1ccccc1 Amb16231123 [0,0,0,0,0,1|2,0,0]=3 2337 B13R1.351 CC(C(=O)N)COc1ccccc1 Amb17233540 [0,0,0,0,0,1|2,0,0]=3 2338 B13R1.351 CC(C(=O)O)CCc1ccncc1 Amb17335289 [0,0,0,0,0,1|2,0,0]=3 2339 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb10199880 [0,0,0,0,0,1|1,0,0]=2 2340 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb1111423 [0,0,0,0,0,1|1,0,0]=2 2341 B13R1.351 CC(C(=O)O)SCc1ccccc1 Amb1137630 [0,0,0,0,0,1|1,0,0]=2 2342 B13R1.351 CC(C)C(N)CNc1ccccc1 Amb19009671 [0,0,0,0,0,1|2,0,1]=4 2343 B13R1.351 CC(C)[C@@H](N)COc1ccccc1 Amb18538509 [0,0,0,0,0,1|2,0,1]=4 2344 B13R1.351 CC(C)[C@H](N)CNc1ccccc1 Amb25191844 [0,0,0,0,0,1|2,0,1]=4 2345 B13R1.351 CC(CNc1[n]ccc[n]1)C(O)=O Amb19027741 [0,0,0,0,0,1|3,0,0]=4 2346 B13R1.351 CC(CNc1c[n]cc[n]1)C(O)=O Amb19027740 [0,0,0,0,0,1|3,0,0]=4 2347 B13R1.351 CC(CNc1cc[n]c[n]1)C(O)=O Amb19027717 [0,0,0,0,0,1|3,0,0]=4 2348 B13R1.351 CC(CNc1cc[n]cc1)C(O)=O Amb19027731 [0,0,0,0,0,1|2,0,0]=3 2349 B13R1.351 CC(O)C(O)CNc1ccccc1 Amb25138128 [0,0,0,0,0,1|2,0,1]=4 2350 B13R1.351 CC(O)C(O)OCc1ccccc1 Amb24366101 [0,0,0,0,0,1|2,0,1]=4 2351 B13R1.351 CC(O)[C@@H](O)OCc1ccccc1 Amb22736709 [0,0,0,0,0,1|2,0,1]=4 2352 B13R1.351 CC(O)[C@H](O)OCc1ccccc1 Amb22736708 [0,0,0,0,0,1|2,0,1]=4 2353 B13R1.351 CC(OCc1ccccc1)B(O)O Amb24344591 [0,0,0,0,0,1|2,0,1]=4 2354 B13R1.351 CC(OCc1ccccc1)C(=O)Cl Amb24354312 [0,0,0,0,0,1|2,0,0]=3 2355 B13R1.351 CC(OCc1ccccc1)C(C)O Amb18809338 [0,0,0,0,0,1|2,0,1]=4 2356 B13R1.351 CC(OCc1ccccc1)C(N)=N Amb18184337 [0,0,0,0,0,1|3,0,0]=4 2357 B13R1.351 CC(OCc1ccccc1)C(N)=S Amb19063930 [0,0,0,0,0,1|2,1,0]=4 2358 B13R1.351 CC(OCc1ccccc1)[C@@H](C)O Amb25716823 [0,0,0,0,0,1|2,0,1]=4 2359 B13R1.351 CC(\C=C\c1ccccc1)C(O)=O Amb18127714 [0,0,0,0,0,1|1,0,1]=3 2360 B13R1.351 CC(\N=C\c1ccccc1)C(N)=O Amb24710253 [0,0,0,0,0,1|2,0,1]=4 2361 B13R1.351 C[C@@H](O)C(O)OCc1ccccc1 Amb19929337 [0,0,0,0,0,1|2,0,1]=4 2362 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)Cl Amb24533460 [0,0,0,0,0,1|2,0,0]=3 2363 B13R1.351 C[C@@H](OCc1ccccc1)C(N)=O Amb25192194 [0,0,0,0,0,1|2,0,0]=3 2364 B13R1.351 C[C@@H](OCc1ccccc1)[C@@H](C)O Amb25762020 [0,0,0,0,0,1|2,0,1]=4 2365 B13R1.351 C[C@@H](\N=C/c1ccccc1)C([O-])=O Amb25299159 [0,0,0,0,0,1|1,0,2]=4 2366 B13R1.351 C[C@H](C(=O)O)NCc1ccccc1 Amb16185448 [0,0,0,0,0,1|1,0,0]=2 2367 B13R1.351 C[C@H](NCc1ccccc1)[C@H](C)O Amb25827843 [0,0,0,0,0,1|2,0,1]=4 2368 B13R1.351 C[C@H](O)C(O)OCc1ccccc1 Amb19929338 [0,0,0,0,0,1|2,0,1]=4 2369 B13R1.351 C[C@H](OCc1ccccc1)B(O)O Amb24404611 [0,0,0,0,0,1|2,0,1]=4 2370 B13R1.351 C[C@H](OCc1ccccc1)C(O)=O Amb25072743 [0,0,0,0,0,1|1,0,0]=2 2371 B13R1.351 C[C@H](OCc1ccccc1)[C@@H](C)O Amb25080136 [0,0,0,0,0,1|2,0,1]=4 2372 B13R1.351 C[C@H](OCc1ccccc1)[C@H](C)O Amb25271838 [0,0,0,0,0,1|2,0,1]=4 2373 B13R1.351 C[C@H](\N=C\c1cc[n]cc1)C(O)=O Amb24397167 [0,0,0,0,0,1|2,0,1]=4 2374 B13R1.351 C[C@H](\N=C\c1ccccc1)C(O)=O Amb25124071 [0,0,0,0,0,1|1,0,1]=3 2375 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [0,0,0,0,0,1|2,0,1]=4 2376 B13R1.351 C\C(=C/Cc1ccccc1)\C(O)=O Amb24462262 [0,0,0,0,0,1|1,0,1]=3 2377 B13R1.351 C\C(=C/Sc1ccccc1)\C(O)=O Amb25072536 [0,0,0,0,0,1|1,0,2]=4 2378 B13R1.351 C\C(=C\Oc1ccccc1)\C(O)=O Amb25798942 [0,0,0,0,0,1|1,0,2]=4 2379 B13R1.351 C\C(=C\Sc1ccccc1)\C(O)=O Amb18130088 [0,0,0,0,0,1|1,0,2]=4 2380 B13R1.351 C\C(=N/Cc1ccccc1)\C(C)=O Amb25130600 [0,0,0,0,0,1|2,0,1]=4 2381 B13R1.351 C\C(=N/Nc1ccccc1)\C(=O)O Amb16205342 [0,0,0,0,0,1|2,0,1]=4 2382 B13R1.351 C\C(=N\Cc1cc[n]cc1)\C(O)=O Amb25684774 [0,0,0,0,0,1|2,0,1]=4 2383 B13R1.351 N=C(NCc1ccccc1)C(O)=O Amb18128144 [0,0,0,0,0,1|0,0,2]=3 2384 B13R1.351 NC(=O)C(=O)CCc1ccccc1 Amb24273105 [0,0,0,0,0,1|2,0,1]=4 2385 B13R1.351 NC(=O)C(=O)NCc1ccccc1 Amb25858184 [0,0,0,0,0,1|2,0,1]=4 2386 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,0,0,0,0,1|1,0,0]=2 2387 B13R1.351 NC(=O)C(O)CNc1cccc[n]1 Amb24591895 [0,0,0,0,0,1|3,0,0]=4 2388 B13R1.351 NC(=O)C(O)CNc1ccccc1 Amb24696346 [0,0,0,0,0,1|2,0,0]=3 2389 B13R1.351 NC(=O)C(O)COc1ccccc1 Amb22497384 [0,0,0,0,0,1|2,0,0]=3 2390 B13R1.351 NC(=O)C(O)\C=C\c1ccccc1 Amb24552951 [0,0,0,0,0,1|2,0,1]=4 2391 B13R1.351 NC(C(=O)O)CCc1ccncc1 Amb17470633 [0,0,0,0,0,1|1,0,0]=2 2392 B13R1.351 NC(CCc1cccc[n]1)C(O)=O Amb24117831 [0,0,0,0,0,1|1,0,0]=2 2393 B13R1.351 NC(CNc1ccccc1)C(O)=O Amb25360987 [0,0,0,0,0,1|0,0,0]=1 2394 B13R1.351 NC(CSc1ccccc1)C(O)=O Amb18325246 [0,0,0,0,0,1|0,0,0]=1 2395 B13R1.351 NC(\C=C\c1ccccc1)P(O)O Amb25155577 [0,0,0,0,0,1|1,0,2]=4 2396 B13R1.351 N[C@H](CCc1ccccc1)C(O)=O Amb17872441 [0,0,0,0,0,1|0,0,0]=1 2397 B13R1.351 N[C@H](CNc1ccccc1)C(O)=O Amb24652450 [0,0,0,0,0,1|0,0,0]=1 2398 B13R1.351 N[C@H](\C=C\c1ccccc1)C(O)=O Amb25187708 [0,0,0,0,0,1|0,0,1]=2 2399 B13R1.351 N\C(=N/Nc1ccccc1)\C(O)=O Amb24658773 [0,0,0,0,0,1|1,0,1]=3 2400 B13R1.351 O=C(C(=O)C)NCc1ccccc1 Amb17400597 [0,0,0,0,0,1|2,0,1]=4 2401 B13R1.351 O=C(C(=O)O)\C=C\c1ccccc1 Amb16192457 [0,0,0,0,0,1|1,0,2]=4 2402 B13R1.351 O=C(OCc1ccccc1)C(=O)Cl Amb24687217 [0,0,0,0,0,1|2,0,1]=4 2403 B13R1.351 OC(=O)C(=O)C#Cc1ccccc1 Amb25298732 [0,0,0,0,0,1|1,0,2]=4 2404 B13R1.351 OC(=O)C(=O)NNc1ccccc1 Amb18128574 [0,0,0,0,0,1|2,0,1]=4 2405 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [0,0,0,0,0,1|1,0,1]=3 2406 B13R1.351 OC(=O)C(Br)CCc1ccccc1 Amb18662872 [0,0,0,0,0,1|1,0,0]=2 2407 B13R1.351 OC(=O)C(CCc1ccccn1)C Amb17335286 [0,0,0,0,0,1|2,0,0]=3 2408 B13R1.351 OC(=O)C(CCc1ccccn1)N Amb1101108 [0,0,0,0,0,1|1,0,0]=2 2409 B13R1.351 OC(=O)C(CCc1cccnc1)C Amb17233532 [0,0,0,0,0,1|2,0,0]=3 2410 B13R1.351 OC(=O)C(Cl)\N=N\c1ccccc1 Amb25724891 [0,0,0,0,0,1|2,0,0]=3 2411 B13R1.351 OC(=O)C(F)OCc1ccccc1 Amb25369072 [0,0,0,0,0,1|1,0,0]=2 2412 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb10609128 [0,0,0,0,0,1|2,0,0]=3 2413 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb1110995 [0,0,0,0,0,1|2,0,0]=3 2414 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb10199875 [0,0,0,0,0,1|2,0,0]=3 2415 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb1110808 [0,0,0,0,0,1|2,0,0]=3 2416 B13R1.351 OC(=O)C(O)C#Cc1ccccc1 Amb25111134 [0,0,0,0,0,1|1,0,1]=3 2417 B13R1.351 OC(=O)C(O)\C=C\c1c[n]ccc1 Amb25108233 [0,0,0,0,0,1|2,0,1]=4 2418 B13R1.351 OC(=O)\C(\Cl)=C\Sc1ccccc1 Amb24587115 [0,0,0,0,0,1|1,0,2]=4 2419 B13R1.351 OC(=O)\C(\F)=C\Cc1ccccc1 Amb25265375 [0,0,0,0,0,1|1,0,1]=3 2420 B13R1.351 OC(=O)\C(\F)=C\Sc1ccccc1 Amb25288171 [0,0,0,0,0,1|1,0,2]=4 2421 B13R1.351 OC(=O)\C(\S)=N\Nc1ccccc1 Amb18130277 [0,0,0,0,0,1|2,0,1]=4 2422 B13R1.351 OC(C(=O)O)\C=C\c1ccccc1 Amb17594531 [0,0,0,0,0,1|1,0,1]=3 2423 B13R1.351 O[C@H](C(=O)O)CCc1ccccc1 Amb10603260 [0,0,0,0,0,1|1,0,0]=2 2424 B13R1.351 O\C(=C/Nc1ccccc1)\C(O)=O Amb24677773 [0,0,0,0,0,1|1,0,2]=4 2425 B10R0.4 C=C\C=C\C=C\C=C\C(O)=O Amb25386381 [1,0,1,0,0,0|0,0,2]=4 2426 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [2,0,0,0,0,0|2,0,0]=4 2427 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [2,0,0,0,0,0|2,0,0]=4 2428 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [2,0,0,0,0,0|1,0,1]=4 2429 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [2,0,0,0,0,0|2,0,0]=4 2430 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [2,0,0,0,0,0|2,0,0]=4 2431 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [2,0,0,0,0,0|2,0,0]=4 2432 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [2,0,0,0,0,0|2,0,0]=4 2433 B10R1.17 C=CNCc1ccccc1 Amb24505107 [2,0,0,0,0,0|2,0,0]=4 2434 B10R1.17 C=COCc1ccccc1 Amb17940722 [2,0,0,0,0,0|2,0,0]=4 2435 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|2,0,0]=4 2436 B10R1.17 CNCCc1ccccc1 Amb2119452 [2,0,0,0,0,0|2,0,0]=4 2437 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [2,0,0,0,0,0|1,0,1]=4 2438 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [2,0,0,0,0,0|2,0,0]=4 2439 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [2,0,0,0,0,0|1,0,1]=4 2440 B10R1.17 FCCCc1ccccc1 Amb25737014 [2,0,0,0,0,0|1,0,1]=4 2441 B10R1.17 ICCCc1ccccc1 Amb10605506 [2,0,0,0,0,0|1,0,1]=4 2442 B10R1.17 N=COCc1ccccc1 Amb22269902 [2,0,0,0,0,0|2,0,0]=4 2443 B10R1.17 N=COCc1ccccc1 Amb24652885 [2,0,0,0,0,0|2,0,0]=4 2444 B10R1.17 NCCCc1ccccc1 Amb22490482 [2,0,0,0,0,0|1,0,1]=4 2445 B10R1.17 NNCCc1ccccc1 Amb10608987 [2,0,0,0,0,0|2,0,0]=4 2446 B10R1.17 NNCCc1ccccc1 Amb1117029 [2,0,0,0,0,0|2,0,0]=4 2447 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [2,0,0,0,0,0|2,0,0]=4 2448 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [2,0,0,0,0,0|2,0,0]=4 2449 B10R1.17 O=CCCc1ccccn1 Amb17081674 [2,0,0,0,0,0|1,0,0]=3 2450 B10R1.17 O=CCCc1cccnc1 Amb17081675 [2,0,0,0,0,0|1,0,0]=3 2451 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [2,0,0,0,0,0|2,0,0]=4 2452 B10R1.17 O=CCNc1ccccc1 Amb24566865 [2,0,0,0,0,0|1,0,0]=3 2453 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [2,0,0,0,0,0|2,0,0]=4 2454 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [2,0,0,0,0,0|2,0,0]=4 2455 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [2,0,0,0,0,0|2,0,0]=4 2456 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [2,0,0,0,0,0|2,0,0]=4 2457 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|1,0,0]=3 2458 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [2,0,0,0,0,0|2,0,0]=4 2459 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,0]=3 2460 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|0,0,2]=4 2461 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [2,0,0,0,0,0|1,0,1]=4 2462 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [2,0,0,0,0,0|1,0,1]=4 2463 B10R1.17 OCCNc1ccccc1 Amb24065196 [2,0,0,0,0,0|1,0,1]=4 2464 B10R1.17 OCCNc1ccccc1 Amb24065197 [2,0,0,0,0,0|1,0,1]=4 2465 B10R1.17 OCCOc1ccccc1 Amb2209344 [2,0,0,0,0,0|1,0,1]=4 2466 B10R1.17 OCNCc1ccccc1 Amb24756521 [2,0,0,0,0,0|1,0,1]=4 2467 B10R1.17 OCOCc1ccccc1 Amb25727798 [2,0,0,0,0,0|1,0,1]=4 2468 B10R1.17 ONCCc1ccccc1 Amb24117032 [2,0,0,0,0,0|1,0,0]=3 2469 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [2,0,0,0,0,0|2,0,0]=4 2470 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [2,0,0,0,0,0|1,0,1]=4 2471 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [2,0,0,0,0,0|2,0,0]=4 2472 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [2,0,0,0,0,0|0,0,1]=3 2473 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [2,0,0,0,0,0|1,0,1]=4 2474 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [2,0,0,0,0,0|2,0,0]=4 2475 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [2,0,0,0,0,0|2,0,0]=4 2476 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [2,0,0,0,0,0|2,0,0]=4 2477 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [2,0,0,0,0,0|1,0,1]=4 2478 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [2,0,0,0,0,0|1,0,1]=4 2479 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [2,0,0,0,0,0|1,0,1]=4 2480 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [2,0,0,0,0,0|1,0,1]=4 2481 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [2,0,0,0,0,0|0,0,1]=3 2482 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [2,0,0,0,0,0|0,0,1]=3 2483 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [2,0,0,0,0,0|1,0,1]=4 2484 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [2,0,0,0,0,0|2,0,0]=4 2485 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [2,0,0,0,0,0|1,0,1]=4 2486 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [2,0,0,0,0,0|2,0,0]=4 2487 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [2,0,0,0,0,0|1,0,0]=3 2488 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [2,0,0,0,0,0|0,0,1]=3 2489 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [2,0,0,0,0,0|0,0,1]=3 2490 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [2,0,0,0,0,0|2,0,0]=4 2491 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [2,0,0,0,0,0|1,0,0]=3 2492 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [2,0,0,0,0,0|0,0,1]=3 2493 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [2,0,0,0,0,0|1,0,1]=4 2494 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [2,0,0,0,0,0|2,0,0]=4 2495 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [2,0,0,0,0,0|2,0,0]=4 2496 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [2,0,0,0,0,0|1,0,1]=4 2497 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [2,0,0,0,0,0|0,0,1]=3 2498 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [2,0,0,0,0,0|1,0,1]=4 2499 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [2,0,0,0,0,0|0,1,1]=4 2500 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [2,0,0,0,0,0|0,0,0]=2 2501 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [2,0,0,0,0,0|2,0,0]=4 2502 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [2,0,0,0,0,0|0,0,0]=2 2503 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [2,0,0,0,0,0|0,0,0]=2 2504 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [2,0,0,0,0,0|2,0,0]=4 2505 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [2,0,0,0,0,0|1,0,1]=4 2506 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [2,0,0,0,0,0|1,0,1]=4 2507 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [2,0,0,0,0,0|1,0,1]=4 2508 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [2,0,0,0,0,0|1,0,0]=3 2509 B10R1.18 OC(O)C[n+]1ccccc1 Amb25149726 [2,0,0,0,0,0|2,0,0]=4 2510 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [2,0,0,0,0,0|1,0,0]=3 2511 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [2,0,0,0,0,0|2,0,0]=4 2512 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [2,0,0,0,0,0|1,0,1]=4 2513 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [2,0,0,0,0,0|1,0,1]=4 2514 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [2,0,0,0,0,0|1,0,1]=4 2515 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [2,0,0,0,0,0|1,0,1]=4 2516 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [2,0,0,0,0,0|1,0,1]=4 2517 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [2,0,0,0,0,0|1,0,1]=4 2518 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [2,0,0,0,0,0|2,0,0]=4 2519 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [1,1,0,0,0,0|1,0,1]=4 2520 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [1,1,0,0,0,0|2,0,0]=4 2521 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [1,1,0,0,0,0|2,0,0]=4 2522 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [1,1,0,0,0,0|1,0,0]=3 2523 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [1,1,0,0,0,0|1,0,1]=4 2524 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,1,0,0,0,0|1,0,1]=4 2525 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [1,1,0,0,0,0|1,1,0]=4 2526 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [1,1,0,0,0,0|1,0,1]=4 2527 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [1,1,0,0,0,0|2,0,0]=4 2528 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [1,1,0,0,0,0|1,0,1]=4 2529 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [1,1,0,0,0,0|0,0,1]=3 2530 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [1,1,0,0,0,0|1,0,0]=3 2531 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [1,1,0,0,0,0|1,0,1]=4 2532 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [1,1,0,0,0,0|1,0,0]=3 2533 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [1,1,0,0,0,0|2,0,0]=4 2534 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [1,1,0,0,0,0|2,0,0]=4 2535 B12R1.32 NN(CCO)Cc1ccccc1 Amb18646608 [1,1,0,0,0,0|1,0,1]=4 2536 B12R1.32 N[C@@H](CC#N)Cc1ccccc1 Amb24483888 [1,1,0,0,0,0|1,0,1]=4 2537 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [1,1,0,0,0,0|1,0,1]=4 2538 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [1,1,0,0,0,0|1,0,1]=4 2539 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [1,1,0,0,0,0|1,0,1]=4 2540 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [1,1,0,0,0,0|1,0,1]=4 2541 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [1,1,0,0,0,0|1,0,0]=3 2542 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [1,1,0,0,0,0|1,0,1]=4 2543 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [1,1,0,0,0,0|2,0,0]=4 2544 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [1,1,0,0,0,0|2,0,0]=4 2545 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [1,1,0,0,0,0|1,0,0]=3 2546 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [1,1,0,0,0,0|2,0,0]=4 2547 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [1,1,0,0,0,0|2,0,0]=4 2548 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [1,1,0,0,0,0|2,0,0]=4 2549 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [1,1,0,0,0,0|1,0,0]=3 2550 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [1,1,0,0,0,0|2,0,0]=4 2551 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [1,1,0,0,0,0|2,0,0]=4 2552 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [1,1,0,0,0,0|2,0,0]=4 2553 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [1,1,0,0,0,0|1,0,0]=3 2554 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [1,1,0,0,0,0|2,0,0]=4 2555 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [1,1,0,0,0,0|2,0,0]=4 2556 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [1,1,0,0,0,0|1,0,0]=3 2557 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [1,1,0,0,0,0|1,0,0]=3 2558 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [1,1,0,0,0,0|1,0,1]=4 2559 B12R1.34 CC(C(N)C#C)c1ccccc1 Amb25159878 [1,1,0,0,0,0|1,0,1]=4 2560 B12R1.34 CC(C(N)C#N)c1ccccc1 Amb18953074 [1,1,0,0,0,0|1,0,1]=4 2561 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [1,1,0,0,0,0|1,0,1]=4 2562 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [1,1,0,0,0,0|1,0,1]=4 2563 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [1,1,0,0,0,0|1,0,1]=4 2564 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [1,1,0,0,0,0|0,0,1]=3 2565 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [1,1,0,0,0,0|0,0,1]=3 2566 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [1,1,0,0,0,0|2,0,0]=4 2567 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [1,1,0,0,0,0|1,0,1]=4 2568 B12R1.34 CC(C=O)C(O)c1cc[n]cc1 Amb25735254 [1,1,0,0,0,0|2,0,0]=4 2569 B12R1.34 CC(C=O)C(O)c1ccc[n]c1 Amb24669013 [1,1,0,0,0,0|2,0,0]=4 2570 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [1,1,0,0,0,0|1,0,1]=4 2571 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [1,1,0,0,0,0|1,0,1]=4 2572 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [1,1,0,0,0,0|1,0,1]=4 2573 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [1,1,0,0,0,0|2,0,0]=4 2574 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [1,1,0,0,0,0|1,0,1]=4 2575 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [1,1,0,0,0,0|1,0,1]=4 2576 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [1,1,0,0,0,0|1,0,1]=4 2577 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [1,1,0,0,0,0|1,0,1]=4 2578 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [1,1,0,0,0,0|1,0,1]=4 2579 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [1,1,0,0,0,0|1,0,1]=4 2580 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [1,1,0,0,0,0|2,0,0]=4 2581 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [1,1,0,0,0,0|2,0,0]=4 2582 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [1,1,0,0,0,0|2,0,0]=4 2583 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [1,1,0,0,0,0|2,0,0]=4 2584 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [1,1,0,0,0,0|2,0,0]=4 2585 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [1,1,0,0,0,0|1,0,0]=3 2586 B12R1.34 C[C@@H](C=O)[C@@H](O)c1ccc[n]c1 Amb25767826 [1,1,0,0,0,0|2,0,0]=4 2587 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [1,1,0,0,0,0|1,0,0]=3 2588 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [1,1,0,0,0,0|1,0,1]=4 2589 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [1,1,0,0,0,0|1,0,1]=4 2590 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [1,1,0,0,0,0|1,0,1]=4 2591 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [1,1,0,0,0,0|1,0,1]=4 2592 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [1,1,0,0,0,0|1,0,1]=4 2593 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [1,1,0,0,0,0|1,0,0]=3 2594 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [1,1,0,0,0,0|1,0,1]=4 2595 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [1,1,0,0,0,0|1,0,1]=4 2596 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [1,1,0,0,0,0|1,0,0]=3 2597 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [1,1,0,0,0,0|1,0,1]=4 2598 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [1,1,0,0,0,0|1,0,0]=3 2599 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [1,1,0,0,0,0|2,0,0]=4 2600 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [1,1,0,0,0,0|1,0,0]=3 2601 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [1,1,0,0,0,0|1,0,1]=4 2602 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [1,1,0,0,0,0|1,0,1]=4 2603 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [1,1,0,0,0,0|1,0,1]=4 2604 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [1,1,0,0,0,0|2,0,0]=4 2605 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [1,1,0,0,0,0|1,0,1]=4 2606 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [1,1,0,0,0,0|0,0,1]=3 2607 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [1,1,0,0,0,0|2,0,0]=4 2608 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [1,1,0,0,0,0|1,0,1]=4 2609 B12R1.34 NC(=S=O)C(N)c1ccccc1 Amb24739656 [1,1,0,0,0,0|1,0,1]=4 2610 B12R1.34 NC(C#N)C(F)c1ccccc1 Amb25335487 [1,1,0,0,0,0|1,0,1]=4 2611 B12R1.34 NC(C(N)C#N)c1ccccc1 Amb25121131 [1,1,0,0,0,0|1,0,1]=4 2612 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [1,1,0,0,0,0|1,0,1]=4 2613 B12R1.34 NC(C=O)C(=O)c1ccccc1 Amb24106087 [1,1,0,0,0,0|0,0,1]=3 2614 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [1,1,0,0,0,0|1,0,1]=4 2615 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [1,1,0,0,0,0|1,0,1]=4 2616 B12R1.34 NC(CO)C(=O)c1ccccc1 Amb24711479 [1,1,0,0,0,0|0,0,2]=4 2617 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [1,1,0,0,0,0|0,0,1]=3 2618 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [1,1,0,0,0,0|0,0,1]=3 2619 B12R1.34 NC(CO)C(O)c1c[n]ccc1 Amb18826621 [1,1,0,0,0,0|1,0,1]=4 2620 B12R1.34 NC(CO)C(O)c1cccc[n]1 Amb25736521 [1,1,0,0,0,0|1,0,1]=4 2621 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [1,1,0,0,0,0|0,0,1]=3 2622 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [1,1,0,0,0,0|0,0,1]=3 2623 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [1,1,0,0,0,0|0,0,1]=3 2624 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [1,1,0,0,0,0|0,0,1]=3 2625 B12R1.34 N[C@H]([C@@H](N)C#N)c1ccccc1 Amb25084618 [1,1,0,0,0,0|1,0,1]=4 2626 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [1,1,0,0,0,0|0,0,1]=3 2627 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [1,1,0,0,0,0|1,0,1]=4 2628 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [1,1,0,0,0,0|1,0,0]=3 2629 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [1,1,0,0,0,0|1,0,0]=3 2630 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [1,1,0,0,0,0|2,0,0]=4 2631 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [1,1,0,0,0,0|1,0,0]=3 2632 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [1,1,0,0,0,0|1,0,0]=3 2633 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [1,1,0,0,0,0|1,0,1]=4 2634 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [1,1,0,0,0,0|1,0,1]=4 2635 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [1,1,0,0,0,0|1,0,1]=4 2636 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [1,1,0,0,0,0|1,0,1]=4 2637 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [1,1,0,0,0,0|1,0,1]=4 2638 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [1,1,0,0,0,0|1,0,1]=4 2639 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [1,1,0,0,0,0|1,0,1]=4 2640 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [1,1,0,0,0,0|1,0,1]=4 2641 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [1,1,0,0,0,0|1,0,1]=4 2642 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [1,1,0,0,0,0|1,0,1]=4 2643 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [1,1,0,0,0,0|1,0,1]=4 2644 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [1,1,0,0,0,0|1,0,1]=4 2645 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [1,1,0,0,0,0|1,0,0]=3 2646 B12R1.49 C#CC(N)Cc1ccc(Br)cc1 Amb25141816 [1,1,0,0,0,0|1,0,1]=4 2647 B12R1.49 C#CC(N)Cc1ccc(F)cc1 Amb25715124 [1,1,0,0,0,0|1,0,1]=4 2648 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [1,1,0,0,0,0|1,0,1]=4 2649 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [1,1,0,0,0,0|1,0,1]=4 2650 B12R1.49 C=CC(Cl)Cc1ccc(Cl)cc1 Amb25318302 [1,1,0,0,0,0|2,0,0]=4 2651 B12R1.49 C=CC(N)Cc1ccc(Br)cc1 Amb25126467 [1,1,0,0,0,0|1,0,0]=3 2652 B12R1.49 C=CC(N)Cc1ccc(Cl)cc1 Amb25148723 [1,1,0,0,0,0|1,0,0]=3 2653 B12R1.49 C=CC(N)Cc1ccc(F)cc1 Amb24695153 [1,1,0,0,0,0|1,0,0]=3 2654 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [1,1,0,0,0,0|2,0,0]=4 2655 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [1,1,0,0,0,0|2,0,0]=4 2656 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [1,1,0,0,0,0|2,0,0]=4 2657 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [1,1,0,0,0,0|2,0,0]=4 2658 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [1,1,0,0,0,0|1,0,1]=4 2659 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [1,1,0,0,0,0|1,0,0]=3 2660 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [1,1,0,0,0,0|1,0,0]=3 2661 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [1,1,0,0,0,0|1,0,0]=3 2662 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [1,1,0,0,0,0|1,0,1]=4 2663 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [1,1,0,0,0,0|1,0,1]=4 2664 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [1,1,0,0,0,0|1,0,1]=4 2665 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [1,1,0,0,0,0|1,0,1]=4 2666 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [1,1,0,0,0,0|1,0,1]=4 2667 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [1,1,0,0,0,0|1,0,1]=4 2668 B12R1.49 CN(Cc1ccc(O)cc1)C=O Amb18792633 [1,1,0,0,0,0|2,0,0]=4 2669 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [1,1,0,0,0,0|1,0,1]=4 2670 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [1,1,0,0,0,0|1,0,1]=4 2671 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [1,1,0,0,0,0|1,0,1]=4 2672 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [1,1,0,0,0,0|1,0,1]=4 2673 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [1,1,0,0,0,0|1,0,1]=4 2674 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [1,1,0,0,0,0|1,0,1]=4 2675 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [1,1,0,0,0,0|1,0,0]=3 2676 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [1,1,0,0,0,0|1,0,1]=4 2677 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [1,1,0,0,0,0|1,0,0]=3 2678 B12R1.49 Cc1ccc(CC(N)C#C)cc1 Amb25742290 [1,1,0,0,0,0|1,0,1]=4 2679 B12R1.49 Cc1ccc(CC(N)CF)cc1 Amb24564243 [1,1,0,0,0,0|1,0,1]=4 2680 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [1,1,0,0,0,0|2,0,0]=4 2681 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [1,1,0,0,0,0|1,0,0]=3 2682 B12R1.49 Cc1ccc(CN(C)C=O)cc1 Amb24601810 [1,1,0,0,0,0|2,0,0]=4 2683 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [1,1,0,0,0,0|1,0,1]=4 2684 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [1,1,0,0,0,0|1,0,1]=4 2685 B12R1.49 Cc1ccc(C[C@H](N)CO)cc1 Amb25257357 [1,1,0,0,0,0|0,0,1]=3 2686 B12R1.49 Cc1ccc(cc1)SC(C)C=O Amb18648416 [1,1,0,0,0,0|2,0,0]=4 2687 B12R1.49 Cc1ccc(cc1)S[C@@H](C)C=O Amb25122785 [1,1,0,0,0,0|2,0,0]=4 2688 B12R1.49 Cc1ccc(cc1)S[C@H](C)C=O Amb25039916 [1,1,0,0,0,0|2,0,0]=4 2689 B12R1.49 NC(CF)Cc1ccc(Cl)cc1 Amb24080995 [1,1,0,0,0,0|1,0,1]=4 2690 B12R1.49 NC(CO)CC=1C=CC(=O)NC1 Amb24413449 [1,1,0,0,0,0|1,0,1]=4 2691 B12R1.49 NC(CO)Cc1ccc(Br)[n]c1 Amb25200151 [1,1,0,0,0,0|1,0,1]=4 2692 B12R1.49 NC(CO)Cc1ccc(I)cc1 Amb25140389 [1,1,0,0,0,0|0,0,1]=3 2693 B12R1.49 NC(Cc1ccc(Br)cc1)C#N Amb23590819 [1,1,0,0,0,0|1,0,1]=4 2694 B12R1.49 NC(Cc1ccc(Cl)cc1)C#N Amb23557156 [1,1,0,0,0,0|1,0,1]=4 2695 B12R1.49 NC(Cc1ccc(O)cc1)C#N Amb24400599 [1,1,0,0,0,0|1,0,1]=4 2696 B12R1.49 NC(Cc1ccc(O)cc1)CF Amb25276877 [1,1,0,0,0,0|1,0,1]=4 2697 B12R1.49 NCC(N)Cc1ccc(Br)cc1 Amb25280308 [1,1,0,0,0,0|1,0,1]=4 2698 B12R1.49 NCC(N)Cc1ccc(Cl)cc1 Amb18649050 [1,1,0,0,0,0|1,0,1]=4 2699 B12R1.49 NCC(N)Cc1ccc(F)cc1 Amb25245193 [1,1,0,0,0,0|1,0,1]=4 2700 B12R1.49 NC[C@H](N)Cc1ccc(F)cc1 Amb25686081 [1,1,0,0,0,0|1,0,1]=4 2701 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22225388 [1,1,0,0,0,0|0,0,1]=3 2702 B12R1.49 N[C@@H](CO)Cc1ccc(Cl)cc1 Amb22747948 [1,1,0,0,0,0|0,0,1]=3 2703 B12R1.49 N[C@@H](CO)Cc1ccc(F)cc1 Amb22746377 [1,1,0,0,0,0|0,0,1]=3 2704 B12R1.49 N[C@@H](CO)Cc1ccc(I)cc1 Amb20242327 [1,1,0,0,0,0|0,0,1]=3 2705 B12R1.49 N[C@@H](Cc1ccc(F)cc1)C#N Amb24585720 [1,1,0,0,0,0|1,0,1]=4 2706 B12R1.49 N[C@@H](Cc1ccc(I)cc1)C#N Amb22899093 [1,1,0,0,0,0|1,0,1]=4 2707 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C#N Amb24435350 [1,1,0,0,0,0|1,0,1]=4 2708 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [1,1,0,0,0,0|0,0,0]=2 2709 B12R1.49 N[C@H](CO)Cc1ccc(Br)cc1 Amb24453435 [1,1,0,0,0,0|0,0,1]=3 2710 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb19943950 [1,1,0,0,0,0|0,0,1]=3 2711 B12R1.49 N[C@H](CO)Cc1ccc(Cl)cc1 Amb22233150 [1,1,0,0,0,0|0,0,1]=3 2712 B12R1.49 N[C@H](CO)Cc1ccc(F)cc1 Amb22233151 [1,1,0,0,0,0|0,0,1]=3 2713 B12R1.49 N[C@H](CO)Cc1ccc(I)cc1 Amb25200273 [1,1,0,0,0,0|0,0,1]=3 2714 B12R1.49 N[C@H](Cc1ccc(O)cc1)C#N Amb24357641 [1,1,0,0,0,0|1,0,1]=4 2715 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [1,1,0,0,0,0|1,0,1]=4 2716 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [1,1,0,0,0,0|1,0,0]=3 2717 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [1,1,0,0,0,0|0,0,0]=2 2718 B12R1.49 Nc1ccc(C[C@H](N)CO)cc1 Amb22233152 [1,1,0,0,0,0|0,0,1]=3 2719 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [1,1,0,0,0,0|1,0,0]=3 2720 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [1,1,0,0,0,0|1,0,0]=3 2721 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [1,1,0,0,0,0|1,0,0]=3 2722 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [1,1,0,0,0,0|1,0,0]=3 2723 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [1,1,0,0,0,0|1,0,0]=3 2724 B12R1.49 OC(Cc1ccc(Br)c[n]1)C=O Amb24492910 [1,1,0,0,0,0|2,0,0]=4 2725 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [1,1,0,0,0,0|1,0,0]=3 2726 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [1,1,0,0,0,0|1,0,0]=3 2727 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [1,1,0,0,0,0|1,0,0]=3 2728 B12R1.49 OCC(Cc1ccc(cc1)Br)N Amb17062713 [1,1,0,0,0,0|0,0,1]=3 2729 B12R1.49 OCC(Cc1ccc(cc1)C)N Amb17062687 [1,1,0,0,0,0|0,0,1]=3 2730 B12R1.49 OCC(Cc1ccc(cc1)F)N Amb17062689 [1,1,0,0,0,0|0,0,1]=3 2731 B12R1.49 OCC(Cc1ccc(cc1)O)N Amb17062710 [1,1,0,0,0,0|0,0,1]=3 2732 B12R1.49 OCC(F)Cc1ccc(Cl)cc1 Amb25741479 [1,1,0,0,0,0|1,0,1]=4 2733 B12R1.49 OC[C@H](Cc1ccc(cc1)O)N Amb1157858 [1,1,0,0,0,0|0,0,1]=3 2734 B12R1.49 OC[C@H](F)Cc1ccc(F)cc1 Amb24749775 [1,1,0,0,0,0|1,0,1]=4 2735 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [1,1,0,0,0,0|1,0,1]=4 2736 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [1,1,0,0,0,0|1,0,1]=4 2737 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [1,1,0,0,0,0|1,0,1]=4 2738 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [1,1,0,0,0,0|1,0,1]=4 2739 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [1,1,0,0,0,0|1,0,1]=4 2740 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [1,1,0,0,0,0|1,0,0]=3 2741 B12R1.49 Oc1ccc(CC(O)CO)cc1 Amb25092907 [1,1,0,0,0,0|1,0,1]=4 2742 B12R1.49 Oc1ccc(C[C@H](O)CO)cc1 Amb24497177 [1,1,0,0,0,0|1,0,1]=4 2743 B12R1.50 C#CC(N)Cc1cccc(Cl)c1 Amb25148721 [1,1,0,0,0,0|1,0,1]=4 2744 B12R1.50 C#C[C@@H](N)Cc1cccc(F)c1 Amb25825141 [1,1,0,0,0,0|1,0,1]=4 2745 B12R1.50 C=CC(N)Cc1cccc(Cl)c1 Amb25126466 [1,1,0,0,0,0|1,0,0]=3 2746 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [1,1,0,0,0,0|2,0,0]=4 2747 B12R1.50 CC(C=O)Oc1cccc(Cl)c1 Amb19045647 [1,1,0,0,0,0|2,0,0]=4 2748 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [1,1,0,0,0,0|1,0,1]=4 2749 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [1,1,0,0,0,0|1,0,1]=4 2750 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [1,1,0,0,0,0|1,0,1]=4 2751 B12R1.50 CC(Cc1c[n]cc(F)c1)C=O Amb25152372 [1,1,0,0,0,0|2,0,0]=4 2752 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [1,1,0,0,0,0|1,0,1]=4 2753 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [1,1,0,0,0,0|1,0,0]=3 2754 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [1,1,0,0,0,0|2,0,0]=4 2755 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [1,1,0,0,0,0|1,0,0]=3 2756 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [1,1,0,0,0,0|1,0,0]=3 2757 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [1,1,0,0,0,0|1,0,1]=4 2758 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [1,1,0,0,0,0|1,0,1]=4 2759 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [1,1,0,0,0,0|1,0,1]=4 2760 B12R1.50 Cc1c[n]cc(CC(C)C=O)c1 Amb24423759 [1,1,0,0,0,0|2,0,0]=4 2761 B12R1.50 Cc1cc(CC(N)C#N)ccc1 Amb24653997 [1,1,0,0,0,0|1,0,1]=4 2762 B12R1.50 Cc1cc(CC(N)CF)ccc1 Amb24708150 [1,1,0,0,0,0|1,0,1]=4 2763 B12R1.50 Cc1cc(CC(N)CO)c[n]c1 Amb25374367 [1,1,0,0,0,0|1,0,1]=4 2764 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [1,1,0,0,0,0|2,0,0]=4 2765 B12R1.50 Cc1cc(CC(O)CO)ccc1 Amb24397224 [1,1,0,0,0,0|1,0,1]=4 2766 B12R1.50 Cc1cc(C[C@@H](N)CO)ccc1 Amb24362986 [1,1,0,0,0,0|0,0,1]=3 2767 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [1,1,0,0,0,0|2,0,0]=4 2768 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [1,1,0,0,0,0|1,0,0]=3 2769 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [1,1,0,0,0,0|1,0,1]=4 2770 B12R1.50 Cc1cccc(CC(N)CO)[n]1 Amb25737795 [1,1,0,0,0,0|1,0,1]=4 2771 B12R1.50 Cc1cccc(c1)OC(C)C=O Amb25780101 [1,1,0,0,0,0|2,0,0]=4 2772 B12R1.50 NC(CO)CC1=CC=CC(=O)N1 Amb25853681 [1,1,0,0,0,0|1,0,1]=4 2773 B12R1.50 NC(CO)Cc1cc(Br)[n]cc1 Amb25241686 [1,1,0,0,0,0|1,0,1]=4 2774 B12R1.50 NC(CO)Cc1cc(F)ccc1 Amb22751648 [1,1,0,0,0,0|0,0,1]=3 2775 B12R1.50 NC(CO)Cc1cc(I)ccc1 Amb24694473 [1,1,0,0,0,0|0,0,1]=3 2776 B12R1.50 NC(Cc1cc(F)ccc1)CF Amb25267761 [1,1,0,0,0,0|1,0,1]=4 2777 B12R1.50 NC(Cc1cccc(F)c1)C#N Amb24596484 [1,1,0,0,0,0|1,0,1]=4 2778 B12R1.50 NCC(N)Cc1cccc(O)c1 Amb25097207 [1,1,0,0,0,0|1,0,1]=4 2779 B12R1.50 N[C@@H](Cc1cc(O)ccc1)CO Amb22233156 [1,1,0,0,0,0|0,0,1]=3 2780 B12R1.50 N[C@H](CO)Cc1cc(Cl)ccc1 Amb22233154 [1,1,0,0,0,0|0,0,1]=3 2781 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [1,1,0,0,0,0|1,0,1]=4 2782 B12R1.50 Nc1cccc(CC(N)CN)c1 Amb24559863 [1,1,0,0,0,0|1,0,1]=4 2783 B12R1.50 Nc1cccc(C[C@H](N)CO)c1 Amb22233155 [1,1,0,0,0,0|0,0,1]=3 2784 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [1,1,0,0,0,0|1,0,1]=4 2785 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [1,1,0,0,0,0|1,0,1]=4 2786 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [1,1,0,0,0,0|1,0,0]=3 2787 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [1,1,0,0,0,0|1,0,0]=3 2788 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [1,1,0,0,0,0|1,0,0]=3 2789 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [1,1,0,0,0,0|1,0,0]=3 2790 B12R1.50 O=CC(Cl)Cc1c[n]cc(F)c1 Amb25701253 [1,1,0,0,0,0|2,0,0]=4 2791 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [1,1,0,0,0,0|1,0,0]=3 2792 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [1,1,0,0,0,0|1,0,0]=3 2793 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [1,1,0,0,0,0|1,0,0]=3 2794 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [1,1,0,0,0,0|1,0,0]=3 2795 B12R1.50 OCC(Cc1cccc(c1)Br)N Amb17062712 [1,1,0,0,0,0|0,0,1]=3 2796 B12R1.50 OCC(Cc1cccc(c1)C)N Amb17062686 [1,1,0,0,0,0|0,0,1]=3 2797 B12R1.50 OCC(Cc1cccc(c1)Cl)N Amb17062695 [1,1,0,0,0,0|0,0,1]=3 2798 B12R1.50 OCC(Cc1cccc(c1)O)N Amb17062711 [1,1,0,0,0,0|0,0,1]=3 2799 B12R1.50 OCC(O)Cc1cccc(Cl)c1 Amb25281635 [1,1,0,0,0,0|1,0,1]=4 2800 B12R1.50 OCC(S)Cc1cc(F)ccc1 Amb25177551 [1,1,0,0,0,0|1,0,1]=4 2801 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [1,1,0,0,0,0|1,0,1]=4 2802 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [1,1,0,0,0,0|1,0,0]=3 2803 B12R1.50 Oc1cccc(CC(O)CO)c1 Amb24497069 [1,1,0,0,0,0|1,0,1]=4 2804 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [1,1,0,0,0,0|1,0,1]=4 2805 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [1,1,0,0,0,0|1,0,1]=4 2806 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [1,1,0,0,0,0|1,0,1]=4 2807 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [1,1,0,0,0,0|1,0,1]=4 2808 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [1,1,0,0,0,0|2,0,0]=4 2809 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [1,1,0,0,0,0|1,0,1]=4 2810 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [1,1,0,0,0,0|0,0,1]=3 2811 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [1,1,0,0,0,0|1,0,1]=4 2812 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [1,1,0,0,0,0|2,0,0]=4 2813 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [1,1,0,0,0,0|1,0,1]=4 2814 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [1,1,0,0,0,0|1,0,1]=4 2815 B12R1.118 N#CC(C=O)Sc1ccccc1 Amb24422403 [1,1,0,0,0,0|1,0,1]=4 2816 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [1,1,0,0,0,0|0,0,2]=4 2817 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [1,1,0,0,0,0|0,0,1]=3 2818 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [1,1,0,0,0,0|0,0,1]=3 2819 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [1,1,0,0,0,0|1,0,1]=4 2820 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [1,1,0,0,0,0|1,0,1]=4 2821 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [1,1,0,0,0,0|1,0,1]=4 2822 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [1,1,0,0,0,0|2,0,0]=4 2823 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [1,1,0,0,0,0|2,0,0]=4 2824 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [1,1,0,0,0,0|2,0,0]=4 2825 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [1,1,0,0,0,0|1,0,1]=4 2826 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [1,1,0,0,0,0|0,0,1]=3 2827 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [1,1,0,0,0,0|1,0,1]=4 2828 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [1,1,0,0,0,0|1,0,0]=3 2829 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [1,1,0,0,0,0|1,0,1]=4 2830 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [1,1,0,0,0,0|1,0,1]=4 2831 B12R1.194 N#CC(Cc1ccccc1)(N)C Amb17232330 [1,1,0,0,0,0|1,0,1]=4 2832 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [1,1,0,0,0,0|1,0,0]=3 2833 B12R1.194 O=CC(Sc1ccccc1)(C)C Amb2412521 [1,1,0,0,0,0|2,0,0]=4 2834 B12R1.194 OCC(F)(Cl)Cc1ccccc1 Amb25182929 [1,1,0,0,0,0|1,0,1]=4 2835 B12R1.194 OCC(F)(F)Cc1ccccc1 Amb25847026 [1,1,0,0,0,0|1,0,1]=4 2836 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [1,1,0,0,0,0|2,0,0]=4 2837 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [1,1,0,0,0,0|1,0,1]=4 2838 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [1,1,0,0,0,0|1,0,1]=4 2839 B12R1.371 C=CC(Cl)Cc1ccccc1Cl Amb25123891 [1,1,0,0,0,0|2,0,0]=4 2840 B12R1.371 C=CC(N)Cc1ccccc1F Amb24471242 [1,1,0,0,0,0|1,0,0]=3 2841 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [1,1,0,0,0,0|2,0,0]=4 2842 B12R1.371 CC(C=O)Oc1ccccc1Cl Amb25224007 [1,1,0,0,0,0|2,0,0]=4 2843 B12R1.371 CC(CN1C=CC=CC1=O)C=O Amb24727711 [1,1,0,0,0,0|2,0,0]=4 2844 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [1,1,0,0,0,0|1,0,1]=4 2845 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [1,1,0,0,0,0|1,0,1]=4 2846 B12R1.371 CC(Cc1c[n]ccc1N)C=O Amb25057141 [1,1,0,0,0,0|2,0,0]=4 2847 B12R1.371 CC(Cc1ccc[n]c1N)C=O Amb25219354 [1,1,0,0,0,0|2,0,0]=4 2848 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [1,1,0,0,0,0|1,0,0]=3 2849 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [1,1,0,0,0,0|1,0,0]=3 2850 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [1,1,0,0,0,0|1,0,0]=3 2851 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [1,1,0,0,0,0|1,0,0]=3 2852 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [1,1,0,0,0,0|1,0,1]=4 2853 B12R1.371 CN(Cc1ccccc1F)C=O Amb25211597 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.371 CN(Cc1ccccc1O)C=O Amb25349061 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [1,1,0,0,0,0|1,0,1]=4 2856 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [1,1,0,0,0,0|1,0,1]=4 2857 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [1,1,0,0,0,0|1,0,1]=4 2858 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [1,1,0,0,0,0|1,0,1]=4 2859 B12R1.371 Cc1c[n]ccc1CC(N)CO Amb24549921 [1,1,0,0,0,0|1,0,1]=4 2860 B12R1.371 Cc1cc[n]cc1CC(C)C=O Amb24685546 [1,1,0,0,0,0|2,0,0]=4 2861 B12R1.371 Cc1ccc[n]c1CC(N)CO Amb25751493 [1,1,0,0,0,0|1,0,1]=4 2862 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [1,1,0,0,0,0|1,0,0]=3 2863 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [1,1,0,0,0,0|1,0,1]=4 2864 B12R1.371 Cc1ccccc1CC(N)C#C Amb25148677 [1,1,0,0,0,0|1,0,1]=4 2865 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [1,1,0,0,0,0|1,0,0]=3 2866 B12R1.371 Cc1ccccc1CC(O)CO Amb24615514 [1,1,0,0,0,0|1,0,1]=4 2867 B12R1.371 Cc1ccccc1CN(C)C=O Amb25088109 [1,1,0,0,0,0|2,0,0]=4 2868 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [1,1,0,0,0,0|1,0,1]=4 2869 B12R1.371 NC(CF)Cc1ccccc1Cl Amb24596044 [1,1,0,0,0,0|1,0,1]=4 2870 B12R1.371 NC(CO)Cc1[n]cccc1Br Amb24581707 [1,1,0,0,0,0|1,0,1]=4 2871 B12R1.371 NC(CO)Cc1cc[n]cc1Br Amb24542635 [1,1,0,0,0,0|1,0,1]=4 2872 B12R1.371 NC(CO)Cc1cc[n]cc1Cl Amb25669679 [1,1,0,0,0,0|1,0,1]=4 2873 B12R1.371 NC(CO)Cc1cc[n]cc1F Amb25261338 [1,1,0,0,0,0|1,0,1]=4 2874 B12R1.371 NC(CO)Cc1ccc[n]c1Cl Amb25241685 [1,1,0,0,0,0|1,0,1]=4 2875 B12R1.371 NC(CO)Cc1ccccc1Br Amb18747032 [1,1,0,0,0,0|0,0,1]=3 2876 B12R1.371 NC(CO)Cc1ccccc1I Amb25200271 [1,1,0,0,0,0|0,0,1]=3 2877 B12R1.371 NC(Cc1ccccc1Cl)C#N Amb23557157 [1,1,0,0,0,0|1,0,1]=4 2878 B12R1.371 NC(Cc1ccccc1F)CF Amb25255727 [1,1,0,0,0,0|1,0,1]=4 2879 B12R1.371 NC(Cc1ccccc1O)CO Amb18827210 [1,1,0,0,0,0|0,0,1]=3 2880 B12R1.371 N[C@@H](CO)Cc1ccccc1Cl Amb25106847 [1,1,0,0,0,0|0,0,1]=3 2881 B12R1.371 N[C@@H](CO)Cc1ccccc1F Amb25331070 [1,1,0,0,0,0|0,0,1]=3 2882 B12R1.371 N[C@H](CO)Cc1ccccc1Br Amb24424605 [1,1,0,0,0,0|0,0,1]=3 2883 B12R1.371 N[C@H](CO)Cc1ccccc1Cl Amb22233157 [1,1,0,0,0,0|0,0,1]=3 2884 B12R1.371 N[C@H](CO)Cc1ccccc1F Amb25308478 [1,1,0,0,0,0|0,0,1]=3 2885 B12R1.371 Nc1[n]cccc1CC(O)C=O Amb24388693 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.371 Nc1c[n]ccc1CC(N)CO Amb25287483 [1,1,0,0,0,0|1,0,1]=4 2887 B12R1.371 Nc1cc[n]cc1CC(O)C=O Amb25115388 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.371 Nc1ccccc1CC(N)CO Amb25712145 [1,1,0,0,0,0|0,0,1]=3 2889 B12R1.371 Nc1ccccc1C[C@H](N)CO Amb22233158 [1,1,0,0,0,0|0,0,1]=3 2890 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [1,1,0,0,0,0|1,0,0]=3 2891 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [1,1,0,0,0,0|1,0,0]=3 2892 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [1,1,0,0,0,0|1,0,0]=3 2893 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [1,1,0,0,0,0|1,0,0]=3 2894 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [1,1,0,0,0,0|1,0,0]=3 2895 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [1,1,0,0,0,0|1,0,0]=3 2896 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [1,1,0,0,0,0|1,0,0]=3 2897 B12R1.371 OC(Cc1[n]cccc1Br)C=O Amb25817354 [1,1,0,0,0,0|2,0,0]=4 2898 B12R1.371 OC(Cc1cc[n]cc1Cl)C=O Amb25789139 [1,1,0,0,0,0|2,0,0]=4 2899 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [1,1,0,0,0,0|1,0,0]=3 2900 B12R1.371 OCC(Cc1ccccc1C)N Amb17062685 [1,1,0,0,0,0|0,0,1]=3 2901 B12R1.371 OCC(Cc1ccccc1Cl)N Amb17062694 [1,1,0,0,0,0|0,0,1]=3 2902 B12R1.371 OCC(Cc1ccccc1F)N Amb17062688 [1,1,0,0,0,0|0,0,1]=3 2903 B12R1.371 ON(Cc1ccccc1Cl)C=O Amb22469654 [1,1,0,0,0,0|2,0,0]=4 2904 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [1,1,0,0,0,0|1,0,1]=4 2905 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [1,1,0,0,0,0|1,0,1]=4 2906 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [1,1,0,0,0,0|1,0,0]=3 2907 B12R1.21 CC(=O)CCC=1C=CC(=O)NC1 Amb24346528 [1,1,0,0,0,0|2,0,0]=4 2908 B12R1.21 CC(=O)CCN1C=CC(=O)C=C1 Amb24483600 [1,1,0,0,0,0|2,0,0]=4 2909 B12R1.21 CC(=O)CCc1ccc(Br)c[n]1 Amb25729593 [1,1,0,0,0,0|2,0,0]=4 2910 B12R1.21 CC(=O)CCc1ccc(Cl)[n]c1 Amb25725533 [1,1,0,0,0,0|2,0,0]=4 2911 B12R1.21 CC(=O)CNc1ccc(Cl)cc1 Amb24729554 [1,1,0,0,0,0|2,0,0]=4 2912 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [1,1,0,0,0,0|2,0,0]=4 2913 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [1,1,0,0,0,0|2,0,0]=4 2914 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [1,1,0,0,0,0|2,0,0]=4 2915 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [1,1,0,0,0,0|2,0,0]=4 2916 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [1,1,0,0,0,0|2,0,0]=4 2917 B12R1.21 CC(=O)NCc1ccc(cc1)O Amb10549495 [1,1,0,0,0,0|2,0,0]=4 2918 B12R1.21 CC(=O)OCc1ccc(I)cc1 Amb25687671 [1,1,0,0,0,0|2,0,0]=4 2919 B12R1.21 CC(=O)OCc1ccc(O)cc1 Amb18646455 [1,1,0,0,0,0|2,0,0]=4 2920 B12R1.21 CC(=O)OCc1ccc(cc1)Cl Amb2421366 [1,1,0,0,0,0|2,0,0]=4 2921 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [1,1,0,0,0,0|2,0,0]=4 2922 B12R1.21 CC(CCc1ccc(cc1)Cl)O Amb17507284 [1,1,0,0,0,0|1,0,1]=4 2923 B12R1.21 CC(CCc1ccc(cc1)F)O Amb17507285 [1,1,0,0,0,0|1,0,1]=4 2924 B12R1.21 CC(CCc1ccc(cc1)O)O Amb1110722 [1,1,0,0,0,0|1,0,1]=4 2925 B12R1.21 CC(O)CCc1ccc(Br)cc1 Amb24056590 [1,1,0,0,0,0|1,0,1]=4 2926 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [1,1,0,0,0,0|2,0,0]=4 2927 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [1,1,0,0,0,0|2,0,0]=4 2928 B12R1.21 C[C@@H](O)CCc1ccc(O)cc1 Amb23604212 [1,1,0,0,0,0|1,0,1]=4 2929 B12R1.21 C[n+]1ccc(cc1)SCC(O)=O Amb22482794 [1,1,0,0,0,0|2,0,0]=4 2930 B12R1.21 Cc1c[n]c(CCC(O)=O)c[n]1 Amb18827880 [1,1,0,0,0,0|2,0,0]=4 2931 B12R1.21 Cc1ccc(CCC(C)=O)c[n]1 Amb25197877 [1,1,0,0,0,0|2,0,0]=4 2932 B12R1.21 Cc1ccc(CCC(C)O)cc1 Amb18800837 [1,1,0,0,0,0|1,0,1]=4 2933 B12R1.21 Cc1ccc(CCC(N)=N)cc1 Amb18065466 [1,1,0,0,0,0|2,0,0]=4 2934 B12R1.21 Cc1ccc(CCC(O)=O)[n]c1 Amb22886574 [1,1,0,0,0,0|1,0,0]=3 2935 B12R1.21 Cc1ccc(CCC(O)=O)c[n]1 Amb18828437 [1,1,0,0,0,0|1,0,0]=3 2936 B12R1.21 Cc1ccc([n]c1)OCC(O)=O Amb24359369 [1,1,0,0,0,0|2,0,0]=4 2937 B12R1.21 Cc1ccc(c[n]1)OCC(O)=O Amb18991754 [1,1,0,0,0,0|2,0,0]=4 2938 B12R1.21 Cc1ccc(cc1)CC[N+](=O)[O-] Amb17400178 [1,1,0,0,0,0|1,0,1]=4 2939 B12R1.21 Cc1ccc(cc1)NCC(C)=O Amb25068510 [1,1,0,0,0,0|2,0,0]=4 2940 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [1,1,0,0,0,0|1,0,0]=3 2941 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [1,1,0,0,0,0|1,0,0]=3 2942 B12R1.21 ClC(=O)COc1ccc(cc1)Br Amb16186415 [1,1,0,0,0,0|2,0,0]=4 2943 B12R1.21 ClC(=O)COc1ccc(cc1)C Amb10880011 [1,1,0,0,0,0|2,0,0]=4 2944 B12R1.21 ClC(=O)CSc1ccc(cc1)Cl Amb17143821 [1,1,0,0,0,0|2,0,0]=4 2945 B12R1.21 NC(=N)CCc1ccc(Br)cc1 Amb18571448 [1,1,0,0,0,0|2,0,0]=4 2946 B12R1.21 NC(=N)CCc1ccc(Cl)cc1 Amb18564231 [1,1,0,0,0,0|2,0,0]=4 2947 B12R1.21 NC(=N)CCc1ccc(F)cc1 Amb18563719 [1,1,0,0,0,0|2,0,0]=4 2948 B12R1.21 NC(=N)CCc1ccc(cc1)O Amb13883011 [1,1,0,0,0,0|2,0,0]=4 2949 B12R1.21 NC(=O)CCN1C=CC(=O)C=C1 Amb18788434 [1,1,0,0,0,0|2,0,0]=4 2950 B12R1.21 NC(=O)CCc1cc[n+](cc1)C Amb10553742 [1,1,0,0,0,0|2,0,0]=4 2951 B12R1.21 NC(=O)CCc1cc[n+](cc1)[O-] Amb10553010 [1,1,0,0,0,0|2,0,0]=4 2952 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [1,1,0,0,0,0|1,0,0]=3 2953 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [1,1,0,0,0,0|1,0,0]=3 2954 B12R1.21 NC(=O)COc1ccc(cc1)F Amb2456996 [1,1,0,0,0,0|2,0,0]=4 2955 B12R1.21 NC(=O)COc1ccc(cc1)I Amb173371 [1,1,0,0,0,0|2,0,0]=4 2956 B12R1.21 NC(=O)CSc1ccc(O)cc1 Amb19057102 [1,1,0,0,0,0|2,0,0]=4 2957 B12R1.21 NC(=O)CSc1ccc(cc1)Br Amb1218433 [1,1,0,0,0,0|2,0,0]=4 2958 B12R1.21 NC(=O)CSc1ccc(cc1)Cl Amb1530887 [1,1,0,0,0,0|2,0,0]=4 2959 B12R1.21 NC(=O)CSc1ccc(cc1)F Amb1646201 [1,1,0,0,0,0|2,0,0]=4 2960 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [1,1,0,0,0,0|2,0,0]=4 2961 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [1,1,0,0,0,0|2,0,0]=4 2962 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [1,1,0,0,0,0|2,0,0]=4 2963 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [1,1,0,0,0,0|2,0,0]=4 2964 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [1,1,0,0,0,0|2,0,0]=4 2965 B12R1.21 NC(=S)CCc1ccc(cc1)Cl Amb17237061 [1,1,0,0,0,0|1,1,0]=4 2966 B12R1.21 Nc1ccc(CCC(O)=O)[n]c1 Amb24663664 [1,1,0,0,0,0|1,0,0]=3 2967 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb19958679 [1,1,0,0,0,0|1,0,0]=3 2968 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb22546430 [1,1,0,0,0,0|1,0,0]=3 2969 B12R1.21 Nc1ccc(CC[N+]([O-])=O)cc1 Amb24406773 [1,1,0,0,0,0|1,0,1]=4 2970 B12R1.21 Nc1ccc([n]c1)SCC(O)=O Amb18291280 [1,1,0,0,0,0|2,0,0]=4 2971 B12R1.21 Nc1ccc(c[n]1)NCC(O)=O Amb18987715 [1,1,0,0,0,0|2,0,0]=4 2972 B12R1.21 Nc1ccc(cc1)C#CC(O)=O Amb25111179 [1,1,0,0,0,0|0,0,2]=4 2973 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [1,1,0,0,0,0|1,0,0]=3 2974 B12R1.21 Nc1ccc(cc1)NCS(O)=O Amb25732370 [1,1,0,0,0,0|2,0,0]=4 2975 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [1,1,0,0,0,0|1,0,0]=3 2976 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [1,1,0,0,0,0|1,0,0]=3 2977 B12R1.21 O=C(Cl)CNc1ccc(Cl)cc1 Amb24537780 [1,1,0,0,0,0|2,0,0]=4 2978 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [1,1,0,0,0,0|2,0,0]=4 2979 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [1,1,0,0,0,0|2,0,0]=4 2980 B12R1.21 OB(O)CCc1ccc(Cl)cc1 Amb25667152 [1,1,0,0,0,0|1,0,1]=4 2981 B12R1.21 OB(O)CCc1ccc(F)cc1 Amb25149900 [1,1,0,0,0,0|1,0,1]=4 2982 B12R1.21 OC(=O)C#Cc1ccc(cc1)C Amb17138496 [1,1,0,0,0,0|0,0,2]=4 2983 B12R1.21 OC(=O)C#Cc1ccc(cc1)Cl Amb10575987 [1,1,0,0,0,0|0,0,2]=4 2984 B12R1.21 OC(=O)C#Cc1ccc(cc1)F Amb17138570 [1,1,0,0,0,0|0,0,2]=4 2985 B12R1.21 OC(=O)C=Cc1ccc(I)cc1 Amb24079623 [1,1,0,0,0,0|0,0,2]=4 2986 B12R1.21 OC(=O)CCC1=CNC(=O)N=C1 Amb24541305 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.21 OC(=O)CCC=1C=CC(=O)NN1 Amb18212062 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.21 OC(=O)CCN1C=CC(=O)C=C1 Amb18534262 [1,1,0,0,0,0|1,0,0]=3 2989 B12R1.21 OC(=O)CCN1C=CC(=S)C=C1 Amb25751169 [1,1,0,0,0,0|1,0,0]=3 2990 B12R1.21 OC(=O)CC[n+]1ccc(cc1)C Amb17098177 [1,1,0,0,0,0|1,0,0]=3 2991 B12R1.21 OC(=O)CCc1[n]cc(F)c[n]1 Amb24673852 [1,1,0,0,0,0|2,0,0]=4 2992 B12R1.21 OC(=O)CCc1ccc(Br)[n]c1 Amb22292277 [1,1,0,0,0,0|1,0,0]=3 2993 B12R1.21 OC(=O)CCc1ccc(Cl)[n]c1 Amb18649204 [1,1,0,0,0,0|1,0,0]=3 2994 B12R1.21 OC(=O)CCc1ccc(F)[n]c1 Amb22886575 [1,1,0,0,0,0|1,0,0]=3 2995 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [1,1,0,0,0,0|0,0,0]=2 2996 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [1,1,0,0,0,0|0,0,0]=2 2997 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [1,1,0,0,0,0|0,0,0]=2 2998 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [1,1,0,0,0,0|0,0,0]=2 2999 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [1,1,0,0,0,0|1,0,0]=3 3000 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [1,1,0,0,0,0|1,0,0]=3 3001 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [1,1,0,0,0,0|1,0,0]=3 3002 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [1,1,0,0,0,0|1,0,0]=3 3003 B12R1.21 OC(=O)CNc1ccc(cn1)N Amb17041212 [1,1,0,0,0,0|2,0,0]=4 3004 B12R1.21 OC(=O)CON1C=CC(=O)C=C1 Amb18647100 [1,1,0,0,0,0|2,0,0]=4 3005 B12R1.21 OC(=O)COc1ccc(F)c[n]1 Amb24748685 [1,1,0,0,0,0|2,0,0]=4 3006 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [1,1,0,0,0,0|1,0,0]=3 3007 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [1,1,0,0,0,0|1,0,0]=3 3008 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [1,1,0,0,0,0|1,0,0]=3 3009 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [1,1,0,0,0,0|1,0,0]=3 3010 B12R1.21 OC(=O)CSc1ccc(F)c[n]1 Amb18976422 [1,1,0,0,0,0|2,0,0]=4 3011 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [1,1,0,0,0,0|1,0,0]=3 3012 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [1,1,0,0,0,0|1,0,0]=3 3013 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [1,1,0,0,0,0|1,0,0]=3 3014 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [1,1,0,0,0,0|1,0,0]=3 3015 B12R1.21 OC(=O)CSc1ccc(nc1)N Amb17305688 [1,1,0,0,0,0|2,0,0]=4 3016 B12R1.21 OC(=O)NCc1ccc(Cl)[n]c1 Amb24068954 [1,1,0,0,0,0|2,0,0]=4 3017 B12R1.21 OC(=O)\C=C/c1ccc(F)cc1 Amb24712642 [1,1,0,0,0,0|0,0,2]=4 3018 B12R1.21 OC(=O)\C=C/c1ccc(cc1)Cl Amb2553273 [1,1,0,0,0,0|0,0,2]=4 3019 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Br Amb1209603 [1,1,0,0,0,0|0,0,2]=4 3020 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Cl Amb1210744 [1,1,0,0,0,0|0,0,2]=4 3021 B12R1.21 OC(=O)\C=C\c1ccc(cc1)I Amb2227429 [1,1,0,0,0,0|0,0,2]=4 3022 B12R1.21 OC(=O)\C=C\c1ccc(cc1)N Amb1196689 [1,1,0,0,0,0|0,0,2]=4 3023 B12R1.21 OC(=O)\C=C\c1ccc(cc1)O Amb1207922 [1,1,0,0,0,0|0,0,2]=4 3024 B12R1.21 OC(=O)\C=C\c1ccc(cc1)S Amb17616840 [1,1,0,0,0,0|0,0,2]=4 3025 B12R1.21 Oc1ccc(CCC(O)=O)[n][n]1 Amb21937853 [1,1,0,0,0,0|2,0,0]=4 3026 B12R1.21 Oc1ccc(cc1)C#CC(O)=O Amb23569631 [1,1,0,0,0,0|0,0,2]=4 3027 B12R1.21 Oc1ccc(cc1)OCC(=O)Cl Amb24467045 [1,1,0,0,0,0|2,0,0]=4 3028 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [1,1,0,0,0,0|1,0,0]=3 3029 B12R1.21 [O-][N+](=O)CCc1ccc(F)cc1 Amb18542361 [1,1,0,0,0,0|1,0,1]=4 3030 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [1,1,0,0,0,0|2,0,0]=4 3031 B12R1.27 C#CC(=O)CCc1cc[n]cc1 Amb24684499 [1,1,0,0,0,0|2,0,0]=4 3032 B12R1.27 C#CC(=O)CCc1ccc[n]c1 Amb25271085 [1,1,0,0,0,0|2,0,0]=4 3033 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [1,1,0,0,0,0|1,0,0]=3 3034 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [1,1,0,0,0,0|2,0,0]=4 3035 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [1,1,0,0,0,0|2,0,0]=4 3036 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [1,1,0,0,0,0|2,0,0]=4 3037 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [1,1,0,0,0,0|2,0,0]=4 3038 B12R1.27 C#CC(O)CCc1ccccc1 Amb25024201 [1,1,0,0,0,0|1,0,1]=4 3039 B12R1.27 C#C[C@H](O)CCc1ccccc1 Amb25266374 [1,1,0,0,0,0|1,0,1]=4 3040 B12R1.27 C=C(CO)CNc1ccccc1 Amb24537817 [1,1,0,0,0,0|2,0,0]=4 3041 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [1,1,0,0,0,0|1,0,0]=3 3042 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [1,1,0,0,0,0|2,0,0]=4 3043 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [1,1,0,0,0,0|2,0,0]=4 3044 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [1,1,0,0,0,0|1,0,1]=4 3045 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [1,1,0,0,0,0|2,0,0]=4 3046 B12R1.27 COC(=N)CCc1cc[n]cc1 Amb18563635 [1,1,0,0,0,0|2,0,0]=4 3047 B12R1.27 COC(=N)CCc1ccc[n]c1 Amb18563630 [1,1,0,0,0,0|2,0,0]=4 3048 B12R1.27 COC(=N)CCc1cccc[n]1 Amb18563625 [1,1,0,0,0,0|2,0,0]=4 3049 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [1,1,0,0,0,0|2,0,0]=4 3050 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [1,1,0,0,0,0|2,0,0]=4 3051 B12R1.27 COC(=O)CCc1c[n]c[n]c1 Amb21922892 [1,1,0,0,0,0|2,0,0]=4 3052 B12R1.27 COC(=O)CCc1cc[n][n]c1 Amb23454523 [1,1,0,0,0,0|2,0,0]=4 3053 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [1,1,0,0,0,0|1,0,0]=3 3054 B12R1.27 COC(=O)CNc1ccc[n]c1 Amb18270093 [1,1,0,0,0,0|2,0,0]=4 3055 B12R1.27 COC(=O)COc1cccc[n]1 Amb24095859 [1,1,0,0,0,0|2,0,0]=4 3056 B12R1.27 COC(=O)CSc1cccc[n]1 Amb22280333 [1,1,0,0,0,0|2,0,0]=4 3057 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [1,1,0,0,0,0|2,0,0]=4 3058 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [1,1,0,0,0,0|2,0,0]=4 3059 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [1,1,0,0,0,0|1,0,0]=3 3060 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [1,1,0,0,0,0|2,0,0]=4 3061 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [1,1,0,0,0,0|1,1,0]=4 3062 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [1,1,0,0,0,0|1,0,1]=4 3063 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [1,1,0,0,0,0|1,0,1]=4 3064 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [1,1,0,0,0,0|1,0,0]=3 3065 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [1,1,0,0,0,0|2,0,0]=4 3066 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [1,1,0,0,0,0|1,0,0]=3 3067 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [1,1,0,0,0,0|2,0,0]=4 3068 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [1,1,0,0,0,0|1,0,0]=3 3069 B12R1.27 N#CC(O)CCc1ccccc1 Amb18177732 [1,1,0,0,0,0|1,0,1]=4 3070 B12R1.27 N#C[C@@H](O)CCc1ccccc1 Amb25073440 [1,1,0,0,0,0|1,0,1]=4 3071 B12R1.27 N#C[C@H](O)CCc1ccccc1 Amb24344695 [1,1,0,0,0,0|1,0,1]=4 3072 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [1,1,0,0,0,0|2,0,0]=4 3073 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [1,1,0,0,0,0|1,0,0]=3 3074 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [1,1,0,0,0,0|2,0,0]=4 3075 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [1,1,0,0,0,0|2,0,0]=4 3076 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [1,1,0,0,0,0|2,0,0]=4 3077 B12R1.27 NNC(=O)CCc1cccc[n]1 Amb25299317 [1,1,0,0,0,0|2,0,0]=4 3078 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [1,1,0,0,0,0|1,0,0]=3 3079 B12R1.27 NNC(=O)CCc1ccncc1 Amb10553044 [1,1,0,0,0,0|2,0,0]=4 3080 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [1,1,0,0,0,0|2,0,0]=4 3081 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [1,1,0,0,0,0|2,0,0]=4 3082 B12R1.27 N\C(\CCc1c[n]ccc1)=N/O Amb24678911 [1,1,0,0,0,0|2,0,0]=4 3083 B12R1.27 N\C(\CCc1cc[n]cc1)=N/O Amb18792640 [1,1,0,0,0,0|2,0,0]=4 3084 B12R1.27 N\C(\CCc1cccc[n]1)=N/O Amb18792639 [1,1,0,0,0,0|2,0,0]=4 3085 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [1,1,0,0,0,0|2,0,0]=4 3086 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [1,1,0,0,0,0|1,0,0]=3 3087 B12R1.27 N\C(\CNc1ccccc1)=N\O Amb24614329 [1,1,0,0,0,0|2,0,0]=4 3088 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [1,1,0,0,0,0|1,0,1]=4 3089 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [1,1,0,0,0,0|1,0,0]=3 3090 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [1,1,0,0,0,0|2,0,0]=4 3091 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [1,1,0,0,0,0|2,0,0]=4 3092 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [1,1,0,0,0,0|2,0,0]=4 3093 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [1,1,0,0,0,0|2,0,0]=4 3094 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [1,1,0,0,0,0|2,0,0]=4 3095 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [1,1,0,0,0,0|1,0,1]=4 3096 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [1,1,0,0,0,0|0,0,2]=4 3097 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [1,1,0,0,0,0|1,0,0]=3 3098 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [1,1,0,0,0,0|1,0,0]=3 3099 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [1,1,0,0,0,0|1,0,0]=3 3100 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [1,1,0,0,0,0|0,0,0]=2 3101 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [1,1,0,0,0,0|1,0,0]=3 3102 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [1,1,0,0,0,0|1,0,0]=3 3103 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [1,1,0,0,0,0|2,0,0]=4 3104 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [1,1,0,0,0,0|2,0,0]=4 3105 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [1,1,0,0,0,0|2,0,0]=4 3106 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [1,1,0,0,0,0|0,0,2]=4 3107 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [1,1,0,0,0,0|1,0,1]=4 3108 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [1,1,0,0,0,0|1,0,1]=4 3109 B12R1.27 ONC(=O)CCc1c[n]cc[n]1 Amb25279606 [1,1,0,0,0,0|2,0,0]=4 3110 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [1,1,0,0,0,0|1,0,0]=3 3111 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [1,1,0,0,0,0|1,0,0]=3 3112 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [1,1,0,0,0,0|1,0,0]=3 3113 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [1,1,0,0,0,0|1,0,0]=3 3114 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [1,1,0,0,0,0|1,1,0]=4 3115 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [1,1,0,0,0,0|1,0,1]=4 3116 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [1,1,0,0,0,0|1,0,0]=3 3117 B12R1.27 O\N=C(\COc1ccccc1)/N Amb1154723 [1,1,0,0,0,0|2,0,0]=4 3118 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [1,1,0,0,0,0|2,0,0]=4 3119 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [1,1,0,0,0,0|0,0,2]=4 3120 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [1,1,0,0,0,0|1,0,1]=4 3121 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [1,1,0,0,0,0|0,0,1]=3 3122 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [1,1,0,0,0,0|2,0,0]=4 3123 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [1,1,0,0,0,0|2,0,0]=4 3124 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [1,1,0,0,0,0|2,0,0]=4 3125 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [1,1,0,0,0,0|2,0,0]=4 3126 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [1,1,0,0,0,0|2,0,0]=4 3127 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [1,1,0,0,0,0|2,0,0]=4 3128 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [1,1,0,0,0,0|2,0,0]=4 3129 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [1,1,0,0,0,0|2,0,0]=4 3130 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [1,1,0,0,0,0|2,0,0]=4 3131 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [1,1,0,0,0,0|2,0,0]=4 3132 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [1,1,0,0,0,0|2,0,0]=4 3133 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [1,1,0,0,0,0|2,0,0]=4 3134 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [1,1,0,0,0,0|2,0,0]=4 3135 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [1,1,0,0,0,0|1,0,1]=4 3136 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [1,1,0,0,0,0|2,0,0]=4 3137 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [1,1,0,0,0,0|1,1,0]=4 3138 B12R1.107 CC(CC(O)=O)c1[n]ccc[n]1 Amb25135402 [1,1,0,0,0,0|2,0,0]=4 3139 B12R1.107 CC(CC(O)=O)c1c[n]cc[n]1 Amb24487345 [1,1,0,0,0,0|2,0,0]=4 3140 B12R1.107 CC(CC(O)=O)c1cc[n]c[n]1 Amb24589784 [1,1,0,0,0,0|2,0,0]=4 3141 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [1,1,0,0,0,0|0,0,2]=4 3142 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [1,1,0,0,0,0|2,0,0]=4 3143 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [1,1,0,0,0,0|1,0,0]=3 3144 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [1,1,0,0,0,0|1,0,1]=4 3145 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [1,1,0,0,0,0|2,0,0]=4 3146 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [1,1,0,0,0,0|1,0,1]=4 3147 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [1,1,0,0,0,0|1,0,1]=4 3148 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [1,1,0,0,0,0|1,0,1]=4 3149 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [1,1,0,0,0,0|1,0,1]=4 3150 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [1,1,0,0,0,0|0,0,0]=2 3151 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [1,1,0,0,0,0|2,0,0]=4 3152 B12R1.107 CN(CC(O)=O)c1ccc[n]c1 Amb18268673 [1,1,0,0,0,0|2,0,0]=4 3153 B12R1.107 CN(CC(O)=O)c1cccc[n]1 Amb22275945 [1,1,0,0,0,0|2,0,0]=4 3154 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [1,1,0,0,0,0|2,0,0]=4 3155 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [1,1,0,0,0,0|1,0,0]=3 3156 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [1,1,0,0,0,0|1,0,0]=3 3157 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [1,1,0,0,0,0|2,0,0]=4 3158 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [1,1,0,0,0,0|2,0,0]=4 3159 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [1,1,0,0,0,0|2,0,0]=4 3160 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [1,1,0,0,0,0|1,0,1]=4 3161 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [1,1,0,0,0,0|1,0,1]=4 3162 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [1,1,0,0,0,0|0,0,0]=2 3163 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [1,1,0,0,0,0|1,0,1]=4 3164 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [1,1,0,0,0,0|2,0,0]=4 3165 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [1,1,0,0,0,0|1,0,1]=4 3166 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [1,1,0,0,0,0|1,0,1]=4 3167 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [1,1,0,0,0,0|1,0,1]=4 3168 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [1,1,0,0,0,0|1,0,1]=4 3169 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [1,1,0,0,0,0|1,0,1]=4 3170 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [1,1,0,0,0,0|0,0,0]=2 3171 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [1,1,0,0,0,0|0,0,2]=4 3172 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [1,1,0,0,0,0|0,0,2]=4 3173 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [1,1,0,0,0,0|2,0,0]=4 3174 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [1,1,0,0,0,0|2,0,0]=4 3175 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [1,1,0,0,0,0|1,0,0]=3 3176 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [1,1,0,0,0,0|1,0,0]=3 3177 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [1,1,0,0,0,0|2,0,0]=4 3178 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [1,1,0,0,0,0|2,0,0]=4 3179 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [1,1,0,0,0,0|1,0,0]=3 3180 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [1,1,0,0,0,0|2,0,0]=4 3181 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [1,1,0,0,0,0|1,1,0]=4 3182 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [1,1,0,0,0,0|1,0,1]=4 3183 B12R1.107 NC(CC(O)=O)c1c[n]cc[n]1 Amb24377112 [1,1,0,0,0,0|2,0,0]=4 3184 B12R1.107 NC(CC(O)=O)c1cc[n]c[n]1 Amb25148500 [1,1,0,0,0,0|2,0,0]=4 3185 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [1,1,0,0,0,0|1,0,0]=3 3186 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [1,1,0,0,0,0|1,0,0]=3 3187 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [1,1,0,0,0,0|1,0,0]=3 3188 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [1,1,0,0,0,0|0,0,0]=2 3189 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [1,1,0,0,0,0|1,0,0]=3 3190 B12R1.107 N[C@@H](CC(O)=O)c1c[n]c[n]c1 Amb25324427 [1,1,0,0,0,0|2,0,0]=4 3191 B12R1.107 N[C@@H](CC(O)=O)c1c[n]cc[n]1 Amb25800392 [1,1,0,0,0,0|2,0,0]=4 3192 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [1,1,0,0,0,0|1,0,0]=3 3193 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [1,1,0,0,0,0|1,0,0]=3 3194 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [1,1,0,0,0,0|1,0,0]=3 3195 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [1,1,0,0,0,0|1,0,0]=3 3196 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [1,1,0,0,0,0|1,0,0]=3 3197 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [1,1,0,0,0,0|1,0,0]=3 3198 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [1,1,0,0,0,0|1,0,0]=3 3199 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [1,1,0,0,0,0|1,0,0]=3 3200 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [1,1,0,0,0,0|0,0,2]=4 3201 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [1,1,0,0,0,0|0,0,2]=4 3202 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [1,1,0,0,0,0|1,0,1]=4 3203 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [1,1,0,0,0,0|0,0,1]=3 3204 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [1,1,0,0,0,0|1,0,0]=3 3205 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [1,1,0,0,0,0|1,0,0]=3 3206 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [1,1,0,0,0,0|1,0,0]=3 3207 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [1,1,0,0,0,0|0,0,0]=2 3208 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [1,1,0,0,0,0|1,0,0]=3 3209 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [1,1,0,0,0,0|0,0,0]=2 3210 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [1,1,0,0,0,0|1,0,0]=3 3211 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [1,1,0,0,0,0|1,0,0]=3 3212 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [1,1,0,0,0,0|0,0,0]=2 3213 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [1,1,0,0,0,0|1,0,0]=3 3214 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [1,1,0,0,0,0|1,0,0]=3 3215 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [1,1,0,0,0,0|1,0,0]=3 3216 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [1,1,0,0,0,0|0,0,2]=4 3217 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [1,1,0,0,0,0|0,2,0]=4 3218 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [1,1,0,0,0,0|1,0,1]=4 3219 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [1,1,0,0,0,0|1,0,1]=4 3220 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [1,1,0,0,0,0|0,0,2]=4 3221 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [1,1,0,0,0,0|0,0,2]=4 3222 B12R1.125 CC(=O)CCC1=CC=CNC1=O Amb24404877 [1,1,0,0,0,0|2,0,0]=4 3223 B12R1.125 CC(=O)CCc1[n]cccc1Br Amb25703295 [1,1,0,0,0,0|2,0,0]=4 3224 B12R1.125 CC(=O)CCc1[n]cccc1O Amb24537666 [1,1,0,0,0,0|2,0,0]=4 3225 B12R1.125 CC(=O)CCc1c[n]ccc1Cl Amb25044219 [1,1,0,0,0,0|2,0,0]=4 3226 B12R1.125 CC(=O)CCc1cc[n]cc1Cl Amb24678607 [1,1,0,0,0,0|2,0,0]=4 3227 B12R1.125 CC(=O)CCc1ccc[n]c1Cl Amb25731066 [1,1,0,0,0,0|2,0,0]=4 3228 B12R1.125 CC(=O)CCc1ccc[n]c1N Amb25687160 [1,1,0,0,0,0|2,0,0]=4 3229 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [1,1,0,0,0,0|1,0,0]=3 3230 B12R1.125 CC(=O)CNc1ccccc1Cl Amb24552973 [1,1,0,0,0,0|2,0,0]=4 3231 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [1,1,0,0,0,0|2,0,0]=4 3232 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [1,1,0,0,0,0|2,0,0]=4 3233 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [1,1,0,0,0,0|2,0,0]=4 3234 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [1,1,0,0,0,0|2,0,0]=4 3235 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [1,1,0,0,0,0|2,0,0]=4 3236 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [1,1,0,0,0,0|2,0,0]=4 3237 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [1,1,0,0,0,0|2,0,0]=4 3238 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [1,1,0,0,0,0|2,0,0]=4 3239 B12R1.125 CC(=O)NCc1ccccc1N Amb18284299 [1,1,0,0,0,0|2,0,0]=4 3240 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [1,1,0,0,0,0|2,0,0]=4 3241 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [1,1,0,0,0,0|2,0,0]=4 3242 B12R1.125 CC(=O)OCc1ccccc1F Amb25788639 [1,1,0,0,0,0|2,0,0]=4 3243 B12R1.125 CC(=O)OCc1ccccc1O Amb18646465 [1,1,0,0,0,0|2,0,0]=4 3244 B12R1.125 CC(=O)SCc1ccccc1F Amb22231630 [1,1,0,0,0,0|2,0,0]=4 3245 B12R1.125 CC(CCc1ccccc1O)O Amb17507249 [1,1,0,0,0,0|1,0,1]=4 3246 B12R1.125 CC(O)CCc1ccccc1Br Amb25763352 [1,1,0,0,0,0|1,0,1]=4 3247 B12R1.125 CC(O)CCc1ccccc1Cl Amb19075162 [1,1,0,0,0,0|1,0,1]=4 3248 B12R1.125 CC(O)CCc1ccccc1F Amb18805845 [1,1,0,0,0,0|1,0,1]=4 3249 B12R1.125 CC(O)CCc1ccccc1N Amb24485690 [1,1,0,0,0,0|1,0,1]=4 3250 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [1,1,0,0,0,0|2,0,0]=4 3251 B12R1.125 Cc1[n]c[n]cc1CCC(O)=O Amb18827881 [1,1,0,0,0,0|2,0,0]=4 3252 B12R1.125 Cc1[n]cccc1CCC(C)=O Amb25859556 [1,1,0,0,0,0|2,0,0]=4 3253 B12R1.125 Cc1[n]cccc1CCC(O)=O Amb18853387 [1,1,0,0,0,0|1,0,0]=3 3254 B12R1.125 Cc1[n]cccc1OCC(O)=O Amb24729073 [1,1,0,0,0,0|2,0,0]=4 3255 B12R1.125 Cc1c[n]c[n]c1CCC(O)=O Amb18827882 [1,1,0,0,0,0|2,0,0]=4 3256 B12R1.125 Cc1c[n]ccc1OCC(O)=O Amb25705533 [1,1,0,0,0,0|2,0,0]=4 3257 B12R1.125 Cc1cc[n]cc1CCC(O)=O Amb18828438 [1,1,0,0,0,0|1,0,0]=3 3258 B12R1.125 Cc1ccc[n]c1OCC(O)=O Amb25154207 [1,1,0,0,0,0|2,0,0]=4 3259 B12R1.125 Cc1ccc[n]c1SCC(O)=O Amb18989775 [1,1,0,0,0,0|2,0,0]=4 3260 B12R1.125 Cc1cccc[n+]1CCC(O)=O Amb24410939 [1,1,0,0,0,0|1,0,0]=3 3261 B12R1.125 Cc1ccccc1C#CC(O)=O Amb20673097 [1,1,0,0,0,0|0,0,2]=4 3262 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [1,1,0,0,0,0|1,0,0]=3 3263 B12R1.125 Cc1ccccc1CCC(C)O Amb18800836 [1,1,0,0,0,0|1,0,1]=4 3264 B12R1.125 Cc1ccccc1CCC(N)=N Amb18065464 [1,1,0,0,0,0|2,0,0]=4 3265 B12R1.125 Cc1ccccc1CNC(C)=O Amb24721874 [1,1,0,0,0,0|2,0,0]=4 3266 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [1,1,0,0,0,0|2,0,0]=4 3267 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [1,1,0,0,0,0|2,0,0]=4 3268 B12R1.125 Cc1ccccc1CSC(C)=O Amb22231631 [1,1,0,0,0,0|2,0,0]=4 3269 B12R1.125 Cc1ccccc1NCC(C)=O Amb25062983 [1,1,0,0,0,0|2,0,0]=4 3270 B12R1.125 Cc1ccccc1SCC(C)=O Amb18796318 [1,1,0,0,0,0|2,0,0]=4 3271 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [1,1,0,0,0,0|1,0,0]=3 3272 B12R1.125 ClC(=O)COc1ccccc1Br Amb16230053 [1,1,0,0,0,0|2,0,0]=4 3273 B12R1.125 ClC(=O)COc1ccccc1C Amb10880009 [1,1,0,0,0,0|2,0,0]=4 3274 B12R1.125 ClC(=O)COc1ccccc1Cl Amb16230049 [1,1,0,0,0,0|2,0,0]=4 3275 B12R1.125 ClC(=O)COc1ccccc1F Amb10880012 [1,1,0,0,0,0|2,0,0]=4 3276 B12R1.125 ClC(=O)CSc1ccccc1C Amb17143248 [1,1,0,0,0,0|2,0,0]=4 3277 B12R1.125 ClC(=O)CSc1ccccc1Cl Amb17143819 [1,1,0,0,0,0|2,0,0]=4 3278 B12R1.125 NC(=N)CCc1ccccc1Br Amb18070244 [1,1,0,0,0,0|2,0,0]=4 3279 B12R1.125 NC(=N)CCc1ccccc1Cl Amb10844871 [1,1,0,0,0,0|2,0,0]=4 3280 B12R1.125 NC(=N)CCc1ccccc1F Amb18563718 [1,1,0,0,0,0|2,0,0]=4 3281 B12R1.125 NC(=O)CCc1[n]cccc1O Amb25760722 [1,1,0,0,0,0|2,0,0]=4 3282 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [1,1,0,0,0,0|1,0,0]=3 3283 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [1,1,0,0,0,0|1,0,0]=3 3284 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [1,1,0,0,0,0|1,0,0]=3 3285 B12R1.125 NC(=O)CNc1ccccc1I Amb142128 [1,1,0,0,0,0|2,0,0]=4 3286 B12R1.125 NC(=O)COc1ccccc1Br Amb1174441 [1,1,0,0,0,0|2,0,0]=4 3287 B12R1.125 NC(=O)COc1ccccc1I Amb15712041 [1,1,0,0,0,0|2,0,0]=4 3288 B12R1.125 NC(=O)CSc1ccccc1Br Amb10189178 [1,1,0,0,0,0|2,0,0]=4 3289 B12R1.125 NC(=O)CSc1ccccc1N Amb1215630 [1,1,0,0,0,0|2,0,0]=4 3290 B12R1.125 NC(=O)CSc1ccccc1O Amb19045199 [1,1,0,0,0,0|2,0,0]=4 3291 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [1,1,0,0,0,0|2,0,0]=4 3292 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [1,1,0,0,0,0|2,0,0]=4 3293 B12R1.125 NC(=S)CCc1ccccc1F Amb17234010 [1,1,0,0,0,0|1,1,0]=4 3294 B12R1.125 Nc1[n]cccc1CCC(O)=O Amb25124989 [1,1,0,0,0,0|1,0,0]=3 3295 B12R1.125 Nc1[n]cccc1OCC(O)=O Amb18290784 [1,1,0,0,0,0|2,0,0]=4 3296 B12R1.125 Nc1c[n]ccc1NCC(O)=O Amb18987716 [1,1,0,0,0,0|2,0,0]=4 3297 B12R1.125 Nc1c[n]ccc1SCC(O)=O Amb18291275 [1,1,0,0,0,0|2,0,0]=4 3298 B12R1.125 Nc1cc[n]cc1CCC(O)=O Amb24375593 [1,1,0,0,0,0|1,0,0]=3 3299 B12R1.125 Nc1ccc[n]c1NCC(O)=O Amb18989766 [1,1,0,0,0,0|2,0,0]=4 3300 B12R1.125 Nc1ccc[n]c1SCC(O)=O Amb18976381 [1,1,0,0,0,0|2,0,0]=4 3301 B12R1.125 Nc1ccccc1/C=C/C(O)=O Amb17777291 [1,1,0,0,0,0|0,0,2]=4 3302 B12R1.125 Nc1ccccc1C#CC(O)=O Amb24355867 [1,1,0,0,0,0|0,0,2]=4 3303 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [1,1,0,0,0,0|0,0,0]=2 3304 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [1,1,0,0,0,0|2,0,0]=4 3305 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [1,1,0,0,0,0|1,0,0]=3 3306 B12R1.125 Nc1ccccc1OCC([O-])=O Amb21972214 [1,1,0,0,0,0|1,0,1]=4 3307 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [1,1,0,0,0,0|1,0,0]=3 3308 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [1,1,0,0,0,0|1,0,0]=3 3309 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [1,1,0,0,0,0|2,0,0]=4 3310 B12R1.125 O=C(Cl)OCc1ccccc1Cl Amb21618686 [1,1,0,0,0,0|2,0,0]=4 3311 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [1,1,0,0,0,0|2,0,0]=4 3312 B12R1.125 OC(=O)C#Cc1ccccc1Br Amb25266206 [1,1,0,0,0,0|0,0,2]=4 3313 B12R1.125 OC(=O)CCC1=CC=CNC1=O Amb18262602 [1,1,0,0,0,0|1,0,0]=3 3314 B12R1.125 OC(=O)CCC1=CN=CNC1=O Amb23248037 [1,1,0,0,0,0|2,0,0]=4 3315 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb18534261 [1,1,0,0,0,0|1,0,0]=3 3316 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb21955606 [1,1,0,0,0,0|1,0,0]=3 3317 B12R1.125 OC(=O)CCN1C=CC=NC1=O Amb18989182 [1,1,0,0,0,0|2,0,0]=4 3318 B12R1.125 OC(=O)CCN1C=CC=NC1=O Amb19372721 [1,1,0,0,0,0|2,0,0]=4 3319 B12R1.125 OC(=O)CCN1C=CN=CC1=O Amb24702797 [1,1,0,0,0,0|2,0,0]=4 3320 B12R1.125 OC(=O)CCN1N=CC=CC1=O Amb18998778 [1,1,0,0,0,0|2,0,0]=4 3321 B12R1.125 OC(=O)CCc1[n]cccc1F Amb25311377 [1,1,0,0,0,0|1,0,0]=3 3322 B12R1.125 OC(=O)CCc1c[n]c[n]c1Cl Amb18821790 [1,1,0,0,0,0|2,0,0]=4 3323 B12R1.125 OC(=O)CCc1c[n]ccc1Br Amb25253329 [1,1,0,0,0,0|1,0,0]=3 3324 B12R1.125 OC(=O)CCc1c[n]ccc1Cl Amb25270751 [1,1,0,0,0,0|1,0,0]=3 3325 B12R1.125 OC(=O)CCc1cc[n]cc1Cl Amb23596515 [1,1,0,0,0,0|1,0,0]=3 3326 B12R1.125 OC(=O)CCc1ccc[n]c1Br Amb24525068 [1,1,0,0,0,0|1,0,0]=3 3327 B12R1.125 OC(=O)CCc1ccc[n]c1Cl Amb24484270 [1,1,0,0,0,0|1,0,0]=3 3328 B12R1.125 OC(=O)CCc1ccc[n]c1F Amb25295347 [1,1,0,0,0,0|1,0,0]=3 3329 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [1,1,0,0,0,0|0,0,0]=2 3330 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [1,1,0,0,0,0|0,0,0]=2 3331 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [1,1,0,0,0,0|0,0,0]=2 3332 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [1,1,0,0,0,0|0,0,0]=2 3333 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [1,1,0,0,0,0|0,0,0]=2 3334 B12R1.125 OC(=O)CCn1ccccc1=O Amb1124605 [1,1,0,0,0,0|1,0,0]=3 3335 B12R1.125 OC(=O)CNc1[n]cccc1Br Amb25295571 [1,1,0,0,0,0|2,0,0]=4 3336 B12R1.125 OC(=O)CNc1[n]cccc1F Amb25777049 [1,1,0,0,0,0|2,0,0]=4 3337 B12R1.125 OC(=O)CNc1c[n]ccc1Cl Amb22495942 [1,1,0,0,0,0|2,0,0]=4 3338 B12R1.125 OC(=O)CNc1cc[n]cc1Cl Amb25119621 [1,1,0,0,0,0|2,0,0]=4 3339 B12R1.125 OC(=O)CNc1ccc[n]c1F Amb24615818 [1,1,0,0,0,0|2,0,0]=4 3340 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [1,1,0,0,0,0|1,0,0]=3 3341 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [1,1,0,0,0,0|1,0,0]=3 3342 B12R1.125 OC(=O)CNc1ncccc1Cl Amb2372425 [1,1,0,0,0,0|2,0,0]=4 3343 B12R1.125 OC(=O)COc1[n]cccc1Cl Amb18649694 [1,1,0,0,0,0|2,0,0]=4 3344 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [1,1,0,0,0,0|1,0,0]=3 3345 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [1,1,0,0,0,0|1,0,0]=3 3346 B12R1.125 OC(=O)CSc1[n]cccc1Br Amb18979322 [1,1,0,0,0,0|2,0,0]=4 3347 B12R1.125 OC(=O)CSc1[n]cccc1F Amb18996004 [1,1,0,0,0,0|2,0,0]=4 3348 B12R1.125 OC(=O)CSc1cc[n]cc1Cl Amb23557951 [1,1,0,0,0,0|2,0,0]=4 3349 B12R1.125 OC(=O)CSc1cccc[n+]1[O-] Amb1104911 [1,1,0,0,0,0|2,0,0]=4 3350 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [1,1,0,0,0,0|1,0,0]=3 3351 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [1,1,0,0,0,0|1,0,0]=3 3352 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [1,1,0,0,0,0|1,0,0]=3 3353 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [1,1,0,0,0,0|1,0,0]=3 3354 B12R1.125 OC(=O)\C=C/c1ccccc1Cl Amb10070070 [1,1,0,0,0,0|0,0,2]=4 3355 B12R1.125 OC(=O)\C=C\c1ccccc1I Amb22584152 [1,1,0,0,0,0|0,0,2]=4 3356 B12R1.125 OC(=O)\C=C\c1ccccc1O Amb1935207 [1,1,0,0,0,0|0,0,2]=4 3357 B12R1.125 OC(=O)\C=C\c1ccccc1S Amb18128711 [1,1,0,0,0,0|0,0,2]=4 3358 B12R1.125 Oc1ccc[n]c1NCC(O)=O Amb18114848 [1,1,0,0,0,0|2,0,0]=4 3359 B12R1.125 Oc1ccc[n]c1SCC(O)=O Amb25798926 [1,1,0,0,0,0|2,0,0]=4 3360 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [1,1,0,0,0,0|1,0,0]=3 3361 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [1,1,0,0,0,0|1,0,0]=3 3362 B12R1.125 [O-]C(=O)COc1ccccc1O Amb10789357 [1,1,0,0,0,0|1,0,1]=4 3363 B12R1.125 [O-][N+](=O)CCc1ccccc1C Amb17400176 [1,1,0,0,0,0|1,0,1]=4 3364 B12R1.125 [O-][N+](=O)CCc1ccccc1Cl Amb17401072 [1,1,0,0,0,0|1,0,1]=4 3365 B12R1.125 [O-][N+](=O)CCc1ccccc1F Amb17400297 [1,1,0,0,0,0|1,0,1]=4 3366 B12R1.125 [O-][n+]1ccccc1NCC(O)=O Amb24560168 [1,1,0,0,0,0|2,0,0]=4 3367 B12R1.226 CC(=O)CCc1c[n]cc(F)c1 Amb25034788 [1,1,0,0,0,0|2,0,0]=4 3368 B12R1.226 CC(=O)CCc1cccc(O)[n]1 Amb24605336 [1,1,0,0,0,0|2,0,0]=4 3369 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [1,1,0,0,0,0|1,0,0]=3 3370 B12R1.226 CC(=O)CNc1cccc(Cl)c1 Amb24626052 [1,1,0,0,0,0|2,0,0]=4 3371 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [1,1,0,0,0,0|2,0,0]=4 3372 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [1,1,0,0,0,0|2,0,0]=4 3373 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [1,1,0,0,0,0|2,0,0]=4 3374 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [1,1,0,0,0,0|2,0,0]=4 3375 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [1,1,0,0,0,0|2,0,0]=4 3376 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [1,1,0,0,0,0|2,0,0]=4 3377 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [1,1,0,0,0,0|2,0,0]=4 3378 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [1,1,0,0,0,0|2,0,0]=4 3379 B12R1.226 CC(=O)NCc1cccc(O)c1 Amb18792630 [1,1,0,0,0,0|2,0,0]=4 3380 B12R1.226 CC(=O)NCc1cccc(c1)Br Amb2085743 [1,1,0,0,0,0|2,0,0]=4 3381 B12R1.226 CC(=O)NCc1cccc(c1)Cl Amb2023612 [1,1,0,0,0,0|2,0,0]=4 3382 B12R1.226 CC(=O)OCc1cccc(Br)c1 Amb25099120 [1,1,0,0,0,0|2,0,0]=4 3383 B12R1.226 CC(=O)OCc1cccc(Cl)c1 Amb25306228 [1,1,0,0,0,0|2,0,0]=4 3384 B12R1.226 CC(=O)OCc1cccc(F)c1 Amb25145061 [1,1,0,0,0,0|2,0,0]=4 3385 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [1,1,0,0,0,0|2,0,0]=4 3386 B12R1.226 CC(=O)OCc1cccc(c1)C Amb10601899 [1,1,0,0,0,0|2,0,0]=4 3387 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [1,1,0,0,0,0|2,0,0]=4 3388 B12R1.226 CC(=O)SCc1cccc(F)c1 Amb22231633 [1,1,0,0,0,0|2,0,0]=4 3389 B12R1.226 CC(CCc1cccc(c1)C)O Amb17507253 [1,1,0,0,0,0|1,0,1]=4 3390 B12R1.226 CC(O)CCc1cc(O)ccc1 Amb25251886 [1,1,0,0,0,0|1,0,1]=4 3391 B12R1.226 CC(O)CCc1cccc(Cl)c1 Amb19075161 [1,1,0,0,0,0|1,0,1]=4 3392 B12R1.226 CC(O)CCc1cccc(F)c1 Amb18805846 [1,1,0,0,0,0|1,0,1]=4 3393 B12R1.226 Cc1[n]c(CCC(O)=O)cc[n]1 Amb24342069 [1,1,0,0,0,0|2,0,0]=4 3394 B12R1.226 Cc1c[n]cc(CCC(O)=O)[n]1 Amb18827855 [1,1,0,0,0,0|2,0,0]=4 3395 B12R1.226 Cc1cc(CCB(O)O)ccc1 Amb25790748 [1,1,0,0,0,0|1,0,1]=4 3396 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [1,1,0,0,0,0|1,0,0]=3 3397 B12R1.226 Cc1cc(CCC(C)=O)cc[n]1 Amb24677051 [1,1,0,0,0,0|2,0,0]=4 3398 B12R1.226 Cc1cc(CCC(N)=N)ccc1 Amb18065465 [1,1,0,0,0,0|2,0,0]=4 3399 B12R1.226 Cc1cc(CCC(N)=O)[n]cc1 Amb25858570 [1,1,0,0,0,0|2,0,0]=4 3400 B12R1.226 Cc1cc(CCC(O)=O)[n]c[n]1 Amb18827877 [1,1,0,0,0,0|2,0,0]=4 3401 B12R1.226 Cc1cc(CCC(O)=O)[n]cc1 Amb18828439 [1,1,0,0,0,0|1,0,0]=3 3402 B12R1.226 Cc1cc(CCC(O)=O)c[n]c1 Amb22886573 [1,1,0,0,0,0|1,0,0]=3 3403 B12R1.226 Cc1cc(CCC(O)=O)cc[n]1 Amb22886572 [1,1,0,0,0,0|1,0,0]=3 3404 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [1,1,0,0,0,0|2,0,0]=4 3405 B12R1.226 Cc1cc(NCC(=O)O)ncc1 Amb10597602 [1,1,0,0,0,0|2,0,0]=4 3406 B12R1.226 Cc1cc([n]cc1)OCC(O)=O Amb25154209 [1,1,0,0,0,0|2,0,0]=4 3407 B12R1.226 Cc1cc([n]cc1)SCC(O)=O Amb18982392 [1,1,0,0,0,0|2,0,0]=4 3408 B12R1.226 Cc1cc(cc[n]1)NCC(O)=O Amb25733691 [1,1,0,0,0,0|2,0,0]=4 3409 B12R1.226 Cc1cc(cc[n]1)OCC(O)=O Amb24450470 [1,1,0,0,0,0|2,0,0]=4 3410 B12R1.226 Cc1cc(ccc1)C#CC(O)=O Amb20673071 [1,1,0,0,0,0|0,0,2]=4 3411 B12R1.226 Cc1cc[n]c(CCC(O)=O)[n]1 Amb18862660 [1,1,0,0,0,0|2,0,0]=4 3412 B12R1.226 Cc1cccc([n]1)OCC(O)=O Amb24389213 [1,1,0,0,0,0|2,0,0]=4 3413 B12R1.226 Cc1cccc(c1)NCC(C)=O Amb25831083 [1,1,0,0,0,0|2,0,0]=4 3414 B12R1.226 Cc1cccc(c1)SCC(C)=O Amb18791171 [1,1,0,0,0,0|2,0,0]=4 3415 B12R1.226 ClC(=O)COc1cccc(c1)Br Amb16230149 [1,1,0,0,0,0|2,0,0]=4 3416 B12R1.226 ClC(=O)COc1cccc(c1)C Amb10880010 [1,1,0,0,0,0|2,0,0]=4 3417 B12R1.226 ClC(=O)CSc1cccc(c1)C Amb17143249 [1,1,0,0,0,0|2,0,0]=4 3418 B12R1.226 ClC(=O)CSc1cccc(c1)Cl Amb17143820 [1,1,0,0,0,0|2,0,0]=4 3419 B12R1.226 NC(=N)CCc1cccc(Br)c1 Amb18571443 [1,1,0,0,0,0|2,0,0]=4 3420 B12R1.226 NC(=N)CCc1cccc(Cl)c1 Amb18564230 [1,1,0,0,0,0|2,0,0]=4 3421 B12R1.226 NC(=N)CCc1cccc(F)c1 Amb18563720 [1,1,0,0,0,0|2,0,0]=4 3422 B12R1.226 NC(=O)CCc1c[n]cc(F)c1 Amb25821158 [1,1,0,0,0,0|2,0,0]=4 3423 B12R1.226 NC(=O)CCc1c[n]cc(O)c1 Amb25833308 [1,1,0,0,0,0|2,0,0]=4 3424 B12R1.226 NC(=O)CCc1cc(Br)cc[n]1 Amb24671371 [1,1,0,0,0,0|2,0,0]=4 3425 B12R1.226 NC(=O)CCc1cc(Cl)cc[n]1 Amb25046525 [1,1,0,0,0,0|2,0,0]=4 3426 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [1,1,0,0,0,0|1,0,0]=3 3427 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [1,1,0,0,0,0|1,0,0]=3 3428 B12R1.226 NC(=O)CNc1cccc(c1)Br Amb143565 [1,1,0,0,0,0|2,0,0]=4 3429 B12R1.226 NC(=O)COc1cccc(c1)Br Amb192032 [1,1,0,0,0,0|2,0,0]=4 3430 B12R1.226 NC(=O)COc1cccc(c1)I Amb181273 [1,1,0,0,0,0|2,0,0]=4 3431 B12R1.226 NC(=O)COc1cccc(c1)N Amb1112358 [1,1,0,0,0,0|2,0,0]=4 3432 B12R1.226 NC(=O)CSc1cccc(Br)c1 Amb25726747 [1,1,0,0,0,0|2,0,0]=4 3433 B12R1.226 NC(=O)CSc1cccc(F)c1 Amb25784013 [1,1,0,0,0,0|2,0,0]=4 3434 B12R1.226 NC(=O)CSc1cccc(O)c1 Amb25102367 [1,1,0,0,0,0|2,0,0]=4 3435 B12R1.226 NC(=O)CSc1cccc(c1)C Amb17142988 [1,1,0,0,0,0|2,0,0]=4 3436 B12R1.226 NC(=O)CSc1cccc(c1)Cl Amb17143258 [1,1,0,0,0,0|2,0,0]=4 3437 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [1,1,0,0,0,0|2,0,0]=4 3438 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [1,1,0,0,0,0|2,0,0]=4 3439 B12R1.226 Nc1[n]c(CCC(O)=O)cc[n]1 Amb18827317 [1,1,0,0,0,0|2,0,0]=4 3440 B12R1.226 Nc1cc(CCC(O)=O)c[n]c1 Amb25760281 [1,1,0,0,0,0|1,0,0]=3 3441 B12R1.226 Nc1cc(CCC(O)=O)cc[n]1 Amb24105413 [1,1,0,0,0,0|1,0,0]=3 3442 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [1,1,0,0,0,0|0,0,1]=3 3443 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [1,1,0,0,0,0|0,0,1]=3 3444 B12R1.226 Nc1cc(NCC(O)=O)[n]cc1 Amb18295951 [1,1,0,0,0,0|2,0,0]=4 3445 B12R1.226 Nc1cc(ccc1)C#CC(O)=O Amb24650985 [1,1,0,0,0,0|0,0,2]=4 3446 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [1,1,0,0,0,0|1,0,0]=3 3447 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [1,1,0,0,0,0|1,0,0]=3 3448 B12R1.226 Nc1cc[n]c(CCC(O)=O)[n]1 Amb18827285 [1,1,0,0,0,0|2,0,0]=4 3449 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [1,1,0,0,0,0|2,0,0]=4 3450 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [1,1,0,0,0,0|1,0,0]=3 3451 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [1,1,0,0,0,0|1,0,0]=3 3452 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [1,1,0,0,0,0|1,0,0]=3 3453 B12R1.226 O=C(Cl)OCc1cccc(Br)c1 Amb24649567 [1,1,0,0,0,0|2,0,0]=4 3454 B12R1.226 OB(O)CCc1cccc(F)c1 Amb24392487 [1,1,0,0,0,0|1,0,1]=4 3455 B12R1.226 OC(=O)C#Cc1cc(Br)ccc1 Amb23504362 [1,1,0,0,0,0|0,0,2]=4 3456 B12R1.226 OC(=O)C#Cc1cc(Cl)ccc1 Amb20673086 [1,1,0,0,0,0|0,0,2]=4 3457 B12R1.226 OC(=O)C#Cc1cc(F)ccc1 Amb20673102 [1,1,0,0,0,0|0,0,2]=4 3458 B12R1.226 OC(=O)CCC1=CC(=O)C=CN1 Amb25230528 [1,1,0,0,0,0|1,0,0]=3 3459 B12R1.226 OC(=O)CCc1c[n]cc(Cl)c1 Amb25689846 [1,1,0,0,0,0|1,0,0]=3 3460 B12R1.226 OC(=O)CCc1c[n]cc(F)c1 Amb23450303 [1,1,0,0,0,0|1,0,0]=3 3461 B12R1.226 OC(=O)CCc1cc(F)cc[n]1 Amb22886576 [1,1,0,0,0,0|1,0,0]=3 3462 B12R1.226 OC(=O)CCc1cc[n]c(Br)c1 Amb24418909 [1,1,0,0,0,0|1,0,0]=3 3463 B12R1.226 OC(=O)CCc1cc[n]c(Cl)[n]1 Amb24346496 [1,1,0,0,0,0|2,0,0]=4 3464 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [1,1,0,0,0,0|0,0,0]=2 3465 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [1,1,0,0,0,0|0,0,0]=2 3466 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [1,1,0,0,0,0|0,0,0]=2 3467 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [1,1,0,0,0,0|0,0,0]=2 3468 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [1,1,0,0,0,0|0,0,0]=2 3469 B12R1.226 OC(=O)CNc1c[n]cc(Br)c1 Amb24483737 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.226 OC(=O)CNc1cc(Br)cc[n]1 Amb24343807 [1,1,0,0,0,0|2,0,0]=4 3471 B12R1.226 OC(=O)CNc1cc(Cl)cc[n]1 Amb24697669 [1,1,0,0,0,0|2,0,0]=4 3472 B12R1.226 OC(=O)CNc1cccc(Br)[n]1 Amb22899453 [1,1,0,0,0,0|2,0,0]=4 3473 B12R1.226 OC(=O)CNc1cccc(Cl)[n]1 Amb25736170 [1,1,0,0,0,0|2,0,0]=4 3474 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [1,1,0,0,0,0|1,0,0]=3 3475 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [1,1,0,0,0,0|1,0,0]=3 3476 B12R1.226 OC(=O)COc1c[n]cc(Br)c1 Amb24271218 [1,1,0,0,0,0|2,0,0]=4 3477 B12R1.226 OC(=O)COc1c[n]cc(F)c1 Amb25760871 [1,1,0,0,0,0|2,0,0]=4 3478 B12R1.226 OC(=O)COc1cc(Br)cc[n]1 Amb18660970 [1,1,0,0,0,0|2,0,0]=4 3479 B12R1.226 OC(=O)COc1cc[n]c(Br)c1 Amb18660965 [1,1,0,0,0,0|2,0,0]=4 3480 B12R1.226 OC(=O)COc1cc[n]c(Cl)c1 Amb25792389 [1,1,0,0,0,0|2,0,0]=4 3481 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [1,1,0,0,0,0|1,0,0]=3 3482 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [1,1,0,0,0,0|1,0,0]=3 3483 B12R1.226 OC(=O)CSc1cc[n]c(Cl)c1 Amb25279825 [1,1,0,0,0,0|2,0,0]=4 3484 B12R1.226 OC(=O)CSc1cccc(Cl)[n]1 Amb25835703 [1,1,0,0,0,0|2,0,0]=4 3485 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [1,1,0,0,0,0|1,0,0]=3 3486 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [1,1,0,0,0,0|1,0,0]=3 3487 B12R1.226 OC(=O)\C=C/c1cccc(c1)F Amb16185904 [1,1,0,0,0,0|0,0,2]=4 3488 B12R1.226 OC(=O)\C=C\c1cccc(c1)Br Amb1207365 [1,1,0,0,0,0|0,0,2]=4 3489 B12R1.226 OC(=O)\C=C\c1cccc(c1)C Amb1212079 [1,1,0,0,0,0|0,0,2]=4 3490 B12R1.226 OC(=O)\C=C\c1cccc(c1)Cl Amb1209598 [1,1,0,0,0,0|0,0,2]=4 3491 B12R1.226 OC(=O)\C=C\c1cccc(c1)F Amb1210956 [1,1,0,0,0,0|0,0,2]=4 3492 B12R1.226 OC(=O)\C=C\c1cccc(c1)I Amb2236388 [1,1,0,0,0,0|0,0,2]=4 3493 B12R1.226 OC(=O)\C=C\c1cccc(c1)N Amb1197625 [1,1,0,0,0,0|0,0,2]=4 3494 B12R1.226 OC(=O)\C=C\c1cccc(c1)O Amb1137756 [1,1,0,0,0,0|0,0,2]=4 3495 B12R1.226 Oc1[n]c(CCC(O)=O)cc[n]1 Amb18826808 [1,1,0,0,0,0|2,0,0]=4 3496 B12R1.226 Oc1c[n]cc(CCC(O)=O)c1 Amb24435210 [1,1,0,0,0,0|1,0,0]=3 3497 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [1,1,0,0,0,0|1,0,0]=3 3498 B12R1.226 Oc1cc(CCC(O)=O)[n]c[n]1 Amb18862743 [1,1,0,0,0,0|2,0,0]=4 3499 B12R1.226 Oc1cc[n]c(CCC(O)=O)[n]1 Amb18862742 [1,1,0,0,0,0|2,0,0]=4 3500 B12R1.226 Oc1cccc(c1)C#CC(O)=O Amb23569602 [1,1,0,0,0,0|0,0,2]=4 3501 B12R1.226 Oc1cccc(c1)\C=C/C(O)=O Amb24584528 [1,1,0,0,0,0|0,0,2]=4 3502 B12R1.226 [O-][N+](=O)CCc1cccc(O)c1 Amb25141958 [1,1,0,0,0,0|1,0,1]=4 3503 B12R1.226 [O-][N+](=O)CCc1cccc(c1)C Amb17400177 [1,1,0,0,0,0|1,0,1]=4 3504 B12R1.226 [O-][N+](=O)CCc1cccc(c1)Cl Amb17401073 [1,1,0,0,0,0|1,0,1]=4 3505 B12R1.891 CC(C)(O)CCc1ccccc1 Amb18540684 [1,1,0,0,0,0|1,0,1]=4 3506 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [1,1,0,0,0,0|1,0,1]=4 3507 B12R1.891 ClS(=O)(=O)CCc1ccccc1 Amb1130049 [1,1,0,0,0,0|1,0,1]=4 3508 B12R1.891 O=S(=O)(Br)CCc1ccccc1 Amb23555507 [1,1,0,0,0,0|1,0,1]=4 3509 B12R1.891 O=S(=O)(F)CCc1ccccc1 Amb19375026 [1,1,0,0,0,0|1,0,1]=4 3510 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [1,1,0,0,0,0|1,0,0]=3 3511 B12R1.891 OS(=O)(=O)NCc1ccccc1 Amb22551828 [1,1,0,0,0,0|2,0,0]=4 3512 B12R1.891 [O-]S(=O)(=O)CCc1ccccc1 Amb22457030 [1,1,0,0,0,0|1,0,1]=4 3513 B12R1.3110 CC1(CCC(O)=O)C=CCC=C1 Amb24677697 [1,1,0,0,0,0|0,0,2]=4 3514 B12R1.104 CC(C(=O)O)Cc1ccc(o1)C Amb17605842 [0,1,0,0,1,0|2,0,0]=4 3515 B12R1.104 CC(C(=O)O)Cc1ccc(s1)C Amb17605840 [0,1,0,0,1,0|2,0,0]=4 3516 B12R1.104 CC(Cc1c[s]c(Cl)c1)C(O)=O Amb25032087 [0,1,0,0,1,0|2,0,0]=4 3517 B12R1.104 CC(Cc1cc(Br)c[s]1)C(O)=O Amb18981859 [0,1,0,0,1,0|2,0,0]=4 3518 B12R1.104 CC(Cc1cc(Cl)c[s]1)C(O)=O Amb24569327 [0,1,0,0,1,0|2,0,0]=4 3519 B12R1.104 CC(Cc1ccc(Br)[s]1)C(O)=O Amb18290324 [0,1,0,0,1,0|2,0,0]=4 3520 B12R1.104 CC(Cc1ccc(Br)o1)C(O)=O Amb25297998 [0,1,0,0,1,0|2,0,0]=4 3521 B12R1.104 CC(Cc1ccc(Cl)[s]1)C(O)=O Amb18290306 [0,1,0,0,1,0|2,0,0]=4 3522 B12R1.104 CC(Cc1coc(Br)c1)C(O)=O Amb25205667 [0,1,0,0,1,0|2,0,0]=4 3523 B12R1.104 C[n]1cc(CC(N)C(O)=O)c[n]1 Amb19429078 [0,1,0,0,1,0|2,0,0]=4 3524 B12R1.104 C[n]1cc(CC(N)C(O)=O)cc1 Amb18563843 [0,1,0,0,1,0|1,0,0]=3 3525 B12R1.104 C[n]1cc(C[C@@H](N)C(O)=O)[n]c1 Amb22747829 [0,1,0,0,1,0|2,0,0]=4 3526 B12R1.104 C[n]1cc(C[C@@H](N)C(O)=O)[n]c1 Amb22801373 [0,1,0,0,1,0|2,0,0]=4 3527 B12R1.104 C[n]1cc(C[C@@H](N)C(O)=O)c[n]1 Amb18801206 [0,1,0,0,1,0|2,0,0]=4 3528 B12R1.104 C[n]1cc(C[C@H](N)C(O)=O)[n]c1 Amb22349466 [0,1,0,0,1,0|2,0,0]=4 3529 B12R1.104 C[n]1cc(C[C@H](N)C(O)=O)c[n]1 Amb25740928 [0,1,0,0,1,0|2,0,0]=4 3530 B12R1.104 Cc1[nH]c(CC(N)C(O)=O)c[n]1 Amb18826090 [0,1,0,0,1,0|2,0,0]=4 3531 B12R1.104 Cc1[nH]cc(C[C@@H](N)C(O)=O)[n]1 Amb22748498 [0,1,0,0,1,0|2,0,0]=4 3532 B12R1.104 Cc1[nH]cc(C[C@H](N)C(O)=O)[n]1 Amb24710097 [0,1,0,0,1,0|2,0,0]=4 3533 B12R1.104 Cc1[n]c(C[C@@H](N)C(O)=O)c[s]1 Amb25667151 [0,1,0,0,1,0|2,0,0]=4 3534 B12R1.104 Cc1[n]cc(CC(N)C(O)=O)[s]1 Amb18822037 [0,1,0,0,1,0|2,0,0]=4 3535 B12R1.104 Cc1[n]cc(C[C@H](N)C(O)=O)[s]1 Amb24346493 [0,1,0,0,1,0|2,0,0]=4 3536 B12R1.104 Cc1c[n](CC(N)C(O)=O)[n]c1 Amb18984357 [0,1,0,0,1,0|2,0,0]=4 3537 B12R1.104 Cc1c[n](CC(N)C(O)=O)[n]c1 Amb24271205 [0,1,0,0,1,0|2,0,0]=4 3538 B12R1.104 Cc1c[n]c(CC(N)C(O)=O)[nH]1 Amb18826089 [0,1,0,0,1,0|2,0,0]=4 3539 B12R1.104 Cc1c[s]c(CC(N)C(O)=O)[n]1 Amb25149859 [0,1,0,0,1,0|2,0,0]=4 3540 B12R1.104 Cc1c[s]c(C[C@@H](N)C(O)=O)[n]1 Amb24450434 [0,1,0,0,1,0|2,0,0]=4 3541 B12R1.104 Cc1c[s]c(C[C@H](N)C(O)=O)[n]1 Amb25770644 [0,1,0,0,1,0|2,0,0]=4 3542 B12R1.104 Cc1cc(CC(C)C(O)=O)c[s]1 Amb25784531 [0,1,0,0,1,0|2,0,0]=4 3543 B12R1.104 Cc1cc(CC(N)C(O)=O)[n][nH]1 Amb18826087 [0,1,0,0,1,0|2,0,0]=4 3544 B12R1.104 Cc1cc(CC(N)C(O)=O)[n]o1 Amb18825740 [0,1,0,0,1,0|2,0,0]=4 3545 B12R1.104 Cc1cc(CC(N)C(O)=O)[s][n]1 Amb18822035 [0,1,0,0,1,0|2,0,0]=4 3546 B12R1.104 Cc1cc(CC(N)C(O)=O)[s]c1 Amb18822423 [0,1,0,0,1,0|1,0,0]=3 3547 B12R1.104 Cc1cc(CC(N)C(O)=O)c[s]1 Amb24671343 [0,1,0,0,1,0|1,0,0]=3 3548 B12R1.104 Cc1cc(CC(N)C(O)=O)co1 Amb18826155 [0,1,0,0,1,0|1,0,0]=3 3549 B12R1.104 Cc1cc(C[C@@H](N)C(O)=O)[s]c1 Amb24655792 [0,1,0,0,1,0|1,0,0]=3 3550 B12R1.104 Cc1cc(C[C@@H](N)C(O)=O)c[s]1 Amb24446585 [0,1,0,0,1,0|1,0,0]=3 3551 B12R1.104 Cc1cc(C[C@H](N)C(O)=O)[s]c1 Amb25301961 [0,1,0,0,1,0|1,0,0]=3 3552 B12R1.104 Cc1cc(on1)C[C@@H](C(=O)O)N Amb16233650 [0,1,0,0,1,0|2,0,0]=4 3553 B12R1.104 Cc1ccc(CC(S)C(O)=O)[s]1 Amb18968188 [0,1,0,0,1,0|2,0,0]=4 3554 B12R1.104 Cc1ccc(CC(S)C(O)=O)o1 Amb18288979 [0,1,0,0,1,0|2,0,0]=4 3555 B12R1.104 Cc1ccc(C[C@@H](N)C(O)=O)[s]1 Amb19069333 [0,1,0,0,1,0|1,0,0]=3 3556 B12R1.104 Cc1ccc(C[C@@H](N)C(O)=O)o1 Amb18801199 [0,1,0,0,1,0|1,0,0]=3 3557 B12R1.104 Cc1ccc(C[C@H](N)C(O)=O)[s]1 Amb24613636 [0,1,0,0,1,0|1,0,0]=3 3558 B12R1.104 Cc1ccc(C[C@H](N)C(O)=O)o1 Amb24380249 [0,1,0,0,1,0|1,0,0]=3 3559 B12R1.104 Cc1coc(CC(N)C(O)=O)[n]1 Amb18825741 [0,1,0,0,1,0|2,0,0]=4 3560 B12R1.104 Cc1nc(cs1)CC(C(=O)O)N Amb17065744 [0,1,0,0,1,0|2,0,0]=4 3561 B12R1.104 Cn1cc(nc1)CC(C(=O)O)N Amb16233066 [0,1,0,0,1,0|2,0,0]=4 3562 B12R1.104 NC(=O)C(N)Cc1cc(Br)c[s]1 Amb24699965 [0,1,0,0,1,0|2,0,0]=4 3563 B12R1.104 NC(=O)C(N)Cc1ccc(Cl)[s]1 Amb25793775 [0,1,0,0,1,0|2,0,0]=4 3564 B12R1.104 NC(C(=O)O)Cc1cnc([nH]1)S Amb17594852 [0,1,0,0,1,0|2,0,0]=4 3565 B12R1.104 NC(CC=1C=NC(=O)N1)C(O)=O Amb25289739 [0,1,0,0,1,0|2,0,0]=4 3566 B12R1.104 NC(CC=1C=NC(=S)N1)C(O)=O Amb25137256 [0,1,0,0,1,0|2,0,0]=4 3567 B12R1.104 NC(CN1C=CC(=O)O1)C(O)=O Amb24652373 [0,1,0,0,1,0|2,0,0]=4 3568 B12R1.104 NC(C[n]1cc(Br)c[n]1)C(O)=O Amb18984365 [0,1,0,0,1,0|2,0,0]=4 3569 B12R1.104 NC(C[n]1cc(Br)c[n]1)C(O)=O Amb24271207 [0,1,0,0,1,0|2,0,0]=4 3570 B12R1.104 NC(C[n]1cc(Cl)c[n]1)C(O)=O Amb18984361 [0,1,0,0,1,0|2,0,0]=4 3571 B12R1.104 NC(C[n]1cc(Cl)c[n]1)C(O)=O Amb24271206 [0,1,0,0,1,0|2,0,0]=4 3572 B12R1.104 NC(C[n]1cc(I)c[n]1)C(O)=O Amb25151054 [0,1,0,0,1,0|2,0,0]=4 3573 B12R1.104 NC(Cc1c[nH]c(Br)[n]1)C(O)=O Amb25104250 [0,1,0,0,1,0|2,0,0]=4 3574 B12R1.104 NC(Cc1c[nH]c(O)[n]1)C(O)=O Amb25293793 [0,1,0,0,1,0|2,0,0]=4 3575 B12R1.104 NC(Cc1c[n]c(I)[s]1)C(O)=O Amb24342000 [0,1,0,0,1,0|2,0,0]=4 3576 B12R1.104 NC(Cc1c[s]c(I)[n]1)C(O)=O Amb25757229 [0,1,0,0,1,0|2,0,0]=4 3577 B12R1.104 NC(Cc1cc(Br)c[nH]1)C(O)=O Amb25734631 [0,1,0,0,1,0|1,0,0]=3 3578 B12R1.104 NC(Cc1cc(O)[n]o1)C(O)=O Amb24634100 [0,1,0,0,1,0|2,0,0]=4 3579 B12R1.104 NC(Cc1ccc(Cl)o1)C(O)=O Amb19000858 [0,1,0,0,1,0|1,0,0]=3 3580 B12R1.104 NC(Cc1ccc(I)o1)C(O)=O Amb24341823 [0,1,0,0,1,0|1,0,0]=3 3581 B12R1.104 NC(Cc1coc(Br)c1)C(O)=O Amb25807466 [0,1,0,0,1,0|1,0,0]=3 3582 B12R1.104 N[C@@H](CC1=CNC(=S)N1)C(O)=O Amb19133014 [0,1,0,0,1,0|2,0,0]=4 3583 B12R1.104 N[C@@H](CC=1C=NC(=O)N1)C(O)=O Amb25281978 [0,1,0,0,1,0|2,0,0]=4 3584 B12R1.104 N[C@@H](CC=1C=NC(=S)N1)C(O)=O Amb24401476 [0,1,0,0,1,0|2,0,0]=4 3585 B12R1.104 N[C@@H](CN1C=CC(=O)O1)C(O)=O Amb24635834 [0,1,0,0,1,0|2,0,0]=4 3586 B12R1.104 N[C@@H](Cc1[n]cc(I)[s]1)C(O)=O Amb25704719 [0,1,0,0,1,0|2,0,0]=4 3587 B12R1.104 N[C@@H](Cc1c[nH]c(Br)[n]1)C(O)=O Amb24448385 [0,1,0,0,1,0|2,0,0]=4 3588 B12R1.104 N[C@@H](Cc1c[nH]c(Cl)[n]1)C(O)=O Amb25265735 [0,1,0,0,1,0|2,0,0]=4 3589 B12R1.104 N[C@@H](Cc1c[nH]c(O)[n]1)C(O)=O Amb24740842 [0,1,0,0,1,0|2,0,0]=4 3590 B12R1.104 N[C@@H](Cc1c[n](O)c[n]1)C(O)=O Amb24373913 [0,1,0,0,1,0|2,0,0]=4 3591 B12R1.104 N[C@@H](Cc1c[s]c(Br)c1)C(O)=O Amb25371112 [0,1,0,0,1,0|1,0,0]=3 3592 B12R1.104 N[C@@H](Cc1c[s]c(Cl)c1)C(O)=O Amb25138005 [0,1,0,0,1,0|1,0,0]=3 3593 B12R1.104 N[C@@H](Cc1cc(Cl)c[s]1)C(O)=O Amb25087999 [0,1,0,0,1,0|1,0,0]=3 3594 B12R1.104 N[C@@H](Cc1cc(I)c[nH]1)C(O)=O Amb24468334 [0,1,0,0,1,0|1,0,0]=3 3595 B12R1.104 N[C@@H](Cc1cc(O)[n]o1)C(O)=O Amb24576853 [0,1,0,0,1,0|2,0,0]=4 3596 B12R1.104 N[C@@H](Cc1ccc(Br)[s]1)C(O)=O Amb22746252 [0,1,0,0,1,0|1,0,0]=3 3597 B12R1.104 N[C@@H](Cc1ccc(Br)o1)C(O)=O Amb24488678 [0,1,0,0,1,0|1,0,0]=3 3598 B12R1.104 N[C@@H](Cc1coc(Br)c1)C(O)=O Amb24690262 [0,1,0,0,1,0|1,0,0]=3 3599 B12R1.104 N[C@H](CC1=CNC(=S)N1)C(O)=O Amb25827584 [0,1,0,0,1,0|2,0,0]=4 3600 B12R1.104 N[C@H](Cc1c[nH]c(I)[n]1)C(O)=O Amb25034861 [0,1,0,0,1,0|2,0,0]=4 3601 B12R1.104 N[C@H](Cc1c[s]c(Cl)c1)C(O)=O Amb24735847 [0,1,0,0,1,0|1,0,0]=3 3602 B12R1.104 N[C@H](Cc1cc(Br)c[s]1)C(O)=O Amb24431257 [0,1,0,0,1,0|1,0,0]=3 3603 B12R1.104 N[C@H](Cc1cc(Br)co1)C(O)=O Amb25223140 [0,1,0,0,1,0|1,0,0]=3 3604 B12R1.104 N[C@H](Cc1cc(I)c[nH]1)C(O)=O Amb24760307 [0,1,0,0,1,0|1,0,0]=3 3605 B12R1.104 N[C@H](Cc1cc(O)[n]o1)C(O)=O Amb25077344 [0,1,0,0,1,0|2,0,0]=4 3606 B12R1.104 N[C@H](Cc1ccc(Br)o1)C(O)=O Amb25791878 [0,1,0,0,1,0|1,0,0]=3 3607 B12R1.104 N[C@H](Cc1ccc(Cl)[s]1)C(O)=O Amb24462225 [0,1,0,0,1,0|1,0,0]=3 3608 B12R1.104 Nc1[nH]c(C[C@@H](N)C(O)=O)c[n]1 Amb24420030 [0,1,0,0,1,0|2,0,0]=4 3609 B12R1.104 Nc1[nH]cc(C[C@H](N)C(O)=O)[n]1 Amb25367260 [0,1,0,0,1,0|2,0,0]=4 3610 B12R1.104 Nc1[n]c(CC(N)C(O)=O)c[s]1 Amb25109207 [0,1,0,0,1,0|2,0,0]=4 3611 B12R1.104 Nc1[n]c(C[C@@H](N)C(O)=O)c[s]1 Amb25667550 [0,1,0,0,1,0|2,0,0]=4 3612 B12R1.104 Nc1[n]cc(CC(N)C(O)=O)[s]1 Amb24677723 [0,1,0,0,1,0|2,0,0]=4 3613 B12R1.104 Nc1[n]cc(C[C@@H](N)C(O)=O)[s]1 Amb25771540 [0,1,0,0,1,0|2,0,0]=4 3614 B12R1.104 OC(=O)C(F)Cc1cc(Cl)c[s]1 Amb25235039 [0,1,0,0,1,0|2,0,0]=4 3615 B12R1.104 OC(=O)C(F)Cc1ccc(Br)o1 Amb25200825 [0,1,0,0,1,0|2,0,0]=4 3616 B12R1.104 OC(=O)C(F)Cc1ccc(Cl)[s]1 Amb25248528 [0,1,0,0,1,0|2,0,0]=4 3617 B12R1.104 OC(=O)C(O)Cc1c[s]c(Cl)c1 Amb24735871 [0,1,0,0,1,0|2,0,0]=4 3618 B12R1.104 OC(=O)C(O)Cc1ccc(Br)[s]1 Amb24376472 [0,1,0,0,1,0|2,0,0]=4 3619 B12R1.104 OC(=O)C(O)Cc1ccc(Cl)[s]1 Amb24483662 [0,1,0,0,1,0|2,0,0]=4 3620 B12R1.108 COC(=O)C(Cc1c[nH]cn1)N Amb2444649 [0,1,0,0,1,0|2,0,0]=4 3621 B12R1.108 COC(=O)C(Cc1ccco1)O Amb17138659 [0,1,0,0,1,0|2,0,0]=4 3622 B12R1.108 COC(=O)C(Cc1cccs1)O Amb17139129 [0,1,0,0,1,0|2,0,0]=4 3623 B12R1.108 COC(=O)C(Cc1cnc[nH]1)N Amb10789312 [0,1,0,0,1,0|2,0,0]=4 3624 B12R1.108 COC(=O)C(Cc1nc[nH]c1)N Amb1154312 [0,1,0,0,1,0|2,0,0]=4 3625 B12R1.108 COC(=O)C(N)C[n]1c[n]cc1 Amb18788965 [0,1,0,0,1,0|2,0,0]=4 3626 B12R1.108 COC(=O)C(N)C[n]1c[n]cc1 Amb24271204 [0,1,0,0,1,0|2,0,0]=4 3627 B12R1.108 COC(=O)C(N)C[n]1ccc[n]1 Amb18788967 [0,1,0,0,1,0|2,0,0]=4 3628 B12R1.108 COC(=O)[C@@H](Cc1nc[nH]c1)N Amb19135253 [0,1,0,0,1,0|2,0,0]=4 3629 B12R1.108 COC(=O)[C@@H](N)Cc1c[nH]c[n]1 Amb22748538 [0,1,0,0,1,0|2,0,0]=4 3630 B12R1.108 COC(=O)[C@@H](N)Cc1ccc[s]1 Amb19149172 [0,1,0,0,1,0|1,0,0]=3 3631 B12R1.108 COC(=O)[C@H](Cc1cnc[nH]1)N Amb17614975 [0,1,0,0,1,0|2,0,0]=4 3632 B12R1.108 N[C@@H](Cc1c[nH]c[n]1)C(=O)NO Amb25751742 [0,1,0,0,1,0|2,0,0]=4 3633 B12R1.120 CC(C(C)c1ccc[nH]1)C(O)=O Amb24343766 [0,1,0,0,1,0|2,0,0]=4 3634 B12R1.120 CC(C(C)c1ccc[s]1)C(O)=O Amb18822834 [0,1,0,0,1,0|2,0,0]=4 3635 B12R1.120 CC(C(C)c1ccco1)C(O)=O Amb18199302 [0,1,0,0,1,0|2,0,0]=4 3636 B12R1.120 CC(C(C)c1ccoc1)C(O)=O Amb25827964 [0,1,0,0,1,0|2,0,0]=4 3637 B12R1.120 CC(C(F)C(O)=O)c1ccc[s]1 Amb24569308 [0,1,0,0,1,0|2,0,0]=4 3638 B12R1.120 CC(C(O)c1ccc[s]1)C(O)=O Amb18990634 [0,1,0,0,1,0|2,0,0]=4 3639 B12R1.120 CC([C@H](N)C(O)=O)c1c[nH]c[n]1 Amb24365920 [0,1,0,0,1,0|2,0,0]=4 3640 B12R1.120 CC(c1c[nH]cn1)C(C(=O)O)N Amb2099484 [0,1,0,0,1,0|2,0,0]=4 3641 B12R1.120 C[C@@H]([C@H](N)C(O)=O)c1c[nH]c[n]1 Amb19890913 [0,1,0,0,1,0|2,0,0]=4 3642 B12R1.120 C[C@H]([C@H](O)c1ccco1)C(O)=O Amb25784032 [0,1,0,0,1,0|2,0,0]=4 3643 B12R1.120 NC(C(O)C(O)=O)c1ccc[s]1 Amb24587339 [0,1,0,0,1,0|2,0,0]=4 3644 B12R1.120 NC(C(O)C(O)=O)c1ccco1 Amb25246683 [0,1,0,0,1,0|2,0,0]=4 3645 B12R1.120 NC(C(O)c1c[nH]c[n]1)C(O)=O Amb18647466 [0,1,0,0,1,0|2,0,0]=4 3646 B12R1.120 NC(C(O)c1c[n]c[nH]1)C(O)=O Amb24118015 [0,1,0,0,1,0|2,0,0]=4 3647 B12R1.120 NC(C(O)c1c[n]c[s]1)C(O)=O Amb18821128 [0,1,0,0,1,0|2,0,0]=4 3648 B12R1.120 NC(C(O)c1c[s]cc1)C(O)=O Amb25273231 [0,1,0,0,1,0|1,0,0]=3 3649 B12R1.120 NC(C(O)c1ccc[s]1)C(O)=O Amb18649596 [0,1,0,0,1,0|1,0,0]=3 3650 B12R1.120 NC(C(O)c1ccc[s]1)C(O)=O Amb22461724 [0,1,0,0,1,0|1,0,0]=3 3651 B12R1.120 NC(C(O)c1cocc1)C(O)=O Amb24411867 [0,1,0,0,1,0|1,0,0]=3 3652 B12R1.120 N[C@@H](C(O)c1c[s]cc1)C(O)=O Amb24740870 [0,1,0,0,1,0|1,0,0]=3 3653 B12R1.120 N[C@@H]([C@@H](O)c1c[nH]c[n]1)C(O)=O Amb24443142 [0,1,0,0,1,0|2,0,0]=4 3654 B12R1.120 N[C@@H]([C@H](O)c1[nH]cc[n]1)C(O)=O Amb24726298 [0,1,0,0,1,0|2,0,0]=4 3655 B12R1.120 N[C@@H]([C@H](O)c1c[nH]c[n]1)C(O)=O Amb25321939 [0,1,0,0,1,0|2,0,0]=4 3656 B12R1.120 N[C@@H]([C@H](O)c1ccco1)C(O)=O Amb25059240 [0,1,0,0,1,0|1,0,0]=3 3657 B12R1.120 N[C@H]([C@@H](O)C(O)=O)c1ccc[s]1 Amb24727529 [0,1,0,0,1,0|2,0,0]=4 3658 B12R1.120 N[C@H]([C@@H](O)c1c[nH]c[n]1)C(O)=O Amb25667172 [0,1,0,0,1,0|2,0,0]=4 3659 B12R1.120 N[C@H]([C@H](O)c1c[nH]c[n]1)C(O)=O Amb25321938 [0,1,0,0,1,0|2,0,0]=4 3660 B12R1.120 OC(=O)C(C(c1ccco1)N)C Amb17470472 [0,1,0,0,1,0|2,0,0]=4 3661 B12R1.120 OC(=O)C(C(c1cccs1)N)C Amb17470675 [0,1,0,0,1,0|2,0,0]=4 3662 B12R1.145 CC(Cc1[s]ccc1Br)C(O)=O Amb18981853 [0,1,0,0,1,0|2,0,0]=4 3663 B12R1.145 CC(Cc1[s]ccc1Cl)C(O)=O Amb25303584 [0,1,0,0,1,0|2,0,0]=4 3664 B12R1.145 CC(Cc1cc[s]c1Cl)C(O)=O Amb25060880 [0,1,0,0,1,0|2,0,0]=4 3665 B12R1.145 C[n]1c[n]cc1CC(N)C(O)=O Amb18647156 [0,1,0,0,1,0|2,0,0]=4 3666 B12R1.145 C[n]1c[n]cc1C[C@@H](N)C(O)=O Amb22757376 [0,1,0,0,1,0|2,0,0]=4 3667 B12R1.145 C[n]1cc[n]c1CC(N)C(O)=O Amb18302430 [0,1,0,0,1,0|2,0,0]=4 3668 B12R1.145 Cc1[nH]c[n]c1C[C@H](N)C(O)=O Amb25069462 [0,1,0,0,1,0|2,0,0]=4 3669 B12R1.145 Cc1[n][nH]cc1CC(N)C(O)=O Amb18788970 [0,1,0,0,1,0|2,0,0]=4 3670 B12R1.145 Cc1[n]c[nH]c1CC(N)C(O)=O Amb18788969 [0,1,0,0,1,0|2,0,0]=4 3671 B12R1.145 Cc1[n]c[s]c1CC(N)C(O)=O Amb18822033 [0,1,0,0,1,0|2,0,0]=4 3672 B12R1.145 Cc1[n]cc[n]1CC(N)C(O)=O Amb18294531 [0,1,0,0,1,0|2,0,0]=4 3673 B12R1.145 Cc1[s]ccc1CC(N)C(O)=O Amb25040252 [0,1,0,0,1,0|1,0,0]=3 3674 B12R1.145 Cc1[s]ccc1C[C@H](N)C(O)=O Amb25780549 [0,1,0,0,1,0|1,0,0]=3 3675 B12R1.145 Cc1cc[n][n]1CC(N)C(O)=O Amb25724699 [0,1,0,0,1,0|2,0,0]=4 3676 B12R1.145 Cc1cc[s]c1CC(S)C(O)=O Amb18288971 [0,1,0,0,1,0|2,0,0]=4 3677 B12R1.145 Cc1cc[s]c1C[C@@H](N)C(O)=O Amb19069332 [0,1,0,0,1,0|1,0,0]=3 3678 B12R1.145 Cc1ccc[n]1CC(N)C(O)=O Amb18826692 [0,1,0,0,1,0|1,0,0]=3 3679 B12R1.145 Cc1ccoc1CC(C)C(O)=O Amb25304965 [0,1,0,0,1,0|2,0,0]=4 3680 B12R1.145 Cc1ccoc1CC(F)C(O)=O Amb25034941 [0,1,0,0,1,0|2,0,0]=4 3681 B12R1.145 Cc1ccoc1CC(N)C(O)=O Amb18826171 [0,1,0,0,1,0|1,0,0]=3 3682 B12R1.145 Cc1ccoc1C[C@H](N)C(O)=O Amb24492875 [0,1,0,0,1,0|1,0,0]=3 3683 B12R1.145 Cc1cocc1CC(N)C(O)=O Amb18826156 [0,1,0,0,1,0|1,0,0]=3 3684 B12R1.145 Cc1occc1C[C@@H](N)C(O)=O Amb25124338 [0,1,0,0,1,0|1,0,0]=3 3685 B12R1.145 Cn1cncc1C[C@@H](C(=O)O)N Amb16226985 [0,1,0,0,1,0|2,0,0]=4 3686 B12R1.145 NC(=O)C(N)Cc1[s]ccc1Br Amb25131511 [0,1,0,0,1,0|2,0,0]=4 3687 B12R1.145 NC(=O)C(N)Cc1[s]ccc1Cl Amb25738868 [0,1,0,0,1,0|2,0,0]=4 3688 B12R1.145 NC(=O)C(N)Cc1cc[s]c1Br Amb25181478 [0,1,0,0,1,0|2,0,0]=4 3689 B12R1.145 NC(CC1=CNNC1=O)C(O)=O Amb24604896 [0,1,0,0,1,0|2,0,0]=4 3690 B12R1.145 NC(C[n]1[n]ccc1Br)C(O)=O Amb24718713 [0,1,0,0,1,0|2,0,0]=4 3691 B12R1.145 NC(C[n]1[n]ccc1Cl)C(O)=O Amb24484306 [0,1,0,0,1,0|2,0,0]=4 3692 B12R1.145 NC(Cc1[nH]c[n]c1Cl)C(O)=O Amb25051372 [0,1,0,0,1,0|2,0,0]=4 3693 B12R1.145 NC(Cc1[nH]c[n]c1F)C(O)=O Amb24602470 [0,1,0,0,1,0|2,0,0]=4 3694 B12R1.145 NC(Cc1[n][nH]cc1Cl)C(O)=O Amb25149860 [0,1,0,0,1,0|2,0,0]=4 3695 B12R1.145 NC(Cc1[n]c[nH]c1S)C(O)=O Amb24455117 [0,1,0,0,1,0|2,0,0]=4 3696 B12R1.145 NC(Cc1[n]cc[n]1O)C(O)=O Amb25667062 [0,1,0,0,1,0|2,0,0]=4 3697 B12R1.145 NC(Cc1c[n]c[n]1S)C(O)=O Amb25124770 [0,1,0,0,1,0|2,0,0]=4 3698 B12R1.145 NC(Cc1cc[s]c1Br)C(O)=O Amb25795560 [0,1,0,0,1,0|1,0,0]=3 3699 B12R1.145 NC(Cc1cc[s]c1Cl)C(O)=O Amb24399335 [0,1,0,0,1,0|1,0,0]=3 3700 B12R1.145 N[C@@H](CC1=CNOC1=O)C(O)=O Amb24602394 [0,1,0,0,1,0|2,0,0]=4 3701 B12R1.145 N[C@@H](CC1=CONC1=O)C(O)=O Amb24659818 [0,1,0,0,1,0|2,0,0]=4 3702 B12R1.145 N[C@@H](Cc1[nH]c[n]c1S)C(O)=O Amb24431503 [0,1,0,0,1,0|2,0,0]=4 3703 B12R1.145 N[C@@H](Cc1[n]c[nH]c1Cl)C(O)=O Amb25072539 [0,1,0,0,1,0|2,0,0]=4 3704 B12R1.145 N[C@@H](Cc1[s]ccc1Br)C(O)=O Amb24615699 [0,1,0,0,1,0|1,0,0]=3 3705 B12R1.145 N[C@@H](Cc1[s]ccc1Cl)C(O)=O Amb25267667 [0,1,0,0,1,0|1,0,0]=3 3706 B12R1.145 N[C@@H](Cc1[s]ccc1I)C(O)=O Amb25364122 [0,1,0,0,1,0|1,0,0]=3 3707 B12R1.145 N[C@@H](Cc1cc[s]c1Br)C(O)=O Amb25335861 [0,1,0,0,1,0|1,0,0]=3 3708 B12R1.145 N[C@@H](Cc1cc[s]c1Cl)C(O)=O Amb24350624 [0,1,0,0,1,0|1,0,0]=3 3709 B12R1.145 N[C@@H](Cc1occc1Br)C(O)=O Amb25042979 [0,1,0,0,1,0|1,0,0]=3 3710 B12R1.145 N[C@H](CC1=CNOC1=O)C(O)=O Amb24398627 [0,1,0,0,1,0|2,0,0]=4 3711 B12R1.145 N[C@H](Cc1[nH]c[n]c1S)C(O)=O Amb25261624 [0,1,0,0,1,0|2,0,0]=4 3712 B12R1.145 N[C@H](Cc1[s]ccc1I)C(O)=O Amb25148737 [0,1,0,0,1,0|1,0,0]=3 3713 B12R1.145 N[C@H](Cc1c[s]cc1Br)C(O)=O Amb25047496 [0,1,0,0,1,0|1,0,0]=3 3714 B12R1.145 N[C@H](Cc1cc[s]c1Br)C(O)=O Amb24600296 [0,1,0,0,1,0|1,0,0]=3 3715 B12R1.145 N[C@H](Cc1co[n]c1O)C(O)=O Amb25045563 [0,1,0,0,1,0|2,0,0]=4 3716 B12R1.145 N[C@H](Cc1occc1Br)C(O)=O Amb25763211 [0,1,0,0,1,0|1,0,0]=3 3717 B12R1.145 Nc1[n]cc[n]1C[C@H](N)C(O)=O Amb24631911 [0,1,0,0,1,0|2,0,0]=4 3718 B12R1.145 OC(=O)C(F)Cc1[s]ccc1Cl Amb25200745 [0,1,0,0,1,0|2,0,0]=4 3719 B12R1.145 OC(=O)C(O)Cc1[s]ccc1Br Amb25071900 [0,1,0,0,1,0|2,0,0]=4 3720 B12R1.145 OC(=O)C(S)Cc1cc[s]c1Cl Amb25101106 [0,1,0,0,1,0|2,0,0]=4 3721 B12R1.298 CCC(C(=O)O)Cc1cscc1 Amb17605845 [0,1,0,0,1,0|2,0,0]=4 3722 B12R1.298 CN[C@@H](Cc1c[nH]c[n]1)C(O)=O Amb22745300 [0,1,0,0,1,0|2,0,0]=4 3723 B12R1.298 N#CC(C(=O)O)Cc1ccco1 Amb17090105 [0,1,0,0,1,0|1,0,1]=4 3724 B12R1.298 N#CC(C(=O)O)Cc1cccs1 Amb17090106 [0,1,0,0,1,0|1,0,1]=4 3725 B12R1.1373 CC(C)(C[n]1cccc1)C(O)=O Amb25751624 [0,1,0,0,1,0|2,0,0]=4 3726 B12R1.1373 CC(C)(Cc1cc[nH]c1)C(O)=O Amb18563805 [0,1,0,0,1,0|2,0,0]=4 3727 B12R1.1373 CC(C)(Cc1cc[s]c1)C(O)=O Amb18302688 [0,1,0,0,1,0|2,0,0]=4 3728 B12R1.1373 CC(C)(Cc1ccc[s]1)C(O)=O Amb18999501 [0,1,0,0,1,0|2,0,0]=4 3729 B12R1.1373 CC(C)(Cc1ccco1)C(O)=O Amb18303224 [0,1,0,0,1,0|2,0,0]=4 3730 B12R1.1373 CC(C)(Cc1ccoc1)C(O)=O Amb25336532 [0,1,0,0,1,0|2,0,0]=4 3731 B12R1.1373 CC(F)(C[n]1cccc1)C(O)=O Amb24742740 [0,1,0,0,1,0|2,0,0]=4 3732 B12R1.1373 CC(N)(C[n]1c[n]cc1)C(O)=O Amb18294519 [0,1,0,0,1,0|2,0,0]=4 3733 B12R1.1373 CC(N)(C[n]1ccc[n]1)C(O)=O Amb18984348 [0,1,0,0,1,0|2,0,0]=4 3734 B12R1.1373 CC(N)(Cc1c[nH]c[n]1)C(O)=O Amb18647159 [0,1,0,0,1,0|2,0,0]=4 3735 B12R1.1373 CC(N)(Cc1c[nH]c[n]1)C(O)=O Amb22800481 [0,1,0,0,1,0|2,0,0]=4 3736 B12R1.1373 CC(N)(Cc1c[n]c[nH]1)C(O)=O Amb22362865 [0,1,0,0,1,0|2,0,0]=4 3737 B12R1.1373 CC(N)(Cc1cc[s]c1)C(O)=O Amb18649169 [0,1,0,0,1,0|1,0,0]=3 3738 B12R1.1373 CC(N)(Cc1ccc[nH]1)C(O)=O Amb24402356 [0,1,0,0,1,0|1,0,0]=3 3739 B12R1.1373 C[C@](N)(Cc1ccc[s]1)C(O)=O Amb24711512 [0,1,0,0,1,0|1,0,0]=3 3740 B12R1.1373 NC(F)(Cc1c[n]c[nH]1)C(O)=O Amb24120402 [0,1,0,0,1,0|2,0,0]=4 3741 B12R1.1373 OC(=O)C(Cc1ccco1)(N)C Amb17232695 [0,1,0,0,1,0|1,0,0]=3 3742 B12R1.1373 OC(=O)C(Cc1cccs1)(N)C Amb17234195 [0,1,0,0,1,0|1,0,0]=3 3743 B12R1.20 BrC(c1ccc(cc1)F)C(=O)C Amb17142689 [0,1,0,0,1,0|2,0,0]=4 3744 B12R1.20 C=C(c1ccc(cc1)Br)C(=O)O Amb17322199 [0,1,0,0,1,0|1,0,1]=4 3745 B12R1.20 C=C(c1ccc(cc1)C)C(=O)O Amb17322163 [0,1,0,0,1,0|1,0,1]=4 3746 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O Amb17322176 [0,1,0,0,1,0|1,0,1]=4 3747 B12R1.20 C=C(c1ccc(cc1)F)C(=O)O Amb17322166 [0,1,0,0,1,0|1,0,1]=4 3748 B12R1.20 CC(=C)C(N)c1ccc(Br)cc1 Amb24355767 [0,1,0,0,1,0|2,0,0]=4 3749 B12R1.20 CC(=C)C(N)c1ccc(Cl)cc1 Amb25035155 [0,1,0,0,1,0|2,0,0]=4 3750 B12R1.20 CC(=C)C(N)c1ccc(F)cc1 Amb24365829 [0,1,0,0,1,0|2,0,0]=4 3751 B12R1.20 CC(=C)C(N)c1ccc(I)cc1 Amb25823888 [0,1,0,0,1,0|2,0,0]=4 3752 B12R1.20 CC(=O)C(Br)c1ccc(N)cc1 Amb25364338 [0,1,0,0,1,0|2,0,0]=4 3753 B12R1.20 CC(=O)C(Br)c1ccc(O)cc1 Amb20620488 [0,1,0,0,1,0|2,0,0]=4 3754 B12R1.20 CC(=O)C(Br)c1ccc(S)cc1 Amb25351848 [0,1,0,0,1,0|2,0,0]=4 3755 B12R1.20 CC(=O)C(C)c1ccc(Br)cc1 Amb25043063 [0,1,0,0,1,0|2,0,0]=4 3756 B12R1.20 CC(=O)C(C)c1ccc(F)cc1 Amb25802289 [0,1,0,0,1,0|2,0,0]=4 3757 B12R1.20 CC(=O)C(N)c1ccc(Br)c[n]1 Amb25716232 [0,1,0,0,1,0|2,0,0]=4 3758 B12R1.20 CC(=O)C(N)c1ccc(Cl)c[n]1 Amb24349800 [0,1,0,0,1,0|2,0,0]=4 3759 B12R1.20 CC(=O)C(N)c1ccc(Cl)cc1 Amb24376685 [0,1,0,0,1,0|1,0,0]=3 3760 B12R1.20 CC(=O)C(N)c1ccc(F)[n]c1 Amb24487166 [0,1,0,0,1,0|2,0,0]=4 3761 B12R1.20 CC(=O)C(N)c1ccc(F)c[n]1 Amb24428783 [0,1,0,0,1,0|2,0,0]=4 3762 B12R1.20 CC(=O)C(N)c1ccc(I)[n]c1 Amb24427622 [0,1,0,0,1,0|2,0,0]=4 3763 B12R1.20 CC(=O)C(N)c1ccc(I)c[n]1 Amb24360228 [0,1,0,0,1,0|2,0,0]=4 3764 B12R1.20 CC(=O)C(N)c1ccc(I)cc1 Amb24483646 [0,1,0,0,1,0|1,0,0]=3 3765 B12R1.20 CC(=O)C(N)c1ccc(N)c[n]1 Amb25836837 [0,1,0,0,1,0|2,0,0]=4 3766 B12R1.20 CC(=O)C(N)c1ccc(N)cc1 Amb24487126 [0,1,0,0,1,0|1,0,0]=3 3767 B12R1.20 CC(=O)C(N)c1ccc(O)[n]c1 Amb24560279 [0,1,0,0,1,0|2,0,0]=4 3768 B12R1.20 CC(=O)C(N)c1ccc(O)c[n]1 Amb25076757 [0,1,0,0,1,0|2,0,0]=4 3769 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [0,1,0,0,1,0|2,0,0]=4 3770 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [0,1,0,0,1,0|2,0,0]=4 3771 B12R1.20 CC(=O)C(O)c1ccc(O)cc1 Amb18646451 [0,1,0,0,1,0|2,0,0]=4 3772 B12R1.20 CC(=O)C(c1ccc(cc1)C)Br Amb17142262 [0,1,0,0,1,0|2,0,0]=4 3773 B12R1.20 CC(=O)C(c1ccc(cc1)C)Cl Amb17139039 [0,1,0,0,1,0|2,0,0]=4 3774 B12R1.20 CC(=O)N(N)c1ccc(Br)cc1 Amb18070169 [0,1,0,0,1,0|2,0,0]=4 3775 B12R1.20 CC(=O)N(N)c1ccc(Cl)cc1 Amb18564312 [0,1,0,0,1,0|2,0,0]=4 3776 B12R1.20 CC(=O)N(N)c1ccc(F)cc1 Amb18563834 [0,1,0,0,1,0|2,0,0]=4 3777 B12R1.20 CC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25852918 [0,1,0,0,1,0|2,0,0]=4 3778 B12R1.20 CC(=O)[C@H](C)c1ccc(Br)cc1 Amb25848276 [0,1,0,0,1,0|2,0,0]=4 3779 B12R1.20 CC(=O)[C@H](O)c1ccc(Cl)cc1 Amb25371989 [0,1,0,0,1,0|2,0,0]=4 3780 B12R1.20 CC(=O)[C@H](O)c1ccc(O)cc1 Amb25807613 [0,1,0,0,1,0|2,0,0]=4 3781 B12R1.20 CC(C(=O)Cl)c1ccc(Br)cc1 Amb24483822 [0,1,0,0,1,0|2,0,0]=4 3782 B12R1.20 CC(C(N)=O)c1ccc(O)cc1 Amb24364677 [0,1,0,0,1,0|2,0,0]=4 3783 B12R1.20 CC(C(O)=O)N1C=CC(=O)C=C1 Amb18534254 [0,1,0,0,1,0|2,0,0]=4 3784 B12R1.20 CC(C(O)=O)c1ccc(C)cc1 Amb17678847 [0,1,0,0,1,0|1,0,0]=3 3785 B12R1.20 CC(C(O)=O)c1ccc(Cl)[n]c1 Amb19944615 [0,1,0,0,1,0|2,0,0]=4 3786 B12R1.20 CC(C(O)=O)c1ccc(I)cc1 Amb20619418 [0,1,0,0,1,0|1,0,0]=3 3787 B12R1.20 CC(C(O)=O)c1ccc(N)cc1 Amb24113246 [0,1,0,0,1,0|1,0,0]=3 3788 B12R1.20 CC(O)C(N)c1ccc(I)cc1 Amb24400403 [0,1,0,0,1,0|1,0,1]=4 3789 B12R1.20 CC(O)C(N)c1ccc(S)cc1 Amb24377200 [0,1,0,0,1,0|1,0,1]=4 3790 B12R1.20 CC(O)[C@@H](N)c1ccc(Cl)cc1 Amb24386533 [0,1,0,0,1,0|1,0,1]=4 3791 B12R1.20 CC(O)[C@@H](N)c1ccc(N)cc1 Amb24470997 [0,1,0,0,1,0|1,0,1]=4 3792 B12R1.20 CC(O)[C@@H](N)c1ccc(O)cc1 Amb25342137 [0,1,0,0,1,0|1,0,1]=4 3793 B12R1.20 CC(O)[C@@H](N)c1ccc(S)cc1 Amb25126099 [0,1,0,0,1,0|1,0,1]=4 3794 B12R1.20 CC(O)[C@H](N)c1ccc(Br)cc1 Amb25850041 [0,1,0,0,1,0|1,0,1]=4 3795 B12R1.20 CC(O)[C@H](N)c1ccc(Cl)cc1 Amb24413930 [0,1,0,0,1,0|1,0,1]=4 3796 B12R1.20 CC(O)[C@H](N)c1ccc(O)cc1 Amb24554138 [0,1,0,0,1,0|1,0,1]=4 3797 B12R1.20 CC(c1ccc(N)cc1)C(N)=O Amb25806999 [0,1,0,0,1,0|2,0,0]=4 3798 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O Amb17087424 [0,1,0,0,1,0|1,0,0]=3 3799 B12R1.20 CC(c1ccc(cc1)N)C(=O)O Amb2438888 [0,1,0,0,1,0|1,0,0]=3 3800 B12R1.20 C[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb24182093 [0,1,0,0,1,0|1,0,0]=3 3801 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(Br)cc1 Amb24382068 [0,1,0,0,1,0|1,0,1]=4 3802 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(N)cc1 Amb24537803 [0,1,0,0,1,0|1,0,1]=4 3803 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(Br)cc1 Amb25055183 [0,1,0,0,1,0|1,0,1]=4 3804 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(F)cc1 Amb25335384 [0,1,0,0,1,0|1,0,1]=4 3805 B12R1.20 C[C@@H](c1ccc(N)cc1)C(N)=O Amb25141393 [0,1,0,0,1,0|2,0,0]=4 3806 B12R1.20 C[C@@H](c1ccc(O)cc1)C(O)=O Amb21855850 [0,1,0,0,1,0|1,0,0]=3 3807 B12R1.20 C[C@H](C(N)=O)c1ccc(Cl)cc1 Amb24723034 [0,1,0,0,1,0|2,0,0]=4 3808 B12R1.20 C[C@H](C(N)=O)c1ccc(F)cc1 Amb24401577 [0,1,0,0,1,0|2,0,0]=4 3809 B12R1.20 C[C@H](C(O)=O)c1ccc(Cl)cc1 Amb24740781 [0,1,0,0,1,0|1,0,0]=3 3810 B12R1.20 C[C@H](C(O)=O)c1ccc(N)cc1 Amb25708326 [0,1,0,0,1,0|1,0,0]=3 3811 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(Cl)cc1 Amb25669590 [0,1,0,0,1,0|1,0,1]=4 3812 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(I)cc1 Amb25369710 [0,1,0,0,1,0|1,0,1]=4 3813 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(N)cc1 Amb24567692 [0,1,0,0,1,0|1,0,1]=4 3814 B12R1.20 C[C@H](O)[C@H](N)c1ccc(Br)cc1 Amb25805244 [0,1,0,0,1,0|1,0,1]=4 3815 B12R1.20 C[C@H](O)[C@H](N)c1ccc(I)cc1 Amb25696576 [0,1,0,0,1,0|1,0,1]=4 3816 B12R1.20 C[C@H](O)[C@H](N)c1ccc(O)cc1 Amb24377198 [0,1,0,0,1,0|1,0,1]=4 3817 B12R1.20 C[C@H](O)[C@H](N)c1ccc(S)cc1 Amb25340511 [0,1,0,0,1,0|1,0,1]=4 3818 B12R1.20 C[C@H](c1ccc(N)cc1)C(N)=O Amb24665804 [0,1,0,0,1,0|2,0,0]=4 3819 B12R1.20 C[C@H](c1ccc(cc1)F)C(=O)O Amb10843989 [0,1,0,0,1,0|1,0,0]=3 3820 B12R1.20 Cc1ccc([n]c1)[C@@H](N)C(O)=O Amb24485647 [0,1,0,0,1,0|1,0,0]=3 3821 B12R1.20 Cc1ccc([n]c1)[C@H](N)C(O)=O Amb24358612 [0,1,0,0,1,0|1,0,0]=3 3822 B12R1.20 Cc1ccc(c[n]1)C(C)C(O)=O Amb18828385 [0,1,0,0,1,0|2,0,0]=4 3823 B12R1.20 Cc1ccc(cc1)C(C)C(=O)Cl Amb24425440 [0,1,0,0,1,0|2,0,0]=4 3824 B12R1.20 Cc1ccc(cc1)C(C)C(N)=O Amb25288853 [0,1,0,0,1,0|2,0,0]=4 3825 B12R1.20 Cc1ccc(cc1)C(Cl)C(N)=O Amb19074654 [0,1,0,0,1,0|2,0,0]=4 3826 B12R1.20 Cc1ccc(cc1)C(F)C(O)=O Amb25320951 [0,1,0,0,1,0|1,0,0]=3 3827 B12R1.20 Cc1ccc(cc1)C(N)C(C)=C Amb25375128 [0,1,0,0,1,0|2,0,0]=4 3828 B12R1.20 Cc1ccc(cc1)C(N)P(O)O Amb24468804 [0,1,0,0,1,0|1,0,1]=4 3829 B12R1.20 Cc1ccc(cc1)C(O)C(N)=O Amb18800898 [0,1,0,0,1,0|2,0,0]=4 3830 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb18563638 [0,1,0,0,1,0|2,0,0]=4 3831 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb24072440 [0,1,0,0,1,0|2,0,0]=4 3832 B12R1.20 Cc1ccc(cc1)[C@@H](C)C(O)=O Amb22736712 [0,1,0,0,1,0|1,0,0]=3 3833 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(N)=O Amb24341621 [0,1,0,0,1,0|1,0,0]=3 3834 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(O)=O Amb22747999 [0,1,0,0,1,0|0,0,0]=2 3835 B12R1.20 Cc1ccc(cc1)[C@H](C)C(O)=O Amb22736713 [0,1,0,0,1,0|1,0,0]=3 3836 B12R1.20 Cc1ccc(cc1)[C@H](O)C(C)=O Amb25320143 [0,1,0,0,1,0|2,0,0]=4 3837 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)C Amb17477759 [0,1,0,0,1,0|2,0,0]=4 3838 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)N Amb1199712 [0,1,0,0,1,0|2,0,0]=4 3839 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)O Amb17261128 [0,1,0,0,1,0|1,0,0]=3 3840 B12R1.20 ClC(c1ccc(cc1)C)C(=O)Cl Amb17506249 [0,1,0,0,1,0|2,0,0]=4 3841 B12R1.20 ClC(c1ccc(cc1)C)C(=O)O Amb17234143 [0,1,0,0,1,0|1,0,0]=3 3842 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)C Amb17477762 [0,1,0,0,1,0|2,0,0]=4 3843 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)O Amb17238287 [0,1,0,0,1,0|1,0,0]=3 3844 B12R1.20 ClC(c1ccc(cc1)F)C(=O)C Amb17139154 [0,1,0,0,1,0|2,0,0]=4 3845 B12R1.20 ClC(c1ccc(cc1)F)C(=O)Cl Amb17098059 [0,1,0,0,1,0|2,0,0]=4 3846 B12R1.20 ClC(c1ccc(cc1)F)C(=O)O Amb17234610 [0,1,0,0,1,0|1,0,0]=3 3847 B12R1.20 NC(=O)C(Br)c1ccc(Br)cc1 Amb23510123 [0,1,0,0,1,0|2,0,0]=4 3848 B12R1.20 NC(=O)C(Cl)c1ccc(F)cc1 Amb18329809 [0,1,0,0,1,0|2,0,0]=4 3849 B12R1.20 NC(=O)C(Cl)c1ccc(I)cc1 Amb24373016 [0,1,0,0,1,0|2,0,0]=4 3850 B12R1.20 NC(=O)C(N)c1ccc(Br)cc1 Amb22478994 [0,1,0,0,1,0|1,0,0]=3 3851 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb19400288 [0,1,0,0,1,0|1,0,0]=3 3852 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb22433459 [0,1,0,0,1,0|1,0,0]=3 3853 B12R1.20 NC(=O)C(N)c1ccc(F)cc1 Amb22469878 [0,1,0,0,1,0|1,0,0]=3 3854 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [0,1,0,0,1,0|2,0,0]=4 3855 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [0,1,0,0,1,0|2,0,0]=4 3856 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [0,1,0,0,1,0|2,0,0]=4 3857 B12R1.20 NC(=O)C(O)c1ccc(I)cc1 Amb25700495 [0,1,0,0,1,0|2,0,0]=4 3858 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [0,1,0,0,1,0|2,0,0]=4 3859 B12R1.20 NC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb25152633 [0,1,0,0,1,0|1,0,0]=3 3860 B12R1.20 NC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25346222 [0,1,0,0,1,0|2,0,0]=4 3861 B12R1.20 NC(=O)[C@H](N)c1ccc(Cl)cc1 Amb25724996 [0,1,0,0,1,0|1,0,0]=3 3862 B12R1.20 NC(=O)[C@H](O)c1ccc(Cl)cc1 Amb24398035 [0,1,0,0,1,0|2,0,0]=4 3863 B12R1.20 NC(=S)C(N)c1ccc(F)cc1 Amb19374912 [0,1,0,0,1,0|1,1,0]=4 3864 B12R1.20 NC(C(=O)Cl)c1ccc(O)cc1 Amb25100939 [0,1,0,0,1,0|1,0,0]=3 3865 B12R1.20 NC(C(O)=O)c1c[n]c(Cl)[n]c1 Amb25075738 [0,1,0,0,1,0|2,0,0]=4 3866 B12R1.20 NC(C(O)=O)c1ccc(Cl)c[n]1 Amb24081006 [0,1,0,0,1,0|1,0,0]=3 3867 B12R1.20 NC(C(O)=O)c1ccc(I)[n]c1 Amb24759938 [0,1,0,0,1,0|1,0,0]=3 3868 B12R1.20 NC(C(O)=O)c1ccc(I)cc1 Amb22899108 [0,1,0,0,1,0|0,0,0]=2 3869 B12R1.20 NC(C(O)=O)c1ccc(S)cc1 Amb24504681 [0,1,0,0,1,0|0,0,0]=2 3870 B12R1.20 NC(c1ccc(O)[n]c1)C(O)=O Amb24674057 [0,1,0,0,1,0|1,0,0]=3 3871 B12R1.20 NC(c1ccc(O)c[n]1)C(O)=O Amb24629017 [0,1,0,0,1,0|1,0,0]=3 3872 B12R1.20 NC(c1ccc(O)cc1)P(O)=O Amb25047232 [0,1,0,0,1,0|1,0,0]=3 3873 B12R1.20 NC(c1ccc(cc1)Br)C(=O)N Amb13951626 [0,1,0,0,1,0|1,0,0]=3 3874 B12R1.20 NC(c1ccc(cc1)Br)C(=O)O Amb1837854 [0,1,0,0,1,0|0,0,0]=2 3875 B12R1.20 NC(c1ccc(cc1)Br)C(O)C Amb17248848 [0,1,0,0,1,0|1,0,1]=4 3876 B12R1.20 NC(c1ccc(cc1)C)C(=O)N Amb17334619 [0,1,0,0,1,0|1,0,0]=3 3877 B12R1.20 NC(c1ccc(cc1)C)C(=O)O Amb2234620 [0,1,0,0,1,0|0,0,0]=2 3878 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)N Amb17335727 [0,1,0,0,1,0|1,0,0]=3 3879 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)O Amb1837642 [0,1,0,0,1,0|0,0,0]=2 3880 B12R1.20 NC(c1ccc(cc1)Cl)C(O)C Amb17234268 [0,1,0,0,1,0|1,0,1]=4 3881 B12R1.20 NC(c1ccc(cc1)F)C(=O)N Amb17334711 [0,1,0,0,1,0|1,0,0]=3 3882 B12R1.20 NC(c1ccc(cc1)I)C(=O)O Amb2234604 [0,1,0,0,1,0|0,0,0]=2 3883 B12R1.20 NC(c1ccc(cc1)O)C(=O)N Amb17334665 [0,1,0,0,1,0|1,0,0]=3 3884 B12R1.20 N[C@@H](C(=O)Cl)c1ccc(O)cc1 Amb24595943 [0,1,0,0,1,0|1,0,0]=3 3885 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)[n]c1 Amb25309311 [0,1,0,0,1,0|1,0,0]=3 3886 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)c[n]1 Amb25824057 [0,1,0,0,1,0|1,0,0]=3 3887 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)cc1 Amb22745984 [0,1,0,0,1,0|0,0,0]=2 3888 B12R1.20 N[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb19889601 [0,1,0,0,1,0|0,0,0]=2 3889 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)[n]c1 Amb25272929 [0,1,0,0,1,0|1,0,0]=3 3890 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)c[n]1 Amb25765185 [0,1,0,0,1,0|1,0,0]=3 3891 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)cc1 Amb19889896 [0,1,0,0,1,0|0,0,0]=2 3892 B12R1.20 N[C@@H](C(O)=O)c1ccc(I)cc1 Amb22745451 [0,1,0,0,1,0|0,0,0]=2 3893 B12R1.20 N[C@@H](c1ccc(O)[n]c1)C(O)=O Amb24365264 [0,1,0,0,1,0|1,0,0]=3 3894 B12R1.20 N[C@@H](c1ccc(cc1)C)C(=O)O Amb17621414 [0,1,0,0,1,0|0,0,0]=2 3895 B12R1.20 N[C@H](C(=O)Cl)c1ccc(O)cc1 Amb25141079 [0,1,0,0,1,0|1,0,0]=3 3896 B12R1.20 N[C@H](C(O)=O)c1ccc(Br)c[n]1 Amb24451007 [0,1,0,0,1,0|1,0,0]=3 3897 B12R1.20 N[C@H](C(O)=O)c1ccc(Cl)[n]c1 Amb25299360 [0,1,0,0,1,0|1,0,0]=3 3898 B12R1.20 N[C@H](C(O)=O)c1ccc(F)[n]c1 Amb24691564 [0,1,0,0,1,0|1,0,0]=3 3899 B12R1.20 N[C@H](C(O)=O)c1ccc(F)c[n]1 Amb24665825 [0,1,0,0,1,0|1,0,0]=3 3900 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 Amb19889897 [0,1,0,0,1,0|0,0,0]=2 3901 B12R1.20 N[C@H](C(O)=O)c1ccc(I)cc1 Amb24653870 [0,1,0,0,1,0|0,0,0]=2 3902 B12R1.20 N[C@H](c1ccc(O)[n]c1)C(O)=O Amb24692602 [0,1,0,0,1,0|1,0,0]=3 3903 B12R1.20 N[C@H](c1ccc(cc1)O)C(=O)N Amb15741205 [0,1,0,0,1,0|1,0,0]=3 3904 B12R1.20 Nc1ccc([n]c1)C(N)C(O)=O Amb25289878 [0,1,0,0,1,0|1,0,0]=3 3905 B12R1.20 Nc1ccc([n]c1)[C@@H](N)C(O)=O Amb24341698 [0,1,0,0,1,0|1,0,0]=3 3906 B12R1.20 Nc1ccc(c[n]1)C(O)C(O)=O Amb24591814 [0,1,0,0,1,0|2,0,0]=4 3907 B12R1.20 Nc1ccc(cc1)C(F)C(O)=O Amb25376043 [0,1,0,0,1,0|1,0,0]=3 3908 B12R1.20 Nc1ccc(cc1)C(N)C(O)=O Amb18646484 [0,1,0,0,1,0|0,0,0]=2 3909 B12R1.20 Nc1ccc(cc1)C(O)C(N)=O Amb24100608 [0,1,0,0,1,0|2,0,0]=4 3910 B12R1.20 Nc1ccc(cc1)C(O)C(O)=O Amb20668152 [0,1,0,0,1,0|1,0,0]=3 3911 B12R1.20 Nc1ccc(cc1)C(S)C(O)=O Amb25299470 [0,1,0,0,1,0|1,0,0]=3 3912 B12R1.20 Nc1ccc(cc1)[C@@H](N)C(O)=O Amb22745344 [0,1,0,0,1,0|0,0,0]=2 3913 B12R1.20 Nc1ccc(cc1)[C@H](N)C(O)=O Amb24568498 [0,1,0,0,1,0|0,0,0]=2 3914 B12R1.20 O=C(Br)C(Br)c1ccc(Br)cc1 Amb23536400 [0,1,0,0,1,0|2,0,0]=4 3915 B12R1.20 O=C(c1ccc(cc1)C)C(=O)O Amb1220932 [0,1,0,0,1,0|1,0,1]=4 3916 B12R1.20 OC(=O)C(Br)c1ccc(Br)cc1 Amb23510124 [0,1,0,0,1,0|1,0,0]=3 3917 B12R1.20 OC(=O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,1,0,0,1,0|1,0,0]=3 3918 B12R1.20 OC(=O)C(Br)c1ccc(F)c[n]1 Amb24420865 [0,1,0,0,1,0|2,0,0]=4 3919 B12R1.20 OC(=O)C(Br)c1ccc(F)cc1 Amb22337461 [0,1,0,0,1,0|1,0,0]=3 3920 B12R1.20 OC(=O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,1,0,0,1,0|1,0,0]=3 3921 B12R1.20 OC(=O)C(O)c1ccc(Br)c[n]1 Amb25083758 [0,1,0,0,1,0|2,0,0]=4 3922 B12R1.20 OC(=O)C(O)c1ccc(I)cc1 Amb25798219 [0,1,0,0,1,0|1,0,0]=3 3923 B12R1.20 OC(=O)C(S)c1ccc(Cl)cc1 Amb24668947 [0,1,0,0,1,0|1,0,0]=3 3924 B12R1.20 OC(=O)[C@@H](F)c1ccc(Br)cc1 Amb25112439 [0,1,0,0,1,0|1,0,0]=3 3925 B12R1.20 OC(=O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,1,0,0,1,0|1,0,0]=3 3926 B12R1.20 OC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,1,0,0,1,0|1,0,0]=3 3927 B12R1.20 OC(=O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,1,0,0,1,0|1,0,0]=3 3928 B12R1.20 OC(=O)[C@@H](S)c1ccc(Cl)cc1 Amb24497033 [0,1,0,0,1,0|1,0,0]=3 3929 B12R1.20 OC(=O)[C@@H](c1ccc(cc1)O)C Amb10843991 [0,1,0,0,1,0|1,0,0]=3 3930 B12R1.20 OC(=O)[C@H](F)c1ccc(Br)cc1 Amb25117435 [0,1,0,0,1,0|1,0,0]=3 3931 B12R1.20 OC(=O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,1,0,0,1,0|1,0,0]=3 3932 B12R1.20 OC(=O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,1,0,0,1,0|1,0,0]=3 3933 B12R1.20 OC(c1ccc(cc1)F)C(=O)O Amb1218322 [0,1,0,0,1,0|1,0,0]=3 3934 B12R1.20 O[C@H](c1ccc(cc1)C)C(=O)O Amb10808019 [0,1,0,0,1,0|1,0,0]=3 3935 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)O Amb16231521 [0,1,0,0,1,0|1,0,1]=4 3936 B12R1.20 Oc1ccc(cc1)[C@@H](O)C(O)=O Amb22745764 [0,1,0,0,1,0|1,0,0]=3 3937 B12R1.20 [NH3+]C(C(=O)Cl)c1ccc(O)cc1 Amb24104191 [0,1,0,0,1,0|1,0,1]=4 3938 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb21964739 [0,1,0,0,1,0|1,0,1]=4 3939 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb22899121 [0,1,0,0,1,0|1,0,1]=4 3940 B12R1.124 CC(=O)C(Br)c1ccccc1Br Amb24664641 [0,1,0,0,1,0|2,0,0]=4 3941 B12R1.124 CC(=O)C(C)c1ccccc1Br Amb25686339 [0,1,0,0,1,0|2,0,0]=4 3942 B12R1.124 CC(=O)C(C)c1ccccc1Cl Amb22753501 [0,1,0,0,1,0|2,0,0]=4 3943 B12R1.124 CC(=O)C(Cl)c1ccccc1N Amb25253259 [0,1,0,0,1,0|2,0,0]=4 3944 B12R1.124 CC(=O)C(N)c1[n]cccc1N Amb25189598 [0,1,0,0,1,0|2,0,0]=4 3945 B12R1.124 CC(=O)C(N)c1c[n]ccc1Cl Amb24715705 [0,1,0,0,1,0|2,0,0]=4 3946 B12R1.124 CC(=O)C(N)c1cc[n]cc1Br Amb25805508 [0,1,0,0,1,0|2,0,0]=4 3947 B12R1.124 CC(=O)C(N)c1ccc[n]c1Cl Amb25292250 [0,1,0,0,1,0|2,0,0]=4 3948 B12R1.124 CC(=O)C(N)c1ccc[n]c1S Amb25328674 [0,1,0,0,1,0|2,0,0]=4 3949 B12R1.124 CC(=O)C(N)c1ccccc1Cl Amb25265226 [0,1,0,0,1,0|1,0,0]=3 3950 B12R1.124 CC(=O)C(N)c1ccccc1S Amb24487128 [0,1,0,0,1,0|1,0,0]=3 3951 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [0,1,0,0,1,0|2,0,0]=4 3952 B12R1.124 CC(=O)C(c1ccccc1C)Cl Amb17477626 [0,1,0,0,1,0|2,0,0]=4 3953 B12R1.124 CC(=O)C(c1ccccc1Cl)Cl Amb17477761 [0,1,0,0,1,0|2,0,0]=4 3954 B12R1.124 CC(=O)C(c1ccccc1F)Br Amb17142690 [0,1,0,0,1,0|2,0,0]=4 3955 B12R1.124 CC(=O)C(c1ccccc1F)Cl Amb17139155 [0,1,0,0,1,0|2,0,0]=4 3956 B12R1.124 CC(=O)N(N)c1ccccc1Br Amb18571906 [0,1,0,0,1,0|2,0,0]=4 3957 B12R1.124 CC(=O)N(N)c1ccccc1Cl Amb18564310 [0,1,0,0,1,0|2,0,0]=4 3958 B12R1.124 CC(=O)N(N)c1ccccc1F Amb18563833 [0,1,0,0,1,0|2,0,0]=4 3959 B12R1.124 CC(=O)[C@@H](O)c1ccccc1F Amb25306551 [0,1,0,0,1,0|2,0,0]=4 3960 B12R1.124 CC(C(=O)Cl)c1ccccc1Br Amb24605624 [0,1,0,0,1,0|2,0,0]=4 3961 B12R1.124 CC(C(=O)Cl)c1ccccc1Cl Amb24699169 [0,1,0,0,1,0|2,0,0]=4 3962 B12R1.124 CC(C(N)=O)c1ccccc1F Amb25285412 [0,1,0,0,1,0|2,0,0]=4 3963 B12R1.124 CC(C(O)=O)N1C=CC=CC1=O Amb18040083 [0,1,0,0,1,0|2,0,0]=4 3964 B12R1.124 CC(C(O)=O)c1[n]cccc1Br Amb25751488 [0,1,0,0,1,0|2,0,0]=4 3965 B12R1.124 CC(C(O)=O)c1[n]cccc1Cl Amb18822248 [0,1,0,0,1,0|2,0,0]=4 3966 B12R1.124 CC(C(O)=O)c1[n]cccc1F Amb25824753 [0,1,0,0,1,0|2,0,0]=4 3967 B12R1.124 CC(C(O)=O)c1cc[n]cc1Cl Amb25850310 [0,1,0,0,1,0|2,0,0]=4 3968 B12R1.124 CC(C(O)=O)c1cc[n]cc1F Amb25682826 [0,1,0,0,1,0|2,0,0]=4 3969 B12R1.124 CC(C(c1ccccc1C)N)O Amb17232544 [0,1,0,0,1,0|1,0,1]=4 3970 B12R1.124 CC(C(c1ccccc1Cl)N)O Amb17234262 [0,1,0,0,1,0|1,0,1]=4 3971 B12R1.124 CC(C(c1ccccc1F)N)O Amb17232699 [0,1,0,0,1,0|1,0,1]=4 3972 B12R1.124 CC(O)C(N)c1ccccc1I Amb24741618 [0,1,0,0,1,0|1,0,1]=4 3973 B12R1.124 CC(O)C(N)c1ccccc1N Amb24548013 [0,1,0,0,1,0|1,0,1]=4 3974 B12R1.124 CC(O)C(N)c1ccccc1O Amb24746675 [0,1,0,0,1,0|1,0,1]=4 3975 B12R1.124 CC(O)[C@@H](N)c1ccccc1F Amb25091100 [0,1,0,0,1,0|1,0,1]=4 3976 B12R1.124 CC(O)[C@@H](N)c1ccccc1N Amb24447701 [0,1,0,0,1,0|1,0,1]=4 3977 B12R1.124 CC(O)[C@H](N)c1ccccc1Br Amb25265718 [0,1,0,0,1,0|1,0,1]=4 3978 B12R1.124 CC(O)[C@H](N)c1ccccc1Cl Amb24341803 [0,1,0,0,1,0|1,0,1]=4 3979 B12R1.124 CC(O)[C@H](N)c1ccccc1F Amb25676286 [0,1,0,0,1,0|1,0,1]=4 3980 B12R1.124 CC(O)[C@H](N)c1ccccc1I Amb25677515 [0,1,0,0,1,0|1,0,1]=4 3981 B12R1.124 CC(O)[C@H](N)c1ccccc1O Amb25859103 [0,1,0,0,1,0|1,0,1]=4 3982 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [0,1,0,0,1,0|1,0,0]=3 3983 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1Br Amb25826654 [0,1,0,0,1,0|1,0,1]=4 3984 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1F Amb24484299 [0,1,0,0,1,0|1,0,1]=4 3985 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1I Amb25667335 [0,1,0,0,1,0|1,0,1]=4 3986 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1Br Amb24710646 [0,1,0,0,1,0|1,0,1]=4 3987 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1F Amb24417148 [0,1,0,0,1,0|1,0,1]=4 3988 B12R1.124 C[C@H](C(O)=O)c1ccccc1Cl Amb25222036 [0,1,0,0,1,0|1,0,0]=3 3989 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Br Amb25771694 [0,1,0,0,1,0|1,0,1]=4 3990 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Cl Amb25245236 [0,1,0,0,1,0|1,0,1]=4 3991 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1F Amb25849179 [0,1,0,0,1,0|1,0,1]=4 3992 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1Cl Amb24732364 [0,1,0,0,1,0|1,0,1]=4 3993 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1F Amb24392926 [0,1,0,0,1,0|1,0,1]=4 3994 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1N Amb24487127 [0,1,0,0,1,0|1,0,1]=4 3995 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1O Amb24522959 [0,1,0,0,1,0|1,0,1]=4 3996 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1S Amb25667120 [0,1,0,0,1,0|1,0,1]=4 3997 B12R1.124 Cc1[n]cccc1[C@@H](N)C(O)=O Amb25097107 [0,1,0,0,1,0|1,0,0]=3 3998 B12R1.124 Cc1[n]cccc1[C@H](N)C(O)=O Amb24485602 [0,1,0,0,1,0|1,0,0]=3 3999 B12R1.124 Cc1c[n]ccc1C(N)C(C)=O Amb25128027 [0,1,0,0,1,0|2,0,0]=4 4000 B12R1.124 Cc1c[n]ccc1[C@@H](N)C(O)=O Amb25121088 [0,1,0,0,1,0|1,0,0]=3 4001 B12R1.124 Cc1c[n]ccc1[C@H](N)C(O)=O Amb24487133 [0,1,0,0,1,0|1,0,0]=3 4002 B12R1.124 Cc1cc[n]cc1C(C)C(O)=O Amb25759366 [0,1,0,0,1,0|2,0,0]=4 4003 B12R1.124 Cc1cc[n]cc1C(N)C(O)=O Amb18827789 [0,1,0,0,1,0|1,0,0]=3 4004 B12R1.124 Cc1cc[n]cc1C(O)C(O)=O Amb25035168 [0,1,0,0,1,0|2,0,0]=4 4005 B12R1.124 Cc1ccc[n]c1C(C)C(O)=O Amb25710871 [0,1,0,0,1,0|2,0,0]=4 4006 B12R1.124 Cc1ccc[n]c1C(N)C(C)=O Amb24428767 [0,1,0,0,1,0|2,0,0]=4 4007 B12R1.124 Cc1ccc[n]c1[C@@H](N)C(O)=O Amb24546429 [0,1,0,0,1,0|1,0,0]=3 4008 B12R1.124 Cc1ccccc1C(Br)C(O)=O Amb25136873 [0,1,0,0,1,0|1,0,0]=3 4009 B12R1.124 Cc1ccccc1C(C)C(=O)Cl Amb25152464 [0,1,0,0,1,0|2,0,0]=4 4010 B12R1.124 Cc1ccccc1C(C)C(C)=O Amb25204377 [0,1,0,0,1,0|2,0,0]=4 4011 B12R1.124 Cc1ccccc1C(Cl)C(N)=O Amb19074653 [0,1,0,0,1,0|2,0,0]=4 4012 B12R1.124 Cc1ccccc1C(Cl)C(O)=O Amb18564301 [0,1,0,0,1,0|1,0,0]=3 4013 B12R1.124 Cc1ccccc1C(N)C(C)=O Amb25131697 [0,1,0,0,1,0|1,0,0]=3 4014 B12R1.124 Cc1ccccc1C(N)P(O)=O Amb24433887 [0,1,0,0,1,0|1,0,0]=3 4015 B12R1.124 Cc1ccccc1C(O)C(C)=O Amb25712931 [0,1,0,0,1,0|2,0,0]=4 4016 B12R1.124 Cc1ccccc1C(O)C(N)=O Amb18800897 [0,1,0,0,1,0|2,0,0]=4 4017 B12R1.124 Cc1ccccc1N(N)C(C)=O Amb18563636 [0,1,0,0,1,0|2,0,0]=4 4018 B12R1.124 Cc1ccccc1[C@@H](C)C(O)=O Amb24426211 [0,1,0,0,1,0|1,0,0]=3 4019 B12R1.124 Cc1ccccc1[C@@H](N)C(O)=O Amb17933183 [0,1,0,0,1,0|0,0,0]=2 4020 B12R1.124 Cc1ccccc1[C@@H](N)[C@@H](C)O Amb25751402 [0,1,0,0,1,0|1,0,1]=4 4021 B12R1.124 Cc1ccccc1[C@@H](O)C(=O)Cl Amb24608093 [0,1,0,0,1,0|2,0,0]=4 4022 B12R1.124 Cc1ccccc1[C@@H](O)C(C)=O Amb24722864 [0,1,0,0,1,0|2,0,0]=4 4023 B12R1.124 Cc1ccccc1[C@H](C)C(O)=O Amb25798862 [0,1,0,0,1,0|1,0,0]=3 4024 B12R1.124 Cc1ccccc1[C@H](N)C(C)O Amb24438525 [0,1,0,0,1,0|1,0,1]=4 4025 B12R1.124 Cc1ccccc1[C@H](N)C(N)=O Amb24483792 [0,1,0,0,1,0|1,0,0]=3 4026 B12R1.124 Cc1ccccc1[C@H](N)[C@@H](C)O Amb25787588 [0,1,0,0,1,0|1,0,1]=4 4027 B12R1.124 Cc1ccccc1[C@H](N)[C@H](C)O Amb25340339 [0,1,0,0,1,0|1,0,1]=4 4028 B12R1.124 NC(=O)C(Br)c1ccccc1Cl Amb25089052 [0,1,0,0,1,0|2,0,0]=4 4029 B12R1.124 NC(=O)C(Cl)c1ccccc1F Amb18329810 [0,1,0,0,1,0|2,0,0]=4 4030 B12R1.124 NC(=O)C(N)c1ccccc1Br Amb18282827 [0,1,0,0,1,0|1,0,0]=3 4031 B12R1.124 NC(=O)C(N)c1ccccc1F Amb19374457 [0,1,0,0,1,0|1,0,0]=3 4032 B12R1.124 NC(=O)C(N)c1ccccc1O Amb24391892 [0,1,0,0,1,0|1,0,0]=3 4033 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [0,1,0,0,1,0|2,0,0]=4 4034 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [0,1,0,0,1,0|2,0,0]=4 4035 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [0,1,0,0,1,0|2,0,0]=4 4036 B12R1.124 NC(=O)C(c1ccccc1C)N Amb17334617 [0,1,0,0,1,0|1,0,0]=3 4037 B12R1.124 NC(=O)C(c1ccccc1Cl)N Amb17335725 [0,1,0,0,1,0|1,0,0]=3 4038 B12R1.124 NC(=O)C(c1ccccc1F)N Amb17334710 [0,1,0,0,1,0|1,0,0]=3 4039 B12R1.124 NC(=O)[C@@H](N)c1ccccc1Cl Amb24483835 [0,1,0,0,1,0|1,0,0]=3 4040 B12R1.124 NC(=O)[C@@H](O)c1ccccc1Cl Amb22799808 [0,1,0,0,1,0|2,0,0]=4 4041 B12R1.124 NC(=O)[C@H](N)c1ccccc1O Amb25056722 [0,1,0,0,1,0|1,0,0]=3 4042 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl Amb24355348 [0,1,0,0,1,0|2,0,0]=4 4043 B12R1.124 NC(C(O)=O)C1=CC=CNC1=O Amb25854713 [0,1,0,0,1,0|1,0,0]=3 4044 B12R1.124 NC(C(O)=O)c1[n]cc[n]c1Cl Amb24712372 [0,1,0,0,1,0|2,0,0]=4 4045 B12R1.124 NC(C(O)=O)c1[n]cccc1Br Amb24695377 [0,1,0,0,1,0|1,0,0]=3 4046 B12R1.124 NC(C(O)=O)c1[n]cccc1Cl Amb25835423 [0,1,0,0,1,0|1,0,0]=3 4047 B12R1.124 NC(C(O)=O)c1cc[n]cc1Br Amb25327473 [0,1,0,0,1,0|1,0,0]=3 4048 B12R1.124 NC(C(O)=O)c1ccc[n]c1Br Amb24420309 [0,1,0,0,1,0|1,0,0]=3 4049 B12R1.124 NC(C(O)=O)c1ccc[n]c1Cl Amb24427947 [0,1,0,0,1,0|1,0,0]=3 4050 B12R1.124 NC(C(O)=O)c1ccc[n]c1F Amb24697660 [0,1,0,0,1,0|1,0,0]=3 4051 B12R1.124 NC(C(O)=O)c1ccc[n]c1S Amb25151059 [0,1,0,0,1,0|1,0,0]=3 4052 B12R1.124 NC(C(O)=O)c1ccccc1F Amb24331712 [0,1,0,0,1,0|0,0,0]=2 4053 B12R1.124 NC(c1[n]cccc1O)C(O)=O Amb24670280 [0,1,0,0,1,0|1,0,0]=3 4054 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1Br Amb25149962 [0,1,0,0,1,0|1,0,0]=3 4055 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1F Amb24484150 [0,1,0,0,1,0|1,0,0]=3 4056 B12R1.124 N[C@@H](C(O)=O)c1cc[n]cc1Cl Amb24648834 [0,1,0,0,1,0|1,0,0]=3 4057 B12R1.124 N[C@@H](C(O)=O)c1ccc[n]c1F Amb25295392 [0,1,0,0,1,0|1,0,0]=3 4058 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb23440362 [0,1,0,0,1,0|0,0,0]=2 4059 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb25270086 [0,1,0,0,1,0|0,0,0]=2 4060 B12R1.124 N[C@@H](C(O)=O)c1ccccc1F Amb22747759 [0,1,0,0,1,0|0,0,0]=2 4061 B12R1.124 N[C@@H](C(O)=O)c1ccccc1I Amb25055265 [0,1,0,0,1,0|0,0,0]=2 4062 B12R1.124 N[C@@H](C(O)=O)c1ccccc1S Amb24649945 [0,1,0,0,1,0|0,0,0]=2 4063 B12R1.124 N[C@@H](c1[n]cccc1O)C(O)=O Amb24635276 [0,1,0,0,1,0|1,0,0]=3 4064 B12R1.124 N[C@@H](c1c[n]ccc1O)C(O)=O Amb25751540 [0,1,0,0,1,0|1,0,0]=3 4065 B12R1.124 N[C@@H](c1ccc[n]c1O)C(O)=O Amb25087908 [0,1,0,0,1,0|1,0,0]=3 4066 B12R1.124 N[C@@H](c1ccccc1O)C(O)=O Amb22748113 [0,1,0,0,1,0|0,0,0]=2 4067 B12R1.124 N[C@H](C(O)=O)c1[n]cccc1Cl Amb25774361 [0,1,0,0,1,0|1,0,0]=3 4068 B12R1.124 N[C@H](C(O)=O)c1cc[n]cc1F Amb25150860 [0,1,0,0,1,0|1,0,0]=3 4069 B12R1.124 N[C@H](C(O)=O)c1ccccc1I Amb24637866 [0,1,0,0,1,0|0,0,0]=2 4070 B12R1.124 N[C@H](c1ccccc1O)C(O)=O Amb25134608 [0,1,0,0,1,0|0,0,0]=2 4071 B12R1.124 Nc1c[n]ccc1C(N)C(O)=O Amb24351686 [0,1,0,0,1,0|1,0,0]=3 4072 B12R1.124 Nc1c[n]ccc1[C@@H](N)C(O)=O Amb25349329 [0,1,0,0,1,0|1,0,0]=3 4073 B12R1.124 Nc1c[n]ccc1[C@H](N)C(O)=O Amb24341560 [0,1,0,0,1,0|1,0,0]=3 4074 B12R1.124 Nc1cc[n]cc1[C@@H](N)C(O)=O Amb24748647 [0,1,0,0,1,0|1,0,0]=3 4075 B12R1.124 Nc1ccc[n]c1C(N)C(O)=O Amb25727218 [0,1,0,0,1,0|1,0,0]=3 4076 B12R1.124 Nc1ccccc1C(O)C(O)=O Amb18646669 [0,1,0,0,1,0|1,0,0]=3 4077 B12R1.124 Nc1ccccc1C(O)C([O-])=O Amb21963741 [0,1,0,0,1,0|1,0,1]=4 4078 B12R1.124 Nc1ccccc1[C@@H](N)C(O)=O Amb25700852 [0,1,0,0,1,0|0,0,0]=2 4079 B12R1.124 Nc1ccccc1[C@H](O)C(O)=O Amb24373910 [0,1,0,0,1,0|1,0,0]=3 4080 B12R1.124 O=C(Cl)C(Br)c1ccccc1Cl Amb24641573 [0,1,0,0,1,0|2,0,0]=4 4081 B12R1.124 OC(=O)C(=C)c1ccccc1C Amb17322164 [0,1,0,0,1,0|1,0,1]=4 4082 B12R1.124 OC(=O)C(=C)c1ccccc1Cl Amb17322174 [0,1,0,0,1,0|1,0,1]=4 4083 B12R1.124 OC(=O)C(=C)c1ccccc1F Amb17322167 [0,1,0,0,1,0|1,0,1]=4 4084 B12R1.124 OC(=O)C(=O)c1ccccc1Br Amb13883630 [0,1,0,0,1,0|1,0,1]=4 4085 B12R1.124 OC(=O)C(=O)c1ccccc1C Amb16231619 [0,1,0,0,1,0|1,0,1]=4 4086 B12R1.124 OC(=O)C(=O)c1ccccc1F Amb13883629 [0,1,0,0,1,0|1,0,1]=4 4087 B12R1.124 OC(=O)C(=O)c1ccccc1N Amb17594093 [0,1,0,0,1,0|1,0,1]=4 4088 B12R1.124 OC(=O)C(=O)c1ccccc1O Amb18646415 [0,1,0,0,1,0|1,0,1]=4 4089 B12R1.124 OC(=O)C(Cl)c1ccccc1Br Amb24060809 [0,1,0,0,1,0|1,0,0]=3 4090 B12R1.124 OC(=O)C(Cl)c1ccccc1Cl Amb18066587 [0,1,0,0,1,0|1,0,0]=3 4091 B12R1.124 OC(=O)C(Cl)c1ccccc1F Amb18564556 [0,1,0,0,1,0|1,0,0]=3 4092 B12R1.124 OC(=O)C(O)c1[n]cccc1F Amb25820427 [0,1,0,0,1,0|2,0,0]=4 4093 B12R1.124 OC(=O)C(O)c1ccccc1I Amb25117434 [0,1,0,0,1,0|1,0,0]=3 4094 B12R1.124 OC(=O)C(c1ccccc1Br)C Amb10844025 [0,1,0,0,1,0|1,0,0]=3 4095 B12R1.124 OC(=O)C(c1ccccc1Br)N Amb2234623 [0,1,0,0,1,0|0,0,0]=2 4096 B12R1.124 OC(=O)C(c1ccccc1C)N Amb1837192 [0,1,0,0,1,0|0,0,0]=2 4097 B12R1.124 OC(=O)C(c1ccccc1Cl)N Amb1841983 [0,1,0,0,1,0|0,0,0]=2 4098 B12R1.124 OC(=O)C(c1ccccc1F)C Amb10843985 [0,1,0,0,1,0|1,0,0]=3 4099 B12R1.124 OC(=O)C(c1ccccc1F)N Amb1837738 [0,1,0,0,1,0|0,0,0]=2 4100 B12R1.124 OC(=O)[C@@H](O)c1ccccc1F Amb22745223 [0,1,0,0,1,0|1,0,0]=3 4101 B12R1.124 OC(=O)[C@H](O)c1ccccc1F Amb24428765 [0,1,0,0,1,0|1,0,0]=3 4102 B12R1.124 Oc1ccccc1C(O)P(O)=O Amb24497278 [0,1,0,0,1,0|2,0,0]=4 4103 B12R1.124 [O-]C(=O)C(O)c1ccccc1F Amb22455226 [0,1,0,0,1,0|1,0,1]=4 4104 B12R1.225 CC(=C)C(N)c1cccc(Cl)c1 Amb25150098 [0,1,0,0,1,0|2,0,0]=4 4105 B12R1.225 CC(=C)C(N)c1cccc(F)c1 Amb25241405 [0,1,0,0,1,0|2,0,0]=4 4106 B12R1.225 CC(=C)C(N)c1cccc(I)c1 Amb24354516 [0,1,0,0,1,0|2,0,0]=4 4107 B12R1.225 CC(=O)C(Br)c1cccc(F)c1 Amb24537119 [0,1,0,0,1,0|2,0,0]=4 4108 B12R1.225 CC(=O)C(Br)c1cccc(O)c1 Amb25253266 [0,1,0,0,1,0|2,0,0]=4 4109 B12R1.225 CC(=O)C(C)c1cccc(Br)c1 Amb22753504 [0,1,0,0,1,0|2,0,0]=4 4110 B12R1.225 CC(=O)C(C)c1cccc(Cl)c1 Amb22753502 [0,1,0,0,1,0|2,0,0]=4 4111 B12R1.225 CC(=O)C(C)c1cccc(F)c1 Amb24430167 [0,1,0,0,1,0|2,0,0]=4 4112 B12R1.225 CC(=O)C(C)c1cccc(I)c1 Amb22753511 [0,1,0,0,1,0|2,0,0]=4 4113 B12R1.225 CC(=O)C(C)c1cccc(O)c1 Amb24537925 [0,1,0,0,1,0|2,0,0]=4 4114 B12R1.225 CC(=O)C(Cl)c1cccc(F)c1 Amb24541089 [0,1,0,0,1,0|2,0,0]=4 4115 B12R1.225 CC(=O)C(N)c1c[n]cc(Br)c1 Amb25375793 [0,1,0,0,1,0|2,0,0]=4 4116 B12R1.225 CC(=O)C(N)c1cc(Br)cc[n]1 Amb25111783 [0,1,0,0,1,0|2,0,0]=4 4117 B12R1.225 CC(=O)C(N)c1cc(N)ccc1 Amb24504677 [0,1,0,0,1,0|1,0,0]=3 4118 B12R1.225 CC(=O)C(N)c1cc[n]c(O)c1 Amb24460340 [0,1,0,0,1,0|2,0,0]=4 4119 B12R1.225 CC(=O)C(N)c1cccc(Cl)[n]1 Amb25259198 [0,1,0,0,1,0|2,0,0]=4 4120 B12R1.225 CC(=O)C(N)c1cccc(F)[n]1 Amb25843808 [0,1,0,0,1,0|2,0,0]=4 4121 B12R1.225 CC(=O)C(N)c1cccc(F)c1 Amb25076722 [0,1,0,0,1,0|1,0,0]=3 4122 B12R1.225 CC(=O)C(N)c1cccc(N)[n]1 Amb25709600 [0,1,0,0,1,0|2,0,0]=4 4123 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [0,1,0,0,1,0|2,0,0]=4 4124 B12R1.225 CC(=O)C(c1cccc(c1)Br)Cl Amb17477760 [0,1,0,0,1,0|2,0,0]=4 4125 B12R1.225 CC(=O)C(c1cccc(c1)C)Cl Amb17477625 [0,1,0,0,1,0|2,0,0]=4 4126 B12R1.225 CC(=O)C(c1cccc(c1)Cl)Cl Amb17477763 [0,1,0,0,1,0|2,0,0]=4 4127 B12R1.225 CC(=O)C(c1cccc(c1)Cl)O Amb17611032 [0,1,0,0,1,0|2,0,0]=4 4128 B12R1.225 CC(=O)C(c1cccc(c1)O)O Amb17594122 [0,1,0,0,1,0|2,0,0]=4 4129 B12R1.225 CC(=O)N(N)c1cccc(Br)c1 Amb18070415 [0,1,0,0,1,0|2,0,0]=4 4130 B12R1.225 CC(=O)N(N)c1cccc(Cl)c1 Amb18564311 [0,1,0,0,1,0|2,0,0]=4 4131 B12R1.225 CC(=O)N(N)c1cccc(F)c1 Amb18563835 [0,1,0,0,1,0|2,0,0]=4 4132 B12R1.225 CC(=O)[C@H](O)c1cc(O)ccc1 Amb25855760 [0,1,0,0,1,0|2,0,0]=4 4133 B12R1.225 CC(=O)[C@H](O)c1cccc(Cl)c1 Amb25832686 [0,1,0,0,1,0|2,0,0]=4 4134 B12R1.225 CC(C(=O)Cl)c1cccc(Br)c1 Amb25150116 [0,1,0,0,1,0|2,0,0]=4 4135 B12R1.225 CC(C(=O)Cl)c1cccc(F)c1 Amb25125145 [0,1,0,0,1,0|2,0,0]=4 4136 B12R1.225 CC(C(N)=O)c1cccc(Br)c1 Amb25333205 [0,1,0,0,1,0|2,0,0]=4 4137 B12R1.225 CC(C(N)=O)c1cccc(F)c1 Amb25760785 [0,1,0,0,1,0|2,0,0]=4 4138 B12R1.225 CC(C(N)=O)c1cccc(O)c1 Amb24743243 [0,1,0,0,1,0|2,0,0]=4 4139 B12R1.225 CC(C(O)=O)c1c[n]cc(F)c1 Amb18961443 [0,1,0,0,1,0|2,0,0]=4 4140 B12R1.225 CC(C(O)=O)c1cc[n]c(Cl)c1 Amb25322122 [0,1,0,0,1,0|2,0,0]=4 4141 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb22265668 [0,1,0,0,1,0|1,0,0]=3 4142 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb24061864 [0,1,0,0,1,0|1,0,0]=3 4143 B12R1.225 CC(C(c1cccc(c1)Br)N)O Amb17248845 [0,1,0,0,1,0|1,0,1]=4 4144 B12R1.225 CC(C(c1cccc(c1)C)N)O Amb17232547 [0,1,0,0,1,0|1,0,1]=4 4145 B12R1.225 CC(C(c1cccc(c1)Cl)N)O Amb17234265 [0,1,0,0,1,0|1,0,1]=4 4146 B12R1.225 CC(O)C(N)c1cc(F)ccc1 Amb18199109 [0,1,0,0,1,0|1,0,1]=4 4147 B12R1.225 CC(O)C(N)c1cc(N)ccc1 Amb24504719 [0,1,0,0,1,0|1,0,1]=4 4148 B12R1.225 CC(O)C(N)c1cc(S)ccc1 Amb25840847 [0,1,0,0,1,0|1,0,1]=4 4149 B12R1.225 CC(O)[C@@H](N)c1cc(Cl)ccc1 Amb25840441 [0,1,0,0,1,0|1,0,1]=4 4150 B12R1.225 CC(O)[C@@H](N)c1cc(I)ccc1 Amb25034880 [0,1,0,0,1,0|1,0,1]=4 4151 B12R1.225 CC(O)[C@@H](N)c1cc(S)ccc1 Amb25308042 [0,1,0,0,1,0|1,0,1]=4 4152 B12R1.225 CC(O)[C@H](N)c1cc(F)ccc1 Amb25721022 [0,1,0,0,1,0|1,0,1]=4 4153 B12R1.225 CC(O)[C@H](N)c1cc(O)ccc1 Amb25751697 [0,1,0,0,1,0|1,0,1]=4 4154 B12R1.225 CC(c1cc(O)ccc1)C(O)=O Amb18646445 [0,1,0,0,1,0|1,0,0]=3 4155 B12R1.225 C[C@@H](C(O)=O)c1cccc(F)c1 Amb25108167 [0,1,0,0,1,0|1,0,0]=3 4156 B12R1.225 C[C@@H](C(O)=O)c1cccc(N)c1 Amb24182071 [0,1,0,0,1,0|1,0,0]=3 4157 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb24437217 [0,1,0,0,1,0|1,0,1]=4 4158 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(O)ccc1 Amb25794132 [0,1,0,0,1,0|1,0,1]=4 4159 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Br)ccc1 Amb24758910 [0,1,0,0,1,0|1,0,1]=4 4160 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Cl)ccc1 Amb24368391 [0,1,0,0,1,0|1,0,1]=4 4161 B12R1.225 C[C@@H](O)[C@H](N)c1cc(N)ccc1 Amb25106841 [0,1,0,0,1,0|1,0,1]=4 4162 B12R1.225 C[C@H](C(N)=O)c1cccc(Cl)c1 Amb25730493 [0,1,0,0,1,0|2,0,0]=4 4163 B12R1.225 C[C@H](C(O)=O)c1cccc(Cl)c1 Amb25124032 [0,1,0,0,1,0|1,0,0]=3 4164 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Br)ccc1 Amb25238682 [0,1,0,0,1,0|1,0,1]=4 4165 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb25076736 [0,1,0,0,1,0|1,0,1]=4 4166 B12R1.225 C[C@H](O)[C@@H](N)c1cc(S)ccc1 Amb24554119 [0,1,0,0,1,0|1,0,1]=4 4167 B12R1.225 C[C@H](O)[C@H](N)c1cc(Cl)ccc1 Amb25761316 [0,1,0,0,1,0|1,0,1]=4 4168 B12R1.225 C[C@H](c1cc(O)ccc1)C(O)=O Amb24677825 [0,1,0,0,1,0|1,0,0]=3 4169 B12R1.225 Cc1c[n]cc(c1)C(N)C(C)=O Amb25189486 [0,1,0,0,1,0|2,0,0]=4 4170 B12R1.225 Cc1cc([n]c[n]1)C(N)C(O)=O Amb18827276 [0,1,0,0,1,0|2,0,0]=4 4171 B12R1.225 Cc1cc([n]cc1)C(O)C(O)=O Amb20246917 [0,1,0,0,1,0|2,0,0]=4 4172 B12R1.225 Cc1cc([n]cc1)[C@@H](N)C(O)=O Amb24462152 [0,1,0,0,1,0|1,0,0]=3 4173 B12R1.225 Cc1cc(c[n]c1)C(N)C(O)=O Amb24488617 [0,1,0,0,1,0|1,0,0]=3 4174 B12R1.225 Cc1cc(c[n]c1)[C@H](N)C(O)=O Amb24485701 [0,1,0,0,1,0|1,0,0]=3 4175 B12R1.225 Cc1cc(cc[n]1)C(C)C(O)=O Amb24584555 [0,1,0,0,1,0|2,0,0]=4 4176 B12R1.225 Cc1cc(cc[n]1)C(N)C(O)=O Amb18827868 [0,1,0,0,1,0|1,0,0]=3 4177 B12R1.225 Cc1cc(ccc1)C(=O)C(O)=O Amb18645964 [0,1,0,0,1,0|1,0,1]=4 4178 B12R1.225 Cc1cc(ccc1)C(Br)C(O)=O Amb25136874 [0,1,0,0,1,0|1,0,0]=3 4179 B12R1.225 Cc1cc(ccc1)C(C)C(=O)Cl Amb25152463 [0,1,0,0,1,0|2,0,0]=4 4180 B12R1.225 Cc1cc(ccc1)C(Cl)C(N)=O Amb19074652 [0,1,0,0,1,0|2,0,0]=4 4181 B12R1.225 Cc1cc(ccc1)C(Cl)C(O)=O Amb18564302 [0,1,0,0,1,0|1,0,0]=3 4182 B12R1.225 Cc1cc(ccc1)C(F)C(N)=O Amb25117936 [0,1,0,0,1,0|2,0,0]=4 4183 B12R1.225 Cc1cc(ccc1)C(O)C(=O)Cl Amb24095714 [0,1,0,0,1,0|2,0,0]=4 4184 B12R1.225 Cc1cc(ccc1)C(O)C(N)=O Amb18800895 [0,1,0,0,1,0|2,0,0]=4 4185 B12R1.225 Cc1cc(ccc1)N(N)C(N)=O Amb25152377 [0,1,0,0,1,0|2,0,0]=4 4186 B12R1.225 Cc1cc(ccc1)[C@@H](C)C(O)=O Amb25065324 [0,1,0,0,1,0|1,0,0]=3 4187 B12R1.225 Cc1cc(ccc1)[C@@H](F)C(N)=O Amb24399357 [0,1,0,0,1,0|2,0,0]=4 4188 B12R1.225 Cc1cc(ccc1)[C@@H](N)C(O)=O Amb24182070 [0,1,0,0,1,0|0,0,0]=2 4189 B12R1.225 Cc1cc(ccc1)[C@H]([NH3+])C([O-])=O Amb24068288 [0,1,0,0,1,0|0,0,2]=4 4190 B12R1.225 Cc1cccc([n]1)C(O)C(O)=O Amb20246916 [0,1,0,0,1,0|2,0,0]=4 4191 B12R1.225 Cc1cccc(c1)C(=C)C(=O)O Amb17322165 [0,1,0,0,1,0|1,0,1]=4 4192 B12R1.225 Cc1cccc(c1)C(O)C(C)=O Amb25801127 [0,1,0,0,1,0|2,0,0]=4 4193 B12R1.225 Cc1cccc(c1)N(N)C(C)=O Amb18563637 [0,1,0,0,1,0|2,0,0]=4 4194 B12R1.225 Cc1cccc(c1)[C@@H](C)C(C)=O Amb25707020 [0,1,0,0,1,0|2,0,0]=4 4195 B12R1.225 Cc1cccc(c1)[C@H](C)C(C)=O Amb25143362 [0,1,0,0,1,0|2,0,0]=4 4196 B12R1.225 Cc1cccc(c1)[C@H](N)[C@@H](C)O Amb25081648 [0,1,0,0,1,0|1,0,1]=4 4197 B12R1.225 Cc1cccc(c1)[C@H](N)[C@H](C)O Amb24426831 [0,1,0,0,1,0|1,0,1]=4 4198 B12R1.225 Clc1cccc(c1)C(=C)C(=O)O Amb17322175 [0,1,0,0,1,0|1,0,1]=4 4199 B12R1.225 Fc1cccc(c1)C(=C)C(=O)O Amb17322168 [0,1,0,0,1,0|1,0,1]=4 4200 B12R1.225 NC(=O)C(Cl)c1cc(Cl)ccc1 Amb25089760 [0,1,0,0,1,0|2,0,0]=4 4201 B12R1.225 NC(=O)C(Cl)c1cccc(Br)c1 Amb22059075 [0,1,0,0,1,0|2,0,0]=4 4202 B12R1.225 NC(=O)C(Cl)c1cccc(F)c1 Amb18329808 [0,1,0,0,1,0|2,0,0]=4 4203 B12R1.225 NC(=O)C(N)c1cccc(Cl)c1 Amb22487627 [0,1,0,0,1,0|1,0,0]=3 4204 B12R1.225 NC(=O)C(N)c1cccc(F)c1 Amb18949669 [0,1,0,0,1,0|1,0,0]=3 4205 B12R1.225 NC(=O)C(O)c1cc(O)ccc1 Amb18805579 [0,1,0,0,1,0|2,0,0]=4 4206 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [0,1,0,0,1,0|2,0,0]=4 4207 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [0,1,0,0,1,0|2,0,0]=4 4208 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [0,1,0,0,1,0|2,0,0]=4 4209 B12R1.225 NC(=O)C(O)c1cccc(I)c1 Amb24554086 [0,1,0,0,1,0|2,0,0]=4 4210 B12R1.225 NC(=O)C(c1cccc(c1)Br)N Amb13951644 [0,1,0,0,1,0|1,0,0]=3 4211 B12R1.225 NC(=O)C(c1cccc(c1)C)N Amb17334618 [0,1,0,0,1,0|1,0,0]=3 4212 B12R1.225 NC(=O)C(c1cccc(c1)Cl)N Amb17335726 [0,1,0,0,1,0|1,0,0]=3 4213 B12R1.225 NC(=O)C(c1cccc(c1)O)N Amb17334666 [0,1,0,0,1,0|1,0,0]=3 4214 B12R1.225 NC(=O)[C@H](O)c1cccc(Cl)c1 Amb24443861 [0,1,0,0,1,0|2,0,0]=4 4215 B12R1.225 NC(C(=O)Cl)c1cc(Cl)ccc1 Amb25764846 [0,1,0,0,1,0|1,0,0]=3 4216 B12R1.225 NC(C(O)=O)c1c[n]cc(Cl)c1 Amb25149922 [0,1,0,0,1,0|1,0,0]=3 4217 B12R1.225 NC(C(O)=O)c1c[n]cc(F)c1 Amb25751298 [0,1,0,0,1,0|1,0,0]=3 4218 B12R1.225 NC(C(O)=O)c1cc[n]c(F)c1 Amb24599975 [0,1,0,0,1,0|1,0,0]=3 4219 B12R1.225 NC(C(O)=O)c1cccc(Br)[n]1 Amb25828657 [0,1,0,0,1,0|1,0,0]=3 4220 B12R1.225 NC(C(O)=O)c1cccc(Cl)[n]1 Amb24531519 [0,1,0,0,1,0|1,0,0]=3 4221 B12R1.225 NC(C(O)=O)c1cccc(F)[n]1 Amb24487122 [0,1,0,0,1,0|1,0,0]=3 4222 B12R1.225 NC(c1cc(O)cc[n]1)C(O)=O Amb24410976 [0,1,0,0,1,0|1,0,0]=3 4223 B12R1.225 NC(c1cc(O)ccc1)C(O)=O Amb21959949 [0,1,0,0,1,0|0,0,0]=2 4224 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Br)c1 Amb24532664 [0,1,0,0,1,0|1,0,0]=3 4225 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Cl)c1 Amb25736271 [0,1,0,0,1,0|1,0,0]=3 4226 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(F)c1 Amb25299280 [0,1,0,0,1,0|1,0,0]=3 4227 B12R1.225 N[C@@H](C(O)=O)c1cc(Br)cc[n]1 Amb25270715 [0,1,0,0,1,0|1,0,0]=3 4228 B12R1.225 N[C@@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24417076 [0,1,0,0,1,0|1,0,0]=3 4229 B12R1.225 N[C@@H](C(O)=O)c1cc[n]c(Br)c1 Amb25082617 [0,1,0,0,1,0|1,0,0]=3 4230 B12R1.225 N[C@@H](C(O)=O)c1cccc(Br)c1 Amb25122869 [0,1,0,0,1,0|0,0,0]=2 4231 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)[n]1 Amb25046108 [0,1,0,0,1,0|1,0,0]=3 4232 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb22899025 [0,1,0,0,1,0|0,0,0]=2 4233 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb23399639 [0,1,0,0,1,0|0,0,0]=2 4234 B12R1.225 N[C@@H](C(O)=O)c1cccc(I)c1 Amb24342192 [0,1,0,0,1,0|0,0,0]=2 4235 B12R1.225 N[C@@H](C(O)=O)c1cccc(S)c1 Amb25361957 [0,1,0,0,1,0|0,0,0]=2 4236 B12R1.225 N[C@@H](c1cc(O)c[n]c1)C(O)=O Amb25724341 [0,1,0,0,1,0|1,0,0]=3 4237 B12R1.225 N[C@@H](c1cc(O)ccc1)C(O)=O Amb25294728 [0,1,0,0,1,0|0,0,0]=2 4238 B12R1.225 N[C@@H](c1cccc(O)[n]1)C(O)=O Amb24406730 [0,1,0,0,1,0|1,0,0]=3 4239 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Br)c1 Amb24461604 [0,1,0,0,1,0|1,0,0]=3 4240 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Cl)c1 Amb24583875 [0,1,0,0,1,0|1,0,0]=3 4241 B12R1.225 N[C@H](C(O)=O)c1cc(Br)cc[n]1 Amb24756460 [0,1,0,0,1,0|1,0,0]=3 4242 B12R1.225 N[C@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24707713 [0,1,0,0,1,0|1,0,0]=3 4243 B12R1.225 N[C@H](C(O)=O)c1cc[n]c(Br)c1 Amb24695338 [0,1,0,0,1,0|1,0,0]=3 4244 B12R1.225 N[C@H](C(O)=O)c1cccc(Br)c1 Amb25150059 [0,1,0,0,1,0|0,0,0]=2 4245 B12R1.225 N[C@H](C(O)=O)c1cccc(Cl)c1 Amb19889600 [0,1,0,0,1,0|0,0,0]=2 4246 B12R1.225 Nc1c[n]cc(c1)C(N)C(O)=O Amb25152306 [0,1,0,0,1,0|1,0,0]=3 4247 B12R1.225 Nc1c[n]cc(c1)[C@@H](N)C(O)=O Amb24485432 [0,1,0,0,1,0|1,0,0]=3 4248 B12R1.225 Nc1c[n]cc(c1)[C@H](N)C(O)=O Amb24422889 [0,1,0,0,1,0|1,0,0]=3 4249 B12R1.225 Nc1cc(cc[n]1)[C@@H](N)C(O)=O Amb25667081 [0,1,0,0,1,0|1,0,0]=3 4250 B12R1.225 Nc1cc(cc[n]1)[C@H](N)C(O)=O Amb24452048 [0,1,0,0,1,0|1,0,0]=3 4251 B12R1.225 Nc1cc(ccc1)C(N)C(O)=O Amb18646483 [0,1,0,0,1,0|0,0,0]=2 4252 B12R1.225 Nc1cc(ccc1)C(O)C(O)=O Amb18646668 [0,1,0,0,1,0|1,0,0]=3 4253 B12R1.225 Nc1cc[n]c(c1)[C@@H](N)C(O)=O Amb24364737 [0,1,0,0,1,0|1,0,0]=3 4254 B12R1.225 Nc1cc[n]c(c1)[C@H](N)C(O)=O Amb25106778 [0,1,0,0,1,0|1,0,0]=3 4255 B12R1.225 O=C(Cl)C(F)c1cc(F)ccc1 Amb25689085 [0,1,0,0,1,0|2,0,0]=4 4256 B12R1.225 OC(=O)C(=O)c1cc(Br)ccc1 Amb18135081 [0,1,0,0,1,0|1,0,1]=4 4257 B12R1.225 OC(=O)C(=O)c1cc(Cl)ccc1 Amb18649007 [0,1,0,0,1,0|1,0,1]=4 4258 B12R1.225 OC(=O)C(=O)c1cc(F)ccc1 Amb18646830 [0,1,0,0,1,0|1,0,1]=4 4259 B12R1.225 OC(=O)C(Br)c1cc(Br)ccc1 Amb25053820 [0,1,0,0,1,0|1,0,0]=3 4260 B12R1.225 OC(=O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,1,0,0,1,0|1,0,0]=3 4261 B12R1.225 OC(=O)C(Cl)c1cc(Cl)ccc1 Amb18066588 [0,1,0,0,1,0|1,0,0]=3 4262 B12R1.225 OC(=O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,1,0,0,1,0|1,0,0]=3 4263 B12R1.225 OC(=O)C(O)c1c[n]cc(Br)c1 Amb25829664 [0,1,0,0,1,0|2,0,0]=4 4264 B12R1.225 OC(=O)C(O)c1c[n]cc(F)c1 Amb25131443 [0,1,0,0,1,0|2,0,0]=4 4265 B12R1.225 OC(=O)C(O)c1cccc(I)c1 Amb25223767 [0,1,0,0,1,0|1,0,0]=3 4266 B12R1.225 OC(=O)C(c1cccc(c1)Br)C Amb10602488 [0,1,0,0,1,0|1,0,0]=3 4267 B12R1.225 OC(=O)C(c1cccc(c1)Br)N Amb2431609 [0,1,0,0,1,0|0,0,0]=2 4268 B12R1.225 OC(=O)C(c1cccc(c1)C)C Amb17232469 [0,1,0,0,1,0|1,0,0]=3 4269 B12R1.225 OC(=O)C(c1cccc(c1)C)N Amb1840070 [0,1,0,0,1,0|0,0,0]=2 4270 B12R1.225 OC(=O)C(c1cccc(c1)Cl)N Amb1840776 [0,1,0,0,1,0|0,0,0]=2 4271 B12R1.225 OC(=O)C(c1cccc(c1)F)C Amb17232662 [0,1,0,0,1,0|1,0,0]=3 4272 B12R1.225 OC(=O)C(c1cccc(c1)F)N Amb2431604 [0,1,0,0,1,0|0,0,0]=2 4273 B12R1.225 OC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,1,0,0,1,0|1,0,0]=3 4274 B12R1.225 OC(=O)[C@@H](O)c1cccc(F)c1 Amb24429173 [0,1,0,0,1,0|1,0,0]=3 4275 B12R1.225 OC(=O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,1,0,0,1,0|1,0,0]=3 4276 B12R1.225 OC(=O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,1,0,0,1,0|1,0,0]=3 4277 B12R1.225 OC(C(=O)Cl)c1cccc(F)c1 Amb24068439 [0,1,0,0,1,0|2,0,0]=4 4278 B12R1.225 Oc1cccc(c1)C(S)C(O)=O Amb25295477 [0,1,0,0,1,0|1,0,0]=3 4279 B12R1.225 Oc1cccc(c1)[C@@H](O)C(O)=O Amb25036246 [0,1,0,0,1,0|1,0,0]=3 4280 B12R1.253 CC(=C)C(C)(N)c1ccccc1 Amb18645556 [0,1,0,0,1,0|2,0,0]=4 4281 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb24738601 [0,1,0,0,1,0|1,0,0]=3 4282 B12R1.253 CC(=O)C(F)(F)c1ccccc1 Amb24105402 [0,1,0,0,1,0|2,0,0]=4 4283 B12R1.253 CC(Br)(C(O)=O)c1ccccc1 Amb18135055 [0,1,0,0,1,0|1,0,0]=3 4284 B12R1.253 CC(C)(C(O)=O)c1cc[n]cc1 Amb18828397 [0,1,0,0,1,0|2,0,0]=4 4285 B12R1.253 CC(C)(C(O)=O)c1ccc[n]c1 Amb18285914 [0,1,0,0,1,0|2,0,0]=4 4286 B12R1.253 CC(C)(C(O)=O)c1cccc[n]1 Amb19930001 [0,1,0,0,1,0|2,0,0]=4 4287 B12R1.253 CC(C)(C(O)=O)c1ccccc1 Amb17773441 [0,1,0,0,1,0|1,0,0]=3 4288 B12R1.253 CC(Cl)(C(O)=O)c1ccccc1 Amb18649035 [0,1,0,0,1,0|1,0,0]=3 4289 B12R1.253 CC(F)(C(N)=O)c1ccccc1 Amb22547011 [0,1,0,0,1,0|2,0,0]=4 4290 B12R1.253 CC(F)(C(O)=O)c1ccccc1 Amb22547630 [0,1,0,0,1,0|1,0,0]=3 4291 B12R1.253 CC(N)(C(O)=O)c1c[n]c[n]c1 Amb25840848 [0,1,0,0,1,0|2,0,0]=4 4292 B12R1.253 CC(N)(C(O)=O)c1c[n]cc[n]1 Amb25339411 [0,1,0,0,1,0|2,0,0]=4 4293 B12R1.253 CC(N)(c1c[n]ccc1)C(N)=O Amb18281146 [0,1,0,0,1,0|2,0,0]=4 4294 B12R1.253 CC(N)(c1cc[n]cc1)C(N)=O Amb18949666 [0,1,0,0,1,0|2,0,0]=4 4295 B12R1.253 CC(N)(c1cccc[n]1)C(N)=O Amb18949664 [0,1,0,0,1,0|2,0,0]=4 4296 B12R1.253 CC(O)(c1c[n]ccc1)C(O)=O Amb18951996 [0,1,0,0,1,0|2,0,0]=4 4297 B12R1.253 CC(O)(c1cc[n]cc1)C(O)=O Amb18952010 [0,1,0,0,1,0|2,0,0]=4 4298 B12R1.253 CC(O)(c1cccc[n]1)C(O)=O Amb18952001 [0,1,0,0,1,0|2,0,0]=4 4299 B12R1.253 CC(O)(c1cccc[sH]1)C(O)=O Amb22547022 [0,1,0,0,1,0|2,0,0]=4 4300 B12R1.253 CC(O)(c1ccccc1)C(O)=O Amb22347941 [0,1,0,0,1,0|1,0,0]=3 4301 B12R1.253 CC(O)C(C)(N)c1ccccc1 Amb24678253 [0,1,0,0,1,0|1,0,1]=4 4302 B12R1.253 C[C@@](F)(C(O)=O)c1ccccc1 Amb25279569 [0,1,0,0,1,0|1,0,0]=3 4303 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]c[n]c1 Amb24443519 [0,1,0,0,1,0|2,0,0]=4 4304 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]cc[n]1 Amb25142458 [0,1,0,0,1,0|2,0,0]=4 4305 B12R1.253 C[C@@](N)(C(O)=O)c1ccc[n]c1 Amb24716336 [0,1,0,0,1,0|1,0,0]=3 4306 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22225774 [0,1,0,0,1,0|0,0,0]=2 4307 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22747027 [0,1,0,0,1,0|0,0,0]=2 4308 B12R1.253 C[C@@](N)(c1ccccc1)C(N)=O Amb24341528 [0,1,0,0,1,0|1,0,0]=3 4309 B12R1.253 C[C@@](O)(C(N)=O)c1ccccc1 Amb24595768 [0,1,0,0,1,0|2,0,0]=4 4310 B12R1.253 C[C@](F)(C(O)=O)c1ccccc1 Amb25100972 [0,1,0,0,1,0|1,0,0]=3 4311 B12R1.253 C[C@](N)(C(O)=O)c1cc[n]cc1 Amb24341761 [0,1,0,0,1,0|1,0,0]=3 4312 B12R1.253 C[C@](N)(C(O)=O)c1cccc[n]1 Amb24562027 [0,1,0,0,1,0|1,0,0]=3 4313 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb19929597 [0,1,0,0,1,0|0,0,0]=2 4314 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb25692685 [0,1,0,0,1,0|0,0,0]=2 4315 B12R1.253 C[C@](N)(c1ccccc1)C(N)=O Amb25374916 [0,1,0,0,1,0|1,0,0]=3 4316 B12R1.253 C[C@](O)(c1ccccc1)C(O)=O Amb22226510 [0,1,0,0,1,0|1,0,0]=3 4317 B12R1.253 NC(=O)C(c1ccccc1)(F)F Amb1104586 [0,1,0,0,1,0|2,0,0]=4 4318 B12R1.253 NC(=O)C(c1ccccc1)(N)C Amb13952027 [0,1,0,0,1,0|1,0,0]=3 4319 B12R1.253 NC(O)(c1ccccc1)C(O)=O Amb24092513 [0,1,0,0,1,0|0,0,0]=2 4320 B12R1.253 O=C(F)C(F)(F)c1ccccc1 Amb25108603 [0,1,0,0,1,0|2,0,0]=4 4321 B12R1.253 OC(=O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,1,0,0,1,0|1,0,0]=3 4322 B12R1.253 OC(=O)C(Cl)(Cl)c1ccccc1 Amb25674448 [0,1,0,0,1,0|1,0,0]=3 4323 B12R1.253 OC(=O)C(F)(Cl)c1ccccc1 Amb24532752 [0,1,0,0,1,0|1,0,0]=3 4324 B12R1.253 OC(=O)C(F)(F)c1cc[n]cc1 Amb23585649 [0,1,0,0,1,0|2,0,0]=4 4325 B12R1.253 OC(=O)C(F)(F)c1ccc[n]c1 Amb18183748 [0,1,0,0,1,0|2,0,0]=4 4326 B12R1.253 OC(=O)C(F)(F)c1cccc[n]1 Amb20668303 [0,1,0,0,1,0|2,0,0]=4 4327 B12R1.253 OC(=O)C(O)(O)c1ccccc1 Amb25684790 [0,1,0,0,1,0|1,0,0]=3 4328 B12R1.253 OC(=O)C(c1ccccc1)(F)F Amb1197472 [0,1,0,0,1,0|1,0,0]=3 4329 B12R1.253 OC(=O)C(c1ccccc1)(N)C Amb10711147 [0,1,0,0,1,0|0,0,0]=2 4330 B12R1.253 OC(=O)C(c1ccccn1)(F)F Amb10840437 [0,1,0,0,1,0|2,0,0]=4 4331 B12R1.253 [2H]C([2H])(C(O)=O)c1ccccc1 Amb22353301 [0,1,0,0,1,0|1,0,0]=3 4332 B12R1.478 C=C=C(C(O)=O)c1ccccc1 Amb24717361 [0,1,0,0,1,0|1,0,1]=4 4333 B12R1.478 C=CC(C(N)=O)c1ccccc1 Amb25361995 [0,1,0,0,1,0|2,0,0]=4 4334 B12R1.478 C=CC(C(O)=O)c1ccccc1 Amb18645652 [0,1,0,0,1,0|1,0,0]=3 4335 B12R1.478 C=NC(C(O)=O)c1ccccc1 Amb24068840 [0,1,0,0,1,0|0,0,1]=3 4336 B12R1.478 CC(=C)C(NN)c1ccccc1 Amb24438127 [0,1,0,0,1,0|2,0,0]=4 4337 B12R1.478 CC(=O)C(/c1ccccc1)=C\N Amb17777807 [0,1,0,0,1,0|1,0,1]=4 4338 B12R1.478 CC(=O)C(C=C)c1ccccc1 Amb24736196 [0,1,0,0,1,0|2,0,0]=4 4339 B12R1.478 CC(=O)C(C=N)c1ccccc1 Amb21952033 [0,1,0,0,1,0|1,0,1]=4 4340 B12R1.478 CC(=O)C(C=O)c1ccccc1 Amb18126328 [0,1,0,0,1,0|2,0,0]=4 4341 B12R1.478 CC(=O)C(CCl)c1ccccc1 Amb24565751 [0,1,0,0,1,0|2,0,0]=4 4342 B12R1.478 CC(=O)C(CN)c1ccccc1 Amb25148601 [0,1,0,0,1,0|1,0,0]=3 4343 B12R1.478 CC(=O)C(CO)c1ccccc1 Amb21962499 [0,1,0,0,1,0|2,0,0]=4 4344 B12R1.478 CC(=O)C(N=O)c1ccccc1 Amb25322912 [0,1,0,0,1,0|1,0,1]=4 4345 B12R1.478 CC(=O)\C(=C\N)\c1ccccc1 Amb25238332 [0,1,0,0,1,0|1,0,1]=4 4346 B12R1.478 CC(O)C(NC)c1ccccc1 Amb18646387 [0,1,0,0,1,0|1,0,1]=4 4347 B12R1.478 CCC(C(O)=O)c1ccc[n]c1 Amb18999434 [0,1,0,0,1,0|2,0,0]=4 4348 B12R1.478 CCC(C(O)=O)c1cccc[n]1 Amb25116759 [0,1,0,0,1,0|2,0,0]=4 4349 B12R1.478 CC[C@@H](C(=O)Cl)c1ccccc1 Amb25207875 [0,1,0,0,1,0|2,0,0]=4 4350 B12R1.478 CC[C@@H](C(N)=O)c1ccccc1 Amb25034606 [0,1,0,0,1,0|2,0,0]=4 4351 B12R1.478 CNC(C(O)=O)c1cc[n]cc1 Amb23555580 [0,1,0,0,1,0|1,0,0]=3 4352 B12R1.478 CNC(C(O)=O)c1cccc[n]1 Amb25159848 [0,1,0,0,1,0|1,0,0]=3 4353 B12R1.478 CNC(C(O)=O)c1ccccc1 Amb19346335 [0,1,0,0,1,0|0,0,0]=2 4354 B12R1.478 CNC(c1ccccc1)C(=O)N Amb17334616 [0,1,0,0,1,0|1,0,0]=3 4355 B12R1.478 CNC(c1ccccn1)C(=O)N Amb17334638 [0,1,0,0,1,0|2,0,0]=4 4356 B12R1.478 CNC(c1cccnc1)C(=O)N Amb17334639 [0,1,0,0,1,0|2,0,0]=4 4357 B12R1.478 CNC(c1ccncc1)C(=O)N Amb17334640 [0,1,0,0,1,0|2,0,0]=4 4358 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O Amb16183859 [0,1,0,0,1,0|0,0,0]=2 4359 B12R1.478 CN[C@H](c1ccccc1)C(=O)O Amb16183947 [0,1,0,0,1,0|0,0,0]=2 4360 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb23440840 [0,1,0,0,1,0|1,0,1]=4 4361 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb24325342 [0,1,0,0,1,0|1,0,1]=4 4362 B12R1.478 COC(c1ccccc1)C(=O)C Amb10562726 [0,1,0,0,1,0|2,0,0]=4 4363 B12R1.478 COC(c1ccccc1)C(=O)N Amb10769824 [0,1,0,0,1,0|2,0,0]=4 4364 B12R1.478 COC(c1ccccc1)C(=O)O Amb2099459 [0,1,0,0,1,0|1,0,0]=3 4365 B12R1.478 CO[C@@H](C(N)=O)c1ccccc1 Amb25363386 [0,1,0,0,1,0|2,0,0]=4 4366 B12R1.478 CSC(C(N)=O)c1ccccc1 Amb25066103 [0,1,0,0,1,0|2,0,0]=4 4367 B12R1.478 CSC(C(O)=O)c1ccccc1 Amb18971615 [0,1,0,0,1,0|1,0,0]=3 4368 B12R1.478 C[C@@H](O)[C@@H](CN)c1ccccc1 Amb24627923 [0,1,0,0,1,0|1,0,1]=4 4369 B12R1.478 C[C@H](O)[C@H](NC)c1ccccc1 Amb24341991 [0,1,0,0,1,0|1,0,1]=4 4370 B12R1.478 C\N=C(\C(O)=O)/c1ccccc1 Amb24652432 [0,1,0,0,1,0|0,0,2]=4 4371 B12R1.478 N#CC(C(O)=O)c1cc[n]cc1 Amb24669640 [0,1,0,0,1,0|1,0,1]=4 4372 B12R1.478 N#CC(C(O)=O)c1ccc[n]c1 Amb24487451 [0,1,0,0,1,0|1,0,1]=4 4373 B12R1.478 N#CC(c1ccccc1)C(=O)C Amb2504502 [0,1,0,0,1,0|1,0,1]=4 4374 B12R1.478 N#CC(c1ccccc1)C(=O)O Amb1783147 [0,1,0,0,1,0|0,0,1]=3 4375 B12R1.478 NC(=O)C(C#N)c1ccccc1 Amb18787947 [0,1,0,0,1,0|1,0,1]=4 4376 B12R1.478 NC(=O)C(CN)c1cccc[n]1 Amb23571970 [0,1,0,0,1,0|2,0,0]=4 4377 B12R1.478 NC(=O)C(CN)c1ccccc1 Amb18999177 [0,1,0,0,1,0|1,0,0]=3 4378 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [0,1,0,0,1,0|2,0,0]=4 4379 B12R1.478 NC(=O)C(NO)c1ccccc1 Amb24373087 [0,1,0,0,1,0|1,0,0]=3 4380 B12R1.478 NC(=O)\C(=N\N)\c1ccccc1 Amb25785115 [0,1,0,0,1,0|1,0,1]=4 4381 B12R1.478 NCC(B(O)O)c1ccccc1 Amb25840910 [0,1,0,0,1,0|1,0,1]=4 4382 B12R1.478 NCC(C(O)=O)c1c[n]cc[n]1 Amb18827270 [0,1,0,0,1,0|2,0,0]=4 4383 B12R1.478 NCC(C(O)=O)c1cc[n]c[n]1 Amb18827271 [0,1,0,0,1,0|2,0,0]=4 4384 B12R1.478 NCC(c1ccccn1)C(=O)O Amb17400194 [0,1,0,0,1,0|1,0,0]=3 4385 B12R1.478 NCC(c1ccncc1)C(=O)O Amb17400195 [0,1,0,0,1,0|1,0,0]=3 4386 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22756742 [0,1,0,0,1,0|0,0,0]=2 4387 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22757442 [0,1,0,0,1,0|0,0,0]=2 4388 B12R1.478 NC[C@H](C(O)=O)c1ccccc1 Amb24674068 [0,1,0,0,1,0|0,0,0]=2 4389 B12R1.478 NNC(c1ccccc1)C(=O)O Amb17400196 [0,1,0,0,1,0|0,0,0]=2 4390 B12R1.478 NNC(c1ccccn1)C(=O)O Amb17400231 [0,1,0,0,1,0|1,0,0]=3 4391 B12R1.478 NNC(c1cccnc1)C(=O)O Amb17400232 [0,1,0,0,1,0|1,0,0]=3 4392 B12R1.478 NNC(c1ccncc1)C(=O)O Amb17400233 [0,1,0,0,1,0|1,0,0]=3 4393 B12R1.478 NN[C@@H](C(O)=O)c1ccccc1 Amb24562213 [0,1,0,0,1,0|0,0,0]=2 4394 B12R1.478 NN[C@H](C(O)=O)c1ccccc1 Amb25132135 [0,1,0,0,1,0|0,0,0]=2 4395 B12R1.478 N\N=C(/C(O)=O)\c1ccccc1 Amb24068345 [0,1,0,0,1,0|0,0,1]=3 4396 B12R1.478 N\N=C(\C(O)=O)/c1ccccc1 Amb25701762 [0,1,0,0,1,0|0,0,1]=3 4397 B12R1.478 O=C(Cl)C(CCl)c1ccccc1 Amb25159574 [0,1,0,0,1,0|2,0,0]=4 4398 B12R1.478 OC(=O)C(CBr)c1ccccc1 Amb24097514 [0,1,0,0,1,0|1,0,0]=3 4399 B12R1.478 OC(=O)C(CCl)c1ccccc1 Amb24099910 [0,1,0,0,1,0|1,0,0]=3 4400 B12R1.478 OC(=O)C(CF)c1ccccc1 Amb25201999 [0,1,0,0,1,0|1,0,0]=3 4401 B12R1.478 OC(=O)C(CS)c1ccccc1 Amb18303086 [0,1,0,0,1,0|1,0,0]=3 4402 B12R1.478 OC(=O)[C@@H](CF)c1ccccc1 Amb24470137 [0,1,0,0,1,0|1,0,0]=3 4403 B12R1.478 OC(=O)[C@@H](CO)c1ccccc1 Amb25109240 [0,1,0,0,1,0|1,0,0]=3 4404 B12R1.478 OC(=O)[C@H](NO)c1ccccc1 Amb25700967 [0,1,0,0,1,0|0,0,0]=2 4405 B12R1.478 OC(=O)\C(=C\O)\c1ccccc1 Amb24598641 [0,1,0,0,1,0|1,0,1]=4 4406 B12R1.478 OC(=O)\C(=N\O)\c1ccccc1 Amb22230611 [0,1,0,0,1,0|0,0,2]=4 4407 B12R1.478 [C-]#[N+]C(C(O)=O)c1ccccc1 Amb25290234 [0,1,0,0,1,0|0,0,1]=3 4408 B12R1.478 [NH3+]CC(C(O)=O)c1ccccc1 Amb22546483 [0,1,0,0,1,0|0,0,1]=3 4409 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb18646373 [0,1,0,0,1,0|1,0,1]=4 4410 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb22748963 [0,1,0,0,1,0|1,0,1]=4 4411 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb23399663 [0,1,0,0,1,0|1,0,1]=4 4412 B12R1.564 CC(C)(O)[C@H](N)c1ccccc1 Amb25667178 [0,1,0,0,1,0|1,0,1]=4 4413 B12R1.564 CC(P(=O)(O)O)c1ccccc1 Amb10975962 [0,1,0,0,1,0|2,0,0]=4 4414 B12R1.564 CP(O)(=O)C(N)c1ccccc1 Amb25772757 [0,1,0,0,1,0|1,0,0]=3 4415 B12R1.564 NC(P(=O)(O)O)c1ccccc1 Amb1148498 [0,1,0,0,1,0|1,0,0]=3 4416 B12R1.564 NC(c1cc[n]cc1)P(O)(O)=O Amb24596428 [0,1,0,0,1,0|2,0,0]=4 4417 B12R1.564 NC(c1ccccc1)S(O)(=O)=O Amb22472999 [0,1,0,0,1,0|1,0,0]=3 4418 B12R1.564 OC(S(=O)(=O)O)c1ccccc1 Amb17594875 [0,1,0,0,1,0|2,0,0]=4 4419 B14R1.337 CC(=O)NC(C)Cc1ccccc1Cl Amb24570130 [0,1,0,0,0,1|2,0,0]=4 4420 B14R1.337 CC(CC(O)=O)Nc1ccccc1N Amb25858120 [0,1,0,0,0,1|2,0,0]=4 4421 B14R1.337 CC(Cc1ccccc1C)CC(=O)O Amb17235384 [0,1,0,0,0,1|1,0,0]=3 4422 B14R1.337 CC(Cc1ccccc1Cl)CC(=O)O Amb17241244 [0,1,0,0,0,1|1,0,0]=3 4423 B14R1.337 CC(Cc1ccccc1F)CC(=O)O Amb17236372 [0,1,0,0,0,1|1,0,0]=3 4424 B14R1.337 CN(Cc1ccccc1F)CC(=O)O Amb13948950 [0,1,0,0,0,1|2,0,0]=4 4425 B14R1.337 CN(Cc1ccccc1I)CC(O)=O Amb21861672 [0,1,0,0,0,1|2,0,0]=4 4426 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1C Amb17234894 [0,1,0,0,0,1|1,0,1]=4 4427 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1Cl Amb17240730 [0,1,0,0,0,1|1,0,1]=4 4428 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1F Amb17235881 [0,1,0,0,0,1|1,0,1]=4 4429 B14R1.337 Cc1ccccc1CC(C)NC(C)=O Amb25833113 [0,1,0,0,0,1|2,0,0]=4 4430 B14R1.337 Cc1ccccc1C[C@@H](N)CC(O)=O Amb22747177 [0,1,0,0,0,1|0,0,0]=2 4431 B14R1.337 Cc1ccccc1C[C@H](C)NC(C)=O Amb25091141 [0,1,0,0,0,1|2,0,0]=4 4432 B14R1.337 NC(Cc1ccccc1Br)CC(=O)O Amb17473601 [0,1,0,0,0,1|0,0,0]=2 4433 B14R1.337 NC(Cc1ccccc1C)CC(=O)O Amb17470840 [0,1,0,0,0,1|0,0,0]=2 4434 B14R1.337 NC(Cc1ccccc1Cl)CC(=O)O Amb17471478 [0,1,0,0,0,1|0,0,0]=2 4435 B14R1.337 NC(Cc1ccccc1F)CC(=O)O Amb17470954 [0,1,0,0,0,1|0,0,0]=2 4436 B14R1.337 N[C@@H](Cc1ccccc1Br)CC(O)=O Amb22746341 [0,1,0,0,0,1|0,0,0]=2 4437 B14R1.337 N[C@@H](Cc1ccccc1Cl)CC(O)=O Amb22746257 [0,1,0,0,0,1|0,0,0]=2 4438 B14R1.337 N[C@@H](Cc1ccccc1F)CC(=O)O Amb16231750 [0,1,0,0,0,1|0,0,0]=2 4439 B14R1.337 N[C@@H](Cc1ccccc1F)CC(O)=O Amb22747012 [0,1,0,0,0,1|0,0,0]=2 4440 B14R1.337 N[C@H](Cc1ccccc1C)CC(=O)O Amb16231753 [0,1,0,0,0,1|0,0,0]=2 4441 B14R1.337 N[C@H](Cc1ccccc1F)CC(O)=O Amb19929569 [0,1,0,0,0,1|0,0,0]=2 4442 B14R1.337 OC(Cc1ccccc1C)CC(=O)O Amb17235898 [0,1,0,0,0,1|1,0,0]=3 4443 B14R1.337 OC(Cc1ccccc1Cl)CC(=O)O Amb17241781 [0,1,0,0,0,1|1,0,0]=3 4444 B14R1.337 OC(Cc1ccccc1F)CC(=O)O Amb17236718 [0,1,0,0,0,1|1,0,0]=3 4445 B14R1.417 BrC(C(=O)c1ccccc1)CC(=O)O Amb1206782 [0,1,0,0,0,1|1,0,1]=4 4446 B14R1.417 CC(=O)NC(C)C(C)c1ccccc1 Amb25086516 [0,1,0,0,0,1|2,0,0]=4 4447 B14R1.417 CC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 Amb25725960 [0,1,0,0,0,1|2,0,0]=4 4448 B14R1.417 CC(=O)N[C@@H](C)[C@@H](O)c1ccccc1 Amb24418068 [0,1,0,0,0,1|2,0,0]=4 4449 B14R1.417 CC(=O)N[C@@H](C)[C@H](S)c1ccccc1 Amb25165741 [0,1,0,0,0,1|2,0,0]=4 4450 B14R1.417 CC(C(=O)c1ccccc1)CC(=O)O Amb17336399 [0,1,0,0,0,1|1,0,1]=4 4451 B14R1.417 CC(C)=CC(N)C(C)c1ccccc1 Amb25840651 [0,1,0,0,0,1|2,0,0]=4 4452 B14R1.417 CC(N(c1ccccc1)C)CC(=O)O Amb17336620 [0,1,0,0,0,1|2,0,0]=4 4453 B14R1.417 CC(NC(N)=O)C(Cl)c1ccccc1 Amb24668959 [0,1,0,0,0,1|2,0,0]=4 4454 B14R1.417 CC(NC(N)=O)C(O)c1ccccc1 Amb25772992 [0,1,0,0,0,1|2,0,0]=4 4455 B14R1.417 CC(c1ccccc1)N(CC(=O)O)C Amb17336640 [0,1,0,0,0,1|2,0,0]=4 4456 B14R1.417 C[C@@H](NC(N)=O)[C@@H](O)c1ccccc1 Amb24433430 [0,1,0,0,0,1|2,0,0]=4 4457 B14R1.417 C[C@@H](NC(N)=O)[C@H](Cl)c1ccccc1 Amb25785564 [0,1,0,0,0,1|2,0,0]=4 4458 B14R1.417 C[C@@H](NC(N)=O)[C@H](O)c1ccccc1 Amb25055138 [0,1,0,0,0,1|2,0,0]=4 4459 B14R1.417 C\C(=C/C(O)=O)\C(C)c1ccccc1 Amb25074635 [0,1,0,0,0,1|1,0,1]=4 4460 B14R1.417 ClC(C(=O)c1ccccc1)CC(=O)O Amb17339884 [0,1,0,0,0,1|1,0,1]=4 4461 B14R1.417 NC(CC(O)=O)C(=O)c1ccccc1 Amb18627624 [0,1,0,0,0,1|0,0,1]=3 4462 B14R1.417 NC(CC(O)=O)C(O)c1c[n]ccc1 Amb18813256 [0,1,0,0,0,1|1,0,0]=3 4463 B14R1.417 NC(CC(O)=O)C(O)c1cccc[n]1 Amb18813257 [0,1,0,0,0,1|1,0,0]=3 4464 B14R1.417 NC(CC(O)=O)C(O)c1ccccc1 Amb18108613 [0,1,0,0,0,1|0,0,0]=2 4465 B14R1.417 OC(c1ccccc1)C(NC(=O)C)C Amb17595062 [0,1,0,0,0,1|2,0,0]=4 4466 B14R1.425 CC(C(O)=O)N(O)Cc1ccccc1 Amb24374587 [0,1,0,0,0,1|2,0,0]=4 4467 B14R1.425 CC(Cc1ccccc1)N(N)C(N)=O Amb22446446 [0,1,0,0,0,1|2,0,0]=4 4468 B14R1.425 CN(Cc1ccccc1)[C@H](C)C(O)=O Amb25299435 [0,1,0,0,0,1|2,0,0]=4 4469 B14R1.425 NC(=O)C(=O)N(N)Cc1ccccc1 Amb25141115 [0,1,0,0,0,1|2,0,0]=4 4470 B14R1.425 NC(Cc1ccccc1)C(O)C(O)=O Amb18652122 [0,1,0,0,0,1|0,0,0]=2 4471 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22744925 [0,1,0,0,0,1|0,0,0]=2 4472 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22750622 [0,1,0,0,0,1|0,0,0]=2 4473 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22746338 [0,1,0,0,0,1|0,0,0]=2 4474 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22747652 [0,1,0,0,0,1|0,0,0]=2 4475 B14R1.433 N[C@@H](Cc1ccccc1)CS(O)(=O)=O Amb19888811 [0,1,0,0,0,1|1,0,0]=3 4476 B14R1.433 N[C@H](CS(=O)(=O)O)Cc1ccccc1 Amb13883585 [0,1,0,0,0,1|1,0,0]=3 4477 B14R1.549 CC(=O)NC(Cc1ccccc1)C#N Amb24539287 [0,1,0,0,0,1|1,0,1]=4 4478 B14R1.549 CC(=O)NC(Cc1ccccc1)C=C Amb24096354 [0,1,0,0,0,1|2,0,0]=4 4479 B14R1.549 ClC[C@H](Cc1ccccc1)NC(=O)C Amb17103592 [0,1,0,0,0,1|2,0,0]=4 4480 B14R1.549 N#CC(Cc1ccccc1)CC(=O)O Amb17336081 [0,1,0,0,0,1|0,0,1]=3 4481 B14R1.549 O=NN(Cc1ccccc1)CC(=O)O Amb17595089 [0,1,0,0,0,1|1,0,1]=4 4482 B14R1.549 OC(=O)CN(Cc1ccccc1)C=O Amb18651419 [0,1,0,0,0,1|2,0,0]=4 4483 B14R1.549 OC[C@H](Cc1ccccc1)NC(=O)C Amb17102648 [0,1,0,0,0,1|2,0,0]=4 4484 B14R1.698 CC(=O)NC(C)Cc1ccc(F)cc1 Amb24721876 [0,1,0,0,0,1|2,0,0]=4 4485 B14R1.698 CC(=O)NC(C)Cc1ccc(O)cc1 Amb25123953 [0,1,0,0,0,1|2,0,0]=4 4486 B14R1.698 CC(=O)N[C@@H](C)Cc1ccc(O)cc1 Amb24345555 [0,1,0,0,0,1|2,0,0]=4 4487 B14R1.698 CC(C)=CC(N)Cc1ccc(C)cc1 Amb24599904 [0,1,0,0,0,1|2,0,0]=4 4488 B14R1.698 CC(CC(O)=O)Nc1ccc(Cl)cc1 Amb22455831 [0,1,0,0,0,1|2,0,0]=4 4489 B14R1.698 CC(CC(O)=O)Nc1ccc(O)cc1 Amb24373101 [0,1,0,0,0,1|2,0,0]=4 4490 B14R1.698 CC(Cc1ccc(Cl)cc1)NC(N)=O Amb22461493 [0,1,0,0,0,1|2,0,0]=4 4491 B14R1.698 CC(Cc1ccc(Cl)cc1)OC(O)=O Amb24063646 [0,1,0,0,0,1|1,0,0]=3 4492 B14R1.698 CC(Cc1ccc(F)cc1)NC(N)=O Amb19053109 [0,1,0,0,0,1|2,0,0]=4 4493 B14R1.698 CC(Cc1ccc(cc1)Br)CC(=O)O Amb17265523 [0,1,0,0,0,1|1,0,0]=3 4494 B14R1.698 CC(Cc1ccc(cc1)Br)NC(=O)C Amb10652716 [0,1,0,0,0,1|2,0,0]=4 4495 B14R1.698 CC(Cc1ccc(cc1)F)CC(=O)O Amb17236375 [0,1,0,0,0,1|1,0,0]=3 4496 B14R1.698 CC(Cc1ccc(cc1)O)CC(=O)O Amb17336807 [0,1,0,0,0,1|1,0,0]=3 4497 B14R1.698 CN(Cc1ccc(I)cc1)CC(O)=O Amb22032587 [0,1,0,0,0,1|2,0,0]=4 4498 B14R1.698 CN(Cc1ccc(cc1)F)CC(=O)O Amb13948951 [0,1,0,0,0,1|2,0,0]=4 4499 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)Br Amb17264237 [0,1,0,0,0,1|1,0,1]=4 4500 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)C Amb17234900 [0,1,0,0,0,1|1,0,1]=4 4501 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)Cl Amb17240736 [0,1,0,0,0,1|1,0,1]=4 4502 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)F Amb17235884 [0,1,0,0,0,1|1,0,1]=4 4503 B14R1.698 Cc1ccc(CC(Br)CC(O)=O)cc1 Amb18108429 [0,1,0,0,0,1|1,0,0]=3 4504 B14R1.698 Cc1ccc(CC(Cl)CC(O)=O)cc1 Amb18627988 [0,1,0,0,0,1|1,0,0]=3 4505 B14R1.698 Cc1ccc(CN(C)CC(O)=O)cc1 Amb22587218 [0,1,0,0,0,1|2,0,0]=4 4506 B14R1.698 NC(Cc1ccc(O)cc1)CC(O)=O Amb18814153 [0,1,0,0,0,1|0,0,0]=2 4507 B14R1.698 NC(Cc1ccc(cc1)Br)CC(=O)O Amb17473597 [0,1,0,0,0,1|0,0,0]=2 4508 B14R1.698 NC(Cc1ccc(cc1)Cl)CC(=O)O Amb17471486 [0,1,0,0,0,1|0,0,0]=2 4509 B14R1.698 N[C@@H](CC(O)=O)Cc1ccc(F)cc1 Amb17678831 [0,1,0,0,0,1|0,0,0]=2 4510 B14R1.698 N[C@@H](Cc1ccc(Cl)cc1)CC(O)=O Amb22745372 [0,1,0,0,0,1|0,0,0]=2 4511 B14R1.698 N[C@@H](Cc1ccc(I)cc1)CC(O)=O Amb22746264 [0,1,0,0,0,1|0,0,0]=2 4512 B14R1.698 N[C@@H](Cc1ccc(O)cc1)CC(O)=O Amb22369425 [0,1,0,0,0,1|0,0,0]=2 4513 B14R1.698 N[C@@H](Cc1ccc(cc1)Br)CC(=O)O Amb16231755 [0,1,0,0,0,1|0,0,0]=2 4514 B14R1.698 N[C@@H](Cc1ccc(cc1)Cl)CC(=O)O Amb10603271 [0,1,0,0,0,1|0,0,0]=2 4515 B14R1.698 N[C@@H](Cc1ccc(cc1)F)CC(=O)O Amb16231675 [0,1,0,0,0,1|0,0,0]=2 4516 B14R1.698 N[C@H](Cc1ccc(cc1)C)CC(=O)O Amb16231749 [0,1,0,0,0,1|0,0,0]=2 4517 B14R1.698 OC(=O)CC(Br)Cc1ccc(Cl)cc1 Amb18628161 [0,1,0,0,0,1|1,0,0]=3 4518 B14R1.698 OC(=O)CC(Br)Cc1ccc(F)cc1 Amb18629098 [0,1,0,0,0,1|1,0,0]=3 4519 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Br)cc1 Amb18111139 [0,1,0,0,0,1|1,0,0]=3 4520 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Cl)cc1 Amb18111140 [0,1,0,0,0,1|1,0,0]=3 4521 B14R1.698 OC(=O)CC(Cl)Cc1ccc(F)cc1 Amb18628471 [0,1,0,0,0,1|1,0,0]=3 4522 B14R1.698 OC(=O)CS(=O)Cc1ccc(Br)cc1 Amb22058852 [0,1,0,0,0,1|2,0,0]=4 4523 B14R1.698 OC(Cc1ccc(cc1)Br)CC(=O)O Amb17266777 [0,1,0,0,0,1|1,0,0]=3 4524 B14R1.698 OC(Cc1ccc(cc1)C)CC(=O)O Amb17235900 [0,1,0,0,0,1|1,0,0]=3 4525 B14R1.698 OC(Cc1ccc(cc1)Cl)CC(=O)O Amb17241783 [0,1,0,0,0,1|1,0,0]=3 4526 B14R1.698 OC(Cc1ccc(cc1)F)CC(=O)O Amb17236719 [0,1,0,0,0,1|1,0,0]=3 4527 B14R1.743 BrCC(=O)NC(Cc1ccccc1)C Amb17333679 [0,1,0,0,0,1|2,0,0]=4 4528 B14R1.743 CC(Cc1ccccc1)NC(=O)CN Amb19036468 [0,1,0,0,0,1|2,0,0]=4 4529 B14R1.743 CC(Cc1ccccc1)NC(=O)NN Amb19042175 [0,1,0,0,0,1|2,0,0]=4 4530 B14R1.743 CC(Cc1ccccc1)NC(N)=NO Amb19042176 [0,1,0,0,0,1|2,0,0]=4 4531 B14R1.743 CNC(=O)NC(C)Cc1ccccc1 Amb25277231 [0,1,0,0,0,1|2,0,0]=4 4532 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,1|1,0,0]=3 4533 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,1|1,0,0]=3 4534 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,1|0,0,0]=2 4535 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,1|0,0,0]=2 4536 B14R1.743 COC(=O)\C=C(\N)/Nc1ccccc1 Amb25843964 [0,1,0,0,0,1|1,0,1]=4 4537 B14R1.1485 CC(=O)NC(C)(C)Cc1ccccc1 Amb19517626 [0,1,0,0,0,1|2,0,0]=4 4538 B14R1.1485 CC(C)(CC(O)=O)Sc1ccccc1 Amb22456988 [0,1,0,0,0,1|2,0,0]=4 4539 B14R1.1485 CC(C)(Cc1ccccc1)NC(N)=O Amb25858099 [0,1,0,0,0,1|2,0,0]=4 4540 B14R1.1485 CC(C)(Cc1ccccc1)OC(N)=O Amb24084628 [0,1,0,0,0,1|2,0,0]=4 4541 B14R1.1485 CC(O)(CC(O)=O)Cc1c[n]ccc1 Amb18863975 [0,1,0,0,0,1|2,0,0]=4 4542 B14R1.1485 CC(O)(CC(O)=O)Cc1cc[n]cc1 Amb18863976 [0,1,0,0,0,1|2,0,0]=4 4543 B14R1.1485 CC(O)(CC(O)=O)Cc1cccc[n]1 Amb18863974 [0,1,0,0,0,1|2,0,0]=4 4544 B14R1.1485 OC(=O)CC(Cc1ccccc1)(C)C Amb17336451 [0,1,0,0,0,1|1,0,0]=3 4545 B14R1.1485 OC(=O)CC(Oc1ccccc1)(C)C Amb17235912 [0,1,0,0,0,1|2,0,0]=4 4546 B14R1.1485 OC(=O)CS(=O)(=O)Cc1ccccc1 Amb1928151 [0,1,0,0,0,1|2,0,0]=4 4547 B14R1.5978 CC(=O)NC(C)Cc1cccc(Cl)c1 Amb24510947 [0,1,0,0,0,1|2,0,0]=4 4548 B14R1.5978 CC(=O)NC(C)Cc1cccc(O)c1 Amb24506362 [0,1,0,0,0,1|2,0,0]=4 4549 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(O)c1 Amb25166006 [0,1,0,0,0,1|2,0,0]=4 4550 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(S)c1 Amb24404829 [0,1,0,0,0,1|2,0,0]=4 4551 B14R1.5978 CC(C)=CC(N)Cc1cc(C)ccc1 Amb24498432 [0,1,0,0,0,1|2,0,0]=4 4552 B14R1.5978 CC(C)=CC(N)Cc1cccc(Cl)c1 Amb25677902 [0,1,0,0,0,1|2,0,0]=4 4553 B14R1.5978 CC(CC(O)=O)Oc1cc(O)ccc1 Amb18813360 [0,1,0,0,0,1|2,0,0]=4 4554 B14R1.5978 CC(Cc1cccc(Cl)c1)NC(N)=O Amb24753672 [0,1,0,0,0,1|2,0,0]=4 4555 B14R1.5978 CC(Cc1cccc(F)c1)CC(O)=O Amb19149363 [0,1,0,0,0,1|1,0,0]=3 4556 B14R1.5978 CC(Cc1cccc(F)c1)NC(N)=O Amb25375940 [0,1,0,0,0,1|2,0,0]=4 4557 B14R1.5978 CC(Cc1cccc(c1)Br)CC(=O)O Amb17265519 [0,1,0,0,0,1|1,0,0]=3 4558 B14R1.5978 CC(Cc1cccc(c1)Br)NC(=O)C Amb12283588 [0,1,0,0,0,1|2,0,0]=4 4559 B14R1.5978 CC(Cc1cccc(c1)Cl)CC(=O)O Amb17241247 [0,1,0,0,0,1|1,0,0]=3 4560 B14R1.5978 CC(Cc1cccc(c1)O)CC(=O)O Amb17336809 [0,1,0,0,0,1|1,0,0]=3 4561 B14R1.5978 CN(Cc1cccc(I)c1)CC(O)=O Amb25386961 [0,1,0,0,0,1|2,0,0]=4 4562 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)Br Amb17264234 [0,1,0,0,0,1|1,0,1]=4 4563 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)C Amb17234897 [0,1,0,0,0,1|1,0,1]=4 4564 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)Cl Amb17240733 [0,1,0,0,0,1|1,0,1]=4 4565 B14R1.5978 C\C(\Cc1cccc(Br)c1)=C\C(O)=O Amb25338453 [0,1,0,0,0,1|1,0,1]=4 4566 B14R1.5978 C\C(\Cc1cccc(Cl)c1)=C\C(O)=O Amb25209527 [0,1,0,0,0,1|1,0,1]=4 4567 B14R1.5978 Cc1cc(C\C(\C)=C/C(O)=O)ccc1 Amb25227689 [0,1,0,0,0,1|1,0,1]=4 4568 B14R1.5978 Cc1cccc(CC(C)NC(C)=O)c1 Amb24393394 [0,1,0,0,0,1|2,0,0]=4 4569 B14R1.5978 Cc1cccc(C[C@H](C)NC(C)=O)c1 Amb25102710 [0,1,0,0,0,1|2,0,0]=4 4570 B14R1.5978 NC(Cc1cc(O)ccc1)CC(O)=O Amb18814152 [0,1,0,0,0,1|0,0,0]=2 4571 B14R1.5978 NC(Cc1cccc(c1)Br)CC(=O)O Amb17473593 [0,1,0,0,0,1|0,0,0]=2 4572 B14R1.5978 NC(Cc1cccc(c1)C)CC(=O)O Amb17470844 [0,1,0,0,0,1|0,0,0]=2 4573 B14R1.5978 NC(Cc1cccc(c1)Cl)CC(=O)O Amb17471482 [0,1,0,0,0,1|0,0,0]=2 4574 B14R1.5978 NC(Cc1cccc(c1)F)CC(=O)O Amb17470961 [0,1,0,0,0,1|0,0,0]=2 4575 B14R1.5978 N[C@@H](Cc1cccc(Br)c1)CC(O)=O Amb22757443 [0,1,0,0,0,1|0,0,0]=2 4576 B14R1.5978 N[C@@H](Cc1cccc(Cl)c1)CC(O)=O Amb22747011 [0,1,0,0,0,1|0,0,0]=2 4577 B14R1.5978 N[C@@H](Cc1cccc(c1)Cl)CC(=O)O Amb16231757 [0,1,0,0,0,1|0,0,0]=2 4578 B14R1.5978 N[C@@H](Cc1cccc(c1)F)CC(=O)O Amb16231652 [0,1,0,0,0,1|0,0,0]=2 4579 B14R1.5978 N[C@H](Cc1cccc(c1)C)CC(=O)O Amb16231754 [0,1,0,0,0,1|0,0,0]=2 4580 B14R1.5978 OC(Cc1cccc(c1)Br)CC(=O)O Amb17266776 [0,1,0,0,0,1|1,0,0]=3 4581 B14R1.5978 OC(Cc1cccc(c1)C)CC(=O)O Amb17235899 [0,1,0,0,0,1|1,0,0]=3 4582 B14R1.5978 OC(Cc1cccc(c1)Cl)CC(=O)O Amb17241782 [0,1,0,0,0,1|1,0,0]=3 4583 B14R1.161 C=C(CNc1ccccc1Br)C(O)=O Amb25714922 [0,1,0,0,0,1|1,0,1]=4 4584 B14R1.161 C=C(CNc1ccccc1Cl)C(O)=O Amb25169854 [0,1,0,0,0,1|1,0,1]=4 4585 B14R1.161 CC(CNc1ccc[n]c1Cl)C(O)=O Amb18607785 [0,1,0,0,0,1|2,0,0]=4 4586 B14R1.161 CC(CNc1ccccc1N)C(O)=O Amb18651898 [0,1,0,0,0,1|1,0,0]=3 4587 B14R1.161 CC(SCc1ccccc1F)C(N)=O Amb21656062 [0,1,0,0,0,1|2,0,0]=4 4588 B14R1.161 C[C@@H](\N=C\c1ccccc1O)C(O)=O Amb24506262 [0,1,0,0,0,1|1,0,1]=4 4589 B14R1.161 Cc1ccc[n]c1NCC(C)C(O)=O Amb18605145 [0,1,0,0,0,1|2,0,0]=4 4590 B14R1.161 Cc1ccccc1NCC(C)C(C)=O Amb25299393 [0,1,0,0,0,1|2,0,0]=4 4591 B14R1.161 Cc1ccccc1NCC(N)C(O)=O Amb24345651 [0,1,0,0,0,1|0,0,0]=2 4592 B14R1.161 Cc1ccccc1NNC(C)C(O)=O Amb25108140 [0,1,0,0,0,1|2,0,0]=4 4593 B14R1.161 NC(=O)C(COc1ccccc1C)C Amb17235638 [0,1,0,0,0,1|2,0,0]=4 4594 B14R1.161 NC(=O)C(COc1ccccc1Cl)C Amb17241549 [0,1,0,0,0,1|2,0,0]=4 4595 B14R1.161 NC(=O)C(COc1ccccc1F)C Amb17236551 [0,1,0,0,0,1|2,0,0]=4 4596 B14R1.161 NC(=O)C(N)CNc1ccccc1Br Amb25353015 [0,1,0,0,0,1|1,0,0]=3 4597 B14R1.161 NC(=O)C(N)CNc1ccccc1I Amb25775520 [0,1,0,0,0,1|1,0,0]=3 4598 B14R1.161 NC(=O)C(SCc1ccccc1Cl)C Amb11298932 [0,1,0,0,0,1|2,0,0]=4 4599 B14R1.161 NC(CNc1ccccc1Br)C(O)=O Amb25204064 [0,1,0,0,0,1|0,0,0]=2 4600 B14R1.161 NC(CNc1ccccc1Cl)C(O)=O Amb25169853 [0,1,0,0,0,1|0,0,0]=2 4601 B14R1.161 NC(CNc1ccccc1F)C(O)=O Amb24454221 [0,1,0,0,0,1|0,0,0]=2 4602 B14R1.161 Nc1ccccc1NCC(N)C(O)=O Amb24563418 [0,1,0,0,0,1|0,0,0]=2 4603 B14R1.161 Nc1ccccc1SCC(N)C(O)=O Amb22466326 [0,1,0,0,0,1|0,0,0]=2 4604 B14R1.161 OC(=O)C(=O)NCc1ccccc1Br Amb25800289 [0,1,0,0,0,1|1,0,1]=4 4605 B14R1.161 OC(=O)C(=O)NCc1ccccc1C Amb17048336 [0,1,0,0,0,1|1,0,1]=4 4606 B14R1.161 OC(=O)C(=O)NCc1ccccc1O Amb24498211 [0,1,0,0,0,1|1,0,1]=4 4607 B14R1.161 OC(=O)C(CCc1ccccc1Br)N Amb17473600 [0,1,0,0,0,1|0,0,0]=2 4608 B14R1.161 OC(=O)C(CCc1ccccc1C)C Amb17235378 [0,1,0,0,0,1|1,0,0]=3 4609 B14R1.161 OC(=O)C(CCc1ccccc1C)N Amb17470839 [0,1,0,0,0,1|0,0,0]=2 4610 B14R1.161 OC(=O)C(CCc1ccccc1Cl)C Amb17241241 [0,1,0,0,0,1|1,0,0]=3 4611 B14R1.161 OC(=O)C(CCc1ccccc1Cl)N Amb17471477 [0,1,0,0,0,1|0,0,0]=2 4612 B14R1.161 OC(=O)C(CCc1ccccc1F)C Amb17236370 [0,1,0,0,0,1|1,0,0]=3 4613 B14R1.161 OC(=O)C(CCc1ccccc1F)N Amb17470953 [0,1,0,0,0,1|0,0,0]=2 4614 B14R1.161 OC(=O)C(NCc1ccccc1Cl)C Amb10199865 [0,1,0,0,0,1|1,0,0]=3 4615 B14R1.161 OC(=O)C(NCc1ccccc1Cl)C Amb1110092 [0,1,0,0,0,1|1,0,0]=3 4616 B14R1.161 OC(=O)C(O)CNc1ccccc1Br Amb24658872 [0,1,0,0,0,1|1,0,0]=3 4617 B14R1.161 OC(=O)C(O)CNc1ccccc1F Amb25819492 [0,1,0,0,0,1|1,0,0]=3 4618 B14R1.161 OC(=O)C(O)\C=C\c1ccccc1Cl Amb25790576 [0,1,0,0,0,1|1,0,1]=4 4619 B14R1.415 CC(C(=O)N)CN(c1ccccc1)C Amb17235455 [0,1,0,0,0,1|2,0,0]=4 4620 B14R1.415 CC(C(=O)O)CC(=O)c1ccncc1 Amb17336556 [0,1,0,0,0,1|2,0,0]=4 4621 B14R1.415 CC(C(=O)O)CN(c1ccccc1)C Amb17336619 [0,1,0,0,0,1|1,0,0]=3 4622 B14R1.415 CC(C(=O)O)NC(=O)c1ccccc1 Amb2499734 [0,1,0,0,0,1|1,0,1]=4 4623 B14R1.415 CC(C[C@@H](N)C(O)=O)c1ccccc1 Amb17933184 [0,1,0,0,0,1|0,0,0]=2 4624 B14R1.415 CC(NC(C)c1ccccc1)C(O)=O Amb24271459 [0,1,0,0,0,1|1,0,0]=3 4625 B14R1.415 CC(\C=C(/Cl)\C(O)=O)c1ccccc1 Amb25827178 [0,1,0,0,0,1|1,0,1]=4 4626 B14R1.415 CC(\C=C(\Cl)/C(O)=O)c1ccccc1 Amb24630828 [0,1,0,0,0,1|1,0,1]=4 4627 B14R1.415 CC(c1ccccc1)SC(C(=O)O)C Amb17501620 [0,1,0,0,0,1|1,0,0]=3 4628 B14R1.415 CN(CC(N)C(O)=O)c1ccccc1 Amb19079990 [0,1,0,0,0,1|0,0,0]=2 4629 B14R1.415 C[C@@H](C(=O)O)NC(=O)c1ccccc1 Amb1206930 [0,1,0,0,0,1|1,0,1]=4 4630 B14R1.415 C[C@@H](NC(=O)C(O)=O)c1ccccc1 Amb25765711 [0,1,0,0,0,1|1,0,1]=4 4631 B14R1.415 C[C@@H](NC(=S)c1ccccc1)C(O)=O Amb25041134 [0,1,0,0,0,1|1,0,1]=4 4632 B14R1.415 C[C@H](NC(=N)c1ccccc1)C(O)=O Amb25102516 [0,1,0,0,0,1|1,0,1]=4 4633 B14R1.415 C[C@H](NC(=O)C(O)=O)c1ccccc1 Amb25200975 [0,1,0,0,0,1|1,0,1]=4 4634 B14R1.415 C[C@H](NC(=S)c1ccccc1)C(O)=O Amb24639167 [0,1,0,0,0,1|1,0,1]=4 4635 B14R1.415 C\C(=C/C(C)c1ccccc1)\C(O)=O Amb24652552 [0,1,0,0,0,1|1,0,1]=4 4636 B14R1.415 C\C(=C/C(O)C(O)=O)\c1ccccc1 Amb18651099 [0,1,0,0,0,1|1,0,1]=4 4637 B14R1.415 C\C(=C/C(O)c1ccccc1)\C(O)=O Amb25321964 [0,1,0,0,0,1|1,0,1]=4 4638 B14R1.415 C\C(=C/[C@H](C)C(O)=O)\c1ccccc1 Amb25765672 [0,1,0,0,0,1|1,0,1]=4 4639 B14R1.415 C\C(=C\C(C)C(O)=O)\c1ccccc1 Amb25088407 [0,1,0,0,0,1|1,0,1]=4 4640 B14R1.415 C\C(=C\C(O)C(O)=O)\c1ccccc1 Amb24651022 [0,1,0,0,0,1|1,0,1]=4 4641 B14R1.415 NC(C(=O)N)NC(=O)c1ccccc1 Amb10558232 [0,1,0,0,0,1|1,0,1]=4 4642 B14R1.415 NC(C(=O)O)CC(=O)c1ccccc1 Amb17470829 [0,1,0,0,0,1|0,0,0]=2 4643 B14R1.415 NC(NC(=O)c1ccccc1)C([O-])=O Amb22263075 [0,1,0,0,0,1|0,0,2]=4 4644 B14R1.415 N[C@@H](CC(=O)c1ccccc1)C(O)=O Amb23403688 [0,1,0,0,0,1|0,0,0]=2 4645 B14R1.415 O=C(c1ccccc1)CC(=C)C(=O)O Amb17594937 [0,1,0,0,0,1|1,0,1]=4 4646 B14R1.415 O=C(c1ccccc1)CC(=O)C(=O)O Amb1102273 [0,1,0,0,0,1|1,0,1]=4 4647 B14R1.415 OC(=O)C(CC(=O)c1ccccn1)C Amb17336551 [0,1,0,0,0,1|2,0,0]=4 4648 B14R1.415 OC(=O)C(CC(=O)c1cccnc1)C Amb17235562 [0,1,0,0,0,1|2,0,0]=4 4649 B14R1.415 OC(=O)C(O)CC(=O)c1ccccc1 Amb18651699 [0,1,0,0,0,1|1,0,0]=3 4650 B14R1.415 OC(=O)[C@@H](O)NC(=O)c1ccccc1 Amb24181930 [0,1,0,0,0,1|1,0,1]=4 4651 B14R1.415 OC(=O)[C@H](O)NC(=O)c1ccccc1 Amb24521905 [0,1,0,0,0,1|1,0,1]=4 4652 B14R1.415 O[C@H](C(=O)O)CC(=O)c1ccccc1 Amb17615662 [0,1,0,0,0,1|1,0,0]=3 4653 B14R1.679 C=C(CNc1ccc(I)cc1)C(O)=O Amb24405269 [0,1,0,0,0,1|1,0,1]=4 4654 B14R1.679 C=C(CSc1ccc(Cl)cc1)C(O)=O Amb22479405 [0,1,0,0,0,1|1,0,1]=4 4655 B14R1.679 CC(C(=O)C)SCc1ccc(cc1)N Amb17498400 [0,1,0,0,0,1|2,0,0]=4 4656 B14R1.679 CC(C(=O)N)COc1ccc(cc1)C Amb17235642 [0,1,0,0,0,1|2,0,0]=4 4657 B14R1.679 CC(C(=O)N)COc1ccc(cc1)Cl Amb17241554 [0,1,0,0,0,1|2,0,0]=4 4658 B14R1.679 CC(C(=O)N)COc1ccc(cc1)F Amb17236557 [0,1,0,0,0,1|2,0,0]=4 4659 B14R1.679 CC(C(=O)N)SCc1ccc(cc1)C Amb11298995 [0,1,0,0,0,1|2,0,0]=4 4660 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Br Amb17265518 [0,1,0,0,0,1|1,0,0]=3 4661 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)C Amb17235380 [0,1,0,0,0,1|1,0,0]=3 4662 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Cl Amb17241243 [0,1,0,0,0,1|1,0,0]=3 4663 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)F Amb17236371 [0,1,0,0,0,1|1,0,0]=3 4664 B14R1.679 CC(C(=O)O)NCc1ccc(cc1)F Amb1110539 [0,1,0,0,0,1|1,0,0]=3 4665 B14R1.679 CC(C(=O)O)SCc1ccc(cc1)Cl Amb2101263 [0,1,0,0,0,1|1,0,0]=3 4666 B14R1.679 CC(C(=O)O)SCc1ccc(cc1)N Amb17497539 [0,1,0,0,0,1|1,0,0]=3 4667 B14R1.679 CC(CNc1ccc(Cl)c[n]1)C(O)=O Amb18095614 [0,1,0,0,0,1|2,0,0]=4 4668 B14R1.679 CC(CNc1ccc(O)cc1)C(O)=O Amb24498328 [0,1,0,0,0,1|1,0,0]=3 4669 B14R1.679 CC(SCc1ccc(F)cc1)C(N)=O Amb21656146 [0,1,0,0,0,1|2,0,0]=4 4670 B14R1.679 CC(\N=C\c1ccc(F)cc1)C(O)=O Amb24336592 [0,1,0,0,0,1|1,0,1]=4 4671 B14R1.679 Cc1ccc(NCC(C)C(O)=O)[n]c1 Amb18607812 [0,1,0,0,0,1|2,0,0]=4 4672 B14R1.679 Cc1ccc(cc1)NCC(O)C(O)=O Amb25102280 [0,1,0,0,0,1|1,0,0]=3 4673 B14R1.679 Cc1ccc(cc1)SCC(=C)C(O)=O Amb18656286 [0,1,0,0,0,1|1,0,1]=4 4674 B14R1.679 Cc1ccc(cc1)SCC(O)C(O)=O Amb22466689 [0,1,0,0,0,1|1,0,0]=3 4675 B14R1.679 Cc1ccc(cc1)SC[C@H](N)C(O)=O Amb22351164 [0,1,0,0,0,1|0,0,0]=2 4676 B14R1.679 Cc1ccc(cc1)\C=C\C(O)C(O)=O Amb18651098 [0,1,0,0,0,1|1,0,1]=4 4677 B14R1.679 Cc1ccc(cc1)\N=N\C(Cl)C(O)=O Amb25366091 [0,1,0,0,0,1|2,0,0]=4 4678 B14R1.679 NC(=O)C(N)CNc1ccc(I)cc1 Amb24700593 [0,1,0,0,0,1|1,0,0]=3 4679 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Br Amb17473596 [0,1,0,0,0,1|0,0,0]=2 4680 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)C Amb17470847 [0,1,0,0,0,1|0,0,0]=2 4681 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Cl Amb17471485 [0,1,0,0,0,1|0,0,0]=2 4682 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)F Amb17470957 [0,1,0,0,0,1|0,0,0]=2 4683 B14R1.679 NC(CCc1ccc(O)cc1)C(O)=O Amb24087709 [0,1,0,0,0,1|0,0,0]=2 4684 B14R1.679 N[C@@H](CSc1ccc(Cl)cc1)C(O)=O Amb22466318 [0,1,0,0,0,1|0,0,0]=2 4685 B14R1.679 N[C@@H](CSc1ccc(F)cc1)C(O)=O Amb22351165 [0,1,0,0,0,1|0,0,0]=2 4686 B14R1.679 N[C@@H](\C=N\c1ccc(O)cc1)C(O)=O Amb25233167 [0,1,0,0,0,1|0,0,1]=3 4687 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(O)=O Amb24099406 [0,1,0,0,0,1|0,0,0]=2 4688 B14R1.679 N[C@H](CSc1ccc(Cl)cc1)C(O)=O Amb22472009 [0,1,0,0,0,1|0,0,0]=2 4689 B14R1.679 Nc1ccc(CCC(O)C(O)=O)cc1 Amb22473017 [0,1,0,0,0,1|1,0,0]=3 4690 B14R1.679 Nc1ccc(cc1)NCC(O)C(N)=O Amb25701492 [0,1,0,0,0,1|2,0,0]=4 4691 B14R1.679 O=C(C(=O)O)NCc1ccc(cc1)Br Amb17415233 [0,1,0,0,0,1|1,0,1]=4 4692 B14R1.679 OC(=O)C(CCc1ccc(cc1)O)C Amb17336808 [0,1,0,0,0,1|1,0,0]=3 4693 B14R1.679 OC(=O)C(O)CNc1ccc(Br)cc1 Amb24555880 [0,1,0,0,0,1|1,0,0]=3 4694 B14R1.679 OC(=O)C(O)CNc1ccc(F)cc1 Amb24700585 [0,1,0,0,0,1|1,0,0]=3 4695 B14R1.679 OC(=O)C(O)\C=C\c1ccc(Cl)cc1 Amb25179889 [0,1,0,0,0,1|1,0,1]=4 4696 B14R1.679 Oc1ccc(CCC(O)C(O)=O)cc1 Amb19928328 [0,1,0,0,0,1|1,0,0]=3 4697 B14R1.756 CC(CNc1ccccc1)C(=O)NN Amb25377013 [0,1,0,0,0,1|2,0,0]=4 4698 B14R1.756 CC(CNc1ccccc1)\C(\N)=N\O Amb24400013 [0,1,0,0,0,1|2,0,0]=4 4699 B14R1.756 CC(NCc1ccccc1)\C(\N)=N\O Amb25053223 [0,1,0,0,0,1|2,0,0]=4 4700 B14R1.756 CC(OCc1ccccc1)C(N)=NO Amb19062506 [0,1,0,0,0,1|2,0,0]=4 4701 B14R1.756 CCC(=O)C(C)OCc1ccccc1 Amb25708039 [0,1,0,0,0,1|2,0,0]=4 4702 B14R1.756 CNC(=O)[C@@H](C)NCc1ccccc1 Amb25819693 [0,1,0,0,0,1|2,0,0]=4 4703 B14R1.756 CNC(=O)[C@H](C)NCc1ccccc1 Amb25819451 [0,1,0,0,0,1|2,0,0]=4 4704 B14R1.756 COC(=O)C(=O)CCc1ccccc1 Amb10069228 [0,1,0,0,0,1|1,0,1]=4 4705 B14R1.756 COC(=O)C(=O)NCc1ccccc1 Amb24444903 [0,1,0,0,0,1|1,0,1]=4 4706 B14R1.756 COC(=O)C(Br)CCc1ccccc1 Amb22500039 [0,1,0,0,0,1|1,0,0]=3 4707 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,1|1,0,0]=3 4708 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,1|1,0,0]=3 4709 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,1|1,0,0]=3 4710 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,1|0,0,0]=2 4711 B14R1.756 COC(=O)C(\N=C\c1ccccc1)C Amb2426902 [0,1,0,0,0,1|1,0,1]=4 4712 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,1|1,0,0]=3 4713 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb23439002 [0,1,0,0,0,1|0,0,0]=2 4714 B14R1.756 COC(=O)[C@H](C)OCc1ccccc1 Amb25833053 [0,1,0,0,0,1|1,0,0]=3 4715 B14R1.756 COC(=O)[C@H](NCc1ccccc1)C Amb16183003 [0,1,0,0,0,1|1,0,0]=3 4716 B14R1.756 COC(=O)[C@H](O)C#Cc1ccccc1 Amb25687820 [0,1,0,0,0,1|1,0,1]=4 4717 B14R1.756 COC(=O)[C@H](OCc1ccccc1)C Amb17617220 [0,1,0,0,0,1|1,0,0]=3 4718 B14R1.756 C[C@@H](OCc1ccccc1)C(=O)NN Amb25242729 [0,1,0,0,0,1|2,0,0]=4 4719 B14R1.756 C[C@H](OCc1ccccc1)C(=C)CO Amb25235678 [0,1,0,0,0,1|2,0,0]=4 4720 B14R1.756 OCC(=O)N(CCc1ccccc1)C Amb17401768 [0,1,0,0,0,1|2,0,0]=4 4721 B14R1.3099 NC(CCc1ccccc1)P(O)(O)=O Amb22465772 [0,1,0,0,0,1|1,0,0]=3 4722 B14R1.3099 NC(\C=C\c1ccccc1)P(O)(O)=O Amb24506404 [0,1,0,0,0,1|1,0,1]=4 4723 B14R1.4194 C=CC(OCc1ccccc1)C(O)=O Amb24507538 [0,1,0,0,0,1|1,0,0]=3 4724 B14R1.4194 CCC(C#Cc1ccccc1)C(O)=O Amb25108669 [0,1,0,0,0,1|1,0,1]=4 4725 B14R1.4194 CCC(NCc1ccccc1)C(N)=O Amb19050628 [0,1,0,0,0,1|2,0,0]=4 4726 B14R1.4194 CCC(NCc1ccccc1)C(O)=O Amb19050997 [0,1,0,0,0,1|1,0,0]=3 4727 B14R1.4194 CCC(OCc1ccccc1)C(N)=O Amb19042068 [0,1,0,0,0,1|2,0,0]=4 4728 B14R1.4194 CNC(CCc1ccccc1)C(O)=O Amb19042064 [0,1,0,0,0,1|0,0,0]=2 4729 B14R1.4194 N#CC(\N=N\c1ccccc1)C(O)=O Amb25783900 [0,1,0,0,0,1|1,0,1]=4 4730 B14R1.4194 NC(=O)C(CO)NCc1ccccc1 Amb25779419 [0,1,0,0,0,1|2,0,0]=4 4731 B14R1.4194 NC(=O)C(CO)OCc1ccccc1 Amb25794467 [0,1,0,0,0,1|2,0,0]=4 4732 B14R1.4194 NCC(OCc1ccccc1)C(O)=O Amb24507733 [0,1,0,0,0,1|0,0,0]=2 4733 B14R1.4194 OC(=O)[C@@H](CS)NCc1ccccc1 Amb25752825 [0,1,0,0,0,1|1,0,0]=3 4734 B14R1.4194 OC(=O)[C@H](CS)NCc1ccccc1 Amb24574718 [0,1,0,0,0,1|1,0,0]=3 4735 B14R1.4194 OCC(NCc1ccccc1)C(O)=O Amb17935753 [0,1,0,0,0,1|1,0,0]=3 4736 B14R1.4194 OC[C@@H](NCc1ccccc1)C(O)=O Amb17739825 [0,1,0,0,0,1|1,0,0]=3 4737 B14R1.5956 Brc1cccc(c1)CNC(=O)C(=O)O Amb17415232 [0,1,0,0,0,1|1,0,1]=4 4738 B14R1.5956 C=C(CNc1cccc(Br)c1)C(O)=O Amb25849575 [0,1,0,0,0,1|1,0,1]=4 4739 B14R1.5956 C=C(CNc1cccc(Cl)c1)C(O)=O Amb25853720 [0,1,0,0,0,1|1,0,1]=4 4740 B14R1.5956 CC(CCc1cccc(F)c1)C(O)=O Amb19337858 [0,1,0,0,0,1|1,0,0]=3 4741 B14R1.5956 CC(CNc1c[n]cc(Br)c1)C(O)=O Amb24722044 [0,1,0,0,0,1|2,0,0]=4 4742 B14R1.5956 CC(CNc1cc(O)ccc1)C(O)=O Amb18095613 [0,1,0,0,0,1|1,0,0]=3 4743 B14R1.5956 CC(\N=C\c1cc(O)ccc1)C(O)=O Amb24730048 [0,1,0,0,0,1|1,0,1]=4 4744 B14R1.5956 Cc1cc(cc[n]1)NCC(C)C(O)=O Amb25035675 [0,1,0,0,0,1|2,0,0]=4 4745 B14R1.5956 Cc1cc(ccc1)NCC(=C)C(O)=O Amb25715643 [0,1,0,0,0,1|1,0,1]=4 4746 B14R1.5956 Cc1cc(ccc1)NCC(N)C(O)=O Amb24361197 [0,1,0,0,0,1|0,0,0]=2 4747 B14R1.5956 Cc1cc[n]c(c1)NCC(C)C(O)=O Amb18095591 [0,1,0,0,0,1|2,0,0]=4 4748 B14R1.5956 Cc1cccc(c1)CNC(=O)C(=O)O Amb17048337 [0,1,0,0,0,1|1,0,1]=4 4749 B14R1.5956 Clc1cccc(c1)CNC(=O)C(=O)O Amb17404277 [0,1,0,0,0,1|1,0,1]=4 4750 B14R1.5956 NC(=O)C(COc1cccc(c1)C)C Amb17235640 [0,1,0,0,0,1|2,0,0]=4 4751 B14R1.5956 NC(=O)C(COc1cccc(c1)Cl)C Amb17241551 [0,1,0,0,0,1|2,0,0]=4 4752 B14R1.5956 NC(=O)C(COc1cccc(c1)F)C Amb17236554 [0,1,0,0,0,1|2,0,0]=4 4753 B14R1.5956 NC(=O)C(N)CNc1c[n]cc(Br)c1 Amb24507090 [0,1,0,0,0,1|2,0,0]=4 4754 B14R1.5956 NC(=O)C(N)CNc1cccc(Br)c1 Amb24471779 [0,1,0,0,0,1|1,0,0]=3 4755 B14R1.5956 NC(=O)C(N)CNc1cccc(I)c1 Amb25853728 [0,1,0,0,0,1|1,0,0]=3 4756 B14R1.5956 NC(=O)C(SCc1cccc(c1)C)C Amb11299004 [0,1,0,0,0,1|2,0,0]=4 4757 B14R1.5956 NC(=O)C(SCc1cccc(c1)Cl)C Amb11298961 [0,1,0,0,0,1|2,0,0]=4 4758 B14R1.5956 Nc1cccc(c1)NCC(O)C(N)=O Amb25066825 [0,1,0,0,0,1|2,0,0]=4 4759 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)C Amb17265517 [0,1,0,0,0,1|1,0,0]=3 4760 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)N Amb17473592 [0,1,0,0,0,1|0,0,0]=2 4761 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)C Amb17235379 [0,1,0,0,0,1|1,0,0]=3 4762 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)N Amb17470843 [0,1,0,0,0,1|0,0,0]=2 4763 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)C Amb17241242 [0,1,0,0,0,1|1,0,0]=3 4764 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)N Amb17471481 [0,1,0,0,0,1|0,0,0]=2 4765 B14R1.5956 OC(=O)C(CCc1cccc(c1)F)N Amb17470960 [0,1,0,0,0,1|0,0,0]=2 4766 B14R1.5956 OC(=O)C(CCc1cccc(c1)O)C Amb17336810 [0,1,0,0,0,1|1,0,0]=3 4767 B14R1.5956 OC(=O)C(NCc1cccc(c1)Cl)C Amb1111448 [0,1,0,0,0,1|1,0,0]=3 4768 B14R1.5956 OC(=O)C(NCc1cccc(c1)F)C Amb10199860 [0,1,0,0,0,1|1,0,0]=3 4769 B14R1.5956 OC(=O)C(NCc1cccc(c1)F)C Amb1109690 [0,1,0,0,0,1|1,0,0]=3 4770 B14R1.5956 OC(=O)C(O)CNc1c[n]cc(Br)c1 Amb24562780 [0,1,0,0,0,1|2,0,0]=4 4771 B14R1.5956 OC(=O)C(O)CNc1cccc(Cl)c1 Amb25140461 [0,1,0,0,0,1|1,0,0]=3 4772 B14R1.5956 OC(=O)C(O)\C=C\c1cccc(F)c1 Amb24610080 [0,1,0,0,0,1|1,0,1]=4 4773 B14R1.6395 CC(=O)C(C)(C)NCc1ccccc1 Amb25377113 [0,1,0,0,0,1|2,0,0]=4 4774 B14R1.6395 CC(C)(C#Cc1ccccc1)C(O)=O Amb24449192 [0,1,0,0,0,1|1,0,1]=4 4775 B14R1.6395 CC(C)(NCc1ccccc1)C(N)=O Amb19007435 [0,1,0,0,0,1|2,0,0]=4 4776 B14R1.6395 CC(C)(NCc1ccccc1)P(O)=O Amb24452596 [0,1,0,0,0,1|2,0,0]=4 4777 B14R1.6395 CC(C)(OCc1ccccc1)C(O)=O Amb19014785 [0,1,0,0,0,1|1,0,0]=3 4778 B14R1.6395 CC(C)(\C=C\c1ccccc1)C(O)=O Amb18650567 [0,1,0,0,0,1|1,0,1]=4 4779 B14R1.6395 CC(N)(COc1ccccc1)C(O)=O Amb19042938 [0,1,0,0,0,1|0,0,0]=2 4780 B14R1.6395 CC(O)(C#Cc1ccccc1)C(O)=O Amb24498318 [0,1,0,0,0,1|1,0,1]=4 4781 B14R1.6395 CC(O)(\C=C\c1ccccc1)C(O)=O Amb24512207 [0,1,0,0,0,1|1,0,1]=4 4782 B14R1.6395 C[C@@](N)(CCc1ccccc1)C(O)=O Amb22229869 [0,1,0,0,0,1|0,0,0]=2 4783 B14R1.6395 ClC(=O)C(CSc1ccccc1)(C)C Amb17144253 [0,1,0,0,0,1|2,0,0]=4 4784 B14R1.6395 NC(=O)C(CSc1ccccc1)(C)C Amb17143481 [0,1,0,0,0,1|2,0,0]=4 4785 B14R1.6395 OC(=O)C(CCc1ccccc1)(C)C Amb17235442 [0,1,0,0,0,1|1,0,0]=3 4786 B14R1.6395 OC(=O)C(CCc1ccccc1)(N)C Amb10609240 [0,1,0,0,0,1|0,0,0]=2 4787 B14R1.6395 OC(=O)C(F)(F)CNc1cc[n]cc1 Amb25112784 [0,1,0,0,0,1|2,0,0]=4 4788 B14R1.6395 OC(=O)C(F)(F)SCc1ccccc1 Amb23586516 [0,1,0,0,0,1|1,0,0]=3 4789 B14R1.6395 OC(=O)C(F)(F)\C=C\c1ccccc1 Amb24558575 [0,1,0,0,0,1|1,0,1]=4 4790 B14R1.6395 OC(=O)C(SCc1ccccc1)(C)C Amb17501463 [0,1,0,0,0,1|1,0,0]=3 4791 B14R1.3 C#Cc1ccc(CC(N)C(O)=O)cc1 Amb25828354 [0,2,0,0,0,0|0,0,0]=2 4792 B14R1.3 C#Cc1ccc(C[C@@H](N)C(O)=O)cc1 Amb22831206 [0,2,0,0,0,0|0,0,0]=2 4793 B14R1.3 C#Cc1ccc(C[C@H](N)C(O)=O)cc1 Amb25114223 [0,2,0,0,0,0|0,0,0]=2 4794 B14R1.3 C=Cc1ccc(C[C@@H](N)C(O)=O)cc1 Amb23440413 [0,2,0,0,0,0|0,0,0]=2 4795 B14R1.3 CC(=O)C(Br)Cc1ccc(CC)cc1 Amb18073266 [0,2,0,0,0,0|2,0,0]=4 4796 B14R1.3 CC(=O)C(Br)Cc1ccc(cc1)C#N Amb25070809 [0,2,0,0,0,0|2,0,0]=4 4797 B14R1.3 CC(=O)C(C)Cc1ccc(cc1)SC Amb18865884 [0,2,0,0,0,0|2,0,0]=4 4798 B14R1.3 CC(C(=O)O)Cc1ccc(cc1)C#N Amb17605814 [0,2,0,0,0,0|1,0,0]=3 4799 B14R1.3 CC(Nc1ccc(CO)cc1)C(O)=O Amb25294241 [0,2,0,0,0,0|2,0,0]=4 4800 B14R1.3 CCc1ccc(CC(Br)C(O)=O)cc1 Amb23320612 [0,2,0,0,0,0|1,0,0]=3 4801 B14R1.3 CCc1ccc(C[C@@H](N)C(O)=O)cc1 Amb19061740 [0,2,0,0,0,0|0,0,0]=2 4802 B14R1.3 CCc1ccc(C[C@H](N)C(O)=O)cc1 Amb24087706 [0,2,0,0,0,0|0,0,0]=2 4803 B14R1.3 CCc1ccc(cc1)CC(=O)C(=O)O Amb1129594 [0,2,0,0,0,0|1,0,1]=4 4804 B14R1.3 CCc1ccc(cc1)CC(C(=O)C)C Amb17234962 [0,2,0,0,0,0|2,0,0]=4 4805 B14R1.3 CCc1ccc(cc1)CC(C(=O)C)Cl Amb17204433 [0,2,0,0,0,0|2,0,0]=4 4806 B14R1.3 CCc1ccc(cc1)CC(C(=O)N)Cl Amb17204439 [0,2,0,0,0,0|2,0,0]=4 4807 B14R1.3 CCc1ccc(cc1)CC(C(=O)O)Cl Amb17204445 [0,2,0,0,0,0|1,0,0]=3 4808 B14R1.3 CCc1ccc(cc1)CC(C(=O)O)O Amb17139447 [0,2,0,0,0,0|1,0,0]=3 4809 B14R1.3 CCc1ccc(cc1)NC(C(=O)O)C Amb17401790 [0,2,0,0,0,0|2,0,0]=4 4810 B14R1.3 CCc1ccc(cc1)SC(C(=O)O)C Amb17083274 [0,2,0,0,0,0|2,0,0]=4 4811 B14R1.3 CNc1ccc(CC(N)C(O)=O)cc1 Amb24347208 [0,2,0,0,0,0|0,0,0]=2 4812 B14R1.3 CNc1ccc(C[C@@H](N)C(O)=O)cc1 Amb24499178 [0,2,0,0,0,0|0,0,0]=2 4813 B14R1.3 CNc1ccc(C[C@H](N)C(O)=O)cc1 Amb24498999 [0,2,0,0,0,0|0,0,0]=2 4814 B14R1.3 CNc1ccc(cc1)OC(C)C(O)=O Amb19063330 [0,2,0,0,0,0|2,0,0]=4 4815 B14R1.3 COc1ccc(CC(Br)C(O)=O)cc1 Amb18668075 [0,2,0,0,0,0|1,0,0]=3 4816 B14R1.3 COc1ccc(CC(Br)C(O)=O)cc1 Amb22339388 [0,2,0,0,0,0|1,0,0]=3 4817 B14R1.3 COc1ccc(C[C@@H](N)C(O)=O)cc1 Amb20241652 [0,2,0,0,0,0|0,0,0]=2 4818 B14R1.3 COc1ccc(C[C@@H](O)C(O)=O)cc1 Amb22747357 [0,2,0,0,0,0|1,0,0]=3 4819 B14R1.3 COc1ccc(cc1)CC(=O)C(=O)O Amb1134810 [0,2,0,0,0,0|1,0,1]=4 4820 B14R1.3 COc1ccc(cc1)CC(C(=O)C)C Amb17235392 [0,2,0,0,0,0|2,0,0]=4 4821 B14R1.3 COc1ccc(cc1)CC(C(=O)C)Cl Amb17204450 [0,2,0,0,0,0|2,0,0]=4 4822 B14R1.3 COc1ccc(cc1)CC(C(=O)N)Cl Amb17204455 [0,2,0,0,0,0|2,0,0]=4 4823 B14R1.3 COc1ccc(cc1)CC(C(=O)O)Cl Amb17204461 [0,2,0,0,0,0|1,0,0]=3 4824 B14R1.3 COc1ccc(cc1)CC(C(=O)O)O Amb17139589 [0,2,0,0,0,0|1,0,0]=3 4825 B14R1.3 COc1ccc(cc1)SC(C(=O)O)C Amb1131411 [0,2,0,0,0,0|2,0,0]=4 4826 B14R1.3 CSc1ccc(cc1)CC(C(=O)O)N Amb13951673 [0,2,0,0,0,0|0,0,0]=2 4827 B14R1.3 CSc1ccc(cc1)NC(C)C(O)=O Amb19033688 [0,2,0,0,0,0|2,0,0]=4 4828 B14R1.3 CSc1ccc(cc1)OC(C)C(O)=O Amb19374820 [0,2,0,0,0,0|2,0,0]=4 4829 B14R1.3 C[C@H](Nc1ccc(cc1)C#N)C(O)=O Amb24751939 [0,2,0,0,0,0|2,0,0]=4 4830 B14R1.3 N#Cc1ccc(CC(Cl)C(O)=O)cc1 Amb24447099 [0,2,0,0,0,0|1,0,0]=3 4831 B14R1.3 N#Cc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25055871 [0,2,0,0,0,0|1,0,0]=3 4832 B14R1.3 N#Cc1ccc(cc1)CC(=O)C(=O)O Amb1139062 [0,2,0,0,0,0|1,0,1]=4 4833 B14R1.3 NC(CC1C=CC(C=C1)=CN)C(O)=O Amb24470780 [0,2,0,0,0,0|0,0,1]=3 4834 B14R1.3 NC(Cc1ccc(C#N)[n]c1)C(O)=O Amb25757405 [0,2,0,0,0,0|1,0,0]=3 4835 B14R1.3 NC(Cc1ccc(cc1)C#N)C(O)=O Amb22002699 [0,2,0,0,0,0|0,0,0]=2 4836 B14R1.3 NCc1ccc(CC(N)C(O)=O)cc1 Amb22002700 [0,2,0,0,0,0|0,0,0]=2 4837 B14R1.3 NCc1ccc(cc1)OC(C(=O)O)C Amb17127290 [0,2,0,0,0,0|2,0,0]=4 4838 B14R1.3 NNc1ccc(CC(N)C(O)=O)cc1 Amb25791647 [0,2,0,0,0,0|0,0,0]=2 4839 B14R1.3 N[C@@H](CC1C=CC(C=C1)=CN)C(O)=O Amb25815708 [0,2,0,0,0,0|0,0,1]=3 4840 B14R1.3 N[C@@H](Cc1ccc(C#N)[n]c1)C(O)=O Amb24446739 [0,2,0,0,0,0|1,0,0]=3 4841 B14R1.3 N[C@@H](Cc1ccc(cc1)C#N)C(O)=O Amb22746029 [0,2,0,0,0,0|0,0,0]=2 4842 B14R1.3 N[C@H](Cc1ccc(CO)cc1)C(O)=O Amb22336868 [0,2,0,0,0,0|0,0,0]=2 4843 B14R1.3 O=Cc1ccc(cc1)OC(C(=O)O)C Amb1786444 [0,2,0,0,0,0|2,0,0]=4 4844 B14R1.3 OCc1ccc(cc1)CC(C(=O)O)N Amb2412263 [0,2,0,0,0,0|0,0,0]=2 4845 B14R1.132 BrC(C(C(=O)C)Br)c1ccc(cc1)Cl Amb2433255 [0,2,0,0,0,0|2,0,0]=4 4846 B14R1.132 BrC(C(C(=O)O)Br)c1ccc(cc1)Br Amb17612538 [0,2,0,0,0,0|1,0,0]=3 4847 B14R1.132 C=C(C(N)c1ccc(Cl)cc1)C(O)=O Amb24568941 [0,2,0,0,0,0|1,0,1]=4 4848 B14R1.132 C=C(C(N)c1ccc(F)cc1)C(O)=O Amb25165745 [0,2,0,0,0,0|1,0,1]=4 4849 B14R1.132 C=C(C(O)c1ccc(F)cc1)C(O)=O Amb25181604 [0,2,0,0,0,0|1,0,1]=4 4850 B14R1.132 C=C([C@@H](N)c1ccc(Cl)cc1)C(O)=O Amb24669038 [0,2,0,0,0,0|1,0,1]=4 4851 B14R1.132 CC(=O)C(Br)C(C)c1ccc(Br)cc1 Amb24510717 [0,2,0,0,0,0|2,0,0]=4 4852 B14R1.132 CC(=O)C(Br)C(C)c1ccc(F)cc1 Amb24696136 [0,2,0,0,0,0|2,0,0]=4 4853 B14R1.132 CC(=O)[C@@H](Cl)[C@@H](O)c1ccc(F)cc1 Amb24539280 [0,2,0,0,0,0|2,0,0]=4 4854 B14R1.132 CC(=O)[C@@H](O)[C@@H](O)c1ccc(F)cc1 Amb25803025 [0,2,0,0,0,0|2,0,0]=4 4855 B14R1.132 CC(=O)[C@H](Cl)[C@H](O)c1ccc(F)cc1 Amb25309554 [0,2,0,0,0,0|2,0,0]=4 4856 B14R1.132 CC(=O)[C@H](O)[C@@H](O)c1ccc(F)cc1 Amb25069715 [0,2,0,0,0,0|2,0,0]=4 4857 B14R1.132 CC(=O)[C@H](O)[C@H](O)c1ccc(F)cc1 Amb25343905 [0,2,0,0,0,0|2,0,0]=4 4858 B14R1.132 CC(C(=C)C(O)=O)c1ccc(F)cc1 Amb24634260 [0,2,0,0,0,0|1,0,1]=4 4859 B14R1.132 CC(C(Br)C(C)=O)c1ccc(C)cc1 Amb25324813 [0,2,0,0,0,0|2,0,0]=4 4860 B14R1.132 CC(C(C)c1ccc(Br)cc1)C(O)=O Amb18692614 [0,2,0,0,0,0|1,0,0]=3 4861 B14R1.132 CC(C(C)c1ccc(Cl)cc1)C(O)=O Amb25237125 [0,2,0,0,0,0|1,0,0]=3 4862 B14R1.132 CC(C(C)c1ccc(F)cc1)C(O)=O Amb18813112 [0,2,0,0,0,0|1,0,0]=3 4863 B14R1.132 CC(C(Cl)C(O)=O)c1ccc(F)cc1 Amb24539303 [0,2,0,0,0,0|1,0,0]=3 4864 B14R1.132 CC(C(F)C(O)=O)c1ccc(Br)cc1 Amb25200829 [0,2,0,0,0,0|1,0,0]=3 4865 B14R1.132 CC(C(F)C(O)=O)c1ccc(F)cc1 Amb25738779 [0,2,0,0,0,0|1,0,0]=3 4866 B14R1.132 CC(C(F)C(O)=O)c1ccc(I)cc1 Amb25235034 [0,2,0,0,0,0|1,0,0]=3 4867 B14R1.132 CC(C(N)C(O)=O)c1ccc(Cl)cc1 Amb18657526 [0,2,0,0,0,0|0,0,0]=2 4868 B14R1.132 CC(C(N)C(O)=O)c1ccc(N)cc1 Amb18651901 [0,2,0,0,0,0|0,0,0]=2 4869 B14R1.132 CC(C(N)c1ccc(F)c[n]1)C(O)=O Amb24553220 [0,2,0,0,0,0|2,0,0]=4 4870 B14R1.132 CC(C(O)=O)S(=O)c1ccc(Cl)cc1 Amb18294600 [0,2,0,0,0,0|2,0,0]=4 4871 B14R1.132 CC(C(O)=O)S(=O)c1ccc(F)cc1 Amb18292849 [0,2,0,0,0,0|2,0,0]=4 4872 B14R1.132 CC(C(O)C(O)=O)c1ccc(F)c[n]1 Amb25368032 [0,2,0,0,0,0|2,0,0]=4 4873 B14R1.132 CC(C(O)c1ccc(Br)[n]c1)C(O)=O Amb25734293 [0,2,0,0,0,0|2,0,0]=4 4874 B14R1.132 CC(C(O)c1ccc(Cl)cc1)C(N)=O Amb25229544 [0,2,0,0,0,0|2,0,0]=4 4875 B14R1.132 CC(C(O)c1ccc(Cl)cc1)C(O)=O Amb18990622 [0,2,0,0,0,0|1,0,0]=3 4876 B14R1.132 CC(C(O)c1ccc(F)cc1)C(O)=O Amb18990625 [0,2,0,0,0,0|1,0,0]=3 4877 B14R1.132 CN(C(C)C(O)=O)c1ccc(Br)cc1 Amb22967142 [0,2,0,0,0,0|2,0,0]=4 4878 B14R1.132 CN(C(C)C(O)=O)c1ccc(Cl)cc1 Amb22967119 [0,2,0,0,0,0|2,0,0]=4 4879 B14R1.132 CN(C(C)C(O)=O)c1ccc(F)cc1 Amb22967001 [0,2,0,0,0,0|2,0,0]=4 4880 B14R1.132 CN(C(C)C(O)=O)c1ccc(I)cc1 Amb22967153 [0,2,0,0,0,0|2,0,0]=4 4881 B14R1.132 CN(C(C)C(O)=O)c1ccc(N)cc1 Amb18999365 [0,2,0,0,0,0|2,0,0]=4 4882 B14R1.132 C[C@@H]([C@@H](N)C(O)=O)c1ccc(F)cc1 Amb24590238 [0,2,0,0,0,0|0,0,0]=2 4883 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb24575274 [0,2,0,0,0,0|0,0,0]=2 4884 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Cl)cc1 Amb24640346 [0,2,0,0,0,0|0,0,0]=2 4885 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25783870 [0,2,0,0,0,0|0,0,0]=2 4886 B14R1.132 C[C@@H]([C@H](O)c1ccc(C)cc1)C(C)=O Amb25357373 [0,2,0,0,0,0|2,0,0]=4 4887 B14R1.132 C[C@@H]([C@H](O)c1ccc(Cl)cc1)C(N)=O Amb24447117 [0,2,0,0,0,0|2,0,0]=4 4888 B14R1.132 C[C@@H]([C@H](O)c1ccc(F)cc1)C(O)=O Amb25134261 [0,2,0,0,0,0|1,0,0]=3 4889 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb25198880 [0,2,0,0,0,0|0,0,0]=2 4890 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25774999 [0,2,0,0,0,0|0,0,0]=2 4891 B14R1.132 Cc1c[n]c(cc1)C(O)C(N)C(O)=O Amb25133208 [0,2,0,0,0,0|1,0,0]=3 4892 B14R1.132 Cc1ccc([n]c1)C(O)C(C)C(O)=O Amb24749401 [0,2,0,0,0,0|2,0,0]=4 4893 B14R1.132 Cc1ccc(cc1)C(=C)C(C)C(O)=O Amb25123160 [0,2,0,0,0,0|1,0,1]=4 4894 B14R1.132 Cc1ccc(cc1)C(C)C(=S)C(O)=O Amb25218249 [0,2,0,0,0,0|1,0,1]=4 4895 B14R1.132 Cc1ccc(cc1)C(C)C(C)C(=O)Cl Amb25677417 [0,2,0,0,0,0|2,0,0]=4 4896 B14R1.132 Cc1ccc(cc1)C(C)C(C)C(O)=O Amb18190563 [0,2,0,0,0,0|1,0,0]=3 4897 B14R1.132 Cc1ccc(cc1)C(C)C(F)C(O)=O Amb25289864 [0,2,0,0,0,0|1,0,0]=3 4898 B14R1.132 Cc1ccc(cc1)C(C)C(N)C(O)=O Amb18651559 [0,2,0,0,0,0|0,0,0]=2 4899 B14R1.132 Cc1ccc(cc1)C(C)C(O)C(O)=O Amb19149343 [0,2,0,0,0,0|1,0,0]=3 4900 B14R1.132 Cc1ccc(cc1)C(N)C(N)C(O)=O Amb25111186 [0,2,0,0,0,0|0,0,0]=2 4901 B14R1.132 Cc1ccc(cc1)C(O)C(N)C(O)=O Amb25232569 [0,2,0,0,0,0|0,0,0]=2 4902 B14R1.132 Cc1ccc(cc1)C(O)C(O)C(C)=O Amb24575586 [0,2,0,0,0,0|2,0,0]=4 4903 B14R1.132 Cc1ccc(cc1)N(C)C(C)C(O)=O Amb22966942 [0,2,0,0,0,0|2,0,0]=4 4904 B14R1.132 Cc1ccc(cc1)S(=O)C(C)C(O)=O Amb18293857 [0,2,0,0,0,0|2,0,0]=4 4905 B14R1.132 Cc1ccc(cc1)[C@@H](C)[C@@H](N)C(O)=O Amb25109337 [0,2,0,0,0,0|0,0,0]=2 4906 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@@H](C)C(O)=O Amb24381868 [0,2,0,0,0,0|1,0,0]=3 4907 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@@H](O)C(O)=O Amb22756713 [0,2,0,0,0,0|1,0,0]=3 4908 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@H](O)C(O)=O Amb24579096 [0,2,0,0,0,0|1,0,0]=3 4909 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@@H](C)C(O)=O Amb25807681 [0,2,0,0,0,0|1,0,0]=3 4910 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@@H](N)C(O)=O Amb25361019 [0,2,0,0,0,0|0,0,0]=2 4911 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@H](N)C(O)=O Amb25101011 [0,2,0,0,0,0|0,0,0]=2 4912 B14R1.132 Cc1ccc(cc1)[C@H](N)[C@@H](N)C(O)=O Amb25061276 [0,2,0,0,0,0|0,0,0]=2 4913 B14R1.132 Cc1ccc(cc1)[C@H](N)[C@H](O)C(O)=O Amb25282340 [0,2,0,0,0,0|1,0,0]=3 4914 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@@H](O)C(C)=O Amb24353141 [0,2,0,0,0,0|2,0,0]=4 4915 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@@H](O)C(O)=O Amb24711257 [0,2,0,0,0,0|1,0,0]=3 4916 B14R1.132 NC(=O)C(N)C(F)c1ccc(Cl)cc1 Amb25790607 [0,2,0,0,0,0|1,0,0]=3 4917 B14R1.132 NC(=O)C(N)C(O)c1ccc(Cl)cc1 Amb25752601 [0,2,0,0,0,0|1,0,0]=3 4918 B14R1.132 NC(=O)C(O)C(N)c1ccc(F)cc1 Amb25164499 [0,2,0,0,0,0|2,0,0]=4 4919 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)Br Amb17473595 [0,2,0,0,0,0|1,0,0]=3 4920 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)C Amb17470846 [0,2,0,0,0,0|1,0,0]=3 4921 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)Cl Amb17471484 [0,2,0,0,0,0|1,0,0]=3 4922 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)F Amb17470956 [0,2,0,0,0,0|1,0,0]=3 4923 B14R1.132 NC(C(F)C(O)=O)c1ccc(F)cc1 Amb24597731 [0,2,0,0,0,0|1,0,0]=3 4924 B14R1.132 NC(C(F)c1ccc(Cl)cc1)C(O)=O Amb25324931 [0,2,0,0,0,0|0,0,0]=2 4925 B14R1.132 NC(C(N)c1ccc(O)cc1)C(O)=O Amb25288112 [0,2,0,0,0,0|0,0,0]=2 4926 B14R1.132 NC(C(O)C(O)=O)c1ccc(Cl)[n]c1 Amb25327828 [0,2,0,0,0,0|2,0,0]=4 4927 B14R1.132 NC(C(O)C(O)=O)c1ccc(Cl)cc1 Amb25308091 [0,2,0,0,0,0|1,0,0]=3 4928 B14R1.132 NC(C(O)C(O)=O)c1ccc(F)cc1 Amb24711455 [0,2,0,0,0,0|1,0,0]=3 4929 B14R1.132 NC(C(O)C(O)=O)c1ccc(I)cc1 Amb24530510 [0,2,0,0,0,0|1,0,0]=3 4930 B14R1.132 NC(C(O)c1ccc(Br)c[n]1)C(O)=O Amb25126511 [0,2,0,0,0,0|1,0,0]=3 4931 B14R1.132 NC(C(O)c1ccc(Br)cc1)C(O)=O Amb18692059 [0,2,0,0,0,0|0,0,0]=2 4932 B14R1.132 NC(C(O)c1ccc(Cl)cc1)C(O)=O Amb18657878 [0,2,0,0,0,0|0,0,0]=2 4933 B14R1.132 NC(C(O)c1ccc(F)cc1)C(O)=O Amb17846423 [0,2,0,0,0,0|0,0,0]=2 4934 B14R1.132 NC(C(O)c1ccc(O)cc1)C(O)=O Amb18652543 [0,2,0,0,0,0|0,0,0]=2 4935 B14R1.132 NC(C(S)c1ccc(Cl)cc1)C(O)=O Amb24355278 [0,2,0,0,0,0|0,0,0]=2 4936 B14R1.132 NC(C(S)c1ccc(F)cc1)C(O)=O Amb25770122 [0,2,0,0,0,0|0,0,0]=2 4937 B14R1.132 N[C@@H](C(O)c1ccc(F)cc1)C(O)=O Amb25288164 [0,2,0,0,0,0|0,0,0]=2 4938 B14R1.132 N[C@@H](C(O)c1ccc(O)cc1)C(O)=O Amb25310972 [0,2,0,0,0,0|0,0,0]=2 4939 B14R1.132 N[C@@H]([C@@H](O)C(O)=O)c1ccc(F)cc1 Amb22746337 [0,2,0,0,0,0|1,0,0]=3 4940 B14R1.132 N[C@@H]([C@@H](O)c1ccc(Cl)cc1)C(O)=O Amb23603668 [0,2,0,0,0,0|0,0,0]=2 4941 B14R1.132 N[C@@H]([C@H](N)c1ccc(F)cc1)C(O)=O Amb24693961 [0,2,0,0,0,0|0,0,0]=2 4942 B14R1.132 N[C@@H]([C@H](O)C(O)=O)c1ccc(Br)cc1 Amb24637298 [0,2,0,0,0,0|1,0,0]=3 4943 B14R1.132 N[C@@H]([C@H](O)C(O)=O)c1ccc(F)cc1 Amb25672659 [0,2,0,0,0,0|1,0,0]=3 4944 B14R1.132 N[C@@H]([C@H](O)c1ccc(Cl)cc1)C(O)=O Amb25715774 [0,2,0,0,0,0|0,0,0]=2 4945 B14R1.132 N[C@@H]([C@H](S)c1ccc(Cl)cc1)C(O)=O Amb25356169 [0,2,0,0,0,0|0,0,0]=2 4946 B14R1.132 N[C@H](C(O)c1ccc(F)cc1)C(O)=O Amb24498337 [0,2,0,0,0,0|0,0,0]=2 4947 B14R1.132 N[C@H](C(O)c1ccc(O)cc1)C(O)=O Amb25181831 [0,2,0,0,0,0|0,0,0]=2 4948 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(Br)cc1 Amb25730047 [0,2,0,0,0,0|1,0,0]=3 4949 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(Cl)c[n]1 Amb25351931 [0,2,0,0,0,0|2,0,0]=4 4950 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(F)[n]c1 Amb24727641 [0,2,0,0,0,0|2,0,0]=4 4951 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(F)cc1 Amb24454558 [0,2,0,0,0,0|1,0,0]=3 4952 B14R1.132 N[C@H]([C@@H](O)c1ccc(O)cc1)C(O)=O Amb24710046 [0,2,0,0,0,0|0,0,0]=2 4953 B14R1.132 N[C@H]([C@H](O)c1ccc(Cl)cc1)C(O)=O Amb25710838 [0,2,0,0,0,0|0,0,0]=2 4954 B14R1.132 N[C@H]([C@H](O)c1ccc(O)cc1)C(O)=O Amb24726352 [0,2,0,0,0,0|0,0,0]=2 4955 B14R1.132 Nc1ccc(cc1)C(N)C(N)C(O)=O Amb25185838 [0,2,0,0,0,0|0,0,0]=2 4956 B14R1.132 Nc1ccc(cc1)C(N)C(O)C(O)=O Amb24445167 [0,2,0,0,0,0|1,0,0]=3 4957 B14R1.132 Nc1ccc(cc1)C(O)C(N)C(O)=O Amb24692799 [0,2,0,0,0,0|0,0,0]=2 4958 B14R1.132 Nc1ccc(cc1)[C@@H](O)[C@@H](N)C(O)=O Amb25362267 [0,2,0,0,0,0|0,0,0]=2 4959 B14R1.132 OC(=O)C(=O)C(Br)c1ccc(F)cc1 Amb25055628 [0,2,0,0,0,0|1,0,1]=4 4960 B14R1.132 OC(=O)C(Br)C(=O)c1ccc(Cl)cc1 Amb22731396 [0,2,0,0,0,0|1,0,1]=4 4961 B14R1.132 OC(=O)[C@H](O)[C@@H](O)c1ccc(F)cc1 Amb25131176 [0,2,0,0,0,0|1,0,0]=3 4962 B14R1.132 Oc1ccc(cc1)C(O)C(O)C(O)=O Amb21964899 [0,2,0,0,0,0|1,0,0]=3 4963 B14R1.134 CCC(=O)C(Cc1ccc(cc1)Br)C Amb17264258 [0,2,0,0,0,0|2,0,0]=4 4964 B14R1.134 CCC(=O)C(Cc1ccc(cc1)C)C Amb17234961 [0,2,0,0,0,0|2,0,0]=4 4965 B14R1.134 CCC(=O)C(Cc1ccc(cc1)Cl)C Amb17240774 [0,2,0,0,0,0|2,0,0]=4 4966 B14R1.134 CCC(=O)C(Cc1ccc(cc1)F)C Amb17235958 [0,2,0,0,0,0|2,0,0]=4 4967 B14R1.134 CNC(=O)C(N)Cc1ccc(O)cc1 Amb18972760 [0,2,0,0,0,0|1,0,0]=3 4968 B14R1.134 CNC(=O)C(O)Cc1ccc(F)cc1 Amb25202672 [0,2,0,0,0,0|2,0,0]=4 4969 B14R1.134 CNC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb24374031 [0,2,0,0,0,0|1,0,0]=3 4970 B14R1.134 CNC(=O)[C@@H](N)Cc1ccc(N)cc1 Amb25309325 [0,2,0,0,0,0|1,0,0]=3 4971 B14R1.134 CNC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb19051584 [0,2,0,0,0,0|1,0,0]=3 4972 B14R1.134 CNC(=O)[C@H](O)Cc1ccc(F)cc1 Amb25805971 [0,2,0,0,0,0|2,0,0]=4 4973 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)Br Amb17162561 [0,2,0,0,0,0|1,0,1]=4 4974 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)C Amb17139342 [0,2,0,0,0,0|1,0,1]=4 4975 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)Cl Amb17140710 [0,2,0,0,0,0|1,0,1]=4 4976 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)F Amb17139585 [0,2,0,0,0,0|1,0,1]=4 4977 B14R1.134 COC(=O)C(C)Cc1ccc(C)cc1 Amb17844107 [0,2,0,0,0,0|1,0,0]=3 4978 B14R1.134 COC(=O)C(C)Nc1ccc(Br)cc1 Amb20628639 [0,2,0,0,0,0|2,0,0]=4 4979 B14R1.134 COC(=O)C(C)Nc1ccc(Cl)cc1 Amb19018827 [0,2,0,0,0,0|2,0,0]=4 4980 B14R1.134 COC(=O)C(C)Nc1ccc(F)cc1 Amb18307969 [0,2,0,0,0,0|2,0,0]=4 4981 B14R1.134 COC(=O)C(C)Nc1ccc(I)cc1 Amb25200887 [0,2,0,0,0,0|2,0,0]=4 4982 B14R1.134 COC(=O)C(C)Nc1ccc(N)cc1 Amb19017407 [0,2,0,0,0,0|2,0,0]=4 4983 B14R1.134 COC(=O)C(C)Nc1ccc(O)cc1 Amb25091338 [0,2,0,0,0,0|2,0,0]=4 4984 B14R1.134 COC(=O)C(C)Sc1ccc(Cl)cc1 Amb22802820 [0,2,0,0,0,0|2,0,0]=4 4985 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)Cl Amb17204951 [0,2,0,0,0,0|1,0,0]=3 4986 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)N Amb17415249 [0,2,0,0,0,0|0,0,0]=2 4987 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)O Amb17163100 [0,2,0,0,0,0|1,0,0]=3 4988 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)Cl Amb17204448 [0,2,0,0,0,0|1,0,0]=3 4989 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)N Amb17401774 [0,2,0,0,0,0|0,0,0]=2 4990 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)O Amb17139450 [0,2,0,0,0,0|1,0,0]=3 4991 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)Cl Amb17204593 [0,2,0,0,0,0|1,0,0]=3 4992 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)N Amb2228449 [0,2,0,0,0,0|0,0,0]=2 4993 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)O Amb17140888 [0,2,0,0,0,0|1,0,0]=3 4994 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)Cl Amb17204463 [0,2,0,0,0,0|1,0,0]=3 4995 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)N Amb17402183 [0,2,0,0,0,0|0,0,0]=2 4996 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)O Amb17139694 [0,2,0,0,0,0|1,0,0]=3 4997 B14R1.134 COC(=O)C(Cc1ccc(cc1)O)N Amb1210958 [0,2,0,0,0,0|0,0,0]=2 4998 B14R1.134 COC(=O)C(N)Cc1ccc(Br)cc1 Amb17943431 [0,2,0,0,0,0|0,0,0]=2 4999 B14R1.134 COC(=O)C(O)Cc1ccc(O)cc1 Amb18652328 [0,2,0,0,0,0|1,0,0]=3 5000 B14R1.134 COC(=O)C(Oc1ccc(cc1)N)C Amb17109999 [0,2,0,0,0,0|2,0,0]=4 5001 B14R1.134 COC(=O)C(Oc1ccc(cc1)O)C Amb2423203 [0,2,0,0,0,0|2,0,0]=4 5002 B14R1.134 COC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb22492774 [0,2,0,0,0,0|0,0,1]=3 5003 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(Cl)c[n]1 Amb23440404 [0,2,0,0,0,0|1,0,0]=3 5004 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb22745758 [0,2,0,0,0,0|0,0,0]=2 5005 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(I)cc1 Amb22226738 [0,2,0,0,0,0|0,0,0]=2 5006 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(N)cc1 Amb22746725 [0,2,0,0,0,0|0,0,0]=2 5007 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(F)cc1 Amb22747622 [0,2,0,0,0,0|1,0,0]=3 5008 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(O)cc1 Amb22747623 [0,2,0,0,0,0|1,0,0]=3 5009 B14R1.134 COC(=O)[C@H](N)Cc1ccc(Cl)c[n]1 Amb24081900 [0,2,0,0,0,0|1,0,0]=3 5010 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb19944299 [0,2,0,0,0,0|0,0,0]=2 5011 B14R1.134 COC(=O)[C@H](O)Cc1ccc(F)cc1 Amb17935903 [0,2,0,0,0,0|1,0,0]=3 5012 B14R1.134 COC(=O)\C(\N)=C\c1ccc(Cl)cc1 Amb25743045 [0,2,0,0,0,0|0,0,2]=4 5013 B14R1.134 COC(=O)\C(\N)=C\c1ccc(O)cc1 Amb18651414 [0,2,0,0,0,0|0,0,2]=4 5014 B14R1.134 Cc1ccc(CC(O)C(=O)NC)cc1 Amb25094388 [0,2,0,0,0,0|2,0,0]=4 5015 B14R1.134 Cc1ccc(C[C@@H](N)C(=O)OC)[n]c1 Amb23440432 [0,2,0,0,0,0|1,0,0]=3 5016 B14R1.134 Cc1ccc(C[C@@H](O)C(=O)NC)cc1 Amb25690415 [0,2,0,0,0,0|2,0,0]=4 5017 B14R1.134 Cc1ccc(C[C@H](N)C(=O)NC)cc1 Amb24541312 [0,2,0,0,0,0|1,0,0]=3 5018 B14R1.134 Cc1ccc(cc1)N[C@H](C)C(=O)OC Amb25075902 [0,2,0,0,0,0|2,0,0]=4 5019 B14R1.134 NC(Cc1ccc(F)cc1)C(=O)NO Amb25104313 [0,2,0,0,0,0|0,0,0]=2 5020 B14R1.134 NC(Cc1ccc(O)cc1)C(=O)NO Amb22451358 [0,2,0,0,0,0|0,0,0]=2 5021 B14R1.134 NC(Cc1ccc(O)cc1)C(=S)NO Amb24629791 [0,2,0,0,0,0|0,1,0]=3 5022 B14R1.134 NNC(=O)[C@H](N)Cc1ccc(O)cc1 Amb24336025 [0,2,0,0,0,0|1,0,0]=3 5023 B14R1.134 N[C@@H](Cc1ccc(O)cc1)C(=O)NO Amb24096672 [0,2,0,0,0,0|0,0,0]=2 5024 B14R1.134 N[C@@H](Cc1ccc(O)cc1)C(=S)NO Amb25125897 [0,2,0,0,0,0|0,1,0]=3 5025 B14R1.134 N[C@H](Cc1ccc(O)cc1)C(=O)NO Amb25185575 [0,2,0,0,0,0|0,0,0]=2 5026 B14R1.134 Nc1ccc(CC(N)C(=O)NO)cc1 Amb24713615 [0,2,0,0,0,0|0,0,0]=2 5027 B14R1.134 Nc1ccc(C[C@H](N)C(=O)NO)cc1 Amb25769906 [0,2,0,0,0,0|0,0,0]=2 5028 B14R1.134 OCC(=O)N(Cc1ccc(cc1)Br)C Amb17415251 [0,2,0,0,0,0|2,0,0]=4 5029 B14R1.134 OCC(=O)N(Cc1ccc(cc1)C)C Amb1110323 [0,2,0,0,0,0|2,0,0]=4 5030 B14R1.134 OCC(=O)N(Cc1ccc(cc1)Cl)C Amb17404296 [0,2,0,0,0,0|2,0,0]=4 5031 B14R1.134 OCC(=O)N(Cc1ccc(cc1)F)C Amb1110198 [0,2,0,0,0,0|2,0,0]=4 5032 B14R1.536 C=C=C(Cc1ccc(F)cc1)C(O)=O Amb25088401 [0,2,0,0,0,0|1,0,1]=4 5033 B14R1.536 C=CC(Nc1ccc(Br)cc1)C(O)=O Amb25190661 [0,2,0,0,0,0|2,0,0]=4 5034 B14R1.536 C=CC(Nc1ccc(Cl)cc1)C(O)=O Amb24701623 [0,2,0,0,0,0|2,0,0]=4 5035 B14R1.536 CCC(C(=O)C)Cc1ccc(cc1)Br Amb17264257 [0,2,0,0,0,0|2,0,0]=4 5036 B14R1.536 CCC(C(=O)C)Cc1ccc(cc1)C Amb17234960 [0,2,0,0,0,0|2,0,0]=4 5037 B14R1.536 CCC(C(=O)C)Cc1ccc(cc1)Cl Amb17240773 [0,2,0,0,0,0|2,0,0]=4 5038 B14R1.536 CCC(C(=O)C)Cc1ccc(cc1)F Amb17235957 [0,2,0,0,0,0|2,0,0]=4 5039 B14R1.536 CCC(C(=O)O)Cc1ccc(cc1)Br Amb17605818 [0,2,0,0,0,0|1,0,0]=3 5040 B14R1.536 CCC(Nc1ccc(O)cc1)C(O)=O Amb25701975 [0,2,0,0,0,0|2,0,0]=4 5041 B14R1.536 CC[C@@H](Nc1ccc(Cl)cc1)C(O)=O Amb25678551 [0,2,0,0,0,0|2,0,0]=4 5042 B14R1.536 CNC(Cc1ccc(O)cc1)C(O)=O Amb18652099 [0,2,0,0,0,0|0,0,0]=2 5043 B14R1.536 CN[C@H](C(=O)O)Cc1ccc(cc1)O Amb17617887 [0,2,0,0,0,0|0,0,0]=2 5044 B14R1.536 COC(C(=O)O)Cc1ccc(cc1)Cl Amb16233253 [0,2,0,0,0,0|1,0,0]=3 5045 B14R1.536 COC(Cc1ccc(Br)cc1)C(O)=O Amb23321116 [0,2,0,0,0,0|1,0,0]=3 5046 B14R1.536 COC(Cc1ccc(F)cc1)C(O)=O Amb23320970 [0,2,0,0,0,0|1,0,0]=3 5047 B14R1.536 COC(Cc1ccc(I)cc1)C(O)=O Amb23321146 [0,2,0,0,0,0|1,0,0]=3 5048 B14R1.536 Cc1ccc(CC(C#N)C(N)=O)cc1 Amb24525160 [0,2,0,0,0,0|1,0,1]=4 5049 B14R1.536 Cc1ccc(CC(CN)C(O)=O)cc1 Amb20622926 [0,2,0,0,0,0|0,0,0]=2 5050 B14R1.536 Cc1ccc(CC(OC)C(O)=O)cc1 Amb23320726 [0,2,0,0,0,0|1,0,0]=3 5051 B14R1.536 Cc1ccc(cc1)NC(C=C)C(O)=O Amb25721285 [0,2,0,0,0,0|2,0,0]=4 5052 B14R1.536 Cc1ccc(cc1)NC(CO)C(O)=O Amb24372963 [0,2,0,0,0,0|2,0,0]=4 5053 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)C Amb17090112 [0,2,0,0,0,0|0,0,1]=3 5054 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)Cl Amb17090120 [0,2,0,0,0,0|0,0,1]=3 5055 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)F Amb17090114 [0,2,0,0,0,0|0,0,1]=3 5056 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)O Amb17090135 [0,2,0,0,0,0|0,0,1]=3 5057 B14R1.536 NC(=O)C(Cc1ccc(Cl)cc1)C#N Amb18656362 [0,2,0,0,0,0|1,0,1]=4 5058 B14R1.536 NC(=O)C(Cc1ccc(Cl)cc1)CN Amb21837690 [0,2,0,0,0,0|1,0,0]=3 5059 B14R1.536 NC(=O)C(Cc1ccc(F)cc1)C#N Amb25124414 [0,2,0,0,0,0|1,0,1]=4 5060 B14R1.536 NCC(Cc1ccc(Cl)cc1)C(O)=O Amb19321135 [0,2,0,0,0,0|0,0,0]=2 5061 B14R1.536 NCC(Nc1ccc(F)cc1)C(O)=O Amb25181876 [0,2,0,0,0,0|1,0,0]=3 5062 B14R1.536 NCC(Nc1ccc(I)cc1)C(O)=O Amb24586491 [0,2,0,0,0,0|1,0,0]=3 5063 B14R1.536 NCC(Oc1ccc(F)cc1)C(O)=O Amb22059585 [0,2,0,0,0,0|1,0,0]=3 5064 B14R1.536 N\N=C(\Cc1ccc(O)cc1)/C(O)=O Amb25288151 [0,2,0,0,0,0|0,0,1]=3 5065 B14R1.536 OC(=O)C(CO)Nc1ccc(F)cc1 Amb25336022 [0,2,0,0,0,0|2,0,0]=4 5066 B14R1.536 OC(=O)\C(\Cc1ccc(Cl)cc1)=N/O Amb23603648 [0,2,0,0,0,0|0,0,2]=4 5067 B14R1.536 OC(=O)\C(\Cc1ccc(F)cc1)=N/O Amb23603649 [0,2,0,0,0,0|0,0,2]=4 5068 B14R1.536 Oc1ccc(C\C(=N/O)\C(O)=O)cc1 Amb24722830 [0,2,0,0,0,0|0,0,2]=4 5069 B14R1.686 CC(=O)C(Br)Cc1cc(Br)c(Cl)cc1 Amb24380013 [0,2,0,0,0,0|2,0,0]=4 5070 B14R1.686 CC(=O)C(Br)Cc1cc(Br)c(F)cc1 Amb24712077 [0,2,0,0,0,0|2,0,0]=4 5071 B14R1.686 CC(=O)C(Br)Cc1cc(F)c(F)cc1 Amb18590643 [0,2,0,0,0,0|2,0,0]=4 5072 B14R1.686 CC(=O)C(Br)Cc1ccc(Br)c(I)c1 Amb25096645 [0,2,0,0,0,0|2,0,0]=4 5073 B14R1.686 CC(=O)C(Br)Cc1ccc(F)c(Cl)c1 Amb18079658 [0,2,0,0,0,0|2,0,0]=4 5074 B14R1.686 CC(=O)C(C)Cc1cc(F)c(F)cc1 Amb18864140 [0,2,0,0,0,0|2,0,0]=4 5075 B14R1.686 CC(=O)C(C)Cc1ccc(F)c(Cl)c1 Amb18866565 [0,2,0,0,0,0|2,0,0]=4 5076 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Br)C)Cl Amb17204927 [0,2,0,0,0,0|2,0,0]=4 5077 B14R1.686 CC(=O)C(Cc1ccc(c(c1)C)Br)Cl Amb17204930 [0,2,0,0,0,0|2,0,0]=4 5078 B14R1.686 CC(=O)C(Cc1ccc(c(c1)C)C)Cl Amb17204430 [0,2,0,0,0,0|2,0,0]=4 5079 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)C)Cl Amb17204557 [0,2,0,0,0,0|2,0,0]=4 5080 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)Cl)Br Amb17507839 [0,2,0,0,0,0|2,0,0]=4 5081 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)Cl)C Amb17249289 [0,2,0,0,0,0|2,0,0]=4 5082 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)Cl)Cl Amb17204742 [0,2,0,0,0,0|2,0,0]=4 5083 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)F)Cl Amb17204610 [0,2,0,0,0,0|2,0,0]=4 5084 B14R1.686 CC(=O)C(Cc1ccc(c(c1)Cl)O)Br Amb17507833 [0,2,0,0,0,0|2,0,0]=4 5085 B14R1.686 CC(=O)C(Cc1ccc(c(c1)F)F)Cl Amb17204489 [0,2,0,0,0,0|2,0,0]=4 5086 B14R1.686 CC(=O)C(N)Cc1cc(Cl)c(Cl)cc1 Amb24705585 [0,2,0,0,0,0|1,0,0]=3 5087 B14R1.686 CC(=O)C(N)Cc1cc(F)c(F)cc1 Amb25781802 [0,2,0,0,0,0|1,0,0]=3 5088 B14R1.686 CC(=O)C(N)Cc1ccc(F)c(Cl)c1 Amb25041795 [0,2,0,0,0,0|1,0,0]=3 5089 B14R1.686 CC(Cc1cc(C)c(C)cc1)C(C)=O Amb19061107 [0,2,0,0,0,0|2,0,0]=4 5090 B14R1.686 CC(Cc1cc(O)c(Br)cc1)C(O)=O Amb24593252 [0,2,0,0,0,0|1,0,0]=3 5091 B14R1.686 CC(Cc1cc(O)c(Cl)cc1)C(O)=O Amb25854276 [0,2,0,0,0,0|1,0,0]=3 5092 B14R1.686 CC(Cc1cc(O)c(F)cc1)C(O)=O Amb25084258 [0,2,0,0,0,0|1,0,0]=3 5093 B14R1.686 CC(Cc1ccc(Br)c(F)c1)C(O)=O Amb24733936 [0,2,0,0,0,0|1,0,0]=3 5094 B14R1.686 CC(Cc1ccc(F)c(Br)c1)C(O)=O Amb20629131 [0,2,0,0,0,0|1,0,0]=3 5095 B14R1.686 CC(Cc1ccc(F)c(N)c1)C(O)=O Amb24514204 [0,2,0,0,0,0|1,0,0]=3 5096 B14R1.686 CC(Nc1ccc(Br)c(F)c1)C(O)=O Amb25204087 [0,2,0,0,0,0|2,0,0]=4 5097 B14R1.686 CC(Nc1ccc(Cl)c(Br)c1)C(O)=O Amb24706095 [0,2,0,0,0,0|2,0,0]=4 5098 B14R1.686 CC(Nc1ccc(Cl)c(F)c1)C(O)=O Amb18293677 [0,2,0,0,0,0|2,0,0]=4 5099 B14R1.686 CC(Nc1ccc(F)c(Br)c1)C(O)=O Amb24428542 [0,2,0,0,0,0|2,0,0]=4 5100 B14R1.686 CC(Nc1ccc(I)c(Br)c1)C(O)=O Amb24535140 [0,2,0,0,0,0|2,0,0]=4 5101 B14R1.686 CC(Oc1ccc(Cl)c(N)c1)C(O)=O Amb24356272 [0,2,0,0,0,0|2,0,0]=4 5102 B14R1.686 CC(Sc1ccc(N)c(Cl)c1)C(O)=O Amb24712220 [0,2,0,0,0,0|2,0,0]=4 5103 B14R1.686 CC(Sc1ccc(N)c(F)c1)C(O)=O Amb25749866 [0,2,0,0,0,0|2,0,0]=4 5104 B14R1.686 CC1=CN(CC(C)C(O)=O)C=CC1=O Amb25679807 [0,2,0,0,0,0|2,0,0]=4 5105 B14R1.686 CC1=CN(CC(Cl)C(O)=O)C=CC1=O Amb24414287 [0,2,0,0,0,0|2,0,0]=4 5106 B14R1.686 CC1=CN(CC(N)C(O)=O)C=CC1=O Amb25843499 [0,2,0,0,0,0|1,0,0]=3 5107 B14R1.686 C[C@@H](Nc1cc(Cl)c(Cl)cc1)C(O)=O Amb24361732 [0,2,0,0,0,0|2,0,0]=4 5108 B14R1.686 C[C@@H](Oc1ccc(Br)c(F)c1)C(O)=O Amb24732350 [0,2,0,0,0,0|2,0,0]=4 5109 B14R1.686 C[C@H](NC1=CC(=O)C(=O)C=C1)C(O)=O Amb25830301 [0,2,0,0,0,0|2,0,0]=4 5110 B14R1.686 C[C@H](Oc1cc(Cl)c(Cl)cc1)C(O)=O Amb25169849 [0,2,0,0,0,0|2,0,0]=4 5111 B14R1.686 C[C@H](Oc1ccc(Br)c(F)c1)C(O)=O Amb25850691 [0,2,0,0,0,0|2,0,0]=4 5112 B14R1.686 C[C@H](Oc1ccc(F)c(Br)c1)C(O)=O Amb25128085 [0,2,0,0,0,0|2,0,0]=4 5113 B14R1.686 C[C@H](Oc1ccc(F)c(Cl)c1)C(O)=O Amb24421170 [0,2,0,0,0,0|2,0,0]=4 5114 B14R1.686 Cc1[n]c(CC(N)C(O)=O)ccc1F Amb24697651 [0,2,0,0,0,0|1,0,0]=3 5115 B14R1.686 Cc1[n]c(C[C@@H](N)C(O)=O)ccc1F Amb25343100 [0,2,0,0,0,0|1,0,0]=3 5116 B14R1.686 Cc1[n]c(C[C@H](N)C(O)=O)ccc1F Amb24598048 [0,2,0,0,0,0|1,0,0]=3 5117 B14R1.686 Cc1cc(CC(=O)C(O)=O)ccc1Br Amb25054918 [0,2,0,0,0,0|1,0,1]=4 5118 B14R1.686 Cc1cc(CC(=O)C(O)=O)ccc1F Amb18295687 [0,2,0,0,0,0|1,0,1]=4 5119 B14R1.686 Cc1cc(CC(Br)C(C)=O)ccc1Br Amb24475370 [0,2,0,0,0,0|2,0,0]=4 5120 B14R1.686 Cc1cc(CC(Br)C(C)=O)ccc1C Amb18073361 [0,2,0,0,0,0|2,0,0]=4 5121 B14R1.686 Cc1cc(CC(Br)C(N)=O)ccc1F Amb25716387 [0,2,0,0,0,0|2,0,0]=4 5122 B14R1.686 Cc1cc(CC(Br)C(O)=O)ccc1C Amb23320609 [0,2,0,0,0,0|1,0,0]=3 5123 B14R1.686 Cc1cc(CC(C)C(C)=O)ccc1F Amb18863906 [0,2,0,0,0,0|2,0,0]=4 5124 B14R1.686 Cc1cc(CC(C)C(O)=O)ccc1F Amb25807813 [0,2,0,0,0,0|1,0,0]=3 5125 B14R1.686 Cc1cc(CC(C)C(O)=O)ccc1O Amb25028881 [0,2,0,0,0,0|1,0,0]=3 5126 B14R1.686 Cc1cc(CC(F)C(O)=O)ccc1F Amb25103157 [0,2,0,0,0,0|1,0,0]=3 5127 B14R1.686 Cc1cc(CC(N)C(C)=C)ccc1C Amb25852119 [0,2,0,0,0,0|2,0,0]=4 5128 B14R1.686 Cc1cc(CC(N)C(N)=O)ccc1C Amb24761161 [0,2,0,0,0,0|1,0,0]=3 5129 B14R1.686 Cc1cc(CC(N)C(O)=O)c[n]c1Cl Amb25324072 [0,2,0,0,0,0|1,0,0]=3 5130 B14R1.686 Cc1cc(CC(N)C(O)=O)c[n]c1F Amb24746572 [0,2,0,0,0,0|1,0,0]=3 5131 B14R1.686 Cc1cc(CC(N)C(O)=O)c[n]c1O Amb25703077 [0,2,0,0,0,0|1,0,0]=3 5132 B14R1.686 Cc1cc(CC(N)C(O)=O)ccc1Cl Amb22043837 [0,2,0,0,0,0|0,0,0]=2 5133 B14R1.686 Cc1cc(CC(N)C(O)=O)ccc1F Amb18300563 [0,2,0,0,0,0|0,0,0]=2 5134 B14R1.686 Cc1cc(CC(O)C(O)=O)ccc1C Amb24726250 [0,2,0,0,0,0|1,0,0]=3 5135 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)c[n]c1Cl Amb24435422 [0,2,0,0,0,0|1,0,0]=3 5136 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)c[n]c1F Amb25841387 [0,2,0,0,0,0|1,0,0]=3 5137 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1C Amb19061741 [0,2,0,0,0,0|0,0,0]=2 5138 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1F Amb18325205 [0,2,0,0,0,0|0,0,0]=2 5139 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1I Amb25112678 [0,2,0,0,0,0|0,0,0]=2 5140 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1N Amb25326363 [0,2,0,0,0,0|0,0,0]=2 5141 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1O Amb25814510 [0,2,0,0,0,0|0,0,0]=2 5142 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)c[n]c1Cl Amb25103716 [0,2,0,0,0,0|1,0,0]=3 5143 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)c[n]c1F Amb25077674 [0,2,0,0,0,0|1,0,0]=3 5144 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)ccc1N Amb25127940 [0,2,0,0,0,0|0,0,0]=2 5145 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)ccc1O Amb24655787 [0,2,0,0,0,0|0,0,0]=2 5146 B14R1.686 Cc1cc(\C=C(\N)/C(O)=O)ccc1F Amb25790261 [0,2,0,0,0,0|0,0,2]=4 5147 B14R1.686 Cc1cc(ccc1Br)OC(F)C(O)=O Amb25812427 [0,2,0,0,0,0|2,0,0]=4 5148 B14R1.686 Cc1cc(ccc1C)OC(F)C(O)=O Amb24498817 [0,2,0,0,0,0|2,0,0]=4 5149 B14R1.686 Cc1cc(ccc1C)SC(F)C(O)=O Amb25360622 [0,2,0,0,0,0|2,0,0]=4 5150 B14R1.686 Cc1cc(ccc1Cl)OC(F)C(O)=O Amb25691308 [0,2,0,0,0,0|2,0,0]=4 5151 B14R1.686 Cc1cc(ccc1Cl)O[C@@H](C)C(O)=O Amb24741873 [0,2,0,0,0,0|2,0,0]=4 5152 B14R1.686 Cc1cc(ccc1Cl)O[C@H](C)C(O)=O Amb25237618 [0,2,0,0,0,0|2,0,0]=4 5153 B14R1.686 Cc1cc(ccc1F)NC(C)C(O)=O Amb18998952 [0,2,0,0,0,0|2,0,0]=4 5154 B14R1.686 Cc1cc(ccc1F)OC(F)C(O)=O Amb24548810 [0,2,0,0,0,0|2,0,0]=4 5155 B14R1.686 Cc1cc(ccc1F)O[C@@H](C)C(O)=O Amb25108419 [0,2,0,0,0,0|2,0,0]=4 5156 B14R1.686 Cc1cc(ccc1N)NC(C)C(O)=O Amb23114171 [0,2,0,0,0,0|2,0,0]=4 5157 B14R1.686 Cc1cc(ccc1N)OC(C)C(O)=O Amb18301893 [0,2,0,0,0,0|2,0,0]=4 5158 B14R1.686 Cc1ccc(CC(=O)C(O)=O)cc1Br Amb25692628 [0,2,0,0,0,0|1,0,1]=4 5159 B14R1.686 Cc1ccc(CC(Br)C(C)=O)cc1Cl Amb18077840 [0,2,0,0,0,0|2,0,0]=4 5160 B14R1.686 Cc1ccc(CC(Br)C(C)=O)cc1F Amb24335657 [0,2,0,0,0,0|2,0,0]=4 5161 B14R1.686 Cc1ccc(CC(Br)C(O)=O)cc1Cl Amb23320628 [0,2,0,0,0,0|1,0,0]=3 5162 B14R1.686 Cc1ccc(CC(C)C(O)=O)cc1Cl Amb25827789 [0,2,0,0,0,0|1,0,0]=3 5163 B14R1.686 Cc1ccc(CC(Cl)C(N)=O)cc1F Amb24530618 [0,2,0,0,0,0|2,0,0]=4 5164 B14R1.686 Cc1ccc(CC(N)C(C)=O)cc1Br Amb25722250 [0,2,0,0,0,0|1,0,0]=3 5165 B14R1.686 Cc1ccc(CC(N)C(C)=O)cc1Cl Amb24534876 [0,2,0,0,0,0|1,0,0]=3 5166 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1Cl Amb24756671 [0,2,0,0,0,0|0,0,0]=2 5167 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1F Amb22047660 [0,2,0,0,0,0|0,0,0]=2 5168 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1I Amb25758874 [0,2,0,0,0,0|0,0,0]=2 5169 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1O Amb25840843 [0,2,0,0,0,0|0,0,0]=2 5170 B14R1.686 Cc1ccc(CC(O)C(O)=O)cc1Br Amb24339477 [0,2,0,0,0,0|1,0,0]=3 5171 B14R1.686 Cc1ccc(CC(O)C(O)=O)cc1Cl Amb24456663 [0,2,0,0,0,0|1,0,0]=3 5172 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1F Amb24643475 [0,2,0,0,0,0|0,0,0]=2 5173 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1I Amb24715553 [0,2,0,0,0,0|0,0,0]=2 5174 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1O Amb25814511 [0,2,0,0,0,0|0,0,0]=2 5175 B14R1.686 Cc1ccc(C[C@@H](O)C(O)=O)cc1Cl Amb25817647 [0,2,0,0,0,0|1,0,0]=3 5176 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1Br Amb24336188 [0,2,0,0,0,0|0,0,0]=2 5177 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1F Amb25340927 [0,2,0,0,0,0|0,0,0]=2 5178 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1N Amb24521109 [0,2,0,0,0,0|0,0,0]=2 5179 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1O Amb24376614 [0,2,0,0,0,0|0,0,0]=2 5180 B14R1.686 Cc1ccc(\C=C(\N)/C(O)=O)cc1Cl Amb24436998 [0,2,0,0,0,0|0,0,2]=4 5181 B14R1.686 Cc1ccc(\C=C(\N)/C(O)=O)cc1F Amb24370813 [0,2,0,0,0,0|0,0,2]=4 5182 B14R1.686 Cc1ccc(cc1Br)OC(C)C(O)=O Amb25279211 [0,2,0,0,0,0|2,0,0]=4 5183 B14R1.686 Cc1ccc(cc1F)NC(C)C(O)=O Amb18981765 [0,2,0,0,0,0|2,0,0]=4 5184 B14R1.686 Cc1ccc(cc1F)OC(C)C(O)=O Amb24646367 [0,2,0,0,0,0|2,0,0]=4 5185 B14R1.686 Cc1ccc(cc1F)OC(F)C(O)=O Amb25117645 [0,2,0,0,0,0|2,0,0]=4 5186 B14R1.686 Cc1ccc(cc1F)O[C@@H](C)C(O)=O Amb24737207 [0,2,0,0,0,0|2,0,0]=4 5187 B14R1.686 Cc1ccc(cc1F)O[C@H](C)C(O)=O Amb24753087 [0,2,0,0,0,0|2,0,0]=4 5188 B14R1.686 Cc1ccc(cc1I)NC(C)C(O)=O Amb25771018 [0,2,0,0,0,0|2,0,0]=4 5189 B14R1.686 Cc1ccc(cc1O)NC(C)C(O)=O Amb25716614 [0,2,0,0,0,0|2,0,0]=4 5190 B14R1.686 NC(=O)C(Br)Cc1cc(Br)c(Cl)cc1 Amb25682222 [0,2,0,0,0,0|2,0,0]=4 5191 B14R1.686 NC(=O)C(Br)Cc1cc(Br)c(F)cc1 Amb25091567 [0,2,0,0,0,0|2,0,0]=4 5192 B14R1.686 NC(=O)C(Br)Cc1ccc(Br)c(I)c1 Amb24507939 [0,2,0,0,0,0|2,0,0]=4 5193 B14R1.686 NC(=O)C(Br)Cc1ccc(Cl)c(F)c1 Amb25704735 [0,2,0,0,0,0|2,0,0]=4 5194 B14R1.686 NC(=O)C(Cc1ccc(c(c1)Br)C)Cl Amb17204936 [0,2,0,0,0,0|2,0,0]=4 5195 B14R1.686 NC(=O)C(Cc1ccc(c(c1)C)Br)Cl Amb17204939 [0,2,0,0,0,0|2,0,0]=4 5196 B14R1.686 NC(=O)C(Cc1ccc(c(c1)C)C)Cl Amb17204436 [0,2,0,0,0,0|2,0,0]=4 5197 B14R1.686 NC(=O)C(Cc1ccc(c(c1)Cl)C)Cl Amb17204561 [0,2,0,0,0,0|2,0,0]=4 5198 B14R1.686 NC(=O)C(Cc1ccc(c(c1)Cl)Cl)Cl Amb17204749 [0,2,0,0,0,0|2,0,0]=4 5199 B14R1.686 NC(=O)C(Cc1ccc(c(c1)Cl)F)Cl Amb17204613 [0,2,0,0,0,0|2,0,0]=4 5200 B14R1.686 NC(=O)C(Cc1ccc(c(c1)F)F)Cl Amb17204498 [0,2,0,0,0,0|2,0,0]=4 5201 B14R1.686 NC(=O)C(Cl)Cc1cc(Cl)c(Br)cc1 Amb25033182 [0,2,0,0,0,0|2,0,0]=4 5202 B14R1.686 NC(=O)C(Cl)Cc1ccc(Br)c(I)c1 Amb24349044 [0,2,0,0,0,0|2,0,0]=4 5203 B14R1.686 NC(=O)C(Cl)Cc1ccc(I)c(Br)c1 Amb24386203 [0,2,0,0,0,0|2,0,0]=4 5204 B14R1.686 NC(=O)C(F)Cc1cc(O)c(O)cc1 Amb24432754 [0,2,0,0,0,0|2,0,0]=4 5205 B14R1.686 NC(=O)C(N)Cc1cc(Cl)c(Cl)cc1 Amb25801268 [0,2,0,0,0,0|1,0,0]=3 5206 B14R1.686 NC(=O)C(N)Cc1cc(F)c(F)cc1 Amb24643562 [0,2,0,0,0,0|1,0,0]=3 5207 B14R1.686 NC(=O)C(N)Cc1cc(O)c(O)cc1 Amb18972785 [0,2,0,0,0,0|1,0,0]=3 5208 B14R1.686 NC(=O)C(N)Cc1ccc(Cl)c(F)c1 Amb25045078 [0,2,0,0,0,0|1,0,0]=3 5209 B14R1.686 NC(=O)C(N)Cc1ccc(F)c(Br)c1 Amb25789656 [0,2,0,0,0,0|1,0,0]=3 5210 B14R1.686 NC(=O)[C@@H](N)Cc1cc(O)c(O)cc1 Amb19053055 [0,2,0,0,0,0|1,0,0]=3 5211 B14R1.686 NC(CC1=CC(=O)C(=O)C=C1)C(O)=O Amb25111133 [0,2,0,0,0,0|0,0,0]=2 5212 B14R1.686 NC(CC1=CC=C(O)C(=O)N1)C(O)=O Amb25758612 [0,2,0,0,0,0|1,0,0]=3 5213 B14R1.686 NC(CC1C=CC(=O)C(O)=C1)C(O)=O Amb24658822 [0,2,0,0,0,0|0,0,1]=3 5214 B14R1.686 NC(CN1C=C(O)C(=O)C=C1)C(O)=O Amb21855906 [0,2,0,0,0,0|1,0,0]=3 5215 B14R1.686 NC(Cc1c[n]c(Cl)c(Br)c1)C(O)=O Amb24505869 [0,2,0,0,0,0|1,0,0]=3 5216 B14R1.686 NC(Cc1cc(F)c(F)[n]c1)C(O)=O Amb25764454 [0,2,0,0,0,0|1,0,0]=3 5217 B14R1.686 NC(Cc1cc(O)c(Br)cc1)C(O)=O Amb18668187 [0,2,0,0,0,0|0,0,0]=2 5218 B14R1.686 NC(Cc1cc(O)c(Cl)cc1)C(O)=O Amb25844062 [0,2,0,0,0,0|0,0,0]=2 5219 B14R1.686 NC(Cc1cc(O)c(F)cc1)C(O)=O Amb24117508 [0,2,0,0,0,0|0,0,0]=2 5220 B14R1.686 NC(Cc1cc(O)c(F)cc1)C(O)=O Amb24671256 [0,2,0,0,0,0|0,0,0]=2 5221 B14R1.686 NC(Cc1cc(O)c(O)cc1)P(O)=O Amb24506351 [0,2,0,0,0,0|1,0,0]=3 5222 B14R1.686 NC(Cc1cc(O)c(O)cc1)P(O)O Amb24682106 [0,2,0,0,0,0|1,0,1]=4 5223 B14R1.686 NC(Cc1ccc(Cl)c(F)c1)C(O)=O Amb18300562 [0,2,0,0,0,0|0,0,0]=2 5224 B14R1.686 NC(Cc1ccc(F)c(Cl)c1)C(O)=O Amb18226045 [0,2,0,0,0,0|0,0,0]=2 5225 B14R1.686 NC(Cc1ccc(F)c(Cl)c1)C(O)=O Amb22047584 [0,2,0,0,0,0|0,0,0]=2 5226 B14R1.686 NC(Cc1ccc(I)c(Br)c1)C(O)=O Amb24731762 [0,2,0,0,0,0|0,0,0]=2 5227 B14R1.686 NC(Cc1ccc(I)c(F)c1)C(O)=O Amb24451684 [0,2,0,0,0,0|0,0,0]=2 5228 B14R1.686 NC(Cc1ccc(O)c(Br)c1)C(O)=O Amb20243421 [0,2,0,0,0,0|0,0,0]=2 5229 B14R1.686 NC(Cc1ccc(O)c(Cl)c1)C(O)=O Amb22349804 [0,2,0,0,0,0|0,0,0]=2 5230 B14R1.686 NC(\C=C\1/C=C(O)C(=O)C=C1)C(O)=O Amb25140893 [0,2,0,0,0,0|0,0,1]=3 5231 B14R1.686 N[C@@H](CC1=CC(=O)C(O)=CN1)C(O)=O Amb25285271 [0,2,0,0,0,0|1,0,0]=3 5232 B14R1.686 N[C@@H](CC1=CC=C(O)C(=O)N1)C(O)=O Amb25721995 [0,2,0,0,0,0|1,0,0]=3 5233 B14R1.686 N[C@@H](CC=1C=CC(=O)C(=N)C1)C(O)=O Amb25668485 [0,2,0,0,0,0|0,0,0]=2 5234 B14R1.686 N[C@@H](CN1C=C(O)C(=O)C=C1)C(O)=O Amb18511712 [0,2,0,0,0,0|1,0,0]=3 5235 B14R1.686 N[C@@H](Cc1c[n]c(F)c(Cl)c1)C(O)=O Amb24521937 [0,2,0,0,0,0|1,0,0]=3 5236 B14R1.686 N[C@@H](Cc1c[n]c(N)c(N)c1)C(O)=O Amb24606179 [0,2,0,0,0,0|1,0,0]=3 5237 B14R1.686 N[C@@H](Cc1c[n]c(O)c(Cl)c1)C(O)=O Amb25167969 [0,2,0,0,0,0|1,0,0]=3 5238 B14R1.686 N[C@@H](Cc1cc(Cl)c(Cl)[n]c1)C(O)=O Amb25741133 [0,2,0,0,0,0|1,0,0]=3 5239 B14R1.686 N[C@@H](Cc1cc(O)c(Br)cc1)C(O)=O Amb25140963 [0,2,0,0,0,0|0,0,0]=2 5240 B14R1.686 N[C@@H](Cc1cc(O)c(Cl)cc1)C(O)=O Amb25785694 [0,2,0,0,0,0|0,0,0]=2 5241 B14R1.686 N[C@@H](Cc1cc(O)c(O)cc1)C(O)=O Amb25671225 [0,2,0,0,0,0|0,0,0]=2 5242 B14R1.686 N[C@@H](Cc1ccc(Br)c(F)c1)C(O)=O Amb25095944 [0,2,0,0,0,0|0,0,0]=2 5243 B14R1.686 N[C@@H](Cc1ccc(Br)c(I)c1)C(O)=O Amb25125922 [0,2,0,0,0,0|0,0,0]=2 5244 B14R1.686 N[C@@H](Cc1ccc(Cl)c(F)c1)C(O)=O Amb25856705 [0,2,0,0,0,0|0,0,0]=2 5245 B14R1.686 N[C@@H](Cc1ccc(Cl)c(I)c1)C(O)=O Amb25082084 [0,2,0,0,0,0|0,0,0]=2 5246 B14R1.686 N[C@@H](Cc1ccc(F)c(Cl)c1)C(O)=O Amb25194777 [0,2,0,0,0,0|0,0,0]=2 5247 B14R1.686 N[C@@H](Cc1ccc(I)c(Br)c1)C(O)=O Amb25748106 [0,2,0,0,0,0|0,0,0]=2 5248 B14R1.686 N[C@@H](Cc1ccc(I)c(F)c1)C(O)=O Amb25375913 [0,2,0,0,0,0|0,0,0]=2 5249 B14R1.686 N[C@@H](Cc1ccc(O)c(Br)c1)C(O)=O Amb22229234 [0,2,0,0,0,0|0,0,0]=2 5250 B14R1.686 N[C@@H](Cc1ccc(O)c(S)c1)C(O)=O Amb25782038 [0,2,0,0,0,0|0,0,0]=2 5251 B14R1.686 N[C@H](CC1=CC(=O)C(=O)C=C1)C(O)=O Amb25274975 [0,2,0,0,0,0|0,0,0]=2 5252 B14R1.686 N[C@H](Cc1c[n]c(Cl)c(Br)c1)C(O)=O Amb24451231 [0,2,0,0,0,0|1,0,0]=3 5253 B14R1.686 N[C@H](Cc1c[n]c(F)c(Cl)c1)C(O)=O Amb25771762 [0,2,0,0,0,0|1,0,0]=3 5254 B14R1.686 N[C@H](Cc1cc(Br)c(Br)[n]c1)C(O)=O Amb24728187 [0,2,0,0,0,0|1,0,0]=3 5255 B14R1.686 N[C@H](Cc1cc(Br)c(Br)cc1)C(O)=O Amb25665238 [0,2,0,0,0,0|0,0,0]=2 5256 B14R1.686 N[C@H](Cc1cc(F)c(F)[n]c1)C(O)=O Amb24400436 [0,2,0,0,0,0|1,0,0]=3 5257 B14R1.686 N[C@H](Cc1ccc(Br)c(Cl)c1)C(O)=O Amb25794884 [0,2,0,0,0,0|0,0,0]=2 5258 B14R1.686 N[C@H](Cc1ccc(Cl)c(Br)c1)C(O)=O Amb24670160 [0,2,0,0,0,0|0,0,0]=2 5259 B14R1.686 N[C@H](Cc1ccc(Cl)c(F)c1)C(O)=O Amb24510514 [0,2,0,0,0,0|0,0,0]=2 5260 B14R1.686 N[C@H](Cc1ccc(I)c(Br)c1)C(O)=O Amb24682403 [0,2,0,0,0,0|0,0,0]=2 5261 B14R1.686 N[C@H](Cc1ccc(I)c(Cl)c1)C(O)=O Amb25313163 [0,2,0,0,0,0|0,0,0]=2 5262 B14R1.686 N[C@H](Cc1ccc(O)c(Br)c1)C(O)=O Amb22229233 [0,2,0,0,0,0|0,0,0]=2 5263 B14R1.686 N\C(=C\c1cc(Cl)c(Cl)cc1)\C(O)=O Amb24728103 [0,2,0,0,0,0|0,0,2]=4 5264 B14R1.686 Nc1[n]cc(C[C@H](N)C(O)=O)cc1Br Amb25080924 [0,2,0,0,0,0|1,0,0]=3 5265 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1N Amb18652146 [0,2,0,0,0,0|0,0,0]=2 5266 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1O Amb22229179 [0,2,0,0,0,0|0,0,0]=2 5267 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1O Amb22492604 [0,2,0,0,0,0|0,0,0]=2 5268 B14R1.686 Nc1cc(CC(O)C(O)=O)ccc1O Amb24710411 [0,2,0,0,0,0|1,0,0]=3 5269 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1Br Amb25342348 [0,2,0,0,0,0|0,0,0]=2 5270 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1Cl Amb25744448 [0,2,0,0,0,0|0,0,0]=2 5271 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1F Amb24595720 [0,2,0,0,0,0|0,0,0]=2 5272 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1O Amb22750576 [0,2,0,0,0,0|0,0,0]=2 5273 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1O Amb22755065 [0,2,0,0,0,0|0,0,0]=2 5274 B14R1.686 Nc1cc(C[C@@H](O)C(O)=O)ccc1O Amb24498396 [0,2,0,0,0,0|1,0,0]=3 5275 B14R1.686 Nc1cc(C[C@H](N)C(O)=O)ccc1Br Amb24402259 [0,2,0,0,0,0|0,0,0]=2 5276 B14R1.686 Nc1cc(C[C@H](N)C(O)=O)ccc1N Amb25757131 [0,2,0,0,0,0|0,0,0]=2 5277 B14R1.686 Nc1ccc(CC(N)C(O)=O)cc1Br Amb25705138 [0,2,0,0,0,0|0,0,0]=2 5278 B14R1.686 Nc1ccc(CC(N)C(O)=O)cc1O Amb22054329 [0,2,0,0,0,0|0,0,0]=2 5279 B14R1.686 Nc1ccc(C[C@@H](N)C(O)=O)cc1Br Amb25342211 [0,2,0,0,0,0|0,0,0]=2 5280 B14R1.686 Nc1ccc(C[C@@H](N)C(O)=O)cc1O Amb25759725 [0,2,0,0,0,0|0,0,0]=2 5281 B14R1.686 Nc1ccc(C[C@H](N)C(O)=O)cc1F Amb24351132 [0,2,0,0,0,0|0,0,0]=2 5282 B14R1.686 Nc1ccc(C[C@H](N)C(O)=O)cc1O Amb24094583 [0,2,0,0,0,0|0,0,0]=2 5283 B14R1.686 OC(=O)C(=O)Cc1ccc(Br)c(Cl)c1 Amb25220059 [0,2,0,0,0,0|1,0,1]=4 5284 B14R1.686 OC(=O)C(=O)Cc1ccc(Br)c(F)c1 Amb24591367 [0,2,0,0,0,0|1,0,1]=4 5285 B14R1.686 OC(=O)C(=O)Cc1ccc(Cl)c(Br)c1 Amb25134658 [0,2,0,0,0,0|1,0,1]=4 5286 B14R1.686 OC(=O)C(=O)Cc1ccc(Cl)c(F)c1 Amb18980641 [0,2,0,0,0,0|1,0,1]=4 5287 B14R1.686 OC(=O)C(=O)Cc1ccc(F)c(Cl)c1 Amb24462337 [0,2,0,0,0,0|1,0,1]=4 5288 B14R1.686 OC(=O)C(=O)Cc1ccc(O)c(Cl)c1 Amb18980953 [0,2,0,0,0,0|1,0,1]=4 5289 B14R1.686 OC(=O)C(=O)Cc1ccc(O)c(F)c1 Amb24655684 [0,2,0,0,0,0|1,0,1]=4 5290 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)Br)F Amb1133011 [0,2,0,0,0,0|1,0,1]=4 5291 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)Cl)Cl Amb1126045 [0,2,0,0,0,0|1,0,1]=4 5292 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)F)F Amb1138787 [0,2,0,0,0,0|1,0,1]=4 5293 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)O)O Amb1127083 [0,2,0,0,0,0|1,0,1]=4 5294 B14R1.686 OC(=O)C(Br)Cc1cc(F)c(F)cc1 Amb25854960 [0,2,0,0,0,0|1,0,0]=3 5295 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Br)C)Cl Amb17204947 [0,2,0,0,0,0|1,0,0]=3 5296 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)Br)Cl Amb17204950 [0,2,0,0,0,0|1,0,0]=3 5297 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)C)C Amb17605829 [0,2,0,0,0,0|1,0,0]=3 5298 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)C)Cl Amb17204442 [0,2,0,0,0,0|1,0,0]=3 5299 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)C)Cl Amb17204588 [0,2,0,0,0,0|1,0,0]=3 5300 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)Br Amb10576762 [0,2,0,0,0,0|1,0,0]=3 5301 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)C Amb17605797 [0,2,0,0,0,0|1,0,0]=3 5302 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)Cl Amb17204773 [0,2,0,0,0,0|1,0,0]=3 5303 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)F)Cl Amb17204626 [0,2,0,0,0,0|1,0,0]=3 5304 B14R1.686 OC(=O)C(Cc1ccc(c(c1)F)F)Cl Amb17204501 [0,2,0,0,0,0|1,0,0]=3 5305 B14R1.686 OC(=O)C(Cc1ccc(c(c1)F)O)C Amb10844160 [0,2,0,0,0,0|1,0,0]=3 5306 B14R1.686 OC(=O)C(Cc1ccc(c(c1)I)O)N Amb16204813 [0,2,0,0,0,0|0,0,0]=2 5307 B14R1.686 OC(=O)C(Cc1ccc(c(c1)O)O)N Amb1216479 [0,2,0,0,0,0|0,0,0]=2 5308 B14R1.686 OC(=O)C(F)Cc1cc(F)c(Cl)cc1 Amb25200731 [0,2,0,0,0,0|1,0,0]=3 5309 B14R1.686 OC(=O)C(F)Cc1ccc(Cl)c(Br)c1 Amb25200807 [0,2,0,0,0,0|1,0,0]=3 5310 B14R1.686 OC(=O)C(F)Cc1ccc(F)c(Br)c1 Amb24586120 [0,2,0,0,0,0|1,0,0]=3 5311 B14R1.686 OC(=O)C(F)Cc1ccc(F)c(Cl)c1 Amb25096720 [0,2,0,0,0,0|1,0,0]=3 5312 B14R1.686 OC(=O)C(F)Oc1cc(Cl)c(Cl)cc1 Amb24579968 [0,2,0,0,0,0|2,0,0]=4 5313 B14R1.686 OC(=O)C(F)Oc1cc(F)c(Br)cc1 Amb25181928 [0,2,0,0,0,0|2,0,0]=4 5314 B14R1.686 OC(=O)C(F)Oc1cc(F)c(Cl)cc1 Amb24442658 [0,2,0,0,0,0|2,0,0]=4 5315 B14R1.686 OC(=O)C(F)Oc1cc(F)c(F)cc1 Amb24641275 [0,2,0,0,0,0|2,0,0]=4 5316 B14R1.686 OC(=O)C(F)Oc1ccc(F)c(Cl)c1 Amb24498515 [0,2,0,0,0,0|2,0,0]=4 5317 B14R1.686 OC(=O)C(F)Sc1cc(Cl)c(Cl)cc1 Amb25680174 [0,2,0,0,0,0|2,0,0]=4 5318 B14R1.686 OC(=O)C(Nc1ccc(c(c1)Br)C)C Amb17415253 [0,2,0,0,0,0|2,0,0]=4 5319 B14R1.686 OC(=O)C(Nc1ccc(c(c1)C)Br)C Amb17415255 [0,2,0,0,0,0|2,0,0]=4 5320 B14R1.686 OC(=O)C(Nc1ccc(c(c1)Cl)C)C Amb17404302 [0,2,0,0,0,0|2,0,0]=4 5321 B14R1.686 OC(=O)C(Nc1ccc(c(c1)F)F)C Amb17402395 [0,2,0,0,0,0|2,0,0]=4 5322 B14R1.686 OC(=O)C(O)Cc1cc(Cl)c(Cl)cc1 Amb24094048 [0,2,0,0,0,0|1,0,0]=3 5323 B14R1.686 OC(=O)C(O)Cc1cc(F)c(F)cc1 Amb25059600 [0,2,0,0,0,0|1,0,0]=3 5324 B14R1.686 OC(=O)C(O)Cc1ccc(F)c(Br)c1 Amb24570493 [0,2,0,0,0,0|1,0,0]=3 5325 B14R1.686 OC(=O)C(Oc1ccc(c(c1)Cl)Cl)C Amb1117496 [0,2,0,0,0,0|2,0,0]=4 5326 B14R1.686 OC(=O)C(Oc1ccc(c(c1)Cl)F)C Amb1111292 [0,2,0,0,0,0|2,0,0]=4 5327 B14R1.686 OC(=O)C(Oc1ccc(c(c1)F)F)C Amb1120299 [0,2,0,0,0,0|2,0,0]=4 5328 B14R1.686 OC(=O)C(Sc1ccc(c(c1)C)C)C Amb1119990 [0,2,0,0,0,0|2,0,0]=4 5329 B14R1.686 OC(=O)C(Sc1ccc(c(c1)C)Cl)C Amb17083290 [0,2,0,0,0,0|2,0,0]=4 5330 B14R1.686 OC(=O)C(Sc1ccc(c(c1)C)F)C Amb17083277 [0,2,0,0,0,0|2,0,0]=4 5331 B14R1.686 OC(=O)C(Sc1ccc(c(c1)Cl)F)C Amb1115467 [0,2,0,0,0,0|2,0,0]=4 5332 B14R1.686 OC(=O)C(Sc1ccc(c(c1)F)F)C Amb1113300 [0,2,0,0,0,0|2,0,0]=4 5333 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)Cl)O)N Amb16231682 [0,2,0,0,0,0|0,0,0]=2 5334 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)F)O)N Amb10839960 [0,2,0,0,0,0|0,0,0]=2 5335 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)I)O)N Amb10072403 [0,2,0,0,0,0|0,0,0]=2 5336 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)N)O)N Amb10072243 [0,2,0,0,0,0|0,0,0]=2 5337 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)O)O)N Amb17613565 [0,2,0,0,0,0|0,0,0]=2 5338 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)C)C)N Amb16231648 [0,2,0,0,0,0|0,0,0]=2 5339 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)Cl)O)N Amb16233351 [0,2,0,0,0,0|0,0,0]=2 5340 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)F)F)C Amb10844146 [0,2,0,0,0,0|1,0,0]=3 5341 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)N)O)N Amb16231672 [0,2,0,0,0,0|0,0,0]=2 5342 B14R1.686 O[C@@H](Cc1cc(O)c(O)cc1)C(O)=O Amb22747075 [0,2,0,0,0,0|1,0,0]=3 5343 B14R1.686 O[C@H](Cc1cc(O)c(O)cc1)C(O)=O Amb24629166 [0,2,0,0,0,0|1,0,0]=3 5344 B14R1.686 Oc1cc(CC(F)C(O)=O)ccc1O Amb25790634 [0,2,0,0,0,0|1,0,0]=3 5345 B14R1.686 Oc1ccc(CC(F)C(O)=O)cc1F Amb25219647 [0,2,0,0,0,0|1,0,0]=3 5346 B14R1.686 Oc1ccc(CC(O)C(O)=O)cc1F Amb25220163 [0,2,0,0,0,0|1,0,0]=3 5347 B14R1.686 [O-]C(=O)C(O)Cc1cc(O)c(O)cc1 Amb20622113 [0,2,0,0,0,0|1,0,1]=4 5348 B14R1.700 Cc1ccc(CC(N)C(C)(C)O)cc1 Amb25761230 [0,2,0,0,0,0|1,0,1]=4 5349 B14R1.700 Cc1ccc(CC(N)P(O)(O)=O)cc1 Amb25313079 [0,2,0,0,0,0|1,0,0]=3 5350 B14R1.700 NC(Cc1ccc(F)cc1)P(O)(O)=O Amb25365229 [0,2,0,0,0,0|1,0,0]=3 5351 B14R1.700 N[C@@H](Cc1ccc(F)cc1)P(O)(O)=O Amb24506411 [0,2,0,0,0,0|1,0,0]=3 5352 B14R1.700 Nc1ccc(CC(N)P(O)(O)=O)cc1 Amb25165747 [0,2,0,0,0,0|1,0,0]=3 5353 B14R1.6049 CC(=C)C(N)Cc1ccc(Cl)cc1Cl Amb24591929 [0,2,0,0,0,0|2,0,0]=4 5354 B14R1.6049 CC(=C)C(N)Cc1ccc(F)cc1Cl Amb25363614 [0,2,0,0,0,0|2,0,0]=4 5355 B14R1.6049 CC(=O)C(Br)Cc1ccc(Br)cc1Br Amb25049674 [0,2,0,0,0,0|2,0,0]=4 5356 B14R1.6049 CC(=O)C(Br)Cc1ccc(Br)cc1Cl Amb24703000 [0,2,0,0,0,0|2,0,0]=4 5357 B14R1.6049 CC(=O)C(Br)Cc1ccc(Br)cc1F Amb25851911 [0,2,0,0,0,0|2,0,0]=4 5358 B14R1.6049 CC(=O)C(Br)Cc1ccc(Cl)cc1Br Amb25231918 [0,2,0,0,0,0|2,0,0]=4 5359 B14R1.6049 CC(=O)C(Br)Cc1ccc(Cl)cc1Cl Amb18599851 [0,2,0,0,0,0|2,0,0]=4 5360 B14R1.6049 CC(=O)C(Br)Cc1ccc(Cl)cc1I Amb25033531 [0,2,0,0,0,0|2,0,0]=4 5361 B14R1.6049 CC(=O)C(Br)Cc1ccc(F)cc1F Amb18073783 [0,2,0,0,0,0|2,0,0]=4 5362 B14R1.6049 CC(=O)C(Br)Cc1ccc(I)cc1Br Amb25040798 [0,2,0,0,0,0|2,0,0]=4 5363 B14R1.6049 CC(=O)C(Br)Cc1ccc(I)cc1Cl Amb25287736 [0,2,0,0,0,0|2,0,0]=4 5364 B14R1.6049 CC(=O)C(C)Cc1ccc(F)cc1Cl Amb24446323 [0,2,0,0,0,0|2,0,0]=4 5365 B14R1.6049 CC(=O)C(C)Cc1ccc(F)cc1F Amb19083330 [0,2,0,0,0,0|2,0,0]=4 5366 B14R1.6049 CC(=O)C(Cc1ccc(cc1Br)C)Cl Amb17204928 [0,2,0,0,0,0|2,0,0]=4 5367 B14R1.6049 CC(=O)C(Cc1ccc(cc1C)Br)Cl Amb17204929 [0,2,0,0,0,0|2,0,0]=4 5368 B14R1.6049 CC(=O)C(Cc1ccc(cc1C)C)C Amb17234967 [0,2,0,0,0,0|2,0,0]=4 5369 B14R1.6049 CC(=O)C(Cc1ccc(cc1C)C)Cl Amb17204428 [0,2,0,0,0,0|2,0,0]=4 5370 B14R1.6049 CC(=O)C(Cc1ccc(cc1C)Cl)Cl Amb17204556 [0,2,0,0,0,0|2,0,0]=4 5371 B14R1.6049 CC(=O)C(Cc1ccc(cc1Cl)Cl)C Amb17249288 [0,2,0,0,0,0|2,0,0]=4 5372 B14R1.6049 CC(=O)C(Cc1ccc(cc1Cl)Cl)Cl Amb17204743 [0,2,0,0,0,0|2,0,0]=4 5373 B14R1.6049 CC(=O)C(Cc1ccc(cc1F)F)Cl Amb17204488 [0,2,0,0,0,0|2,0,0]=4 5374 B14R1.6049 CC(=O)C(N)Cc1ccc(F)cc1F Amb25689019 [0,2,0,0,0,0|1,0,0]=3 5375 B14R1.6049 CC(Cc1ccc(Cl)cc1Br)C(O)=O Amb25028936 [0,2,0,0,0,0|1,0,0]=3 5376 B14R1.6049 CC(Cc1ccc(Cl)cc1Cl)C(N)=O Amb19367036 [0,2,0,0,0,0|2,0,0]=4 5377 B14R1.6049 CC(Cc1ccc(Cl)cc1F)C(O)=O Amb24463169 [0,2,0,0,0,0|1,0,0]=3 5378 B14R1.6049 CC(Cc1ccc(F)cc1Br)C(O)=O Amb24502990 [0,2,0,0,0,0|1,0,0]=3 5379 B14R1.6049 CC(Cc1ccc(F)cc1Cl)C(O)=O Amb25849479 [0,2,0,0,0,0|1,0,0]=3 5380 B14R1.6049 CC(Cc1ccc(F)cc1F)C(=O)Cl Amb25190866 [0,2,0,0,0,0|2,0,0]=4 5381 B14R1.6049 CC(Nc1ccc(Br)cc1Cl)C(O)=O Amb25374745 [0,2,0,0,0,0|2,0,0]=4 5382 B14R1.6049 CC(Nc1ccc(Cl)cc1Cl)C(O)=O Amb18039871 [0,2,0,0,0,0|2,0,0]=4 5383 B14R1.6049 CC(Nc1ccc(Cl)cc1F)C(O)=O Amb18999364 [0,2,0,0,0,0|2,0,0]=4 5384 B14R1.6049 CC(Nc1ccc(F)cc1Cl)C(O)=O Amb18981770 [0,2,0,0,0,0|2,0,0]=4 5385 B14R1.6049 CC(Nc1ccc(F)cc1O)C(O)=O Amb22463061 [0,2,0,0,0,0|2,0,0]=4 5386 B14R1.6049 CC(Nc1ccc(I)cc1Br)C(O)=O Amb24715296 [0,2,0,0,0,0|2,0,0]=4 5387 B14R1.6049 CC(Oc1ccc(Cl)cc1N)C(O)=O Amb18301894 [0,2,0,0,0,0|2,0,0]=4 5388 B14R1.6049 CC(Oc1ccc(Cl)cc1O)C(O)=O Amb25166086 [0,2,0,0,0,0|2,0,0]=4 5389 B14R1.6049 CC(Oc1ccc(F)cc1N)C(O)=O Amb18297279 [0,2,0,0,0,0|2,0,0]=4 5390 B14R1.6049 CC(Oc1ccc(N)cc1Cl)C(O)=O Amb18301896 [0,2,0,0,0,0|2,0,0]=4 5391 B14R1.6049 CC(Oc1ccc(N)cc1F)C(O)=O Amb19001360 [0,2,0,0,0,0|2,0,0]=4 5392 B14R1.6049 CC(Oc1ccc(O)cc1F)C(O)=O Amb25668478 [0,2,0,0,0,0|2,0,0]=4 5393 B14R1.6049 CC(Sc1ccc(Cl)cc1N)C(O)=O Amb18979580 [0,2,0,0,0,0|2,0,0]=4 5394 B14R1.6049 CC(Sc1ccc(F)cc1N)C(O)=O Amb18975667 [0,2,0,0,0,0|2,0,0]=4 5395 B14R1.6049 CC(Sc1ccc(N)cc1Br)C(O)=O Amb24566051 [0,2,0,0,0,0|2,0,0]=4 5396 B14R1.6049 CC(Sc1ccc(N)cc1Cl)C(O)=O Amb18291277 [0,2,0,0,0,0|2,0,0]=4 5397 B14R1.6049 CC(Sc1ccc(N)cc1F)C(O)=O Amb18294569 [0,2,0,0,0,0|2,0,0]=4 5398 B14R1.6049 CC1=CC(=O)N(CC(N)C(O)=O)C=C1 Amb25360430 [0,2,0,0,0,0|1,0,0]=3 5399 B14R1.6049 CC=1C=CN(CC(C)C(O)=O)C(=O)C1 Amb18302714 [0,2,0,0,0,0|2,0,0]=4 5400 B14R1.6049 CC=1C=CN(CC(N)C(O)=O)C(=O)N1 Amb25823602 [0,2,0,0,0,0|2,0,0]=4 5401 B14R1.6049 CC=1NC=C(C[C@H](N)C(O)=O)C(=O)N1 Amb25752495 [0,2,0,0,0,0|2,0,0]=4 5402 B14R1.6049 C[C@@H](Oc1ccc(Br)cc1Cl)C(O)=O Amb24413189 [0,2,0,0,0,0|2,0,0]=4 5403 B14R1.6049 C[C@@H](Oc1ccc(Cl)cc1Cl)C(O)=O Amb22348379 [0,2,0,0,0,0|2,0,0]=4 5404 B14R1.6049 C[C@@H](Oc1ccc(F)cc1Cl)C(O)=O Amb25778373 [0,2,0,0,0,0|2,0,0]=4 5405 B14R1.6049 C[C@@H](Oc1ccc(F)cc1F)C(O)=O Amb24466389 [0,2,0,0,0,0|2,0,0]=4 5406 B14R1.6049 C[C@H](Cc1ccc(Cl)cc1F)C(O)=O Amb24668899 [0,2,0,0,0,0|1,0,0]=3 5407 B14R1.6049 C[C@H](Oc1ccc(Br)cc1Br)C(O)=O Amb24407895 [0,2,0,0,0,0|2,0,0]=4 5408 B14R1.6049 C[C@H](Oc1ccc(Cl)cc1Cl)C(O)=O Amb25067445 [0,2,0,0,0,0|2,0,0]=4 5409 B14R1.6049 Cc1[n]c(F)ccc1CC(N)C(O)=O Amb25789508 [0,2,0,0,0,0|1,0,0]=3 5410 B14R1.6049 Cc1[n]c(N)c(C[C@H](N)C(O)=O)c[n]1 Amb24454751 [0,2,0,0,0,0|2,0,0]=4 5411 B14R1.6049 Cc1[n]c(N)ccc1CC(N)C(O)=O Amb25113397 [0,2,0,0,0,0|1,0,0]=3 5412 B14R1.6049 Cc1[n]c(O)c(CC(N)C(O)=O)c[n]1 Amb25088434 [0,2,0,0,0,0|2,0,0]=4 5413 B14R1.6049 Cc1[n]c(O)ccc1CC(N)C(O)=O Amb24697620 [0,2,0,0,0,0|1,0,0]=3 5414 B14R1.6049 Cc1cc(Br)c(CC(Br)C(N)=O)cc1 Amb25692071 [0,2,0,0,0,0|2,0,0]=4 5415 B14R1.6049 Cc1cc(Br)c[n]c1C[C@H](N)C(O)=O Amb24511204 [0,2,0,0,0,0|1,0,0]=3 5416 B14R1.6049 Cc1cc(Br)ccc1CC(N)C(C)=O Amb25084294 [0,2,0,0,0,0|1,0,0]=3 5417 B14R1.6049 Cc1cc(Br)ccc1C[C@H](N)C(O)=O Amb24421163 [0,2,0,0,0,0|0,0,0]=2 5418 B14R1.6049 Cc1cc(Br)ccc1O[C@@H](C)C(O)=O Amb24543778 [0,2,0,0,0,0|2,0,0]=4 5419 B14R1.6049 Cc1cc(Br)ccc1O[C@H](C)C(O)=O Amb25304550 [0,2,0,0,0,0|2,0,0]=4 5420 B14R1.6049 Cc1cc(C)c(CC(Br)C(C)=O)cc1 Amb18585221 [0,2,0,0,0,0|2,0,0]=4 5421 B14R1.6049 Cc1cc(C)c(CN(N)C(N)=O)cc1 Amb24423907 [0,2,0,0,0,0|2,0,0]=4 5422 B14R1.6049 Cc1cc(Cl)[n]cc1C[C@H](N)C(O)=O Amb25167991 [0,2,0,0,0,0|1,0,0]=3 5423 B14R1.6049 Cc1cc(Cl)ccc1CC(=O)C(O)=O Amb25028752 [0,2,0,0,0,0|1,0,1]=4 5424 B14R1.6049 Cc1cc(Cl)ccc1CC(Br)C(C)=O Amb18077770 [0,2,0,0,0,0|2,0,0]=4 5425 B14R1.6049 Cc1cc(Cl)ccc1CC(Br)C(O)=O Amb23320626 [0,2,0,0,0,0|1,0,0]=3 5426 B14R1.6049 Cc1cc(Cl)ccc1CC(N)C(C)=O Amb24507511 [0,2,0,0,0,0|1,0,0]=3 5427 B14R1.6049 Cc1cc(Cl)ccc1CC(N)C(O)=O Amb25732389 [0,2,0,0,0,0|0,0,0]=2 5428 B14R1.6049 Cc1cc(Cl)ccc1OC(F)C(O)=O Amb25749899 [0,2,0,0,0,0|2,0,0]=4 5429 B14R1.6049 Cc1cc(Cl)ccc1O[C@@H](C)C(O)=O Amb22747827 [0,2,0,0,0,0|2,0,0]=4 5430 B14R1.6049 Cc1cc(Cl)ccc1O[C@H](C)C(O)=O Amb22350595 [0,2,0,0,0,0|2,0,0]=4 5431 B14R1.6049 Cc1cc(F)[n]cc1C[C@H](N)C(O)=O Amb25133405 [0,2,0,0,0,0|1,0,0]=3 5432 B14R1.6049 Cc1cc(F)ccc1CC(=O)C(O)=O Amb18986590 [0,2,0,0,0,0|1,0,1]=4 5433 B14R1.6049 Cc1cc(F)ccc1CC(Br)C(C)=O Amb25769853 [0,2,0,0,0,0|2,0,0]=4 5434 B14R1.6049 Cc1cc(F)ccc1CC(C)C(C)=O Amb25832282 [0,2,0,0,0,0|2,0,0]=4 5435 B14R1.6049 Cc1cc(F)ccc1CC(Cl)C(N)=O Amb24530619 [0,2,0,0,0,0|2,0,0]=4 5436 B14R1.6049 Cc1cc(F)ccc1CC(N)C(N)=O Amb25822607 [0,2,0,0,0,0|1,0,0]=3 5437 B14R1.6049 Cc1cc(F)ccc1CC(N)C(O)=O Amb18995883 [0,2,0,0,0,0|0,0,0]=2 5438 B14R1.6049 Cc1cc(F)ccc1C[C@@H](N)C(O)=O Amb18325206 [0,2,0,0,0,0|0,0,0]=2 5439 B14R1.6049 Cc1cc(F)ccc1C[C@H](N)C(O)=O Amb25309017 [0,2,0,0,0,0|0,0,0]=2 5440 B14R1.6049 Cc1cc(F)ccc1NC(C)C(O)=O Amb18999361 [0,2,0,0,0,0|2,0,0]=4 5441 B14R1.6049 Cc1cc(F)ccc1OC(C)C(O)=O Amb25731652 [0,2,0,0,0,0|2,0,0]=4 5442 B14R1.6049 Cc1cc(F)ccc1OC(F)C(O)=O Amb25731653 [0,2,0,0,0,0|2,0,0]=4 5443 B14R1.6049 Cc1cc(F)ccc1O[C@@H](C)C(O)=O Amb24732351 [0,2,0,0,0,0|2,0,0]=4 5444 B14R1.6049 Cc1cc(N)[n]cc1CC(N)C(O)=O Amb24525952 [0,2,0,0,0,0|1,0,0]=3 5445 B14R1.6049 Cc1cc(N)ccc1CC(N)C(O)=O Amb25670989 [0,2,0,0,0,0|0,0,0]=2 5446 B14R1.6049 Cc1cc(N)ccc1C[C@H](N)C(O)=O Amb24714719 [0,2,0,0,0,0|0,0,0]=2 5447 B14R1.6049 Cc1cc(N)ccc1SC(C)C(O)=O Amb18291279 [0,2,0,0,0,0|2,0,0]=4 5448 B14R1.6049 Cc1cc(N)ccc1SC(F)C(O)=O Amb24395414 [0,2,0,0,0,0|2,0,0]=4 5449 B14R1.6049 Cc1cc(O)[n]cc1CC(N)C(O)=O Amb24460277 [0,2,0,0,0,0|1,0,0]=3 5450 B14R1.6049 Cc1cc(O)[n]cc1C[C@H](N)C(O)=O Amb24551041 [0,2,0,0,0,0|1,0,0]=3 5451 B14R1.6049 Cc1cc(O)c(C[C@H](N)C(O)=O)cc1 Amb25749763 [0,2,0,0,0,0|0,0,0]=2 5452 B14R1.6049 Cc1cc(O)ccc1CC(Cl)C(O)=O Amb25801019 [0,2,0,0,0,0|1,0,0]=3 5453 B14R1.6049 Cc1cc(O)ccc1NC(C)C(O)=O Amb24618078 [0,2,0,0,0,0|2,0,0]=4 5454 B14R1.6049 Cc1cc(O)ccc1OC(C)C(O)=O Amb24498332 [0,2,0,0,0,0|2,0,0]=4 5455 B14R1.6049 Cc1cc(S)ccc1OC(C)C(O)=O Amb18771867 [0,2,0,0,0,0|2,0,0]=4 5456 B14R1.6049 Cc1ccc(CC(Br)C(C)=O)c(Cl)c1 Amb25726037 [0,2,0,0,0,0|2,0,0]=4 5457 B14R1.6049 Cc1ccc(CC(Br)C(N)=O)c(F)c1 Amb25775764 [0,2,0,0,0,0|2,0,0]=4 5458 B14R1.6049 Cc1ccc(CC(Br)C(O)=O)c(C)c1 Amb23320605 [0,2,0,0,0,0|1,0,0]=3 5459 B14R1.6049 Cc1ccc(CC(C)C(C)=O)c(Cl)c1 Amb25131990 [0,2,0,0,0,0|2,0,0]=4 5460 B14R1.6049 Cc1ccc(CC(C)C(N)=O)c(C)c1 Amb25373951 [0,2,0,0,0,0|2,0,0]=4 5461 B14R1.6049 Cc1ccc(CC(C)C(O)=O)c(C)c1 Amb24498055 [0,2,0,0,0,0|1,0,0]=3 5462 B14R1.6049 Cc1ccc(CC(C)C(O)=O)c(Cl)c1 Amb25251901 [0,2,0,0,0,0|1,0,0]=3 5463 B14R1.6049 Cc1ccc(CC(Cl)C(N)=O)c(F)c1 Amb24530620 [0,2,0,0,0,0|2,0,0]=4 5464 B14R1.6049 Cc1ccc(CC(F)C(O)=O)c(Br)c1 Amb25352789 [0,2,0,0,0,0|1,0,0]=3 5465 B14R1.6049 Cc1ccc(CC(F)C(O)=O)c(C)c1 Amb25237498 [0,2,0,0,0,0|1,0,0]=3 5466 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(Br)c1 Amb24399395 [0,2,0,0,0,0|0,0,0]=2 5467 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(C)[n]1 Amb18814994 [0,2,0,0,0,0|1,0,0]=3 5468 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(Cl)c1 Amb25744040 [0,2,0,0,0,0|0,0,0]=2 5469 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(F)c1 Amb22043806 [0,2,0,0,0,0|0,0,0]=2 5470 B14R1.6049 Cc1ccc(C[C@@H](N)C(O)=O)c(Cl)c1 Amb24452116 [0,2,0,0,0,0|0,0,0]=2 5471 B14R1.6049 Cc1ccc(C[C@H](N)C(O)=O)c(Cl)[n]1 Amb25252950 [0,2,0,0,0,0|1,0,0]=3 5472 B14R1.6049 Cc1ccc(C[C@H](N)C(O)=O)c(Cl)c1 Amb25730036 [0,2,0,0,0,0|0,0,0]=2 5473 B14R1.6049 Cc1ccc(C[C@H](N)C(O)=O)c(F)c1 Amb24617556 [0,2,0,0,0,0|0,0,0]=2 5474 B14R1.6049 Cc1ccc(NC(C)C(O)=O)c(Cl)c1 Amb18981767 [0,2,0,0,0,0|2,0,0]=4 5475 B14R1.6049 Cc1ccc(NC(C)C(O)=O)c(F)c1 Amb18981766 [0,2,0,0,0,0|2,0,0]=4 5476 B14R1.6049 Cc1ccc(NC(C)C(O)=O)c(N)c1 Amb23114175 [0,2,0,0,0,0|2,0,0]=4 5477 B14R1.6049 Cc1ccc(OC(C)C(O)=O)c(Cl)c1 Amb19960766 [0,2,0,0,0,0|2,0,0]=4 5478 B14R1.6049 Cc1ccc(OC(C)C(O)=O)c(N)c1 Amb18999353 [0,2,0,0,0,0|2,0,0]=4 5479 B14R1.6049 Cc1ccc(O[C@@H](C)C(O)=O)c(Br)c1 Amb25092375 [0,2,0,0,0,0|2,0,0]=4 5480 B14R1.6049 Cc1ccc(O[C@@H](C)C(O)=O)c(C)c1 Amb25088382 [0,2,0,0,0,0|2,0,0]=4 5481 B14R1.6049 Cc1ccc(O[C@@H](C)C(O)=O)c(Cl)c1 Amb24437935 [0,2,0,0,0,0|2,0,0]=4 5482 B14R1.6049 Cc1ccc(O[C@H](C)C(O)=O)c(Cl)c1 Amb25715785 [0,2,0,0,0,0|2,0,0]=4 5483 B14R1.6049 Cc1ccc(SC(C)C(O)=O)c(N)c1 Amb18292852 [0,2,0,0,0,0|2,0,0]=4 5484 B14R1.6049 Cc1ccc(SC(F)C(O)=O)c(C)c1 Amb25362757 [0,2,0,0,0,0|2,0,0]=4 5485 B14R1.6049 Cc1ccc(SC(F)C(O)=O)c(N)c1 Amb25342755 [0,2,0,0,0,0|2,0,0]=4 5486 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)C(=O)O Amb1125553 [0,2,0,0,0,0|1,0,1]=4 5487 B14R1.6049 Clc1ccc(c(c1)Cl)CC(=O)C(=O)O Amb1139812 [0,2,0,0,0,0|1,0,1]=4 5488 B14R1.6049 Fc1ccc(c(c1)F)CC(=O)C(=O)O Amb1140150 [0,2,0,0,0,0|1,0,1]=4 5489 B14R1.6049 NC(=O)C(Br)Cc1ccc(Br)cc1Br Amb24700905 [0,2,0,0,0,0|2,0,0]=4 5490 B14R1.6049 NC(=O)C(Br)Cc1ccc(Br)cc1F Amb24348287 [0,2,0,0,0,0|2,0,0]=4 5491 B14R1.6049 NC(=O)C(Br)Cc1ccc(Cl)cc1Br Amb25251447 [0,2,0,0,0,0|2,0,0]=4 5492 B14R1.6049 NC(=O)C(Br)Cc1ccc(Cl)cc1Cl Amb24530462 [0,2,0,0,0,0|2,0,0]=4 5493 B14R1.6049 NC(=O)C(Br)Cc1ccc(Cl)cc1F Amb24438147 [0,2,0,0,0,0|2,0,0]=4 5494 B14R1.6049 NC(=O)C(Br)Cc1ccc(F)cc1Br Amb24701984 [0,2,0,0,0,0|2,0,0]=4 5495 B14R1.6049 NC(=O)C(Br)Cc1ccc(F)cc1F Amb25126209 [0,2,0,0,0,0|2,0,0]=4 5496 B14R1.6049 NC(=O)C(Br)Cc1ccc(F)cc1I Amb25330404 [0,2,0,0,0,0|2,0,0]=4 5497 B14R1.6049 NC(=O)C(Br)Cc1ccc(I)cc1Cl Amb24355768 [0,2,0,0,0,0|2,0,0]=4 5498 B14R1.6049 NC(=O)C(Cc1ccc(cc1Br)C)Cl Amb17204937 [0,2,0,0,0,0|2,0,0]=4 5499 B14R1.6049 NC(=O)C(Cc1ccc(cc1C)Br)Cl Amb17204938 [0,2,0,0,0,0|2,0,0]=4 5500 B14R1.6049 NC(=O)C(Cc1ccc(cc1C)C)Cl Amb17204434 [0,2,0,0,0,0|2,0,0]=4 5501 B14R1.6049 NC(=O)C(Cc1ccc(cc1C)Cl)Cl Amb17204560 [0,2,0,0,0,0|2,0,0]=4 5502 B14R1.6049 NC(=O)C(Cc1ccc(cc1Cl)Cl)Cl Amb17204750 [0,2,0,0,0,0|2,0,0]=4 5503 B14R1.6049 NC(=O)C(Cc1ccc(cc1F)F)Cl Amb17204497 [0,2,0,0,0,0|2,0,0]=4 5504 B14R1.6049 NC(=O)C(Cl)Cc1ccc(Br)cc1Br Amb24573722 [0,2,0,0,0,0|2,0,0]=4 5505 B14R1.6049 NC(=O)C(Cl)Cc1ccc(Cl)cc1Br Amb25037917 [0,2,0,0,0,0|2,0,0]=4 5506 B14R1.6049 NC(=O)C(Cl)Cc1ccc(Cl)cc1F Amb24413724 [0,2,0,0,0,0|2,0,0]=4 5507 B14R1.6049 NC(=O)C(Cl)Cc1ccc(I)cc1Cl Amb25776583 [0,2,0,0,0,0|2,0,0]=4 5508 B14R1.6049 NC(=O)C(N)Cc1ccc(Br)cc1Cl Amb25077849 [0,2,0,0,0,0|1,0,0]=3 5509 B14R1.6049 NC(=O)C(N)Cc1ccc(Cl)cc1F Amb24464861 [0,2,0,0,0,0|1,0,0]=3 5510 B14R1.6049 NC(=O)C(N)Cc1ccc(F)cc1Cl Amb25316319 [0,2,0,0,0,0|1,0,0]=3 5511 B14R1.6049 NC(=O)C(N)Cc1ccc(F)cc1F Amb25367009 [0,2,0,0,0,0|1,0,0]=3 5512 B14R1.6049 NC(=O)[C@@H](N)Cc1ccc(Br)cc1F Amb25712177 [0,2,0,0,0,0|1,0,0]=3 5513 B14R1.6049 NC(CN1C=CC(=O)NC1=O)C(O)=O Amb18652980 [0,2,0,0,0,0|2,0,0]=4 5514 B14R1.6049 NC(CN1C=CC(=O)NC1=O)C(O)=O Amb22587980 [0,2,0,0,0,0|2,0,0]=4 5515 B14R1.6049 NC(Cc1ccc(Br)[n]c1Br)C(O)=O Amb25696095 [0,2,0,0,0,0|1,0,0]=3 5516 B14R1.6049 NC(Cc1ccc(Br)cc1Br)C(O)=O Amb24454739 [0,2,0,0,0,0|0,0,0]=2 5517 B14R1.6049 NC(Cc1ccc(Cl)[n]c1Cl)C(O)=O Amb18135670 [0,2,0,0,0,0|1,0,0]=3 5518 B14R1.6049 NC(Cc1ccc(Cl)cc1Br)C(O)=O Amb25376983 [0,2,0,0,0,0|0,0,0]=2 5519 B14R1.6049 NC(Cc1ccc(Cl)cc1F)C(O)=O Amb22738201 [0,2,0,0,0,0|0,0,0]=2 5520 B14R1.6049 NC(Cc1ccc(Cl)cc1I)C(O)=O Amb25275250 [0,2,0,0,0,0|0,0,0]=2 5521 B14R1.6049 NC(Cc1ccc(Cl)cc1O)C(O)=O Amb25790444 [0,2,0,0,0,0|0,0,0]=2 5522 B14R1.6049 NC(Cc1ccc(F)cc1I)C(O)=O Amb24356682 [0,2,0,0,0,0|0,0,0]=2 5523 B14R1.6049 NC(Cc1ccc(I)cc1O)C(O)=O Amb25737858 [0,2,0,0,0,0|0,0,0]=2 5524 B14R1.6049 NC(Cc1ccc(O)cc1Br)C(O)=O Amb22749906 [0,2,0,0,0,0|0,0,0]=2 5525 B14R1.6049 NC1=NC(=O)NC=C1CC(N)C(O)=O Amb24398609 [0,2,0,0,0,0|2,0,0]=4 5526 B14R1.6049 NC=1NC(=O)C(CC(N)C(O)=O)=CN1 Amb25199976 [0,2,0,0,0,0|2,0,0]=4 5527 B14R1.6049 N[C@@H](CN1C=CC(=O)NC1=O)C(O)=O Amb19893387 [0,2,0,0,0,0|2,0,0]=4 5528 B14R1.6049 N[C@@H](Cc1[n]cc(Br)cc1Br)C(O)=O Amb24664142 [0,2,0,0,0,0|1,0,0]=3 5529 B14R1.6049 N[C@@H](Cc1[n]cc(Br)cc1F)C(O)=O Amb25669112 [0,2,0,0,0,0|1,0,0]=3 5530 B14R1.6049 N[C@@H](Cc1[n]cc(Cl)cc1Cl)C(O)=O Amb24756645 [0,2,0,0,0,0|1,0,0]=3 5531 B14R1.6049 N[C@@H](Cc1[n]cc(F)cc1F)C(O)=O Amb25193250 [0,2,0,0,0,0|1,0,0]=3 5532 B14R1.6049 N[C@@H](Cc1ccc(Br)[n]c1Br)C(O)=O Amb24427602 [0,2,0,0,0,0|1,0,0]=3 5533 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1Br)C(O)=O Amb24367958 [0,2,0,0,0,0|0,0,0]=2 5534 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1Cl)C(O)=O Amb25103196 [0,2,0,0,0,0|0,0,0]=2 5535 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1Br)C(O)=O Amb25124932 [0,2,0,0,0,0|0,0,0]=2 5536 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1F)C(O)=O Amb22752990 [0,2,0,0,0,0|0,0,0]=2 5537 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1O)C(O)=O Amb25165000 [0,2,0,0,0,0|0,0,0]=2 5538 B14R1.6049 N[C@@H](Cc1ccc(F)cc1Br)C(O)=O Amb25254735 [0,2,0,0,0,0|0,0,0]=2 5539 B14R1.6049 N[C@@H](Cc1ccc(F)cc1Cl)C(O)=O Amb25766645 [0,2,0,0,0,0|0,0,0]=2 5540 B14R1.6049 N[C@@H](Cc1ccc(F)cc1I)C(O)=O Amb25313302 [0,2,0,0,0,0|0,0,0]=2 5541 B14R1.6049 N[C@@H](Cc1ccc(F)cc1O)C(O)=O Amb25104765 [0,2,0,0,0,0|0,0,0]=2 5542 B14R1.6049 N[C@@H](Cc1ccc(I)cc1Cl)C(O)=O Amb24587175 [0,2,0,0,0,0|0,0,0]=2 5543 B14R1.6049 N[C@@H](Cc1ccc(I)cc1F)C(O)=O Amb25076319 [0,2,0,0,0,0|0,0,0]=2 5544 B14R1.6049 N[C@@H](Cc1ccc(I)cc1O)C(O)=O Amb24394391 [0,2,0,0,0,0|0,0,0]=2 5545 B14R1.6049 N[C@@H](Cc1ccc(O)cc1Br)C(O)=O Amb25222655 [0,2,0,0,0,0|0,0,0]=2 5546 B14R1.6049 N[C@@H](Cc1ccc(O)cc1Cl)C(O)=O Amb22746045 [0,2,0,0,0,0|0,0,0]=2 5547 B14R1.6049 N[C@@H](Cc1ccc(O)cc1I)C(O)=O Amb22228858 [0,2,0,0,0,0|0,0,0]=2 5548 B14R1.6049 N[C@@H](Cc1ccc(O)cc1O)C(O)=O Amb22228337 [0,2,0,0,0,0|0,0,0]=2 5549 B14R1.6049 N[C@@H](Cc1ccc(O)cc1O)C(O)=O Amb22755431 [0,2,0,0,0,0|0,0,0]=2 5550 B14R1.6049 N[C@H](CN1C=CC(=O)NC1=O)C(O)=O Amb25798898 [0,2,0,0,0,0|2,0,0]=4 5551 B14R1.6049 N[C@H](Cc1[n]cc(Br)cc1Cl)C(O)=O Amb25096378 [0,2,0,0,0,0|1,0,0]=3 5552 B14R1.6049 N[C@H](Cc1[n]cc(Cl)cc1Br)C(O)=O Amb24336232 [0,2,0,0,0,0|1,0,0]=3 5553 B14R1.6049 N[C@H](Cc1[n]cc(Cl)cc1Cl)C(O)=O Amb25312083 [0,2,0,0,0,0|1,0,0]=3 5554 B14R1.6049 N[C@H](Cc1ccc(Br)[n]c1Br)C(O)=O Amb24382088 [0,2,0,0,0,0|1,0,0]=3 5555 B14R1.6049 N[C@H](Cc1ccc(Br)cc1Br)C(O)=O Amb25676247 [0,2,0,0,0,0|0,0,0]=2 5556 B14R1.6049 N[C@H](Cc1ccc(Br)cc1O)C(O)=O Amb25798177 [0,2,0,0,0,0|0,0,0]=2 5557 B14R1.6049 N[C@H](Cc1ccc(Cl)[n]c1Cl)C(O)=O Amb24442864 [0,2,0,0,0,0|1,0,0]=3 5558 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1I)C(O)=O Amb24416902 [0,2,0,0,0,0|0,0,0]=2 5559 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1O)C(O)=O Amb25377140 [0,2,0,0,0,0|0,0,0]=2 5560 B14R1.6049 N[C@H](Cc1ccc(F)cc1Br)C(O)=O Amb25238670 [0,2,0,0,0,0|0,0,0]=2 5561 B14R1.6049 N[C@H](Cc1ccc(F)cc1O)C(O)=O Amb24655941 [0,2,0,0,0,0|0,0,0]=2 5562 B14R1.6049 N[C@H](Cc1ccc(I)cc1Cl)C(O)=O Amb25756677 [0,2,0,0,0,0|0,0,0]=2 5563 B14R1.6049 N[C@H](Cc1ccc(I)cc1O)C(O)=O Amb24729507 [0,2,0,0,0,0|0,0,0]=2 5564 B14R1.6049 N[C@H](Cc1ccc(O)cc1Br)C(O)=O Amb24703086 [0,2,0,0,0,0|0,0,0]=2 5565 B14R1.6049 N[C@H](Cc1ccc(O)cc1F)C(O)=O Amb25181843 [0,2,0,0,0,0|0,0,0]=2 5566 B14R1.6049 N[C@H](Cc1ccc(O)cc1O)C(O)=O Amb22228336 [0,2,0,0,0,0|0,0,0]=2 5567 B14R1.6049 Nc1cc(Br)ccc1CC(N)C(O)=O Amb24437621 [0,2,0,0,0,0|0,0,0]=2 5568 B14R1.6049 Nc1cc(Br)ccc1C[C@@H](N)C(O)=O Amb25748112 [0,2,0,0,0,0|0,0,0]=2 5569 B14R1.6049 Nc1cc(Br)ccc1C[C@H](N)C(O)=O Amb24391831 [0,2,0,0,0,0|0,0,0]=2 5570 B14R1.6049 Nc1cc(Br)ccc1SC(F)C(O)=O Amb25704793 [0,2,0,0,0,0|2,0,0]=4 5571 B14R1.6049 Nc1cc(Cl)c[n]c1CC(N)C(O)=O Amb24754099 [0,2,0,0,0,0|1,0,0]=3 5572 B14R1.6049 Nc1cc(Cl)ccc1CC(N)C(O)=O Amb18657750 [0,2,0,0,0,0|0,0,0]=2 5573 B14R1.6049 Nc1cc(Cl)ccc1C[C@H](N)C(O)=O Amb24662691 [0,2,0,0,0,0|0,0,0]=2 5574 B14R1.6049 Nc1cc(Cl)ccc1SC(F)C(O)=O Amb24360805 [0,2,0,0,0,0|2,0,0]=4 5575 B14R1.6049 Nc1cc(F)ccc1C[C@@H](N)C(O)=O Amb25088945 [0,2,0,0,0,0|0,0,0]=2 5576 B14R1.6049 Nc1cc(F)ccc1SC(F)C(O)=O Amb24360050 [0,2,0,0,0,0|2,0,0]=4 5577 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(Cl)c1 Amb24597038 [0,2,0,0,0,0|0,0,0]=2 5578 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(F)c1 Amb25276148 [0,2,0,0,0,0|0,0,0]=2 5579 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(O)c1 Amb24392157 [0,2,0,0,0,0|0,0,0]=2 5580 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(Br)c1 Amb24591786 [0,2,0,0,0,0|0,0,0]=2 5581 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(Cl)c1 Amb25364211 [0,2,0,0,0,0|0,0,0]=2 5582 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(F)c1 Amb24498927 [0,2,0,0,0,0|0,0,0]=2 5583 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(O)c1 Amb25278467 [0,2,0,0,0,0|0,0,0]=2 5584 B14R1.6049 Nc1ccc(SC(F)C(O)=O)c(Br)c1 Amb25054402 [0,2,0,0,0,0|2,0,0]=4 5585 B14R1.6049 OC(=O)C(=O)Cc1ccc(Br)cc1Cl Amb25823249 [0,2,0,0,0,0|1,0,1]=4 5586 B14R1.6049 OC(=O)C(=O)Cc1ccc(Cl)cc1Br Amb25165671 [0,2,0,0,0,0|1,0,1]=4 5587 B14R1.6049 OC(=O)C(=O)Cc1ccc(Cl)cc1F Amb25167113 [0,2,0,0,0,0|1,0,1]=4 5588 B14R1.6049 OC(=O)C(Br)Cc1ccc(F)cc1F Amb25754333 [0,2,0,0,0,0|1,0,0]=3 5589 B14R1.6049 OC(=O)C(Cc1ccc(cc1Br)C)Cl Amb17204948 [0,2,0,0,0,0|1,0,0]=3 5590 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)Br)Cl Amb17204949 [0,2,0,0,0,0|1,0,0]=3 5591 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)C)Cl Amb17204440 [0,2,0,0,0,0|1,0,0]=3 5592 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)Cl)Cl Amb17204587 [0,2,0,0,0,0|1,0,0]=3 5593 B14R1.6049 OC(=O)C(Cc1ccc(cc1Cl)Cl)Br Amb10597007 [0,2,0,0,0,0|1,0,0]=3 5594 B14R1.6049 OC(=O)C(Cc1ccc(cc1Cl)Cl)C Amb17605799 [0,2,0,0,0,0|1,0,0]=3 5595 B14R1.6049 OC(=O)C(Cc1ccc(cc1F)F)C Amb17605827 [0,2,0,0,0,0|1,0,0]=3 5596 B14R1.6049 OC(=O)C(Cc1ccc(cc1F)F)Cl Amb17204500 [0,2,0,0,0,0|1,0,0]=3 5597 B14R1.6049 OC(=O)C(Cc1ccc(cc1N)O)N Amb16767184 [0,2,0,0,0,0|0,0,0]=2 5598 B14R1.6049 OC(=O)C(Cc1cnc(nc1N)C)N Amb10573285 [0,2,0,0,0,0|2,0,0]=4 5599 B14R1.6049 OC(=O)C(F)Cc1ccc(Cl)cc1F Amb24717270 [0,2,0,0,0,0|1,0,0]=3 5600 B14R1.6049 OC(=O)C(F)Cc1ccc(F)cc1Cl Amb25213697 [0,2,0,0,0,0|1,0,0]=3 5601 B14R1.6049 OC(=O)C(F)Cc1ccc(F)cc1F Amb25165244 [0,2,0,0,0,0|1,0,0]=3 5602 B14R1.6049 OC(=O)C(F)Oc1ccc(Cl)cc1Br Amb25361637 [0,2,0,0,0,0|2,0,0]=4 5603 B14R1.6049 OC(=O)C(F)Oc1ccc(Cl)cc1F Amb25041406 [0,2,0,0,0,0|2,0,0]=4 5604 B14R1.6049 OC(=O)C(F)Oc1ccc(F)cc1Br Amb25100759 [0,2,0,0,0,0|2,0,0]=4 5605 B14R1.6049 OC(=O)C(F)Oc1ccc(F)cc1Cl Amb24669679 [0,2,0,0,0,0|2,0,0]=4 5606 B14R1.6049 OC(=O)C(Nc1ccc(cc1C)Br)C Amb17415254 [0,2,0,0,0,0|2,0,0]=4 5607 B14R1.6049 OC(=O)C(Nc1ccc(cc1C)Cl)C Amb17404301 [0,2,0,0,0,0|2,0,0]=4 5608 B14R1.6049 OC(=O)C(Nc1ccc(cc1F)F)C Amb17402393 [0,2,0,0,0,0|2,0,0]=4 5609 B14R1.6049 OC(=O)C(O)Cc1ccc(Br)cc1F Amb24389246 [0,2,0,0,0,0|1,0,0]=3 5610 B14R1.6049 OC(=O)C(Oc1ccc(cc1Br)Br)C Amb1114877 [0,2,0,0,0,0|2,0,0]=4 5611 B14R1.6049 OC(=O)C(Oc1ccc(cc1Br)C)C Amb1109789 [0,2,0,0,0,0|2,0,0]=4 5612 B14R1.6049 OC(=O)C(Oc1ccc(cc1Br)F)C Amb1140649 [0,2,0,0,0,0|2,0,0]=4 5613 B14R1.6049 OC(=O)C(Oc1ccc(cc1C)Cl)C Amb1885033 [0,2,0,0,0,0|2,0,0]=4 5614 B14R1.6049 OC(=O)C(Oc1ccc(cc1F)Br)C Amb1109857 [0,2,0,0,0,0|2,0,0]=4 5615 B14R1.6049 OC(=O)C(Oc1ccc(cc1F)F)C Amb1127912 [0,2,0,0,0,0|2,0,0]=4 5616 B14R1.6049 OC(=O)C(Sc1ccc(cc1C)C)C Amb1118227 [0,2,0,0,0,0|2,0,0]=4 5617 B14R1.6049 OC(=O)C(Sc1ccc(cc1C)F)C Amb17083278 [0,2,0,0,0,0|2,0,0]=4 5618 B14R1.6049 OC(=O)C(Sc1ccc(cc1F)F)C Amb1119963 [0,2,0,0,0,0|2,0,0]=4 5619 B14R1.6049 OC(=O)[C@@H](Cc1ccc(cc1F)F)N Amb16231883 [0,2,0,0,0,0|0,0,0]=2 5620 B14R1.6049 OC(=O)[C@H](Cc1ccc(cc1F)O)N Amb10845772 [0,2,0,0,0,0|0,0,0]=2 5621 B14R1.7626 CC(Br)(Cc1ccc(Cl)cc1)C(O)=O Amb24507517 [0,2,0,0,0,0|1,0,0]=3 5622 B14R1.7626 CC(C)(CN1C=CC(=O)C=C1)C(O)=O Amb18534865 [0,2,0,0,0,0|2,0,0]=4 5623 B14R1.7626 CC(C)(Cc1ccc(Cl)[n]c1)C(O)=O Amb25715569 [0,2,0,0,0,0|2,0,0]=4 5624 B14R1.7626 CC(C)(Cc1ccc(Cl)cc1)C(=O)Cl Amb25850029 [0,2,0,0,0,0|2,0,0]=4 5625 B14R1.7626 CC(C)(Oc1ccc(O)cc1)C(O)=O Amb18652342 [0,2,0,0,0,0|2,0,0]=4 5626 B14R1.7626 CC(C)(Sc1ccc(F)cc1)C(O)=O Amb18976769 [0,2,0,0,0,0|2,0,0]=4 5627 B14R1.7626 CC(C)(Sc1ccc(N)cc1)C(O)=O Amb18976876 [0,2,0,0,0,0|2,0,0]=4 5628 B14R1.7626 CC(Cl)(Cc1ccc(Cl)cc1)C(O)=O Amb24644127 [0,2,0,0,0,0|1,0,0]=3 5629 B14R1.7626 CC(F)(Cc1ccc(F)cc1)C(O)=O Amb24747199 [0,2,0,0,0,0|1,0,0]=3 5630 B14R1.7626 CC(N)(Cc1ccc(Br)[n]c1)C(O)=O Amb25202712 [0,2,0,0,0,0|1,0,0]=3 5631 B14R1.7626 CC(N)(Cc1ccc(Br)c[n]1)C(O)=O Amb25842453 [0,2,0,0,0,0|1,0,0]=3 5632 B14R1.7626 CC(N)(Cc1ccc(Br)cc1)C(N)=O Amb25764964 [0,2,0,0,0,0|1,0,0]=3 5633 B14R1.7626 CC(N)(Cc1ccc(Cl)[n]c1)C(O)=O Amb18657756 [0,2,0,0,0,0|1,0,0]=3 5634 B14R1.7626 CC(N)(Cc1ccc(F)c[n]1)C(O)=O Amb25747967 [0,2,0,0,0,0|1,0,0]=3 5635 B14R1.7626 CC(N)(Cc1ccc(N)cc1)C(O)=O Amb24618145 [0,2,0,0,0,0|0,0,0]=2 5636 B14R1.7626 CC(N)(Cc1ccc(O)[n]c1)C(O)=O Amb18652390 [0,2,0,0,0,0|1,0,0]=3 5637 B14R1.7626 CC(N)(Cc1ccc(O)c[n]1)C(O)=O Amb25352442 [0,2,0,0,0,0|1,0,0]=3 5638 B14R1.7626 CC(N)(Cc1ccc(S)cc1)C(O)=O Amb25365035 [0,2,0,0,0,0|0,0,0]=2 5639 B14R1.7626 CC(O)(Cc1ccc(Br)cc1)C(N)=O Amb25829210 [0,2,0,0,0,0|2,0,0]=4 5640 B14R1.7626 CC(O)(Cc1ccc(Br)cc1)C(O)=O Amb25327444 [0,2,0,0,0,0|1,0,0]=3 5641 B14R1.7626 CC(O)(Cc1ccc(Cl)cc1)C(O)=O Amb25104269 [0,2,0,0,0,0|1,0,0]=3 5642 B14R1.7626 C[C@@](N)(Cc1ccc(Cl)cc1)C(O)=O Amb24468309 [0,2,0,0,0,0|0,0,0]=2 5643 B14R1.7626 C[C@@](N)(Cc1ccc(F)cc1)C(O)=O Amb22745963 [0,2,0,0,0,0|0,0,0]=2 5644 B14R1.7626 C[C@@](N)(Cc1ccc(S)cc1)C(O)=O Amb25364941 [0,2,0,0,0,0|0,0,0]=2 5645 B14R1.7626 C[C@](N)(Cc1ccc(F)cc1)C(O)=O Amb25077186 [0,2,0,0,0,0|0,0,0]=2 5646 B14R1.7626 C[C@](N)(Cc1ccc(N)cc1)C(O)=O Amb24761343 [0,2,0,0,0,0|0,0,0]=2 5647 B14R1.7626 C[C@](N)(Cc1ccc(S)cc1)C(O)=O Amb24720142 [0,2,0,0,0,0|0,0,0]=2 5648 B14R1.7626 C[C@](O)(Cc1ccc(Br)cc1)C(O)=O Amb25095876 [0,2,0,0,0,0|1,0,0]=3 5649 B14R1.7626 C[C@](O)(Cc1ccc(Cl)cc1)C(O)=O Amb25106563 [0,2,0,0,0,0|1,0,0]=3 5650 B14R1.7626 Cc1ccc(CC(C)(Br)C(O)=O)cc1 Amb25852765 [0,2,0,0,0,0|1,0,0]=3 5651 B14R1.7626 Cc1ccc(CC(C)(C)C(N)=O)cc1 Amb22549662 [0,2,0,0,0,0|2,0,0]=4 5652 B14R1.7626 Cc1ccc(CC(C)(Cl)C(O)=O)cc1 Amb25783790 [0,2,0,0,0,0|1,0,0]=3 5653 B14R1.7626 Cc1ccc(CC(C)(N)C(O)=O)[n]c1 Amb24531813 [0,2,0,0,0,0|1,0,0]=3 5654 B14R1.7626 Cc1ccc(CC(C)(N)C(O)=O)c[n]1 Amb25812618 [0,2,0,0,0,0|1,0,0]=3 5655 B14R1.7626 Cc1ccc(CC(C)(O)C(O)=O)cc1 Amb25779395 [0,2,0,0,0,0|1,0,0]=3 5656 B14R1.7626 Cc1ccc(C[C@](C)(N)C(O)=O)cc1 Amb25809391 [0,2,0,0,0,0|0,0,0]=2 5657 B14R1.7626 Cc1ccc(cc1)SC(F)(F)C(O)=O Amb23538488 [0,2,0,0,0,0|2,0,0]=4 5658 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Br)(C)C Amb17265524 [0,2,0,0,0,0|1,0,0]=3 5659 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Br)(N)C Amb17266143 [0,2,0,0,0,0|0,0,0]=2 5660 B14R1.7626 OC(=O)C(Cc1ccc(cc1)C)(C)C Amb17235388 [0,2,0,0,0,0|1,0,0]=3 5661 B14R1.7626 OC(=O)C(Cc1ccc(cc1)C)(N)C Amb17235616 [0,2,0,0,0,0|0,0,0]=2 5662 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Cl)(C)C Amb17241249 [0,2,0,0,0,0|1,0,0]=3 5663 B14R1.7626 OC(=O)C(Cc1ccc(cc1)F)(C)C Amb17236376 [0,2,0,0,0,0|1,0,0]=3 5664 B14R1.7626 OC(=O)C(Cc1ccc(cc1)F)(N)C Amb17236544 [0,2,0,0,0,0|0,0,0]=2 5665 B14R1.7626 OC(=O)C(Cc1ccc(cc1)S)(C)C Amb17613333 [0,2,0,0,0,0|1,0,0]=3 5666 B14R1.7626 OC(=O)C(F)(F)Cc1ccc(Br)cc1 Amb25313273 [0,2,0,0,0,0|1,0,0]=3 5667 B14R1.7626 OC(=O)C(F)(F)Cc1ccc(F)cc1 Amb25747554 [0,2,0,0,0,0|1,0,0]=3 5668 B14R1.7626 OC(=O)C(F)(F)Sc1ccc(Br)cc1 Amb25144915 [0,2,0,0,0,0|2,0,0]=4 5669 B14R1.7626 OC(=O)C(F)(F)Sc1ccc(Cl)cc1 Amb23538494 [0,2,0,0,0,0|2,0,0]=4 5670 B14R1.7626 OC(=O)[C@@](Cc1ccc(cc1)I)(N)C Amb16183900 [0,2,0,0,0,0|0,0,0]=2 5671 B14R1.7626 OC(=O)[C@](Cc1ccc(cc1)Br)(N)C Amb16183906 [0,2,0,0,0,0|0,0,0]=2 5672 B14R1.7626 OC(=O)[C@](Cc1ccc(cc1)I)(N)C Amb16183907 [0,2,0,0,0,0|0,0,0]=2 5673 B14R1.7626 Oc1ccc(cc1)CC(C(=O)O)(N)C Amb1917483 [0,2,0,0,0,0|0,0,0]=2 5674 B14R1.60 CCNC(=O)C(N)Cc1ccccc1 Amb21958668 [0,2,0,0,0,0|1,0,0]=3 5675 B14R1.60 CCNC(=O)[C@H](Cc1ccccc1)N Amb17235472 [0,2,0,0,0,0|1,0,0]=3 5676 B14R1.60 CCOC(=O)C(C)Nc1ccccc1 Amb19051002 [0,2,0,0,0,0|2,0,0]=4 5677 B14R1.60 CCOC(=O)C(C[n+]1ccccc1)Br Amb1030020 [0,2,0,0,0,0|2,0,0]=4 5678 B14R1.60 CCOC(=O)C(Cl)Cc1ccccc1 Amb24066460 [0,2,0,0,0,0|1,0,0]=3 5679 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 Amb17940943 [0,2,0,0,0,0|2,0,0]=4 5680 B14R1.60 CCOC(=O)C(N)Cc1cc[n]cc1 Amb20622578 [0,2,0,0,0,0|1,0,0]=3 5681 B14R1.60 CCOC(=O)C(N)Cc1cccc[n]1 Amb22498620 [0,2,0,0,0,0|1,0,0]=3 5682 B14R1.60 CCOC(=O)C(N)Cc1cccc[n]1 Amb22755784 [0,2,0,0,0,0|1,0,0]=3 5683 B14R1.60 CCOC(=O)C(N)Sc1ccccc1 Amb24066449 [0,2,0,0,0,0|1,0,0]=3 5684 B14R1.60 CCOC(=O)C(O)Cc1ccccc1 Amb19079971 [0,2,0,0,0,0|1,0,0]=3 5685 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb19889827 [0,2,0,0,0,0|0,0,0]=2 5686 B14R1.60 CN(Cc1ccccc1)C(=O)OCCl Amb24371177 [0,2,0,0,0,0|2,0,0]=4 5687 B14R1.60 CONC(=O)C(C)Sc1ccccc1 Amb20813816 [0,2,0,0,0,0|2,0,0]=4 5688 B14R1.60 N#CNC(=O)C(O)Cc1ccccc1 Amb25309649 [0,2,0,0,0,0|2,0,0]=4 5689 B14R1.60 OCCC(=O)N(Cc1ccccc1)C Amb17336607 [0,2,0,0,0,0|2,0,0]=4 5690 B14R1.85 CC(C(Cl)C(=O)OC)c1ccccc1 Amb22059076 [0,2,0,0,0,0|1,0,0]=3 5691 B14R1.85 CC(C(N)C(=O)OC)c1ccccc1 Amb19013065 [0,2,0,0,0,0|0,0,0]=2 5692 B14R1.85 CC(C(N)c1ccccc1)C(=O)C#C Amb25131565 [0,2,0,0,0,0|2,0,0]=4 5693 B14R1.85 CC(C(N)c1ccccc1)C(=O)NO Amb24369091 [0,2,0,0,0,0|1,0,0]=3 5694 B14R1.85 CC(C(N)c1ccccc1)C(=O)OC Amb20623659 [0,2,0,0,0,0|1,0,0]=3 5695 B14R1.85 CC(C(O)c1ccccc1)C(=O)NC Amb25166106 [0,2,0,0,0,0|2,0,0]=4 5696 B14R1.85 CNC(=O)C(Cl)C(O)c1ccccc1 Amb25790564 [0,2,0,0,0,0|2,0,0]=4 5697 B14R1.85 CNC(=O)C(N)C(F)c1ccccc1 Amb24757801 [0,2,0,0,0,0|1,0,0]=3 5698 B14R1.85 CNC(=O)C(O)C(O)c1ccccc1 Amb25035731 [0,2,0,0,0,0|2,0,0]=4 5699 B14R1.85 CNC(=O)[C@@H](N)[C@H](F)c1ccccc1 Amb25738665 [0,2,0,0,0,0|1,0,0]=3 5700 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccc1 Amb18866388 [0,2,0,0,0,0|1,0,1]=4 5701 B14R1.85 COC(=O)C(=O)C(c1ccccc1)C Amb17139343 [0,2,0,0,0,0|1,0,1]=4 5702 B14R1.85 COC(=O)C(C(=O)c1ccccc1)C Amb10553472 [0,2,0,0,0,0|1,0,1]=4 5703 B14R1.85 COC(=O)C(Cl)C(=O)c1ccccc1 Amb18866389 [0,2,0,0,0,0|1,0,1]=4 5704 B14R1.85 COC(=O)C(N)C(=O)c1ccccc1 Amb22325263 [0,2,0,0,0,0|0,0,1]=3 5705 B14R1.85 COC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb23439859 [0,2,0,0,0,0|1,0,0]=3 5706 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb17844463 [0,2,0,0,0,0|1,0,0]=3 5707 B14R1.85 COC(=O)[C@@H](O)[C@H](N)c1ccccc1 Amb22744727 [0,2,0,0,0,0|1,0,0]=3 5708 B14R1.85 COC(=O)[C@@H](O)[C@H](O)c1ccccc1 Amb22336526 [0,2,0,0,0,0|1,0,0]=3 5709 B14R1.85 COC(=O)[C@@H]([C@H](c1ccccc1)N)O Amb10603125 [0,2,0,0,0,0|1,0,0]=3 5710 B14R1.85 COC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb22230835 [0,2,0,0,0,0|1,0,0]=3 5711 B14R1.85 C[C@H]([C@@H](O)c1ccccc1)C(=O)NN Amb24733322 [0,2,0,0,0,0|2,0,0]=4 5712 B14R1.85 NC(C(O)c1ccccc1)C(=O)NN Amb25799623 [0,2,0,0,0,0|1,0,0]=3 5713 B14R1.85 NC(C(O)c1ccccc1)C(=O)NO Amb25362212 [0,2,0,0,0,0|0,0,0]=2 5714 B14R1.85 NNC(=O)C(Cl)C(O)c1ccccc1 Amb24394365 [0,2,0,0,0,0|2,0,0]=4 5715 B14R1.85 N[C@H]([C@@H](O)c1ccccc1)C(=O)NN Amb24634184 [0,2,0,0,0,0|1,0,0]=3 5716 B14R1.85 OCC(=O)N(C(c1ccccc1)C)C Amb1109670 [0,2,0,0,0,0|2,0,0]=4 5717 B14R1.135 CCC(=O)C(Cc1cccc(c1)Br)C Amb17264256 [0,2,0,0,0,0|2,0,0]=4 5718 B14R1.135 CCC(=O)C(Cc1cccc(c1)C)C Amb17234959 [0,2,0,0,0,0|2,0,0]=4 5719 B14R1.135 CCC(=O)C(Cc1cccc(c1)Cl)C Amb17240772 [0,2,0,0,0,0|2,0,0]=4 5720 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)Br Amb17162560 [0,2,0,0,0,0|1,0,1]=4 5721 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)C Amb17139341 [0,2,0,0,0,0|1,0,1]=4 5722 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)Cl Amb17140709 [0,2,0,0,0,0|1,0,1]=4 5723 B14R1.135 COC(=O)C(C)Nc1cccc(Cl)c1 Amb18307968 [0,2,0,0,0,0|2,0,0]=4 5724 B14R1.135 COC(=O)C(C)Nc1cccc(F)c1 Amb19018826 [0,2,0,0,0,0|2,0,0]=4 5725 B14R1.135 COC(=O)C(C)Nc1cccc(N)c1 Amb19017409 [0,2,0,0,0,0|2,0,0]=4 5726 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)Cl Amb17204953 [0,2,0,0,0,0|1,0,0]=3 5727 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)N Amb17415246 [0,2,0,0,0,0|0,0,0]=2 5728 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)O Amb17163099 [0,2,0,0,0,0|1,0,0]=3 5729 B14R1.135 COC(=O)C(Cc1cccc(c1)C)Cl Amb17204447 [0,2,0,0,0,0|1,0,0]=3 5730 B14R1.135 COC(=O)C(Cc1cccc(c1)C)N Amb17401771 [0,2,0,0,0,0|0,0,0]=2 5731 B14R1.135 COC(=O)C(Cc1cccc(c1)C)O Amb17139449 [0,2,0,0,0,0|1,0,0]=3 5732 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204592 [0,2,0,0,0,0|1,0,0]=3 5733 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)N Amb17404295 [0,2,0,0,0,0|0,0,0]=2 5734 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)O Amb17140887 [0,2,0,0,0,0|1,0,0]=3 5735 B14R1.135 COC(=O)C(Cc1cccc(c1)F)Br Amb17357773 [0,2,0,0,0,0|1,0,0]=3 5736 B14R1.135 COC(=O)C(Cc1cccc(c1)F)Cl Amb17204464 [0,2,0,0,0,0|1,0,0]=3 5737 B14R1.135 COC(=O)C(Cc1cccc(c1)O)N Amb17621158 [0,2,0,0,0,0|0,0,0]=2 5738 B14R1.135 COC(=O)C(Oc1cccc(c1)N)C Amb17110000 [0,2,0,0,0,0|2,0,0]=4 5739 B14R1.135 COC(=O)[C@@H](N)Cc1cccc(O)c1 Amb22746779 [0,2,0,0,0,0|0,0,0]=2 5740 B14R1.135 Cc1cc(C[C@H](N)C(=O)NO)ccc1 Amb24444731 [0,2,0,0,0,0|0,0,0]=2 5741 B14R1.135 Cc1cc(ccc1)OC(C)C(=O)OC Amb19079942 [0,2,0,0,0,0|2,0,0]=4 5742 B14R1.135 OCC(=O)N(Cc1cccc(c1)Br)C Amb17415248 [0,2,0,0,0,0|2,0,0]=4 5743 B14R1.135 OCC(=O)N(Cc1cccc(c1)C)C Amb17401773 [0,2,0,0,0,0|2,0,0]=4 5744 B14R1.1007 CCC(=O)C(Cc1ccccc1C)C Amb17234957 [0,2,0,0,0,0|2,0,0]=4 5745 B14R1.1007 CCC(=O)C(Cc1ccccc1Cl)C Amb17240770 [0,2,0,0,0,0|2,0,0]=4 5746 B14R1.1007 CCC(=O)C(Cc1ccccc1F)C Amb17235956 [0,2,0,0,0,0|2,0,0]=4 5747 B14R1.1007 COC(=O)C(=O)Cc1ccccc1C Amb17139340 [0,2,0,0,0,0|1,0,1]=4 5748 B14R1.1007 COC(=O)C(=O)Cc1ccccc1Cl Amb17140708 [0,2,0,0,0,0|1,0,1]=4 5749 B14R1.1007 COC(=O)C(=O)Cc1ccccc1F Amb17139584 [0,2,0,0,0,0|1,0,1]=4 5750 B14R1.1007 COC(=O)C(C)Nc1ccccc1Cl Amb19018595 [0,2,0,0,0,0|2,0,0]=4 5751 B14R1.1007 COC(=O)C(C)Nc1ccccc1F Amb19018598 [0,2,0,0,0,0|2,0,0]=4 5752 B14R1.1007 COC(=O)C(C)Nc1ccccc1N Amb19051593 [0,2,0,0,0,0|2,0,0]=4 5753 B14R1.1007 COC(=O)C(C)Nc1ccccc1O Amb24336771 [0,2,0,0,0,0|2,0,0]=4 5754 B14R1.1007 COC(=O)C(Cc1ccccc1Br)Cl Amb17204952 [0,2,0,0,0,0|1,0,0]=3 5755 B14R1.1007 COC(=O)C(Cc1ccccc1C)Br Amb17355935 [0,2,0,0,0,0|1,0,0]=3 5756 B14R1.1007 COC(=O)C(Cc1ccccc1C)Cl Amb17204446 [0,2,0,0,0,0|1,0,0]=3 5757 B14R1.1007 COC(=O)C(Cc1ccccc1C)N Amb17401769 [0,2,0,0,0,0|0,0,0]=2 5758 B14R1.1007 COC(=O)C(Cc1ccccc1C)O Amb17139448 [0,2,0,0,0,0|1,0,0]=3 5759 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)Cl Amb17204591 [0,2,0,0,0,0|1,0,0]=3 5760 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)N Amb17404292 [0,2,0,0,0,0|0,0,0]=2 5761 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)O Amb17140886 [0,2,0,0,0,0|1,0,0]=3 5762 B14R1.1007 COC(=O)C(Cc1ccccc1F)Br Amb17357772 [0,2,0,0,0,0|1,0,0]=3 5763 B14R1.1007 COC(=O)C(Cc1ccccc1F)Cl Amb17204462 [0,2,0,0,0,0|1,0,0]=3 5764 B14R1.1007 COC(=O)C(Cc1ccccc1F)N Amb17402181 [0,2,0,0,0,0|0,0,0]=2 5765 B14R1.1007 COC(=O)C(Cc1ccccc1F)O Amb17139693 [0,2,0,0,0,0|1,0,0]=3 5766 B14R1.1007 COC(=O)C(Oc1ccccc1N)C Amb17110001 [0,2,0,0,0,0|2,0,0]=4 5767 B14R1.1007 Cc1ccccc1NC(C)C(=O)OC Amb19018596 [0,2,0,0,0,0|2,0,0]=4 5768 B14R1.1007 NNC(=O)C(Cc1ccccc1Cl)S Amb1766077 [0,2,0,0,0,0|2,0,0]=4 5769 B14R1.1007 OCC(=O)N(Cc1ccccc1Br)C Amb1110503 [0,2,0,0,0,0|2,0,0]=4 5770 B14R1.1007 OCC(=O)N(Cc1ccccc1C)C Amb1109921 [0,2,0,0,0,0|2,0,0]=4 5771 B14R1.1007 OCC(=O)N(Cc1ccccc1Cl)C Amb17404294 [0,2,0,0,0,0|2,0,0]=4 5772 B14R1.1031 CCC(Nc1ccccc1)C(=O)OC Amb19050998 [0,2,0,0,0,0|2,0,0]=4 5773 B14R1.1031 CCN(Cc1ccccc1)C(=O)OC Amb24448645 [0,2,0,0,0,0|2,0,0]=4 5774 B14R1.1031 CNC(=O)C(Cc1ccccc1)C#N Amb19077180 [0,2,0,0,0,0|1,0,1]=4 5775 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb22463164 [0,2,0,0,0,0|0,0,0]=2 5776 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb22745351 [0,2,0,0,0,0|0,0,0]=2 5777 B14R1.1031 COC(=O)C(C#N)Nc1ccccc1 Amb25223076 [0,2,0,0,0,0|1,0,1]=4 5778 B14R1.1031 COC(=O)C(CN)Cc1cc[n]cc1 Amb19514908 [0,2,0,0,0,0|1,0,0]=3 5779 B14R1.1031 COC(=O)C(Cc1ccccc1)C#N Amb17336069 [0,2,0,0,0,0|0,0,1]=3 5780 B14R1.1031 COC(=O)C(Cc1ccccc1)OC Amb22499910 [0,2,0,0,0,0|1,0,0]=3 5781 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)OC Amb22747354 [0,2,0,0,0,0|1,0,0]=3 5782 B14R1.1031 COC(=O)\C(\CN)=C\c1ccccc1 Amb18650860 [0,2,0,0,0,0|0,0,2]=4 5783 B14R1.1031 NNC(=O)C(Cc1ccccc1)C#N Amb19748596 [0,2,0,0,0,0|1,0,1]=4 5784 B14R1.1031 NNC(=O)\C(\Cc1ccccc1)=N\N Amb25291010 [0,2,0,0,0,0|1,0,1]=4 5785 B14R1.1031 N\C(=N/O)\C(Cc1ccccc1)C#N Amb25825112 [0,2,0,0,0,0|1,0,1]=4 5786 B14R1.1031 OCC(C(=O)OC)Cc1ccccc1 Amb10608962 [0,2,0,0,0,0|1,0,0]=3 5787 B14R1.1107 CC(C)(Cc1ccccc1)C(=O)NN Amb24423490 [0,2,0,0,0,0|2,0,0]=4 5788 B14R1.1107 CC(C)(Nc1ccccc1)C(=O)OC Amb18304726 [0,2,0,0,0,0|2,0,0]=4 5789 B14R1.1107 CC(N)(Cc1ccccc1)C(=O)NC Amb18651311 [0,2,0,0,0,0|1,0,0]=3 5790 B14R1.1107 CNC(=O)C(Cc1ccccc1)(C)C Amb16943079 [0,2,0,0,0,0|2,0,0]=4 5791 B14R1.1107 COC(=O)C(C)(C)Cc1ccccc1 Amb17844108 [0,2,0,0,0,0|1,0,0]=3 5792 B14R1.1107 COC(=O)C(Cc1ccccc1)(N)C Amb17401738 [0,2,0,0,0,0|0,0,0]=2 5793 B14R1.1107 COC(=O)C(Cc1ccccn1)(N)C Amb17401871 [0,2,0,0,0,0|1,0,0]=3 5794 B14R1.1107 COC(=O)C(Cc1cccnc1)(N)C Amb17401875 [0,2,0,0,0,0|1,0,0]=3 5795 B14R1.1107 COC(=O)C(Cc1ccncc1)(N)C Amb17401880 [0,2,0,0,0,0|1,0,0]=3 5796 B14R1.1107 COC(=O)C(Oc1ccccc1)(C)C Amb17401865 [0,2,0,0,0,0|2,0,0]=4 5797 B14R1.1107 C[C@@](N)(Cc1ccccc1)C(=O)NC Amb24382473 [0,2,0,0,0,0|1,0,0]=3 5798 B14R1.1107 C[C@](N)(Cc1ccccc1)C(=O)NC Amb25164421 [0,2,0,0,0,0|1,0,0]=3 5799 B14R1.75 C#Cc1cccc(CC(N)C(N)=O)c1 Amb24672706 [0,2,0,0,0,0|1,0,0]=3 5800 B14R1.75 C#Cc1cccc(C[C@@H](N)C(N)=O)c1 Amb25198579 [0,2,0,0,0,0|1,0,0]=3 5801 B14R1.75 C#Cc1cccc(C[C@@H](N)C(O)=O)c1 Amb25313172 [0,2,0,0,0,0|0,0,0]=2 5802 B14R1.75 CC(Nc1cc(ccc1)C#C)C(O)=O Amb18999355 [0,2,0,0,0,0|2,0,0]=4 5803 B14R1.75 CC(Nc1cc(ccc1)C#N)C(O)=O Amb18999359 [0,2,0,0,0,0|2,0,0]=4 5804 B14R1.75 CC(Oc1cccc(CO)c1)C(O)=O Amb19064505 [0,2,0,0,0,0|2,0,0]=4 5805 B14R1.75 CC(Oc1cccc(CS)c1)C(O)=O Amb24080863 [0,2,0,0,0,0|2,0,0]=4 5806 B14R1.75 CCc1cc(ccc1)NC(C)C(O)=O Amb18315702 [0,2,0,0,0,0|2,0,0]=4 5807 B14R1.75 CCc1cccc(c1)OC(C(=O)O)C Amb1110108 [0,2,0,0,0,0|2,0,0]=4 5808 B14R1.75 COc1cc(\C=C(\N)/C(O)=O)ccc1 Amb25341647 [0,2,0,0,0,0|0,0,2]=4 5809 B14R1.75 COc1cccc(CC(Br)C(O)=O)c1 Amb23320637 [0,2,0,0,0,0|1,0,0]=3 5810 B14R1.75 COc1cccc(c1)CC(=O)C(=O)O Amb1129281 [0,2,0,0,0,0|1,0,1]=4 5811 B14R1.75 COc1cccc(c1)CC(C(=O)C)C Amb17235391 [0,2,0,0,0,0|2,0,0]=4 5812 B14R1.75 COc1cccc(c1)CC(C(=O)C)Cl Amb17204449 [0,2,0,0,0,0|2,0,0]=4 5813 B14R1.75 COc1cccc(c1)CC(C(=O)N)Cl Amb17204454 [0,2,0,0,0,0|2,0,0]=4 5814 B14R1.75 COc1cccc(c1)CC(C(=O)O)Cl Amb17204460 [0,2,0,0,0,0|1,0,0]=3 5815 B14R1.75 COc1cccc(c1)CC(C(=O)O)O Amb17139588 [0,2,0,0,0,0|1,0,0]=3 5816 B14R1.75 COc1cccc(c1)C[C@H](C(=O)O)N Amb16231882 [0,2,0,0,0,0|0,0,0]=2 5817 B14R1.75 COc1cccc(c1)SC(C(=O)O)C Amb1130562 [0,2,0,0,0,0|2,0,0]=4 5818 B14R1.75 CSc1cc(ccc1)NC(C)C(O)=O Amb19033687 [0,2,0,0,0,0|2,0,0]=4 5819 B14R1.75 N#Cc1cccc(c1)CC(=O)C(=O)O Amb1130314 [0,2,0,0,0,0|1,0,1]=4 5820 B14R1.75 N#Cc1cccc(c1)CC(C(=O)O)C Amb17605833 [0,2,0,0,0,0|1,0,0]=3 5821 B14R1.75 NC(=O)C(Br)Cc1cc(ccc1)C#N Amb24643648 [0,2,0,0,0,0|2,0,0]=4 5822 B14R1.75 NC(Cc1cc(C#N)[n]cc1)C(O)=O Amb25683407 [0,2,0,0,0,0|1,0,0]=3 5823 B14R1.75 NC(Cc1cc(c[n]c1)C#N)C(O)=O Amb24745510 [0,2,0,0,0,0|1,0,0]=3 5824 B14R1.75 NC(Cc1cc(cc[n]1)C#N)C(O)=O Amb25806036 [0,2,0,0,0,0|1,0,0]=3 5825 B14R1.75 NC(Cc1cc(ccc1)C#N)C(O)=O Amb18650431 [0,2,0,0,0,0|0,0,0]=2 5826 B14R1.75 N[C@H](Cc1cc(cc[n]1)C#N)C(O)=O Amb24385553 [0,2,0,0,0,0|1,0,0]=3 5827 B14R1.75 N[C@H](Cc1cccc(C#N)[n]1)C(O)=O Amb24344825 [0,2,0,0,0,0|1,0,0]=3 5828 B14R1.75 N\C(=C\c1cc(ccc1)C#N)\C(O)=O Amb25330228 [0,2,0,0,0,0|0,0,2]=4 5829 B14R1.150 C=C(C(N)C(O)=O)c1cc(O)ccc1 Amb18651393 [0,2,0,0,0,0|0,0,1]=3 5830 B14R1.150 C=C(C(N)c1cccc(Cl)c1)C(O)=O Amb25114043 [0,2,0,0,0,0|1,0,1]=4 5831 B14R1.150 C=C(C(O)c1cccc(Br)c1)C(O)=O Amb24381720 [0,2,0,0,0,0|1,0,1]=4 5832 B14R1.150 C=C(C(O)c1cccc(Cl)c1)C(O)=O Amb25733510 [0,2,0,0,0,0|1,0,1]=4 5833 B14R1.150 CC(=O)C(Br)C(C)c1cccc(Cl)c1 Amb25732259 [0,2,0,0,0,0|2,0,0]=4 5834 B14R1.150 CC(=O)C(Br)C(C)c1cccc(F)c1 Amb25181187 [0,2,0,0,0,0|2,0,0]=4 5835 B14R1.150 CC(=O)C(Cl)C(O)c1cccc(F)c1 Amb25112169 [0,2,0,0,0,0|2,0,0]=4 5836 B14R1.150 CC(=O)[C@@H](Cl)[C@@H](O)c1cccc(F)c1 Amb25798340 [0,2,0,0,0,0|2,0,0]=4 5837 B14R1.150 CC(C(Br)C(C)=O)c1cc(C)ccc1 Amb24400063 [0,2,0,0,0,0|2,0,0]=4 5838 B14R1.150 CC(C(C)c1c[n]cc(F)c1)C(O)=O Amb25761382 [0,2,0,0,0,0|2,0,0]=4 5839 B14R1.150 CC(C(C)c1cccc(Br)c1)C(O)=O Amb25200830 [0,2,0,0,0,0|1,0,0]=3 5840 B14R1.150 CC(C(C)c1cccc(Cl)c1)C(O)=O Amb25265872 [0,2,0,0,0,0|1,0,0]=3 5841 B14R1.150 CC(C(C)c1cccc(F)c1)C(O)=O Amb25707225 [0,2,0,0,0,0|1,0,0]=3 5842 B14R1.150 CC(C(F)C(O)=O)c1c[n]cc(F)c1 Amb24557646 [0,2,0,0,0,0|2,0,0]=4 5843 B14R1.150 CC(C(F)C(O)=O)c1cccc(Br)c1 Amb25200831 [0,2,0,0,0,0|1,0,0]=3 5844 B14R1.150 CC(C(F)C(O)=O)c1cccc(Cl)c1 Amb25213678 [0,2,0,0,0,0|1,0,0]=3 5845 B14R1.150 CC(C(F)C(O)=O)c1cccc(F)c1 Amb25289863 [0,2,0,0,0,0|1,0,0]=3 5846 B14R1.150 CC(C(N)C(O)=O)c1cccc(N)c1 Amb18651902 [0,2,0,0,0,0|0,0,0]=2 5847 B14R1.150 CC(C(N)c1cccc(O)c1)C(O)=O Amb24391526 [0,2,0,0,0,0|1,0,0]=3 5848 B14R1.150 CC(C(O)=O)S(=O)c1cccc(Cl)c1 Amb18299922 [0,2,0,0,0,0|2,0,0]=4 5849 B14R1.150 CC(C(O)=O)S(=O)c1cccc(F)c1 Amb24369093 [0,2,0,0,0,0|2,0,0]=4 5850 B14R1.150 CC(C(O)C(O)=O)c1cccc(F)c1 Amb25139188 [0,2,0,0,0,0|1,0,0]=3 5851 B14R1.150 CN(C(C)C(O)=O)c1cccc(Br)c1 Amb22967130 [0,2,0,0,0,0|2,0,0]=4 5852 B14R1.150 CN(C(C)C(O)=O)c1cccc(Cl)c1 Amb22967110 [0,2,0,0,0,0|2,0,0]=4 5853 B14R1.150 CN(C(C)C(O)=O)c1cccc(N)c1 Amb18294613 [0,2,0,0,0,0|2,0,0]=4 5854 B14R1.150 C[C@H]([C@H](N)C(O)=O)c1cccc(N)c1 Amb24552903 [0,2,0,0,0,0|0,0,0]=2 5855 B14R1.150 Cc1c[n]cc(c1)C(C)C(C)C(O)=O Amb24615544 [0,2,0,0,0,0|2,0,0]=4 5856 B14R1.150 Cc1cc(ccc1)C(C)C(C)C(O)=O Amb25795828 [0,2,0,0,0,0|1,0,0]=3 5857 B14R1.150 Cc1cc(ccc1)C(N)C(O)C(O)=O Amb24381383 [0,2,0,0,0,0|1,0,0]=3 5858 B14R1.150 Cc1cc(ccc1)C(O)C(N)C(O)=O Amb18814158 [0,2,0,0,0,0|0,0,0]=2 5859 B14R1.150 Cc1cc(ccc1)N(C)C(C)C(O)=O Amb22966932 [0,2,0,0,0,0|2,0,0]=4 5860 B14R1.150 Cc1cc(ccc1)S(=O)C(C)C(O)=O Amb18979570 [0,2,0,0,0,0|2,0,0]=4 5861 B14R1.150 Cc1cc(ccc1)[C@@H](N)[C@@H](O)C(O)=O Amb22756710 [0,2,0,0,0,0|1,0,0]=3 5862 B14R1.150 Cc1cccc([n]1)C(O)C(C)C(O)=O Amb24397924 [0,2,0,0,0,0|2,0,0]=4 5863 B14R1.150 Cc1cccc([n]1)[C@H](O)[C@H](C)C(O)=O Amb24396959 [0,2,0,0,0,0|2,0,0]=4 5864 B14R1.150 NC(C(O)C(O)=O)c1cc(Cl)cc[n]1 Amb24760821 [0,2,0,0,0,0|2,0,0]=4 5865 B14R1.150 NC(C(O)C(O)=O)c1cc(F)cc[n]1 Amb25264863 [0,2,0,0,0,0|2,0,0]=4 5866 B14R1.150 NC(C(O)C(O)=O)c1cc[n]c(Br)c1 Amb25366478 [0,2,0,0,0,0|2,0,0]=4 5867 B14R1.150 NC(C(O)C(O)=O)c1cccc(Br)[n]1 Amb24612112 [0,2,0,0,0,0|2,0,0]=4 5868 B14R1.150 NC(C(O)C(O)=O)c1cccc(F)c1 Amb25122657 [0,2,0,0,0,0|1,0,0]=3 5869 B14R1.150 NC(C(O)c1cc(Br)ccc1)C(O)=O Amb18692061 [0,2,0,0,0,0|0,0,0]=2 5870 B14R1.150 NC(C(O)c1cc(Cl)ccc1)C(O)=O Amb18657877 [0,2,0,0,0,0|0,0,0]=2 5871 B14R1.150 NC(C(O)c1cc(F)ccc1)C(O)=O Amb18187798 [0,2,0,0,0,0|0,0,0]=2 5872 B14R1.150 NC(C(O)c1cccc(O)c1)C(O)=O Amb25211277 [0,2,0,0,0,0|0,0,0]=2 5873 B14R1.150 N[C@@H]([C@@H](O)C(O)=O)c1cccc(F)c1 Amb22756701 [0,2,0,0,0,0|1,0,0]=3 5874 B14R1.150 N[C@@H]([C@@H](O)c1cc(Cl)ccc1)C(O)=O Amb25817634 [0,2,0,0,0,0|0,0,0]=2 5875 B14R1.150 N[C@@H]([C@H](O)C(O)=O)c1cc(Cl)cc[n]1 Amb24638196 [0,2,0,0,0,0|2,0,0]=4 5876 B14R1.150 N[C@@H]([C@H](O)C(O)=O)c1cc[n]c(Br)c1 Amb24743742 [0,2,0,0,0,0|2,0,0]=4 5877 B14R1.150 N[C@@H]([C@H](O)C(O)=O)c1cc[n]c(F)c1 Amb24574149 [0,2,0,0,0,0|2,0,0]=4 5878 B14R1.150 N[C@@H]([C@H](O)C(O)=O)c1cccc(Br)[n]1 Amb24656636 [0,2,0,0,0,0|2,0,0]=4 5879 B14R1.150 N[C@@H]([C@H](O)C(O)=O)c1cccc(Cl)[n]1 Amb24656635 [0,2,0,0,0,0|2,0,0]=4 5880 B14R1.150 N[C@H]([C@@H](O)C(O)=O)c1cc(F)cc[n]1 Amb25270770 [0,2,0,0,0,0|2,0,0]=4 5881 B14R1.150 N[C@H]([C@@H](O)C(O)=O)c1cc[n]c(F)c1 Amb24579095 [0,2,0,0,0,0|2,0,0]=4 5882 B14R1.150 N[C@H]([C@@H](O)C(O)=O)c1cccc(Br)[n]1 Amb24638064 [0,2,0,0,0,0|2,0,0]=4 5883 B14R1.150 N[C@H]([C@@H](O)c1cccc(O)c1)C(O)=O Amb24535338 [0,2,0,0,0,0|0,0,0]=2 5884 B14R1.150 N[C@H]([C@H](O)c1cccc(O)c1)C(O)=O Amb25138797 [0,2,0,0,0,0|0,0,0]=2 5885 B14R1.150 Nc1cc(ccc1)C(Br)C(Br)C(O)=O Amb21968238 [0,2,0,0,0,0|1,0,0]=3 5886 B14R1.150 Nc1cccc(c1)C(N)C(O)C(O)=O Amb25815588 [0,2,0,0,0,0|1,0,0]=3 5887 B14R1.150 Nc1cccc(c1)[C@H](N)[C@@H](O)C(O)=O Amb25752298 [0,2,0,0,0,0|1,0,0]=3 5888 B14R1.150 OC(=O)C(C(c1cccc(c1)Br)N)C Amb17473591 [0,2,0,0,0,0|1,0,0]=3 5889 B14R1.150 OC(=O)C(C(c1cccc(c1)C)N)C Amb17470842 [0,2,0,0,0,0|1,0,0]=3 5890 B14R1.150 OC(=O)C(C(c1cccc(c1)Cl)N)C Amb17471480 [0,2,0,0,0,0|1,0,0]=3 5891 B14R1.150 OC(=O)C(C(c1cccc(c1)F)N)C Amb17470959 [0,2,0,0,0,0|1,0,0]=3 5892 B14R1.153 CC(=C)C(N)Cc1cccc(Cl)c1F Amb24476231 [0,2,0,0,0,0|2,0,0]=4 5893 B14R1.153 CC(=C)C(N)Cc1cccc(F)c1F Amb25078386 [0,2,0,0,0,0|2,0,0]=4 5894 B14R1.153 CC(=O)C(Br)Cc1cccc(Cl)c1Cl Amb18084861 [0,2,0,0,0,0|2,0,0]=4 5895 B14R1.153 CC(=O)C(Br)Cc1cccc(F)c1F Amb24395569 [0,2,0,0,0,0|2,0,0]=4 5896 B14R1.153 CC(=O)C(Br)Cc1cccc(F)c1I Amb25055582 [0,2,0,0,0,0|2,0,0]=4 5897 B14R1.153 CC(=O)C(C)Cc1cccc(Cl)c1Cl Amb24382834 [0,2,0,0,0,0|2,0,0]=4 5898 B14R1.153 CC(=O)C(C)Cc1cccc(Cl)c1F Amb25140592 [0,2,0,0,0,0|2,0,0]=4 5899 B14R1.153 CC(=O)C(C)Cc1cccc(F)c1F Amb19054980 [0,2,0,0,0,0|2,0,0]=4 5900 B14R1.153 CC(=O)C(Cc1cccc(c1C)C)Cl Amb17204432 [0,2,0,0,0,0|2,0,0]=4 5901 B14R1.153 CC(=O)C(Cc1cccc(c1Cl)Cl)Cl Amb17204746 [0,2,0,0,0,0|2,0,0]=4 5902 B14R1.153 CC(C(=O)O)Cc1cccc(c1Cl)Cl Amb17605805 [0,2,0,0,0,0|1,0,0]=3 5903 B14R1.153 CC(C(=O)O)Nc1cccc(c1Cl)Cl Amb17408472 [0,2,0,0,0,0|2,0,0]=4 5904 B14R1.153 CC(Cc1cccc(F)c1Br)C(O)=O Amb24521620 [0,2,0,0,0,0|1,0,0]=3 5905 B14R1.153 CC(Cc1cccc(F)c1F)C(O)=O Amb18972344 [0,2,0,0,0,0|1,0,0]=3 5906 B14R1.153 CC(Cc1cccc(O)c1Br)C(O)=O Amb25674846 [0,2,0,0,0,0|1,0,0]=3 5907 B14R1.153 CC(Cc1cccc(O)c1Cl)C(O)=O Amb25699254 [0,2,0,0,0,0|1,0,0]=3 5908 B14R1.153 CC(Nc1cccc(Cl)c1F)C(O)=O Amb18981769 [0,2,0,0,0,0|2,0,0]=4 5909 B14R1.153 CC(Nc1cccc(F)c1F)C(O)=O Amb18293675 [0,2,0,0,0,0|2,0,0]=4 5910 B14R1.153 CC(Nc1cccc(F)c1I)C(O)=O Amb24471754 [0,2,0,0,0,0|2,0,0]=4 5911 B14R1.153 CC(Nc1cccc(O)c1O)C(O)=O Amb24498204 [0,2,0,0,0,0|2,0,0]=4 5912 B14R1.153 CC(Oc1cccc(Cl)c1F)C(O)=O Amb24573910 [0,2,0,0,0,0|2,0,0]=4 5913 B14R1.153 CC(Oc1cccc(F)c1F)C(O)=O Amb19002175 [0,2,0,0,0,0|2,0,0]=4 5914 B14R1.153 CC(Oc1cccc(N)c1Br)C(O)=O Amb24499691 [0,2,0,0,0,0|2,0,0]=4 5915 B14R1.153 CC(Oc1cccc(O)c1N)C(O)=O Amb24427102 [0,2,0,0,0,0|2,0,0]=4 5916 B14R1.153 C[C@@H](Oc1cccc(F)c1F)C(O)=O Amb25127055 [0,2,0,0,0,0|2,0,0]=4 5917 B14R1.153 C[C@H](Oc1cccc(Cl)c1F)C(O)=O Amb25706361 [0,2,0,0,0,0|2,0,0]=4 5918 B14R1.153 Cc1c(Br)c[n]cc1C[C@H](N)C(O)=O Amb25095900 [0,2,0,0,0,0|1,0,0]=3 5919 B14R1.153 Cc1c(Br)cccc1CC(C)C(O)=O Amb25705224 [0,2,0,0,0,0|1,0,0]=3 5920 B14R1.153 Cc1c(Br)cccc1CC(Cl)C(N)=O Amb25847115 [0,2,0,0,0,0|2,0,0]=4 5921 B14R1.153 Cc1c(Br)cccc1CC(N)C(O)=O Amb25365005 [0,2,0,0,0,0|0,0,0]=2 5922 B14R1.153 Cc1c(Br)cccc1C[C@@H](N)C(O)=O Amb24417880 [0,2,0,0,0,0|0,0,0]=2 5923 B14R1.153 Cc1c(Br)cccc1NC(C)C(O)=O Amb25208231 [0,2,0,0,0,0|2,0,0]=4 5924 B14R1.153 Cc1c(CC(C(=O)C)Cl)cccc1Cl Amb17204554 [0,2,0,0,0,0|2,0,0]=4 5925 B14R1.153 Cc1c(CC(C(=O)N)Cl)cccc1C Amb17204438 [0,2,0,0,0,0|2,0,0]=4 5926 B14R1.153 Cc1c(CC(C(=O)N)Cl)cccc1Cl Amb17204558 [0,2,0,0,0,0|2,0,0]=4 5927 B14R1.153 Cc1c(CC(C(=O)O)Cl)cccc1C Amb17204444 [0,2,0,0,0,0|1,0,0]=3 5928 B14R1.153 Cc1c(CC(C(=O)O)Cl)cccc1Cl Amb17204585 [0,2,0,0,0,0|1,0,0]=3 5929 B14R1.153 Cc1c(C[C@@H](N)C(O)=O)cccc1N Amb25694338 [0,2,0,0,0,0|0,0,0]=2 5930 B14R1.153 Cc1c(C[C@@H](N)C(O)=O)cccc1O Amb25113927 [0,2,0,0,0,0|0,0,0]=2 5931 B14R1.153 Cc1c(Cl)cccc1CC(Br)C(C)=O Amb18074220 [0,2,0,0,0,0|2,0,0]=4 5932 B14R1.153 Cc1c(Cl)cccc1CC(Br)C(O)=O Amb23320623 [0,2,0,0,0,0|1,0,0]=3 5933 B14R1.153 Cc1c(Cl)cccc1CC(C)C(O)=O Amb24439500 [0,2,0,0,0,0|1,0,0]=3 5934 B14R1.153 Cc1c(Cl)cccc1OC(C)C(O)=O Amb24383107 [0,2,0,0,0,0|2,0,0]=4 5935 B14R1.153 Cc1c(F)cccc1CC(Br)C(N)=O Amb24659194 [0,2,0,0,0,0|2,0,0]=4 5936 B14R1.153 Cc1c(F)cccc1CC(Cl)C(N)=O Amb24471976 [0,2,0,0,0,0|2,0,0]=4 5937 B14R1.153 Cc1c(F)cccc1CC(N)C(O)=O Amb22738001 [0,2,0,0,0,0|0,0,0]=2 5938 B14R1.153 Cc1c(F)cccc1C[C@@H](N)C(O)=O Amb25843792 [0,2,0,0,0,0|0,0,0]=2 5939 B14R1.153 Cc1c(F)cccc1C[C@H](N)C(O)=O Amb24715735 [0,2,0,0,0,0|0,0,0]=2 5940 B14R1.153 Cc1c(F)cccc1NC(C)C(O)=O Amb18984515 [0,2,0,0,0,0|2,0,0]=4 5941 B14R1.153 Cc1c(I)cccc1CC(Br)C(C)=O Amb24365149 [0,2,0,0,0,0|2,0,0]=4 5942 B14R1.153 Cc1c(I)cccc1CC(Br)C(N)=O Amb24440708 [0,2,0,0,0,0|2,0,0]=4 5943 B14R1.153 Cc1c(I)cccc1CC(Cl)C(N)=O Amb24423658 [0,2,0,0,0,0|2,0,0]=4 5944 B14R1.153 Cc1c(I)cccc1C[C@@H](N)C(O)=O Amb24417877 [0,2,0,0,0,0|0,0,0]=2 5945 B14R1.153 Cc1c(I)cccc1NC(C)C(O)=O Amb25819347 [0,2,0,0,0,0|2,0,0]=4 5946 B14R1.153 Cc1c(N)cccc1OC(C)C(O)=O Amb18293671 [0,2,0,0,0,0|2,0,0]=4 5947 B14R1.153 Cc1c(O)cccc1CC(C)C(O)=O Amb25282969 [0,2,0,0,0,0|1,0,0]=3 5948 B14R1.153 Cc1c(\C=C(\N)/C(O)=O)cccc1C Amb25103028 [0,2,0,0,0,0|0,0,2]=4 5949 B14R1.153 Cc1cccc(CC(=O)C(O)=O)c1C Amb18293177 [0,2,0,0,0,0|1,0,1]=4 5950 B14R1.153 Cc1cccc(CC(=O)C(O)=O)c1F Amb25359744 [0,2,0,0,0,0|1,0,1]=4 5951 B14R1.153 Cc1cccc(CC(Br)C(C)=O)c1Br Amb25790720 [0,2,0,0,0,0|2,0,0]=4 5952 B14R1.153 Cc1cccc(CC(Br)C(C)=O)c1C Amb18072848 [0,2,0,0,0,0|2,0,0]=4 5953 B14R1.153 Cc1cccc(CC(Br)C(C)=O)c1F Amb24395465 [0,2,0,0,0,0|2,0,0]=4 5954 B14R1.153 Cc1cccc(CC(Br)C(N)=O)c1Br Amb25849744 [0,2,0,0,0,0|2,0,0]=4 5955 B14R1.153 Cc1cccc(CC(Br)C(N)=O)c1Cl Amb25369084 [0,2,0,0,0,0|2,0,0]=4 5956 B14R1.153 Cc1cccc(CC(Br)C(O)=O)c1C Amb23320604 [0,2,0,0,0,0|1,0,0]=3 5957 B14R1.153 Cc1cccc(CC(C)C(=O)Cl)c1F Amb24345715 [0,2,0,0,0,0|2,0,0]=4 5958 B14R1.153 Cc1cccc(CC(C)C(N)=O)c1C Amb24348042 [0,2,0,0,0,0|2,0,0]=4 5959 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1Br Amb24645293 [0,2,0,0,0,0|1,0,0]=3 5960 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1Cl Amb25316214 [0,2,0,0,0,0|1,0,0]=3 5961 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1F Amb25763027 [0,2,0,0,0,0|1,0,0]=3 5962 B14R1.153 Cc1cccc(CC(Cl)C(N)=O)c1Cl Amb25092246 [0,2,0,0,0,0|2,0,0]=4 5963 B14R1.153 Cc1cccc(CC(Cl)C(N)=O)c1F Amb24645502 [0,2,0,0,0,0|2,0,0]=4 5964 B14R1.153 Cc1cccc(CC(F)C(O)=O)c1C Amb24741532 [0,2,0,0,0,0|1,0,0]=3 5965 B14R1.153 Cc1cccc(CC(N)C(C)=O)c1C Amb24507236 [0,2,0,0,0,0|1,0,0]=3 5966 B14R1.153 Cc1cccc(CC(S)C(O)=O)c1C Amb24416836 [0,2,0,0,0,0|1,0,0]=3 5967 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1C Amb19061743 [0,2,0,0,0,0|0,0,0]=2 5968 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1Cl Amb25747558 [0,2,0,0,0,0|0,0,0]=2 5969 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1O Amb24350644 [0,2,0,0,0,0|0,0,0]=2 5970 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1Br Amb24499225 [0,2,0,0,0,0|0,0,0]=2 5971 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1C Amb24093651 [0,2,0,0,0,0|0,0,0]=2 5972 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1N Amb25326362 [0,2,0,0,0,0|0,0,0]=2 5973 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1O Amb25671992 [0,2,0,0,0,0|0,0,0]=2 5974 B14R1.153 Cc1cccc(NC(C)C(O)=O)c1Br Amb25817891 [0,2,0,0,0,0|2,0,0]=4 5975 B14R1.153 Cc1cccc(NC(C)C(O)=O)c1Cl Amb25092271 [0,2,0,0,0,0|2,0,0]=4 5976 B14R1.153 Cc1cccc(NC(C)C(O)=O)c1F Amb25710677 [0,2,0,0,0,0|2,0,0]=4 5977 B14R1.153 Cc1cccc(OC(C)C(O)=O)c1N Amb18999351 [0,2,0,0,0,0|2,0,0]=4 5978 B14R1.153 Cc1cccc(OC(F)C(O)=O)c1C Amb24498765 [0,2,0,0,0,0|2,0,0]=4 5979 B14R1.153 Cc1cccc(O[C@@H](C)C(O)=O)c1C Amb24677769 [0,2,0,0,0,0|2,0,0]=4 5980 B14R1.153 Cc1cccc(O[C@H](C)C(O)=O)c1C Amb25227477 [0,2,0,0,0,0|2,0,0]=4 5981 B14R1.153 Cc1cccc(O[C@H](C)C(O)=O)c1Cl Amb25081397 [0,2,0,0,0,0|2,0,0]=4 5982 B14R1.153 Cc1cccc(O[C@H](C)C(O)=O)c1F Amb25033534 [0,2,0,0,0,0|2,0,0]=4 5983 B14R1.153 NC(=O)C(Br)Cc1cccc(Cl)c1Cl Amb24455238 [0,2,0,0,0,0|2,0,0]=4 5984 B14R1.153 NC(=O)C(Br)Cc1cccc(F)c1F Amb24700904 [0,2,0,0,0,0|2,0,0]=4 5985 B14R1.153 NC(=O)C(Cc1cccc(c1Cl)Cl)Cl Amb17204753 [0,2,0,0,0,0|2,0,0]=4 5986 B14R1.153 NC(=O)C(Cl)Cc1cccc(F)c1I Amb25684508 [0,2,0,0,0,0|2,0,0]=4 5987 B14R1.153 NC(=O)C(N)Cc1cccc(F)c1F Amb25855321 [0,2,0,0,0,0|1,0,0]=3 5988 B14R1.153 NC(CC1=CNC=C(O)C1=O)C(O)=O Amb25133111 [0,2,0,0,0,0|1,0,0]=3 5989 B14R1.153 NC(CN1C=CC=C(O)C1=O)C(O)=O Amb25815605 [0,2,0,0,0,0|1,0,0]=3 5990 B14R1.153 NC(Cc1cc[n]c(Br)c1Br)C(O)=O Amb25805292 [0,2,0,0,0,0|1,0,0]=3 5991 B14R1.153 NC(Cc1cc[n]c(Cl)c1Cl)C(O)=O Amb25366057 [0,2,0,0,0,0|1,0,0]=3 5992 B14R1.153 NC(Cc1cccc(Br)c1Cl)C(O)=O Amb25049491 [0,2,0,0,0,0|0,0,0]=2 5993 B14R1.153 NC(Cc1cccc(Br)c1F)C(O)=O Amb25253473 [0,2,0,0,0,0|0,0,0]=2 5994 B14R1.153 NC(Cc1cccc(Cl)c1Br)C(O)=O Amb25121247 [0,2,0,0,0,0|0,0,0]=2 5995 B14R1.153 NC(Cc1cccc(Cl)c1F)C(O)=O Amb22738179 [0,2,0,0,0,0|0,0,0]=2 5996 B14R1.153 NC(Cc1cccc(Cl)c1O)C(O)=O Amb25752870 [0,2,0,0,0,0|0,0,0]=2 5997 B14R1.153 NC(Cc1cccc(F)c1Br)C(O)=O Amb24540531 [0,2,0,0,0,0|0,0,0]=2 5998 B14R1.153 NC(Cc1cccc(F)c1I)C(O)=O Amb25812910 [0,2,0,0,0,0|0,0,0]=2 5999 B14R1.153 NC(Cc1cccc(F)c1O)C(O)=O Amb24526128 [0,2,0,0,0,0|0,0,0]=2 6000 B14R1.153 NC(Cc1cccc(I)c1Cl)C(O)=O Amb25330907 [0,2,0,0,0,0|0,0,0]=2 6001 B14R1.153 NC(Cc1cccc(I)c1O)C(O)=O Amb24559177 [0,2,0,0,0,0|0,0,0]=2 6002 B14R1.153 NC(Cc1cccc(O)c1Cl)C(O)=O Amb25758579 [0,2,0,0,0,0|0,0,0]=2 6003 B14R1.153 NC(Cc1cccc(O)c1O)C(O)=O Amb21858507 [0,2,0,0,0,0|0,0,0]=2 6004 B14R1.153 N[C@@H](Cc1cccc(Br)c1Br)C(O)=O Amb25739023 [0,2,0,0,0,0|0,0,0]=2 6005 B14R1.153 N[C@@H](Cc1cccc(Br)c1O)C(O)=O Amb25339195 [0,2,0,0,0,0|0,0,0]=2 6006 B14R1.153 N[C@@H](Cc1cccc(Cl)c1Cl)C(O)=O Amb22228263 [0,2,0,0,0,0|0,0,0]=2 6007 B14R1.153 N[C@@H](Cc1cccc(Cl)c1F)C(O)=O Amb25047473 [0,2,0,0,0,0|0,0,0]=2 6008 B14R1.153 N[C@@H](Cc1cccc(Cl)c1O)C(O)=O Amb25835765 [0,2,0,0,0,0|0,0,0]=2 6009 B14R1.153 N[C@@H](Cc1cccc(F)c1Cl)C(O)=O Amb25784695 [0,2,0,0,0,0|0,0,0]=2 6010 B14R1.153 N[C@@H](Cc1cccc(F)c1I)C(O)=O Amb25748095 [0,2,0,0,0,0|0,0,0]=2 6011 B14R1.153 N[C@@H](Cc1cccc(I)c1Br)C(O)=O Amb25352707 [0,2,0,0,0,0|0,0,0]=2 6012 B14R1.153 N[C@@H](Cc1cccc(I)c1Cl)C(O)=O Amb25752312 [0,2,0,0,0,0|0,0,0]=2 6013 B14R1.153 N[C@@H](Cc1cccc(I)c1O)C(O)=O Amb25679133 [0,2,0,0,0,0|0,0,0]=2 6014 B14R1.153 N[C@@H](Cc1cccc(O)c1O)C(O)=O Amb22228292 [0,2,0,0,0,0|0,0,0]=2 6015 B14R1.153 N[C@H](Cc1c[n]cc(Br)c1O)C(O)=O Amb25691847 [0,2,0,0,0,0|1,0,0]=3 6016 B14R1.153 N[C@H](Cc1cccc(Br)c1Cl)C(O)=O Amb24659596 [0,2,0,0,0,0|0,0,0]=2 6017 B14R1.153 N[C@H](Cc1cccc(Br)c1F)C(O)=O Amb25346904 [0,2,0,0,0,0|0,0,0]=2 6018 B14R1.153 N[C@H](Cc1cccc(Cl)c1Br)C(O)=O Amb24530391 [0,2,0,0,0,0|0,0,0]=2 6019 B14R1.153 N[C@H](Cc1cccc(Cl)c1Cl)C(O)=O Amb22228262 [0,2,0,0,0,0|0,0,0]=2 6020 B14R1.153 N[C@H](Cc1cccc(Cl)c1F)C(O)=O Amb24666507 [0,2,0,0,0,0|0,0,0]=2 6021 B14R1.153 N[C@H](Cc1cccc(Cl)c1O)C(O)=O Amb25726348 [0,2,0,0,0,0|0,0,0]=2 6022 B14R1.153 N[C@H](Cc1cccc(F)c1Br)C(O)=O Amb25808910 [0,2,0,0,0,0|0,0,0]=2 6023 B14R1.153 N[C@H](Cc1cccc(F)c1F)C(O)=O Amb20241135 [0,2,0,0,0,0|0,0,0]=2 6024 B14R1.153 N[C@H](Cc1cccc(F)c1O)C(O)=O Amb25181013 [0,2,0,0,0,0|0,0,0]=2 6025 B14R1.153 N[C@H](Cc1cccc(I)c1Cl)C(O)=O Amb24647989 [0,2,0,0,0,0|0,0,0]=2 6026 B14R1.153 N[C@H](Cc1cccc(O)c1Cl)C(O)=O Amb24640517 [0,2,0,0,0,0|0,0,0]=2 6027 B14R1.153 N[C@H](Cc1cccc(O)c1O)C(O)=O Amb22228291 [0,2,0,0,0,0|0,0,0]=2 6028 B14R1.153 N\C(=C\c1cccc(Br)c1F)\C(O)=O Amb24683364 [0,2,0,0,0,0|0,0,2]=4 6029 B14R1.153 Nc1c(Cl)cccc1CC(N)C(O)=O Amb18657749 [0,2,0,0,0,0|0,0,0]=2 6030 B14R1.153 Nc1c(Cl)cccc1C[C@@H](N)C(O)=O Amb25133741 [0,2,0,0,0,0|0,0,0]=2 6031 B14R1.153 Nc1c(Cl)cccc1C[C@H](N)C(O)=O Amb25185966 [0,2,0,0,0,0|0,0,0]=2 6032 B14R1.153 Nc1c(F)cccc1CC(N)C(O)=O Amb25214648 [0,2,0,0,0,0|0,0,0]=2 6033 B14R1.153 Nc1c(F)cccc1C[C@@H](N)C(O)=O Amb25710900 [0,2,0,0,0,0|0,0,0]=2 6034 B14R1.153 Nc1c(O)cccc1CC(N)C(O)=O Amb25294692 [0,2,0,0,0,0|0,0,0]=2 6035 B14R1.153 Nc1cccc(CC(N)C(O)=O)c1N Amb24746593 [0,2,0,0,0,0|0,0,0]=2 6036 B14R1.153 Nc1cccc(CC(N)C(O)=O)c1O Amb24419964 [0,2,0,0,0,0|0,0,0]=2 6037 B14R1.153 Nc1cccc(C[C@@H](N)C(O)=O)c1N Amb24621838 [0,2,0,0,0,0|0,0,0]=2 6038 B14R1.153 Nc1cccc(C[C@@H](N)C(O)=O)c1O Amb25224927 [0,2,0,0,0,0|0,0,0]=2 6039 B14R1.153 Nc1cccc(C[C@H](N)C(O)=O)c1O Amb25104253 [0,2,0,0,0,0|0,0,0]=2 6040 B14R1.153 OC(=O)C(=O)Cc1cccc(Br)c1F Amb24527493 [0,2,0,0,0,0|1,0,1]=4 6041 B14R1.153 OC(=O)C(Br)Cc1cccc(Cl)c1Cl Amb23320629 [0,2,0,0,0,0|1,0,0]=3 6042 B14R1.153 OC(=O)C(Cc1cccc(c1Cl)Cl)Cl Amb17204776 [0,2,0,0,0,0|1,0,0]=3 6043 B14R1.153 OC(=O)C(F)Oc1cccc(Cl)c1Cl Amb24392417 [0,2,0,0,0,0|2,0,0]=4 6044 B14R1.153 OC(=O)C(Nc1cccc(c1C)Cl)C Amb17404300 [0,2,0,0,0,0|2,0,0]=4 6045 B14R1.153 OC(=O)C(O)Cc1cccc(Cl)c1Cl Amb24358285 [0,2,0,0,0,0|1,0,0]=3 6046 B14R1.153 OC(=O)C(O)Cc1cccc(Cl)c1F Amb25079623 [0,2,0,0,0,0|1,0,0]=3 6047 B14R1.153 Oc1cccc(OC(O)C(O)=O)c1O Amb24100313 [0,2,0,0,0,0|2,0,0]=4 6048 B14R1.542 C=CC(Nc1cccc(Br)c1)C(O)=O Amb24445561 [0,2,0,0,0,0|2,0,0]=4 6049 B14R1.542 C=CC(Nc1cccc(F)c1)C(O)=O Amb25716184 [0,2,0,0,0,0|2,0,0]=4 6050 B14R1.542 CCC(C(=O)C)Cc1cccc(c1)Br Amb17264255 [0,2,0,0,0,0|2,0,0]=4 6051 B14R1.542 CCC(C(=O)C)Cc1cccc(c1)C Amb17234958 [0,2,0,0,0,0|2,0,0]=4 6052 B14R1.542 CCC(C(=O)C)Cc1cccc(c1)Cl Amb17240771 [0,2,0,0,0,0|2,0,0]=4 6053 B14R1.542 CCC(C(=O)O)Cc1cccc(c1)F Amb17605809 [0,2,0,0,0,0|1,0,0]=3 6054 B14R1.542 CCC(Cc1cc(Br)ccc1)C(O)=O Amb19374383 [0,2,0,0,0,0|1,0,0]=3 6055 B14R1.542 CCC(Nc1cc(O)ccc1)C(O)=O Amb25274775 [0,2,0,0,0,0|2,0,0]=4 6056 B14R1.542 CNC(Cc1cccc(F)c1)C(O)=O Amb22468483 [0,2,0,0,0,0|0,0,0]=2 6057 B14R1.542 COC(Cc1cccc(Br)c1)C(O)=O Amb23321086 [0,2,0,0,0,0|1,0,0]=3 6058 B14R1.542 COC(Cc1cccc(Cl)c1)C(O)=O Amb23321027 [0,2,0,0,0,0|1,0,0]=3 6059 B14R1.542 Cc1cc(CC(C#N)C(N)=O)ccc1 Amb25088813 [0,2,0,0,0,0|1,0,1]=4 6060 B14R1.542 Cc1cc(CC(CN)C(O)=O)ccc1 Amb20622915 [0,2,0,0,0,0|0,0,0]=2 6061 B14R1.542 Cc1cc(CC(OC)C(O)=O)ccc1 Amb23320709 [0,2,0,0,0,0|1,0,0]=3 6062 B14R1.542 Cc1cc(C\C(=N\O)\C(O)=O)ccc1 Amb25725090 [0,2,0,0,0,0|0,0,2]=4 6063 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)C Amb17090111 [0,2,0,0,0,0|0,0,1]=3 6064 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)Cl Amb17090119 [0,2,0,0,0,0|0,0,1]=3 6065 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)O Amb17090136 [0,2,0,0,0,0|0,0,1]=3 6066 B14R1.542 NC(=O)C(Cc1cccc(Br)c1)C#N Amb25323576 [0,2,0,0,0,0|1,0,1]=4 6067 B14R1.542 NC(=O)C(Cc1cccc(F)c1)C#N Amb25318506 [0,2,0,0,0,0|1,0,1]=4 6068 B14R1.542 NCC(Cc1cc(Cl)ccc1)C(O)=O Amb19321126 [0,2,0,0,0,0|0,0,0]=2 6069 B14R1.542 NCC(Nc1c[n]cc(Br)c1)C(O)=O Amb25698448 [0,2,0,0,0,0|2,0,0]=4 6070 B14R1.542 NCC(Nc1cccc(Cl)c1)C(O)=O Amb25742741 [0,2,0,0,0,0|1,0,0]=3 6071 B14R1.542 NCC(Nc1cccc(F)c1)C(O)=O Amb25195242 [0,2,0,0,0,0|1,0,0]=3 6072 B14R1.542 NC\C(=C/c1cccc(Cl)c1)\C(O)=O Amb25041133 [0,2,0,0,0,0|0,0,2]=4 6073 B14R1.542 NC\C(=C\c1cccc(Cl)c1)\C(O)=O Amb25252120 [0,2,0,0,0,0|0,0,2]=4 6074 B14R1.4257 CC(=O)C(Br)Cc1cc(Br)cc(F)c1 Amb24601031 [0,2,0,0,0,0|2,0,0]=4 6075 B14R1.4257 CC(=O)C(Br)Cc1cc(C)cc(C)c1 Amb18073008 [0,2,0,0,0,0|2,0,0]=4 6076 B14R1.4257 CC(=O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb18084860 [0,2,0,0,0,0|2,0,0]=4 6077 B14R1.4257 CC(=O)C(Br)Cc1cc(F)cc(Cl)c1 Amb25183984 [0,2,0,0,0,0|2,0,0]=4 6078 B14R1.4257 CC(=O)C(C)Cc1cc(F)cc(F)c1 Amb25087592 [0,2,0,0,0,0|2,0,0]=4 6079 B14R1.4257 CC(=O)C(Cc1cc(C)cc(c1)C)Cl Amb17204431 [0,2,0,0,0,0|2,0,0]=4 6080 B14R1.4257 CC(=O)C(N)Cc1cc(C)cc(C)c1 Amb25033445 [0,2,0,0,0,0|1,0,0]=3 6081 B14R1.4257 CC(=O)C(N)Cc1cc(Cl)cc(Cl)c1 Amb24556101 [0,2,0,0,0,0|1,0,0]=3 6082 B14R1.4257 CC(C(=O)O)Cc1cc(Cl)cc(c1)Cl Amb17605838 [0,2,0,0,0,0|1,0,0]=3 6083 B14R1.4257 CC(C(=O)O)Nc1cc(Cl)cc(c1)Cl Amb17408471 [0,2,0,0,0,0|2,0,0]=4 6084 B14R1.4257 CC(Cc1cc(C)cc(C)c1)C(C)=O Amb19061086 [0,2,0,0,0,0|2,0,0]=4 6085 B14R1.4257 CC(Cc1cc(C)cc(C)c1)C(O)=O Amb19050593 [0,2,0,0,0,0|1,0,0]=3 6086 B14R1.4257 CC(Cc1cc(F)cc(Cl)c1)C(O)=O Amb25762039 [0,2,0,0,0,0|1,0,0]=3 6087 B14R1.4257 CC(Cc1cc(F)cc(F)c1)C(O)=O Amb25850756 [0,2,0,0,0,0|1,0,0]=3 6088 B14R1.4257 CC(Cc1cc(O)cc(Br)c1)C(O)=O Amb24473206 [0,2,0,0,0,0|1,0,0]=3 6089 B14R1.4257 CC(Cc1cc(O)cc(Cl)c1)C(O)=O Amb25220157 [0,2,0,0,0,0|1,0,0]=3 6090 B14R1.4257 CC(Nc1cc(Cl)cc(Br)c1)C(O)=O Amb24391043 [0,2,0,0,0,0|2,0,0]=4 6091 B14R1.4257 CC(Nc1cc(F)cc(Cl)c1)C(O)=O Amb25774264 [0,2,0,0,0,0|2,0,0]=4 6092 B14R1.4257 CC(Nc1cc(F)cc(F)c1)C(O)=O Amb18999362 [0,2,0,0,0,0|2,0,0]=4 6093 B14R1.4257 CC(Oc1cc(F)cc(Br)c1)C(O)=O Amb24667595 [0,2,0,0,0,0|2,0,0]=4 6094 B14R1.4257 CC(Oc1cc(F)cc(F)c1)C(O)=O Amb18997296 [0,2,0,0,0,0|2,0,0]=4 6095 B14R1.4257 C[C@@H](Oc1cc(C)cc(C)c1)C(O)=O Amb25820783 [0,2,0,0,0,0|2,0,0]=4 6096 B14R1.4257 C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(O)=O Amb25693879 [0,2,0,0,0,0|2,0,0]=4 6097 B14R1.4257 C[C@H](Oc1cc(Cl)cc(Cl)c1)C(O)=O Amb24463122 [0,2,0,0,0,0|2,0,0]=4 6098 B14R1.4257 C[C@H](Oc1cc(F)cc(Br)c1)C(O)=O Amb24385512 [0,2,0,0,0,0|2,0,0]=4 6099 B14R1.4257 C[C@H](Oc1cc(F)cc(F)c1)C(O)=O Amb25282256 [0,2,0,0,0,0|2,0,0]=4 6100 B14R1.4257 Cc1[n]c(CC(N)C(O)=O)cc(C)[n]1 Amb25127895 [0,2,0,0,0,0|2,0,0]=4 6101 B14R1.4257 Cc1cc(CC(=O)C(O)=O)cc(C)c1 Amb18980661 [0,2,0,0,0,0|1,0,1]=4 6102 B14R1.4257 Cc1cc(CC(Br)C(C)=O)cc(Br)c1 Amb25039728 [0,2,0,0,0,0|2,0,0]=4 6103 B14R1.4257 Cc1cc(CC(Br)C(N)=O)cc(F)c1 Amb25692072 [0,2,0,0,0,0|2,0,0]=4 6104 B14R1.4257 Cc1cc(CC(Br)C(O)=O)cc(C)c1 Amb23320610 [0,2,0,0,0,0|1,0,0]=3 6105 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(Cl)[n]1 Amb25684945 [0,2,0,0,0,0|2,0,0]=4 6106 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(Cl)c1 Amb25754465 [0,2,0,0,0,0|1,0,0]=3 6107 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(F)c1 Amb25251900 [0,2,0,0,0,0|1,0,0]=3 6108 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(O)c1 Amb24359044 [0,2,0,0,0,0|1,0,0]=3 6109 B14R1.4257 Cc1cc(CC(F)C(O)=O)cc(Cl)c1 Amb25352804 [0,2,0,0,0,0|1,0,0]=3 6110 B14R1.4257 Cc1cc(CC(N)C(O)=O)cc(C)c1 Amb19348396 [0,2,0,0,0,0|0,0,0]=2 6111 B14R1.4257 Cc1cc(CC(N)C(O)=O)cc(Cl)[n]1 Amb25055161 [0,2,0,0,0,0|1,0,0]=3 6112 B14R1.4257 Cc1cc(CC(O)C(O)=O)[n]c(C)c1 Amb24443123 [0,2,0,0,0,0|2,0,0]=4 6113 B14R1.4257 Cc1cc(CC(S)C(O)=O)cc(C)c1 Amb25266214 [0,2,0,0,0,0|1,0,0]=3 6114 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(C)c1 Amb19061744 [0,2,0,0,0,0|0,0,0]=2 6115 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(Cl)[n]1 Amb25750049 [0,2,0,0,0,0|1,0,0]=3 6116 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(Cl)c1 Amb24446519 [0,2,0,0,0,0|0,0,0]=2 6117 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(F)c1 Amb24426801 [0,2,0,0,0,0|0,0,0]=2 6118 B14R1.4257 Cc1cc(C[C@H](N)C(O)=O)cc(Br)c1 Amb25804244 [0,2,0,0,0,0|0,0,0]=2 6119 B14R1.4257 Cc1cc(C[C@H](N)C(O)=O)cc(C)c1 Amb24087704 [0,2,0,0,0,0|0,0,0]=2 6120 B14R1.4257 Cc1cc(C[C@H](N)C(O)=O)cc(Cl)[n]1 Amb24610641 [0,2,0,0,0,0|1,0,0]=3 6121 B14R1.4257 Cc1cc(O)[n]c(CC(N)C(O)=O)[n]1 Amb24546976 [0,2,0,0,0,0|2,0,0]=4 6122 B14R1.4257 Cc1cc(\C=C(\N)/C(O)=O)cc(C)c1 Amb24731298 [0,2,0,0,0,0|0,0,2]=4 6123 B14R1.4257 Cc1cc(\C=C(\N)/C(O)=O)cc(F)c1 Amb25798051 [0,2,0,0,0,0|0,0,2]=4 6124 B14R1.4257 Cc1cc(cc(Br)c1)NC(C)C(O)=O Amb25315673 [0,2,0,0,0,0|2,0,0]=4 6125 B14R1.4257 Cc1cc(cc(F)c1)NC(C)C(O)=O Amb25280451 [0,2,0,0,0,0|2,0,0]=4 6126 B14R1.4257 ClC(C(=O)C)Cc1cc(Cl)cc(c1)Cl Amb17204745 [0,2,0,0,0,0|2,0,0]=4 6127 B14R1.4257 ClC(C(=O)N)Cc1cc(C)cc(c1)C Amb17204437 [0,2,0,0,0,0|2,0,0]=4 6128 B14R1.4257 ClC(C(=O)N)Cc1cc(Cl)cc(c1)Cl Amb17204752 [0,2,0,0,0,0|2,0,0]=4 6129 B14R1.4257 ClC(C(=O)O)Cc1cc(C)cc(c1)C Amb17204443 [0,2,0,0,0,0|1,0,0]=3 6130 B14R1.4257 ClC(C(=O)O)Cc1cc(Cl)cc(c1)Cl Amb17204775 [0,2,0,0,0,0|1,0,0]=3 6131 B14R1.4257 NC(=O)C(Br)Cc1cc(F)cc(Cl)c1 Amb24500054 [0,2,0,0,0,0|2,0,0]=4 6132 B14R1.4257 NC(=O)C(Br)Cc1cc(F)cc(F)c1 Amb24471656 [0,2,0,0,0,0|2,0,0]=4 6133 B14R1.4257 NC(=O)C(Cl)Cc1cc(Cl)cc(F)c1 Amb25336262 [0,2,0,0,0,0|2,0,0]=4 6134 B14R1.4257 NC(=O)C(Cl)Cc1cc(F)cc(Br)c1 Amb25294562 [0,2,0,0,0,0|2,0,0]=4 6135 B14R1.4257 NC(=O)C(Cl)Cc1cc(F)cc(F)c1 Amb25692073 [0,2,0,0,0,0|2,0,0]=4 6136 B14R1.4257 NC(CC1=CC(=O)NC(=S)N1)C(O)=O Amb25326044 [0,2,0,0,0,0|2,0,0]=4 6137 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb18300561 [0,2,0,0,0,0|0,0,0]=2 6138 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb20627895 [0,2,0,0,0,0|0,0,0]=2 6139 B14R1.4257 NC(Cc1cc(F)cc(Cl)c1)C(O)=O Amb22738184 [0,2,0,0,0,0|0,0,0]=2 6140 B14R1.4257 NC(Cc1cc(F)cc(F)c1)P(O)=O Amb25802822 [0,2,0,0,0,0|1,0,0]=3 6141 B14R1.4257 NC(Cc1cc(O)cc(F)c1)C(O)=O Amb25791570 [0,2,0,0,0,0|0,0,0]=2 6142 B14R1.4257 NC(Cc1cc(O)cc(O)c1)C(O)=O Amb22002701 [0,2,0,0,0,0|0,0,0]=2 6143 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb22229070 [0,2,0,0,0,0|0,0,0]=2 6144 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(I)c1)C(O)=O Amb24587152 [0,2,0,0,0,0|0,0,0]=2 6145 B14R1.4257 N[C@@H](Cc1cc(F)cc(Cl)c1)C(O)=O Amb25761525 [0,2,0,0,0,0|0,0,0]=2 6146 B14R1.4257 N[C@@H](Cc1cc(I)cc(I)c1)C(O)=O Amb22232859 [0,2,0,0,0,0|0,0,0]=2 6147 B14R1.4257 N[C@@H](Cc1cc(O)[n]c(O)c1)C(O)=O Amb25812868 [0,2,0,0,0,0|1,0,0]=3 6148 B14R1.4257 N[C@@H](Cc1cc(O)cc(O)c1)C(O)=O Amb22229078 [0,2,0,0,0,0|0,0,0]=2 6149 B14R1.4257 N[C@@H](Cc1cc(O)cc(O)c1)C(O)=O Amb23438870 [0,2,0,0,0,0|0,0,0]=2 6150 B14R1.4257 N[C@H](Cc1cc(Br)cc(Br)c1)C(O)=O Amb25702985 [0,2,0,0,0,0|0,0,0]=2 6151 B14R1.4257 N[C@H](Cc1cc(Cl)cc(Br)c1)C(O)=O Amb25664947 [0,2,0,0,0,0|0,0,0]=2 6152 B14R1.4257 N[C@H](Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb22229068 [0,2,0,0,0,0|0,0,0]=2 6153 B14R1.4257 N[C@H](Cc1cc(Cl)cc(I)c1)C(O)=O Amb25771105 [0,2,0,0,0,0|0,0,0]=2 6154 B14R1.4257 N[C@H](Cc1cc(I)cc(I)c1)C(O)=O Amb25075204 [0,2,0,0,0,0|0,0,0]=2 6155 B14R1.4257 N[C@H](Cc1cc(O)[n]c(O)c1)C(O)=O Amb25723345 [0,2,0,0,0,0|1,0,0]=3 6156 B14R1.4257 N[C@H](Cc1cc(O)cc(F)c1)C(O)=O Amb25342632 [0,2,0,0,0,0|0,0,0]=2 6157 B14R1.4257 N[C@H](Cc1cc(O)cc(O)c1)C(O)=O Amb22229077 [0,2,0,0,0,0|0,0,0]=2 6158 B14R1.4257 Nc1cc(Cl)[n]c(CC(N)C(O)=O)[n]1 Amb24452200 [0,2,0,0,0,0|2,0,0]=4 6159 B14R1.4257 Nc1cc(F)cc(c1)SC(F)C(O)=O Amb25131765 [0,2,0,0,0,0|2,0,0]=4 6160 B14R1.4257 OC(=O)C(=O)Cc1cc(Br)cc(Br)c1 Amb24532316 [0,2,0,0,0,0|1,0,1]=4 6161 B14R1.4257 OC(=O)C(=O)Cc1cc(Cl)cc(Cl)c1 Amb18288917 [0,2,0,0,0,0|1,0,1]=4 6162 B14R1.4257 OC(=O)C(=O)Cc1cc(F)cc(O)c1 Amb25818974 [0,2,0,0,0,0|1,0,1]=4 6163 B14R1.4257 OC(=O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb23320633 [0,2,0,0,0,0|1,0,0]=3 6164 B14R1.4257 OC(=O)C(F)Cc1cc(Br)cc(Br)c1 Amb24569309 [0,2,0,0,0,0|1,0,0]=3 6165 B14R1.4257 OC(=O)C(F)Cc1cc(F)cc(Br)c1 Amb25200788 [0,2,0,0,0,0|1,0,0]=3 6166 B14R1.4257 OC(=O)C(F)Cc1cc(F)cc(F)c1 Amb24472049 [0,2,0,0,0,0|1,0,0]=3 6167 B14R1.4257 OC(=O)C(F)Oc1cc(F)cc(Br)c1 Amb25785912 [0,2,0,0,0,0|2,0,0]=4 6168 B14R1.4257 OC(=O)C(F)Oc1cc(F)cc(F)c1 Amb24567735 [0,2,0,0,0,0|2,0,0]=4 6169 B14R1.4257 OC(=O)C(F)Sc1cc(Cl)cc(Cl)c1 Amb24535738 [0,2,0,0,0,0|2,0,0]=4 6170 B14R1.4257 OC(=O)C(O)Cc1cc(Cl)cc(Cl)c1 Amb24472418 [0,2,0,0,0,0|1,0,0]=3 6171 B14R1.4257 Oc1cc(CC(F)C(O)=O)cc(F)c1 Amb25260509 [0,2,0,0,0,0|1,0,0]=3 6172 B14R1.4404 Brc1cccc(c1)CC(C(=O)O)(C)C Amb17265522 [0,2,0,0,0,0|1,0,0]=3 6173 B14R1.4404 Brc1cccc(c1)CC(C(=O)O)(N)C Amb17266142 [0,2,0,0,0,0|0,0,0]=2 6174 B14R1.4404 Brc1cccc(c1)C[C@@](C(=O)O)(N)C Amb10066901 [0,2,0,0,0,0|0,0,0]=2 6175 B14R1.4404 CC(Br)(Cc1cccc(Cl)c1)C(O)=O Amb25029122 [0,2,0,0,0,0|1,0,0]=3 6176 B14R1.4404 CC(C)(Cc1c[n]cc(F)c1)C(O)=O Amb25256410 [0,2,0,0,0,0|2,0,0]=4 6177 B14R1.4404 CC(C)(Oc1cccc(N)c1)C(O)=O Amb18111930 [0,2,0,0,0,0|2,0,0]=4 6178 B14R1.4404 CC(C)(Sc1cccc(Br)c1)C(O)=O Amb25164898 [0,2,0,0,0,0|2,0,0]=4 6179 B14R1.4404 CC(C)(Sc1cccc(F)c1)C(O)=O Amb25847199 [0,2,0,0,0,0|2,0,0]=4 6180 B14R1.4404 CC(Cl)(Cc1cccc(Br)c1)C(O)=O Amb25029076 [0,2,0,0,0,0|1,0,0]=3 6181 B14R1.4404 CC(F)(Cc1cccc(Cl)c1)C(O)=O Amb25217872 [0,2,0,0,0,0|1,0,0]=3 6182 B14R1.4404 CC(N)(Cc1c[n]cc(Br)c1)C(O)=O Amb25077509 [0,2,0,0,0,0|1,0,0]=3 6183 B14R1.4404 CC(N)(Cc1cc(Cl)cc[n]1)C(O)=O Amb25812727 [0,2,0,0,0,0|1,0,0]=3 6184 B14R1.4404 CC(N)(Cc1cc[n]c(Br)c1)C(O)=O Amb24555660 [0,2,0,0,0,0|1,0,0]=3 6185 B14R1.4404 CC(N)(Cc1cccc(Br)[n]1)C(O)=O Amb24395301 [0,2,0,0,0,0|1,0,0]=3 6186 B14R1.4404 CC(N)(Cc1cccc(F)[n]1)C(O)=O Amb25721112 [0,2,0,0,0,0|1,0,0]=3 6187 B14R1.4404 CC(N)(Cc1cccc(F)c1)C(N)=O Amb25731610 [0,2,0,0,0,0|1,0,0]=3 6188 B14R1.4404 CC(N)(Cc1cccc(N)[n]1)C(O)=O Amb25786430 [0,2,0,0,0,0|1,0,0]=3 6189 B14R1.4404 CC(O)(Cc1cccc(Cl)c1)C(O)=O Amb25278384 [0,2,0,0,0,0|1,0,0]=3 6190 B14R1.4404 CC(O)(Cc1cccc(F)c1)C(N)=O Amb24702916 [0,2,0,0,0,0|2,0,0]=4 6191 B14R1.4404 C[C@@](N)(Cc1cc(N)ccc1)C(O)=O Amb25791126 [0,2,0,0,0,0|0,0,0]=2 6192 B14R1.4404 C[C@@](N)(Cc1cc(O)ccc1)C(O)=O Amb22751251 [0,2,0,0,0,0|0,0,0]=2 6193 B14R1.4404 C[C@@](N)(Cc1cccc(Cl)c1)C(O)=O Amb25703828 [0,2,0,0,0,0|0,0,0]=2 6194 B14R1.4404 C[C@@](N)(Cc1cccc(F)c1)C(O)=O Amb23439046 [0,2,0,0,0,0|0,0,0]=2 6195 B14R1.4404 C[C@@](N)(Cc1cccc(S)c1)C(O)=O Amb24382646 [0,2,0,0,0,0|0,0,0]=2 6196 B14R1.4404 C[C@@](O)(Cc1cccc(Br)c1)C(O)=O Amb24452123 [0,2,0,0,0,0|1,0,0]=3 6197 B14R1.4404 C[C@@](O)(Cc1cccc(Cl)c1)C(O)=O Amb24336050 [0,2,0,0,0,0|1,0,0]=3 6198 B14R1.4404 C[C@](N)(Cc1cc(N)[n]cc1)C(O)=O Amb24581689 [0,2,0,0,0,0|1,0,0]=3 6199 B14R1.4404 C[C@](N)(Cc1cc(O)ccc1)C(O)=O Amb24761288 [0,2,0,0,0,0|0,0,0]=2 6200 B14R1.4404 C[C@](N)(Cc1cccc(Cl)c1)C(O)=O Amb24468738 [0,2,0,0,0,0|0,0,0]=2 6201 B14R1.4404 C[C@](N)(Cc1cccc(F)c1)C(O)=O Amb25117945 [0,2,0,0,0,0|0,0,0]=2 6202 B14R1.4404 C[C@](N)(Cc1cccc(S)c1)C(O)=O Amb25826608 [0,2,0,0,0,0|0,0,0]=2 6203 B14R1.4404 C[C@](O)(Cc1cccc(Br)c1)C(O)=O Amb25729870 [0,2,0,0,0,0|1,0,0]=3 6204 B14R1.4404 Cc1c[n]cc(CC(C)(C)C(O)=O)c1 Amb24591319 [0,2,0,0,0,0|2,0,0]=4 6205 B14R1.4404 Cc1cc(CC(C)(Cl)C(O)=O)ccc1 Amb24463739 [0,2,0,0,0,0|1,0,0]=3 6206 B14R1.4404 Cc1cc(ccc1)SC(F)(F)C(O)=O Amb25733941 [0,2,0,0,0,0|2,0,0]=4 6207 B14R1.4404 Cc1cc[n]c(CC(C)(N)C(O)=O)c1 Amb25256020 [0,2,0,0,0,0|1,0,0]=3 6208 B14R1.4404 Cc1cccc(CC(C)(C)C(O)=O)[n]1 Amb25331309 [0,2,0,0,0,0|2,0,0]=4 6209 B14R1.4404 Cc1cccc(C[C@](C)(O)C(O)=O)c1 Amb25132097 [0,2,0,0,0,0|1,0,0]=3 6210 B14R1.4404 Cc1cccc(c1)CC(C(=O)O)(C)C Amb17235387 [0,2,0,0,0,0|1,0,0]=3 6211 B14R1.4404 Cc1cccc(c1)CC(C(=O)O)(N)C Amb17235615 [0,2,0,0,0,0|0,0,0]=2 6212 B14R1.4404 Clc1cccc(c1)CC(C(=O)O)(C)C Amb17241248 [0,2,0,0,0,0|1,0,0]=3 6213 B14R1.4404 Clc1cccc(c1)CC(C(=O)O)(N)C Amb17241539 [0,2,0,0,0,0|0,0,0]=2 6214 B14R1.4404 Fc1cccc(c1)CC(C(=O)O)(C)C Amb17333792 [0,2,0,0,0,0|1,0,0]=3 6215 B14R1.4404 Ic1cccc(c1)C[C@@](C(=O)O)(N)C Amb16183904 [0,2,0,0,0,0|0,0,0]=2 6216 B14R1.4404 Ic1cccc(c1)C[C@](C(=O)O)(N)C Amb16183898 [0,2,0,0,0,0|0,0,0]=2 6217 B14R1.4404 Nc1cc(ccc1)SC(F)(F)C(O)=O Amb25185760 [0,2,0,0,0,0|2,0,0]=4 6218 B14R1.4404 OC(=O)C(F)(F)Sc1cccc(Br)c1 Amb24659934 [0,2,0,0,0,0|2,0,0]=4 6219 B14R1.4404 OC(=O)C(F)(F)Sc1cccc(Cl)c1 Amb25134505 [0,2,0,0,0,0|2,0,0]=4 6220 B14R1.4405 CC(C)(O)C(N)Cc1cc(O)ccc1 Amb25855016 [0,2,0,0,0,0|1,0,1]=4 6221 B14R1.4405 Cc1cccc(CC(N)C(C)(C)O)c1 Amb25705221 [0,2,0,0,0,0|1,0,1]=4 6222 B14R1.4405 Cc1cccc(CC(N)P(O)(O)=O)[n]1 Amb24462830 [0,2,0,0,0,0|2,0,0]=4 6223 B14R1.4405 NC(Cc1cccc(Cl)c1)P(O)(O)=O Amb25766948 [0,2,0,0,0,0|1,0,0]=3 6224 B14R1.4405 NC(Cc1cccc(F)c1)P(O)(O)=O Amb24402919 [0,2,0,0,0,0|1,0,0]=3 6225 B14R1.4474 CC(=O)C(Br)Cc1cc(Br)ccc1Cl Amb24373683 [0,2,0,0,0,0|2,0,0]=4 6226 B14R1.4474 CC(=O)C(Br)Cc1cc(Br)ccc1F Amb24445578 [0,2,0,0,0,0|2,0,0]=4 6227 B14R1.4474 CC(=O)C(Br)Cc1cc(Cl)ccc1Cl Amb18084859 [0,2,0,0,0,0|2,0,0]=4 6228 B14R1.4474 CC(=O)C(Br)Cc1cc(Cl)ccc1F Amb24675765 [0,2,0,0,0,0|2,0,0]=4 6229 B14R1.4474 CC(=O)C(Br)Cc1cc(F)ccc1Br Amb24726933 [0,2,0,0,0,0|2,0,0]=4 6230 B14R1.4474 CC(=O)C(Br)Cc1cc(F)ccc1Cl Amb24594219 [0,2,0,0,0,0|2,0,0]=4 6231 B14R1.4474 CC(=O)C(C)Cc1cc(Cl)ccc1Br Amb25065824 [0,2,0,0,0,0|2,0,0]=4 6232 B14R1.4474 CC(=O)C(C)Cc1cc(Cl)ccc1Cl Amb24418335 [0,2,0,0,0,0|2,0,0]=4 6233 B14R1.4474 CC(=O)C(C)Cc1cc(Cl)ccc1F Amb18866568 [0,2,0,0,0,0|2,0,0]=4 6234 B14R1.4474 CC(=O)C(C)Cc1cc(F)ccc1F Amb18325481 [0,2,0,0,0,0|2,0,0]=4 6235 B14R1.4474 CC(=O)C(Cc1cc(C)ccc1C)C Amb17234965 [0,2,0,0,0,0|2,0,0]=4 6236 B14R1.4474 CC(=O)C(Cc1cc(C)ccc1C)Cl Amb17204429 [0,2,0,0,0,0|2,0,0]=4 6237 B14R1.4474 CC(=O)C(Cc1cc(Cl)ccc1Cl)Cl Amb17204744 [0,2,0,0,0,0|2,0,0]=4 6238 B14R1.4474 CC(=O)C(Cl)Cc1cc(F)ccc1F Amb24704308 [0,2,0,0,0,0|2,0,0]=4 6239 B14R1.4474 CC(C(=O)O)Cc1cc(F)ccc1F Amb17605835 [0,2,0,0,0,0|1,0,0]=3 6240 B14R1.4474 CC(C(=O)O)Nc1cc(Cl)ccc1Cl Amb17408470 [0,2,0,0,0,0|2,0,0]=4 6241 B14R1.4474 CC(C(=O)O)Sc1cc(Cl)ccc1Cl Amb1114451 [0,2,0,0,0,0|2,0,0]=4 6242 B14R1.4474 CC(C(=O)O)Sc1cc(F)ccc1F Amb1114026 [0,2,0,0,0,0|2,0,0]=4 6243 B14R1.4474 CC(Cc1cc(Cl)ccc1Cl)C(O)=O Amb22483423 [0,2,0,0,0,0|1,0,0]=3 6244 B14R1.4474 CC(Cc1cc(F)[n]cc1F)C(O)=O Amb25300770 [0,2,0,0,0,0|2,0,0]=4 6245 B14R1.4474 CC(Cc1cc(F)ccc1Cl)C(O)=O Amb24695088 [0,2,0,0,0,0|1,0,0]=3 6246 B14R1.4474 CC(Cc1cc(O)ccc1Cl)C(O)=O Amb25699867 [0,2,0,0,0,0|1,0,0]=3 6247 B14R1.4474 CC(NC1=CC(=O)C=CC1=O)C(O)=O Amb24498112 [0,2,0,0,0,0|2,0,0]=4 6248 B14R1.4474 CC(Nc1cc(Br)ccc1Br)C(O)=O Amb25118550 [0,2,0,0,0,0|2,0,0]=4 6249 B14R1.4474 CC(Nc1cc(Cl)ccc1F)C(O)=O Amb19000456 [0,2,0,0,0,0|2,0,0]=4 6250 B14R1.4474 CC(Nc1cc(F)ccc1F)C(O)=O Amb18999357 [0,2,0,0,0,0|2,0,0]=4 6251 B14R1.4474 CC(Nc1cc(I)ccc1Br)C(O)=O Amb25244944 [0,2,0,0,0,0|2,0,0]=4 6252 B14R1.4474 CC(Nc1cc(I)ccc1Cl)C(O)=O Amb24360858 [0,2,0,0,0,0|2,0,0]=4 6253 B14R1.4474 CC(Oc1cc(Br)ccc1Cl)C(O)=O Amb25183159 [0,2,0,0,0,0|2,0,0]=4 6254 B14R1.4474 CC(Oc1cc(Br)ccc1F)C(O)=O Amb25841963 [0,2,0,0,0,0|2,0,0]=4 6255 B14R1.4474 CC(Oc1cc(Cl)ccc1N)C(O)=O Amb18296944 [0,2,0,0,0,0|2,0,0]=4 6256 B14R1.4474 CC(Oc1cc(F)ccc1Br)C(O)=O Amb25284891 [0,2,0,0,0,0|2,0,0]=4 6257 B14R1.4474 CC(Oc1cc(F)ccc1Cl)C(O)=O Amb25679502 [0,2,0,0,0,0|2,0,0]=4 6258 B14R1.4474 CC(Oc1cc(F)ccc1N)C(O)=O Amb18981764 [0,2,0,0,0,0|2,0,0]=4 6259 B14R1.4474 CC(Oc1cc(N)ccc1Br)C(O)=O Amb25781236 [0,2,0,0,0,0|2,0,0]=4 6260 B14R1.4474 CC(Sc1cc(Cl)ccc1N)C(O)=O Amb25709070 [0,2,0,0,0,0|2,0,0]=4 6261 B14R1.4474 CC(Sc1cc(F)ccc1N)C(O)=O Amb25376539 [0,2,0,0,0,0|2,0,0]=4 6262 B14R1.4474 CC=1C=CC(=O)N(CC(N)C(O)=O)N1 Amb25830791 [0,2,0,0,0,0|2,0,0]=4 6263 B14R1.4474 C[C@@H](Oc1cc(Br)ccc1Cl)C(O)=O Amb25754258 [0,2,0,0,0,0|2,0,0]=4 6264 B14R1.4474 C[C@@H](Oc1cc(F)ccc1Cl)C(O)=O Amb24385822 [0,2,0,0,0,0|2,0,0]=4 6265 B14R1.4474 C[C@H](NC1=CC(=O)C=CC1=O)C(O)=O Amb24498245 [0,2,0,0,0,0|2,0,0]=4 6266 B14R1.4474 C[C@H](Oc1cc(Cl)ccc1Cl)C(O)=O Amb25671889 [0,2,0,0,0,0|2,0,0]=4 6267 B14R1.4474 C[C@H](Oc1cc(F)ccc1Br)C(O)=O Amb25692676 [0,2,0,0,0,0|2,0,0]=4 6268 B14R1.4474 Cc1c[n]c(N)c(C[C@@H](N)C(O)=O)c1 Amb25076732 [0,2,0,0,0,0|1,0,0]=3 6269 B14R1.4474 Cc1c[n]c(N)c(C[C@H](N)C(O)=O)c1 Amb25084517 [0,2,0,0,0,0|1,0,0]=3 6270 B14R1.4474 Cc1cc(CC(=O)C(O)=O)c(C)cc1 Amb18978989 [0,2,0,0,0,0|1,0,1]=4 6271 B14R1.4474 Cc1cc(CC(Br)C(C)=O)c(C)cc1 Amb18585222 [0,2,0,0,0,0|2,0,0]=4 6272 B14R1.4474 Cc1cc(CC(Br)C(N)=O)c(C)cc1 Amb25676778 [0,2,0,0,0,0|2,0,0]=4 6273 B14R1.4474 Cc1cc(CC(Br)C(N)=O)c(Cl)cc1 Amb25073013 [0,2,0,0,0,0|2,0,0]=4 6274 B14R1.4474 Cc1cc(CC(Br)C(N)=O)c(F)cc1 Amb25089000 [0,2,0,0,0,0|2,0,0]=4 6275 B14R1.4474 Cc1cc(CC(Br)C(O)=O)c(C)cc1 Amb23320606 [0,2,0,0,0,0|1,0,0]=3 6276 B14R1.4474 Cc1cc(CC(C)C(O)=O)c(C)cc1 Amb19050594 [0,2,0,0,0,0|1,0,0]=3 6277 B14R1.4474 Cc1cc(CC(Cl)C(N)=O)c(Br)cc1 Amb25796698 [0,2,0,0,0,0|2,0,0]=4 6278 B14R1.4474 Cc1cc(CC(F)C(O)=O)c(C)cc1 Amb25183609 [0,2,0,0,0,0|1,0,0]=3 6279 B14R1.4474 Cc1cc(CC(N)C(C)=C)c(C)cc1 Amb25167331 [0,2,0,0,0,0|2,0,0]=4 6280 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(Br)cc1 Amb25068352 [0,2,0,0,0,0|0,0,0]=2 6281 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(Cl)cc1 Amb25363453 [0,2,0,0,0,0|0,0,0]=2 6282 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(F)cc1 Amb22011666 [0,2,0,0,0,0|0,0,0]=2 6283 B14R1.4474 Cc1cc(CC(O)C(O)=O)c(C)cc1 Amb25372528 [0,2,0,0,0,0|1,0,0]=3 6284 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(Br)cc1 Amb25858033 [0,2,0,0,0,0|0,0,0]=2 6285 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(C)cc1 Amb19061742 [0,2,0,0,0,0|0,0,0]=2 6286 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(Cl)cc1 Amb25305742 [0,2,0,0,0,0|0,0,0]=2 6287 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(Br)cc1 Amb24499102 [0,2,0,0,0,0|0,0,0]=2 6288 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(C)cc1 Amb22228362 [0,2,0,0,0,0|0,0,0]=2 6289 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(Cl)cc1 Amb25207104 [0,2,0,0,0,0|0,0,0]=2 6290 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(F)cc1 Amb24398947 [0,2,0,0,0,0|0,0,0]=2 6291 B14R1.4474 Cc1cc(OC(F)C(O)=O)c(C)cc1 Amb25856750 [0,2,0,0,0,0|2,0,0]=4 6292 B14R1.4474 Cc1cc(OC(F)C(O)=O)c(Cl)cc1 Amb24498516 [0,2,0,0,0,0|2,0,0]=4 6293 B14R1.4474 Cc1cc(\C=C(\N)/C(O)=O)c(Cl)cc1 Amb24339218 [0,2,0,0,0,0|0,0,2]=4 6294 B14R1.4474 Cc1ccc(Br)c(CC(Br)C(N)=O)c1 Amb25126562 [0,2,0,0,0,0|2,0,0]=4 6295 B14R1.4474 Cc1ccc(Br)c(CC(C)C(O)=O)c1 Amb25320687 [0,2,0,0,0,0|1,0,0]=3 6296 B14R1.4474 Cc1ccc(Br)c(c1)NC(C)C(O)=O Amb24455204 [0,2,0,0,0,0|2,0,0]=4 6297 B14R1.4474 Cc1ccc(Br)cc1CC(=O)C(O)=O Amb25281136 [0,2,0,0,0,0|1,0,1]=4 6298 B14R1.4474 Cc1ccc(Br)cc1CC(Br)C(N)=O Amb25133455 [0,2,0,0,0,0|2,0,0]=4 6299 B14R1.4474 Cc1ccc(Br)cc1CC(C)C(C)=O Amb25031152 [0,2,0,0,0,0|2,0,0]=4 6300 B14R1.4474 Cc1ccc(Br)cc1CC(C)C(O)=O Amb24361964 [0,2,0,0,0,0|1,0,0]=3 6301 B14R1.4474 Cc1ccc(Br)cc1CC(Cl)C(N)=O Amb25303770 [0,2,0,0,0,0|2,0,0]=4 6302 B14R1.4474 Cc1ccc(Br)cc1CC(N)C(N)=O Amb25031131 [0,2,0,0,0,0|1,0,0]=3 6303 B14R1.4474 Cc1ccc(Br)cc1C[C@@H](N)C(O)=O Amb25217556 [0,2,0,0,0,0|0,0,0]=2 6304 B14R1.4474 Cc1ccc(Br)cc1C[C@H](N)C(O)=O Amb24664141 [0,2,0,0,0,0|0,0,0]=2 6305 B14R1.4474 Cc1ccc(Br)cc1OC(C)C(O)=O Amb24687292 [0,2,0,0,0,0|2,0,0]=4 6306 B14R1.4474 Cc1ccc(Br)cc1O[C@@H](C)C(O)=O Amb25797211 [0,2,0,0,0,0|2,0,0]=4 6307 B14R1.4474 Cc1ccc(Br)cc1O[C@H](C)C(O)=O Amb24455961 [0,2,0,0,0,0|2,0,0]=4 6308 B14R1.4474 Cc1ccc(C)cc1\C=C(\N)/C(O)=O Amb24468653 [0,2,0,0,0,0|0,0,2]=4 6309 B14R1.4474 Cc1ccc(Cl)c(CC(C)C(O)=O)c1 Amb25028914 [0,2,0,0,0,0|1,0,0]=3 6310 B14R1.4474 Cc1ccc(Cl)c(c1)O[C@H](C)C(O)=O Amb25806925 [0,2,0,0,0,0|2,0,0]=4 6311 B14R1.4474 Cc1ccc(Cl)cc1CC(Br)C(C)=O Amb18076227 [0,2,0,0,0,0|2,0,0]=4 6312 B14R1.4474 Cc1ccc(Cl)cc1CC(Br)C(O)=O Amb23320627 [0,2,0,0,0,0|1,0,0]=3 6313 B14R1.4474 Cc1ccc(Cl)cc1C[C@@H](N)C(O)=O Amb25363915 [0,2,0,0,0,0|0,0,0]=2 6314 B14R1.4474 Cc1ccc(Cl)cc1C[C@H](N)C(O)=O Amb25786160 [0,2,0,0,0,0|0,0,0]=2 6315 B14R1.4474 Cc1ccc(Cl)cc1OC(F)C(O)=O Amb24498549 [0,2,0,0,0,0|2,0,0]=4 6316 B14R1.4474 Cc1ccc(Cl)cc1O[C@@H](C)C(O)=O Amb25754259 [0,2,0,0,0,0|2,0,0]=4 6317 B14R1.4474 Cc1ccc(Cl)cc1O[C@H](C)C(O)=O Amb24455941 [0,2,0,0,0,0|2,0,0]=4 6318 B14R1.4474 Cc1ccc(F)c(CC(C)C(=O)Cl)c1 Amb25777004 [0,2,0,0,0,0|2,0,0]=4 6319 B14R1.4474 Cc1ccc(F)c(CC(C)C(O)=O)c1 Amb25777200 [0,2,0,0,0,0|1,0,0]=3 6320 B14R1.4474 Cc1ccc(F)c(CC(F)C(O)=O)c1 Amb25284684 [0,2,0,0,0,0|1,0,0]=3 6321 B14R1.4474 Cc1ccc(F)c(c1)NC(C)C(O)=O Amb18981768 [0,2,0,0,0,0|2,0,0]=4 6322 B14R1.4474 Cc1ccc(F)c(c1)OC(C)C(O)=O Amb25704905 [0,2,0,0,0,0|2,0,0]=4 6323 B14R1.4474 Cc1ccc(F)c(c1)OC(F)C(O)=O Amb25732241 [0,2,0,0,0,0|2,0,0]=4 6324 B14R1.4474 Cc1ccc(F)c(c1)O[C@@H](C)C(O)=O Amb25304551 [0,2,0,0,0,0|2,0,0]=4 6325 B14R1.4474 Cc1ccc(F)cc1CC(=O)C(O)=O Amb25857137 [0,2,0,0,0,0|1,0,1]=4 6326 B14R1.4474 Cc1ccc(F)cc1CC(C)C(O)=O Amb24732449 [0,2,0,0,0,0|1,0,0]=3 6327 B14R1.4474 Cc1ccc(F)cc1CC(Cl)C(N)=O Amb25354534 [0,2,0,0,0,0|2,0,0]=4 6328 B14R1.4474 Cc1ccc(F)cc1CC(F)C(O)=O Amb25028754 [0,2,0,0,0,0|1,0,0]=3 6329 B14R1.4474 Cc1ccc(F)cc1CC(N)C(O)=O Amb22738112 [0,2,0,0,0,0|0,0,0]=2 6330 B14R1.4474 Cc1ccc(F)cc1CC(O)C(O)=O Amb24688553 [0,2,0,0,0,0|1,0,0]=3 6331 B14R1.4474 Cc1ccc(F)cc1NC(C)C(O)=O Amb18999360 [0,2,0,0,0,0|2,0,0]=4 6332 B14R1.4474 Cc1ccc(F)cc1O[C@@H](C)C(O)=O Amb24387338 [0,2,0,0,0,0|2,0,0]=4 6333 B14R1.4474 Cc1ccc(F)cc1O[C@H](C)C(O)=O Amb25821563 [0,2,0,0,0,0|2,0,0]=4 6334 B14R1.4474 Cc1ccc(F)cc1\C=C(\N)/C(O)=O Amb24685348 [0,2,0,0,0,0|0,0,2]=4 6335 B14R1.4474 Cc1ccc(I)cc1CC(Br)C(C)=O Amb25242413 [0,2,0,0,0,0|2,0,0]=4 6336 B14R1.4474 Cc1ccc(I)cc1CC(Cl)C(N)=O Amb25258676 [0,2,0,0,0,0|2,0,0]=4 6337 B14R1.4474 Cc1ccc(I)cc1C[C@H](N)C(O)=O Amb25343363 [0,2,0,0,0,0|0,0,0]=2 6338 B14R1.4474 Cc1ccc(I)cc1NC(C)C(O)=O Amb25737526 [0,2,0,0,0,0|2,0,0]=4 6339 B14R1.4474 Cc1ccc(N)c(CC(N)C(O)=O)c1 Amb25062542 [0,2,0,0,0,0|0,0,0]=2 6340 B14R1.4474 Cc1ccc(N)c(c1)NC(C)C(O)=O Amb23114188 [0,2,0,0,0,0|2,0,0]=4 6341 B14R1.4474 Cc1ccc(N)c(c1)OC(C)C(O)=O Amb18301895 [0,2,0,0,0,0|2,0,0]=4 6342 B14R1.4474 Cc1ccc(N)cc1CC(N)C(O)=O Amb25701785 [0,2,0,0,0,0|0,0,0]=2 6343 B14R1.4474 Cc1ccc(N)cc1OC(C)C(O)=O Amb18999352 [0,2,0,0,0,0|2,0,0]=4 6344 B14R1.4474 Cc1ccc(O)c(CC(C)C(O)=O)c1 Amb24652411 [0,2,0,0,0,0|1,0,0]=3 6345 B14R1.4474 Cc1ccc(O)c(C[C@@H](N)C(O)=O)c1 Amb24712160 [0,2,0,0,0,0|0,0,0]=2 6346 B14R1.4474 Cc1ccc(O)c(C[C@H](N)C(O)=O)c1 Amb24621792 [0,2,0,0,0,0|0,0,0]=2 6347 B14R1.4474 Cc1ccc(O)cc1C[C@@H](N)C(O)=O Amb25340505 [0,2,0,0,0,0|0,0,0]=2 6348 B14R1.4474 Cc1ccc(O)cc1C[C@H](N)C(O)=O Amb25749760 [0,2,0,0,0,0|0,0,0]=2 6349 B14R1.4474 Cc1ccc(cc1CC(C(=O)C)Cl)Cl Amb17204555 [0,2,0,0,0,0|2,0,0]=4 6350 B14R1.4474 Cc1ccc(cc1CC(C(=O)N)Cl)C Amb17204435 [0,2,0,0,0,0|2,0,0]=4 6351 B14R1.4474 Cc1ccc(cc1CC(C(=O)N)Cl)Cl Amb17204559 [0,2,0,0,0,0|2,0,0]=4 6352 B14R1.4474 Cc1ccc(cc1CC(C(=O)O)Cl)C Amb17204441 [0,2,0,0,0,0|1,0,0]=3 6353 B14R1.4474 Cc1ccc(cc1CC(C(=O)O)Cl)Cl Amb17204586 [0,2,0,0,0,0|1,0,0]=3 6354 B14R1.4474 NC(=O)C(Br)Cc1cc(Br)ccc1Br Amb25783565 [0,2,0,0,0,0|2,0,0]=4 6355 B14R1.4474 NC(=O)C(Br)Cc1cc(Br)ccc1Cl Amb24348288 [0,2,0,0,0,0|2,0,0]=4 6356 B14R1.4474 NC(=O)C(Br)Cc1cc(Br)ccc1F Amb25783563 [0,2,0,0,0,0|2,0,0]=4 6357 B14R1.4474 NC(=O)C(Br)Cc1cc(Cl)ccc1Br Amb24471975 [0,2,0,0,0,0|2,0,0]=4 6358 B14R1.4474 NC(=O)C(Br)Cc1cc(Cl)ccc1Cl Amb24530461 [0,2,0,0,0,0|2,0,0]=4 6359 B14R1.4474 NC(=O)C(Br)Cc1cc(Cl)ccc1F Amb24438148 [0,2,0,0,0,0|2,0,0]=4 6360 B14R1.4474 NC(=O)C(Br)Cc1cc(F)ccc1Br Amb25033532 [0,2,0,0,0,0|2,0,0]=4 6361 B14R1.4474 NC(=O)C(Cc1cc(Cl)ccc1Cl)Cl Amb17204751 [0,2,0,0,0,0|2,0,0]=4 6362 B14R1.4474 NC(=O)C(Cl)Cc1cc(Br)ccc1Br Amb25704736 [0,2,0,0,0,0|2,0,0]=4 6363 B14R1.4474 NC(=O)C(Cl)Cc1cc(Br)ccc1Cl Amb24447399 [0,2,0,0,0,0|2,0,0]=4 6364 B14R1.4474 NC(=O)C(Cl)Cc1cc(Br)ccc1F Amb24405519 [0,2,0,0,0,0|2,0,0]=4 6365 B14R1.4474 NC(=O)C(Cl)Cc1cc(Cl)ccc1F Amb25716388 [0,2,0,0,0,0|2,0,0]=4 6366 B14R1.4474 NC(=O)C(Cl)Cc1cc(F)ccc1F Amb24530464 [0,2,0,0,0,0|2,0,0]=4 6367 B14R1.4474 NC(=O)C(Cl)Cc1cc(I)ccc1Cl Amb24507936 [0,2,0,0,0,0|2,0,0]=4 6368 B14R1.4474 NC(=O)C(N)CN1C=C(Br)C=CC1=O Amb25787495 [0,2,0,0,0,0|2,0,0]=4 6369 B14R1.4474 NC(=O)C(N)Cc1cc(Cl)ccc1F Amb24507413 [0,2,0,0,0,0|1,0,0]=3 6370 B14R1.4474 NC(=O)C(N)Cc1cc(F)ccc1Cl Amb25769912 [0,2,0,0,0,0|1,0,0]=3 6371 B14R1.4474 NC(CN1C=C(Br)C=CC1=O)C(O)=O Amb25766385 [0,2,0,0,0,0|1,0,0]=3 6372 B14R1.4474 NC(CN1NC(=O)C=CC1=O)C(O)=O Amb25118488 [0,2,0,0,0,0|2,0,0]=4 6373 B14R1.4474 NC(Cc1[n]c(Cl)ccc1Cl)C(O)=O Amb25780752 [0,2,0,0,0,0|1,0,0]=3 6374 B14R1.4474 NC(Cc1cc(Br)c[n]c1O)C(O)=O Amb25800162 [0,2,0,0,0,0|1,0,0]=3 6375 B14R1.4474 NC(Cc1cc(Br)ccc1Cl)C(O)=O Amb25193399 [0,2,0,0,0,0|0,0,0]=2 6376 B14R1.4474 NC(Cc1cc(Cl)ccc1F)C(O)=O Amb18225658 [0,2,0,0,0,0|0,0,0]=2 6377 B14R1.4474 NC(Cc1cc(Cl)ccc1O)C(O)=O Amb19000855 [0,2,0,0,0,0|0,0,0]=2 6378 B14R1.4474 NC(Cc1cc(F)[n]cc1F)C(O)=O Amb24511436 [0,2,0,0,0,0|1,0,0]=3 6379 B14R1.4474 NC(Cc1cc(F)c[n]c1Cl)C(O)=O Amb25212912 [0,2,0,0,0,0|1,0,0]=3 6380 B14R1.4474 NC(Cc1cc(F)ccc1Cl)C(O)=O Amb18769201 [0,2,0,0,0,0|0,0,0]=2 6381 B14R1.4474 NC(Cc1cc(F)ccc1I)C(O)=O Amb24375672 [0,2,0,0,0,0|0,0,0]=2 6382 B14R1.4474 NC(Cc1cc(I)ccc1I)C(O)=O Amb25322230 [0,2,0,0,0,0|0,0,0]=2 6383 B14R1.4474 NC(Cc1cc(O)ccc1Br)C(O)=O Amb18668185 [0,2,0,0,0,0|0,0,0]=2 6384 B14R1.4474 NC(Cc1cc(O)ccc1Cl)C(O)=O Amb25287152 [0,2,0,0,0,0|0,0,0]=2 6385 B14R1.4474 NC(Cc1cc(O)ccc1F)C(O)=O Amb18130582 [0,2,0,0,0,0|0,0,0]=2 6386 B14R1.4474 N[C@@H](Cc1[n]c(Cl)ccc1Cl)C(O)=O Amb25800216 [0,2,0,0,0,0|1,0,0]=3 6387 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1Cl)C(O)=O Amb24678954 [0,2,0,0,0,0|0,0,0]=2 6388 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1F)C(O)=O Amb25062850 [0,2,0,0,0,0|0,0,0]=2 6389 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1O)C(O)=O Amb25726419 [0,2,0,0,0,0|0,0,0]=2 6390 B14R1.4474 N[C@@H](Cc1cc(Cl)[n]cc1Br)C(O)=O Amb24408546 [0,2,0,0,0,0|1,0,0]=3 6391 B14R1.4474 N[C@@H](Cc1cc(Cl)[n]cc1F)C(O)=O Amb24511102 [0,2,0,0,0,0|1,0,0]=3 6392 B14R1.4474 N[C@@H](Cc1cc(Cl)c[n]c1Cl)C(O)=O Amb25195347 [0,2,0,0,0,0|1,0,0]=3 6393 B14R1.4474 N[C@@H](Cc1cc(Cl)c[n]c1F)C(O)=O Amb25764459 [0,2,0,0,0,0|1,0,0]=3 6394 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Br)C(O)=O Amb25727085 [0,2,0,0,0,0|0,0,0]=2 6395 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb22228353 [0,2,0,0,0,0|0,0,0]=2 6396 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb23399720 [0,2,0,0,0,0|0,0,0]=2 6397 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1F)C(O)=O Amb25793157 [0,2,0,0,0,0|0,0,0]=2 6398 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1I)C(O)=O Amb25783838 [0,2,0,0,0,0|0,0,0]=2 6399 B14R1.4474 N[C@@H](Cc1cc(F)ccc1F)C(O)=O Amb19087680 [0,2,0,0,0,0|0,0,0]=2 6400 B14R1.4474 N[C@@H](Cc1cc(F)ccc1I)C(O)=O Amb25066516 [0,2,0,0,0,0|0,0,0]=2 6401 B14R1.4474 N[C@@H](Cc1cc(I)ccc1Cl)C(O)=O Amb24451620 [0,2,0,0,0,0|0,0,0]=2 6402 B14R1.4474 N[C@@H](Cc1cc(O)ccc1O)C(O)=O Amb22228356 [0,2,0,0,0,0|0,0,0]=2 6403 B14R1.4474 N[C@H](Cc1[n]c(Cl)ccc1Cl)C(O)=O Amb24535250 [0,2,0,0,0,0|1,0,0]=3 6404 B14R1.4474 N[C@H](Cc1cc(Br)ccc1Br)C(O)=O Amb25841588 [0,2,0,0,0,0|0,0,0]=2 6405 B14R1.4474 N[C@H](Cc1cc(Br)ccc1Cl)C(O)=O Amb25691521 [0,2,0,0,0,0|0,0,0]=2 6406 B14R1.4474 N[C@H](Cc1cc(Br)ccc1O)C(O)=O Amb25354524 [0,2,0,0,0,0|0,0,0]=2 6407 B14R1.4474 N[C@H](Cc1cc(Cl)[n]cc1F)C(O)=O Amb25193414 [0,2,0,0,0,0|1,0,0]=3 6408 B14R1.4474 N[C@H](Cc1cc(Cl)c[n]c1F)C(O)=O Amb24505919 [0,2,0,0,0,0|1,0,0]=3 6409 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb22228352 [0,2,0,0,0,0|0,0,0]=2 6410 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1I)C(O)=O Amb24467769 [0,2,0,0,0,0|0,0,0]=2 6411 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1O)C(O)=O Amb25792747 [0,2,0,0,0,0|0,0,0]=2 6412 B14R1.4474 N[C@H](Cc1cc(F)ccc1F)C(O)=O Amb19887665 [0,2,0,0,0,0|0,0,0]=2 6413 B14R1.4474 N[C@H](Cc1cc(F)ccc1I)C(O)=O Amb24603871 [0,2,0,0,0,0|0,0,0]=2 6414 B14R1.4474 N[C@H](Cc1cc(O)ccc1F)C(O)=O Amb25724385 [0,2,0,0,0,0|0,0,0]=2 6415 B14R1.4474 N[C@H](Cc1cc(O)ccc1O)C(O)=O Amb22228355 [0,2,0,0,0,0|0,0,0]=2 6416 B14R1.4474 N\C(=C\c1cc(Cl)ccc1Cl)\C(O)=O Amb25085548 [0,2,0,0,0,0|0,0,2]=4 6417 B14R1.4474 N\C(=C\c1cc(F)ccc1Cl)\C(O)=O Amb24444594 [0,2,0,0,0,0|0,0,2]=4 6418 B14R1.4474 Nc1[n]cc(Br)cc1C[C@H](N)C(O)=O Amb24424595 [0,2,0,0,0,0|1,0,0]=3 6419 B14R1.4474 Nc1cc(CC(N)C(O)=O)c(Br)c[n]1 Amb25742510 [0,2,0,0,0,0|1,0,0]=3 6420 B14R1.4474 Nc1cc(C[C@H](N)C(O)=O)c(Br)c[n]1 Amb24438718 [0,2,0,0,0,0|1,0,0]=3 6421 B14R1.4474 Nc1cc(C[C@H](N)C(O)=O)c(N)cc1 Amb25708458 [0,2,0,0,0,0|0,0,0]=2 6422 B14R1.4474 Nc1ccc(Br)cc1CC(N)C(O)=O Amb24399924 [0,2,0,0,0,0|0,0,0]=2 6423 B14R1.4474 Nc1ccc(Br)cc1SC(F)C(O)=O Amb24498721 [0,2,0,0,0,0|2,0,0]=4 6424 B14R1.4474 Nc1ccc(Cl)c(C[C@@H](N)C(O)=O)c1 Amb24425013 [0,2,0,0,0,0|0,0,0]=2 6425 B14R1.4474 Nc1ccc(Cl)cc1CC(N)C(O)=O Amb25707564 [0,2,0,0,0,0|0,0,0]=2 6426 B14R1.4474 Nc1ccc(Cl)cc1C[C@@H](N)C(O)=O Amb24664382 [0,2,0,0,0,0|0,0,0]=2 6427 B14R1.4474 Nc1ccc(F)c(CC(N)C(O)=O)c1 Amb25063755 [0,2,0,0,0,0|0,0,0]=2 6428 B14R1.4474 Nc1ccc(F)c(C[C@@H](N)C(O)=O)c1 Amb25342014 [0,2,0,0,0,0|0,0,0]=2 6429 B14R1.4474 Nc1ccc(F)c(C[C@H](N)C(O)=O)c1 Amb25360924 [0,2,0,0,0,0|0,0,0]=2 6430 B14R1.4474 Nc1ccc(F)cc1CC(N)C(O)=O Amb18652765 [0,2,0,0,0,0|0,0,0]=2 6431 B14R1.4474 Nc1ccc(F)cc1C[C@@H](N)C(O)=O Amb24402834 [0,2,0,0,0,0|0,0,0]=2 6432 B14R1.4474 Nc1ccc(F)cc1C[C@H](N)C(O)=O Amb25131679 [0,2,0,0,0,0|0,0,0]=2 6433 B14R1.4474 Nc1ccc(O)c(CC(N)C(O)=O)c1 Amb25128000 [0,2,0,0,0,0|0,0,0]=2 6434 B14R1.4474 Nc1ccc(O)c(C[C@@H](N)C(O)=O)c1 Amb24655929 [0,2,0,0,0,0|0,0,0]=2 6435 B14R1.4474 Nc1ccc(O)cc1CC(N)C(O)=O Amb25127999 [0,2,0,0,0,0|0,0,0]=2 6436 B14R1.4474 Nc1ccc(O)cc1C[C@H](N)C(O)=O Amb25378751 [0,2,0,0,0,0|0,0,0]=2 6437 B14R1.4474 OC(=O)C(=O)Cc1cc(Br)ccc1F Amb1139984 [0,2,0,0,0,0|1,0,1]=4 6438 B14R1.4474 OC(=O)C(=O)Cc1cc(F)ccc1Br Amb25028844 [0,2,0,0,0,0|1,0,1]=4 6439 B14R1.4474 OC(=O)C(Cc1cc(Cl)ccc1Cl)Br Amb10596988 [0,2,0,0,0,0|1,0,0]=3 6440 B14R1.4474 OC(=O)C(Cc1cc(Cl)ccc1Cl)Cl Amb17204774 [0,2,0,0,0,0|1,0,0]=3 6441 B14R1.4474 OC(=O)C(Cc1cc(O)ccc1O)N Amb17595220 [0,2,0,0,0,0|0,0,0]=2 6442 B14R1.4474 OC(=O)C(F)Cc1cc(Br)ccc1F Amb24586119 [0,2,0,0,0,0|1,0,0]=3 6443 B14R1.4474 OC(=O)C(F)Cc1cc(Cl)ccc1Cl Amb24717269 [0,2,0,0,0,0|1,0,0]=3 6444 B14R1.4474 OC(=O)C(F)Cc1cc(Cl)ccc1F Amb25229337 [0,2,0,0,0,0|1,0,0]=3 6445 B14R1.4474 OC(=O)C(F)Cc1cc(F)ccc1Br Amb25200744 [0,2,0,0,0,0|1,0,0]=3 6446 B14R1.4474 OC(=O)C(F)Cc1cc(F)ccc1F Amb24375896 [0,2,0,0,0,0|1,0,0]=3 6447 B14R1.4474 OC(=O)C(F)Oc1cc(Cl)ccc1Cl Amb24730519 [0,2,0,0,0,0|2,0,0]=4 6448 B14R1.4474 OC(=O)C(F)Oc1cc(F)ccc1Cl Amb24428879 [0,2,0,0,0,0|2,0,0]=4 6449 B14R1.4474 OC(=O)C(O)Cc1cc(Cl)ccc1Cl Amb25193286 [0,2,0,0,0,0|1,0,0]=3 6450 B14R1.4474 OC(=O)C(Sc1cc(C)ccc1C)C Amb1129776 [0,2,0,0,0,0|2,0,0]=4 6451 B14R1.4474 Oc1cc(CC(O)C(O)=O)c(O)cc1 Amb24498275 [0,2,0,0,0,0|1,0,0]=3 6452 B14R1.243 CC(=O)C(Br)C(C)c1ccccc1Br Amb25239210 [0,2,0,0,0,0|2,0,0]=4 6453 B14R1.243 CC(=O)C(Br)C(C)c1ccccc1Cl Amb25731644 [0,2,0,0,0,0|2,0,0]=4 6454 B14R1.243 CC(C(Br)C(C)=O)c1ccccc1C Amb24696137 [0,2,0,0,0,0|2,0,0]=4 6455 B14R1.243 CC(C(C)c1c[n]ccc1N)C(O)=O Amb24359203 [0,2,0,0,0,0|2,0,0]=4 6456 B14R1.243 CC(C(C)c1ccc[n]c1N)C(O)=O Amb25786716 [0,2,0,0,0,0|2,0,0]=4 6457 B14R1.243 CC(C(C)c1ccccc1Br)C(O)=O Amb25200833 [0,2,0,0,0,0|1,0,0]=3 6458 B14R1.243 CC(C(C)c1ccccc1Cl)C(O)=O Amb24521299 [0,2,0,0,0,0|1,0,0]=3 6459 B14R1.243 CC(C(F)C(O)=O)c1ccccc1F Amb25165246 [0,2,0,0,0,0|1,0,0]=3 6460 B14R1.243 CC(C(N)C(O)=O)c1ccccc1Br Amb24679388 [0,2,0,0,0,0|0,0,0]=2 6461 B14R1.243 CC(C(N)C(O)=O)c1ccccc1N Amb18651900 [0,2,0,0,0,0|0,0,0]=2 6462 B14R1.243 CC(C(N)c1ccccc1N)C(O)=O Amb25247358 [0,2,0,0,0,0|1,0,0]=3 6463 B14R1.243 CC(C(O)=O)S(=O)c1ccccc1Cl Amb18292848 [0,2,0,0,0,0|2,0,0]=4 6464 B14R1.243 CC(C(O)=O)S(=O)c1ccccc1F Amb18985849 [0,2,0,0,0,0|2,0,0]=4 6465 B14R1.243 CC(C(O)C(O)=O)c1ccccc1Br Amb25301573 [0,2,0,0,0,0|1,0,0]=3 6466 B14R1.243 CC(C(O)c1ccc[n]c1Cl)C(O)=O Amb25666952 [0,2,0,0,0,0|2,0,0]=4 6467 B14R1.243 CC(C(O)c1ccccc1C)C(C)=O Amb25750420 [0,2,0,0,0,0|2,0,0]=4 6468 B14R1.243 CN(C(C)C(O)=O)c1ccccc1Br Amb25089404 [0,2,0,0,0,0|2,0,0]=4 6469 B14R1.243 CN(C(C)C(O)=O)c1ccccc1Cl Amb22967010 [0,2,0,0,0,0|2,0,0]=4 6470 B14R1.243 CN(C(C)C(O)=O)c1ccccc1F Amb22967078 [0,2,0,0,0,0|2,0,0]=4 6471 B14R1.243 CN(C(C)C(O)=O)c1ccccc1I Amb24751949 [0,2,0,0,0,0|2,0,0]=4 6472 B14R1.243 CN(C(C)C(O)=O)c1ccccc1N Amb18984722 [0,2,0,0,0,0|2,0,0]=4 6473 B14R1.243 C[C@H]([C@@H](N)C(O)=O)c1ccccc1N Amb24355363 [0,2,0,0,0,0|0,0,0]=2 6474 B14R1.243 C[C@H]([C@H](N)C(O)=O)c1ccccc1N Amb25193515 [0,2,0,0,0,0|0,0,0]=2 6475 B14R1.243 Cc1[n]cccc1C(O)C(C)C(O)=O Amb24751969 [0,2,0,0,0,0|2,0,0]=4 6476 B14R1.243 Cc1cc[n]cc1C(O)C(N)C(O)=O Amb24426460 [0,2,0,0,0,0|1,0,0]=3 6477 B14R1.243 Cc1ccccc1C(C)C(=C)C(O)=O Amb25815056 [0,2,0,0,0,0|1,0,1]=4 6478 B14R1.243 Cc1ccccc1C(C)C(C)C(O)=O Amb24552960 [0,2,0,0,0,0|1,0,0]=3 6479 B14R1.243 Cc1ccccc1C(C)C(F)C(O)=O Amb25165245 [0,2,0,0,0,0|1,0,0]=3 6480 B14R1.243 Cc1ccccc1C(C)C(O)C(O)=O Amb25779784 [0,2,0,0,0,0|1,0,0]=3 6481 B14R1.243 Cc1ccccc1C(O)C(N)C(O)=O Amb18814159 [0,2,0,0,0,0|0,0,0]=2 6482 B14R1.243 Cc1ccccc1C(O)[C@H](N)C(O)=O Amb25725073 [0,2,0,0,0,0|0,0,0]=2 6483 B14R1.243 Cc1ccccc1N(C)C(C)C(O)=O Amb22966922 [0,2,0,0,0,0|2,0,0]=4 6484 B14R1.243 Cc1ccccc1S(=O)C(C)C(O)=O Amb18979569 [0,2,0,0,0,0|2,0,0]=4 6485 B14R1.243 Cc1ccccc1[C@@H](N)[C@@H](O)C(O)=O Amb22756711 [0,2,0,0,0,0|1,0,0]=3 6486 B14R1.243 Cc1ccccc1[C@@H](N)[C@H](O)C(O)=O Amb24727642 [0,2,0,0,0,0|1,0,0]=3 6487 B14R1.243 Cc1ccccc1[C@H](N)[C@H](O)C(O)=O Amb25850769 [0,2,0,0,0,0|1,0,0]=3 6488 B14R1.243 NC(C(O)C(O)=O)c1[n]cccc1Cl Amb24642071 [0,2,0,0,0,0|2,0,0]=4 6489 B14R1.243 NC(C(O)C(O)=O)c1ccccc1Br Amb24670417 [0,2,0,0,0,0|1,0,0]=3 6490 B14R1.243 NC(C(O)C(O)=O)c1ccccc1F Amb24419847 [0,2,0,0,0,0|1,0,0]=3 6491 B14R1.243 NC(C(O)c1ccccc1Br)C(O)=O Amb18692060 [0,2,0,0,0,0|0,0,0]=2 6492 B14R1.243 NC(C(O)c1ccccc1Cl)C(O)=O Amb18170660 [0,2,0,0,0,0|0,0,0]=2 6493 B14R1.243 NC(C(O)c1ccccc1F)C(O)=O Amb24652416 [0,2,0,0,0,0|0,0,0]=2 6494 B14R1.243 NC(C(O)c1ccccc1O)C(O)=O Amb24365903 [0,2,0,0,0,0|0,0,0]=2 6495 B14R1.243 N[C@@H](C(O)c1ccccc1F)C(O)=O Amb24651121 [0,2,0,0,0,0|0,0,0]=2 6496 B14R1.243 N[C@@H](C(O)c1ccccc1O)C(O)=O Amb25798965 [0,2,0,0,0,0|0,0,0]=2 6497 B14R1.243 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1F Amb22756700 [0,2,0,0,0,0|1,0,0]=3 6498 B14R1.243 N[C@@H]([C@@H](O)c1ccccc1Br)C(O)=O Amb24710896 [0,2,0,0,0,0|0,0,0]=2 6499 B14R1.243 N[C@@H]([C@@H](O)c1ccccc1O)C(O)=O Amb25664914 [0,2,0,0,0,0|0,0,0]=2 6500 B14R1.243 N[C@@H]([C@H](O)C(O)=O)c1[n]cccc1Br Amb24628285 [0,2,0,0,0,0|2,0,0]=4 6501 B14R1.243 N[C@@H]([C@H](O)C(O)=O)c1ccc[n]c1Cl Amb24574148 [0,2,0,0,0,0|2,0,0]=4 6502 B14R1.243 N[C@@H]([C@H](O)C(O)=O)c1ccccc1Br Amb24638195 [0,2,0,0,0,0|1,0,0]=3 6503 B14R1.243 N[C@@H]([C@H](O)c1ccccc1Cl)C(O)=O Amb25324164 [0,2,0,0,0,0|0,0,0]=2 6504 B14R1.243 N[C@H]([C@@H](O)C(O)=O)c1c[n]ccc1Br Amb25217923 [0,2,0,0,0,0|2,0,0]=4 6505 B14R1.243 N[C@H]([C@@H](O)C(O)=O)c1ccccc1Br Amb25248799 [0,2,0,0,0,0|1,0,0]=3 6506 B14R1.243 N[C@H]([C@@H](O)c1ccccc1Cl)C(O)=O Amb25119158 [0,2,0,0,0,0|0,0,0]=2 6507 B14R1.243 N[C@H]([C@@H](O)c1ccccc1O)C(O)=O Amb24710044 [0,2,0,0,0,0|0,0,0]=2 6508 B14R1.243 OC(=O)C(C(c1ccccc1Br)Br)Br Amb17612539 [0,2,0,0,0,0|1,0,0]=3 6509 B14R1.243 OC(=O)C(C(c1ccccc1Br)N)C Amb17473599 [0,2,0,0,0,0|1,0,0]=3 6510 B14R1.243 OC(=O)C(C(c1ccccc1C)N)C Amb17470838 [0,2,0,0,0,0|1,0,0]=3 6511 B14R1.243 OC(=O)C(C(c1ccccc1Cl)N)C Amb17471476 [0,2,0,0,0,0|1,0,0]=3 6512 B14R1.243 OC(=O)C(C(c1ccccc1F)N)C Amb17470952 [0,2,0,0,0,0|1,0,0]=3 6513 B14R1.243 OC(=O)C(C(c1ccccc1N)O)N Amb2228469 [0,2,0,0,0,0|0,0,0]=2 6514 B14R1.1017 CC(C(C(=O)O)C#N)c1ccccc1 Amb17089331 [0,2,0,0,0,0|0,0,1]=3 6515 B14R1.1017 CC(\C(=N\O)\C(O)=O)c1ccccc1 Amb25756389 [0,2,0,0,0,0|0,0,2]=4 6516 B14R1.1017 CCC(C(O)=O)S(=O)c1ccccc1 Amb19012044 [0,2,0,0,0,0|2,0,0]=4 6517 B14R1.1017 CCC(C(O)c1ccccc1)C(O)=O Amb19022377 [0,2,0,0,0,0|1,0,0]=3 6518 B14R1.1017 CN(C(CC)C(O)=O)c1ccccc1 Amb22966906 [0,2,0,0,0,0|2,0,0]=4 6519 B14R1.1017 OC(=O)\C(=N/O)\C(F)c1ccccc1 Amb25279502 [0,2,0,0,0,0|0,0,2]=4 6520 B14R1.1027 CC(C(C=C)c1ccccc1)C(N)=O Amb22453893 [0,2,0,0,0,0|2,0,0]=4 6521 B14R1.1027 C\C=C(\C(C)C(O)=O)/c1ccccc1 Amb24498338 [0,2,0,0,0,0|1,0,1]=4 6522 B14R1.6306 CC(=C)C(N)C(C)(C)c1ccccc1 Amb24726953 [0,2,0,0,0,0|2,0,0]=4 6523 B14R1.6306 CC(C(O)=O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|1,0,0]=3 6524 B14R1.6306 CC(C(O)=O)P(O)(=O)c1ccccc1 Amb24759105 [0,2,0,0,0,0|2,0,0]=4 6525 B14R1.6306 CC(C)(C(O)C(O)=O)c1ccccc1 Amb18651885 [0,2,0,0,0,0|1,0,0]=3 6526 B14R1.6306 CC(C)(C(S)C(O)=O)c1ccccc1 Amb25119225 [0,2,0,0,0,0|1,0,0]=3 6527 B14R1.6306 CC(C)([C@H](C)C(O)=O)c1ccccc1 Amb24498135 [0,2,0,0,0,0|1,0,0]=3 6528 B14R1.6306 CC(F)(C(N)C(O)=O)c1ccccc1 Amb25341618 [0,2,0,0,0,0|0,0,0]=2 6529 B14R1.6306 CC(N)(C(O)C(N)=O)c1ccccc1 Amb25279511 [0,2,0,0,0,0|2,0,0]=4 6530 B14R1.6306 CC(O)(C(C)C(N)=O)c1ccccc1 Amb25114161 [0,2,0,0,0,0|2,0,0]=4 6531 B14R1.6306 CC(O)(C(Cl)C(O)=O)c1ccccc1 Amb24452133 [0,2,0,0,0,0|1,0,0]=3 6532 B14R1.6306 CC(O)(C(N)C(O)=O)c1ccccc1 Amb25672532 [0,2,0,0,0,0|0,0,0]=2 6533 B14R1.6306 CC(O)(C(O)C(O)=O)c1c[n]ccc1 Amb25139451 [0,2,0,0,0,0|2,0,0]=4 6534 B14R1.6306 C[C@@H](C(O)=O)[C@](C)(O)c1ccccc1 Amb25164442 [0,2,0,0,0,0|1,0,0]=3 6535 B14R1.6306 C[C@@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929617 [0,2,0,0,0,0|1,0,0]=3 6536 B14R1.6306 C[C@H](C(O)=O)S(=O)(=O)c1ccccc1 Amb25783740 [0,2,0,0,0,0|2,0,0]=4 6537 B14R1.6306 C[C@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929616 [0,2,0,0,0,0|1,0,0]=3 6538 B14R1.6306 C[C@](O)([C@@H](F)C(O)=O)c1ccccc1 Amb24498134 [0,2,0,0,0,0|1,0,0]=3 6539 B14R1.6306 C[C@](O)([C@@H](O)C(O)=O)c1c[n]ccc1 Amb25299463 [0,2,0,0,0,0|2,0,0]=4 6540 B14R1.6306 FC(S(=O)(=O)c1ccccc1)C(=O)O Amb17595931 [0,2,0,0,0,0|2,0,0]=4 6541 B14R1.6306 NC(=O)C(N)C(F)(F)c1ccccc1 Amb22325275 [0,2,0,0,0,0|1,0,0]=3 6542 B14R1.6306 NC(C(O)=O)C(F)(F)c1ccccc1 Amb22325271 [0,2,0,0,0,0|0,0,0]=2 6543 B14R1.6306 O=C(C(c1ccccc1)(F)F)C(=O)O Amb10841761 [0,2,0,0,0,0|1,0,1]=4 6544 B14R1.6306 OC(=O)C(=O)C(F)(F)c1ccccc1 Amb22325268 [0,2,0,0,0,0|1,0,1]=4 6545 B14R1.6306 OC(=O)C(O)P(O)(=O)c1ccccc1 Amb24452208 [0,2,0,0,0,0|2,0,0]=4 6546 B14R1.6306 [2H]C([2H])(C(N)C(O)=O)c1ccccc1 Amb22363149 [0,2,0,0,0,0|0,0,0]=2 6547 B14R1.6306 [2H]C([2H])([C@H](N)C(O)=O)c1ccccc1 Amb22367257 [0,2,0,0,0,0|0,0,0]=2 6548 B14R1.6391 CC(=O)C(C)(N)C(O)c1ccccc1 Amb25339242 [0,2,0,0,0,0|1,0,0]=3 6549 B14R1.6391 CC(=O)C(C)(O)C(O)c1ccccc1 Amb24474267 [0,2,0,0,0,0|2,0,0]=4 6550 B14R1.6391 CC(C(C(=O)O)(C)C)c1ccccc1 Amb17333790 [0,2,0,0,0,0|1,0,0]=3 6551 B14R1.6391 CC(C)(C(=C)c1ccccc1)C(O)=O Amb24602424 [0,2,0,0,0,0|1,0,1]=4 6552 B14R1.6391 CC(C)(C(N)c1ccc[n]c1)C(O)=O Amb25076677 [0,2,0,0,0,0|2,0,0]=4 6553 B14R1.6391 CC(C)(C(N)c1ccccc1)C(O)=O Amb18651525 [0,2,0,0,0,0|1,0,0]=3 6554 B14R1.6391 CC(C)(C(N)c1ccccc1)C(O)=O Amb20623909 [0,2,0,0,0,0|1,0,0]=3 6555 B14R1.6391 CC(C)(C(O)=O)S(=O)c1ccccc1 Amb18657301 [0,2,0,0,0,0|2,0,0]=4 6556 B14R1.6391 CC(C)([C@@H](N)c1cc[n]cc1)C(O)=O Amb24460268 [0,2,0,0,0,0|2,0,0]=4 6557 B14R1.6391 CC(C)([C@H](C)c1ccccc1)C(O)=O Amb24498119 [0,2,0,0,0,0|1,0,0]=3 6558 B14R1.6391 CC(C)([C@H](N)c1ccc[n]c1)C(O)=O Amb24349707 [0,2,0,0,0,0|2,0,0]=4 6559 B14R1.6391 CC(C)([C@H](N)c1ccccc1)C(O)=O Amb25183035 [0,2,0,0,0,0|1,0,0]=3 6560 B14R1.6391 CC(Cl)(C(O)c1ccccc1)C(O)=O Amb24574677 [0,2,0,0,0,0|1,0,0]=3 6561 B14R1.6391 CC(N)(C(=C)c1ccccc1)C(O)=O Amb25695231 [0,2,0,0,0,0|0,0,1]=3 6562 B14R1.6391 CC(N)(C(O)c1ccccc1)C(N)=O Amb25069472 [0,2,0,0,0,0|1,0,0]=3 6563 B14R1.6391 CC(O)(C(=O)c1ccccc1)C(O)=O Amb22230255 [0,2,0,0,0,0|1,0,1]=4 6564 B14R1.6391 CC(O)(C(O)c1ccccc1)C(N)=O Amb25067866 [0,2,0,0,0,0|2,0,0]=4 6565 B14R1.6391 CC(S)(C(N)c1ccccc1)C(N)=O Amb24506354 [0,2,0,0,0,0|2,0,0]=4 6566 B14R1.6391 CC(c1ccccc1)C(C)(O)C(O)=O Amb20623542 [0,2,0,0,0,0|1,0,0]=3 6567 B14R1.6391 C[C@@](O)([C@@H](O)c1ccccc1)C(N)=O Amb25766627 [0,2,0,0,0,0|2,0,0]=4 6568 B14R1.6391 C[C@@](O)([C@H](N)c1ccccc1)C(N)=O Amb25105054 [0,2,0,0,0,0|2,0,0]=4 6569 B14R1.6391 C[C@@](O)([C@H](N)c1ccccc1)C(O)=O Amb22748830 [0,2,0,0,0,0|1,0,0]=3 6570 B14R1.6391 C[C@](N)([C@@H](O)c1ccccc1)C(N)=O Amb25764494 [0,2,0,0,0,0|1,0,0]=3 6571 B14R1.6391 C[C@](N)([C@H](C)c1ccccc1)C(O)=O Amb24739555 [0,2,0,0,0,0|0,0,0]=2 6572 B14R1.6391 C[C@](N)([C@H](O)c1ccccc1)C(O)=O Amb25279530 [0,2,0,0,0,0|0,0,0]=2 6573 B14R1.6391 C[C@](O)([C@@H](N)c1ccccc1)C(O)=O Amb24373205 [0,2,0,0,0,0|1,0,0]=3 6574 B14R1.6391 NC(c1ccc[n]c1)C(F)(F)C(O)=O Amb25677738 [0,2,0,0,0,0|2,0,0]=4 6575 B14R1.6391 NC(c1cccc[n]1)C(F)(F)C(O)=O Amb25198737 [0,2,0,0,0,0|2,0,0]=4 6576 B14R1.6391 N[C@@H](c1cc[n]cc1)C(F)(F)C(O)=O Amb25304065 [0,2,0,0,0,0|2,0,0]=4 6577 B14R1.6391 N[C@@H](c1ccc[n]c1)C(F)(F)C(O)=O Amb25676140 [0,2,0,0,0,0|2,0,0]=4 6578 B14R1.6391 N[C@@H](c1ccccc1)C(F)(F)C(O)=O Amb19929520 [0,2,0,0,0,0|1,0,0]=3 6579 B14R1.6391 N[C@@H](c1ccccc1)C(F)(F)C(O)=O Amb24499222 [0,2,0,0,0,0|1,0,0]=3 6580 B14R1.6391 N[C@H](c1ccccc1)C(F)(F)C(O)=O Amb19929519 [0,2,0,0,0,0|1,0,0]=3 6581 B14R1.6391 N[C@H](c1ccccc1)C(F)(F)C(O)=O Amb25117836 [0,2,0,0,0,0|1,0,0]=3 6582 B14R1.6391 OC(=O)C(C(c1cccnc1)O)(F)F Amb17612835 [0,2,0,0,0,0|2,0,0]=4 6583 B14R1.6391 OC(=O)C(F)(F)C(O)c1cc[n]cc1 Amb25790565 [0,2,0,0,0,0|2,0,0]=4 6584 B14R1.6391 OC(=O)C(F)(F)C(O)c1cccc[n]1 Amb24336590 [0,2,0,0,0,0|2,0,0]=4 6585 B14R1.6391 OC(=O)C(O)(O)C(F)c1ccccc1 Amb25756176 [0,2,0,0,0,0|1,0,0]=3 6586 B14R1.10526 NC(C(=O)c1ccccc1)P(O)(O)=O Amb25029958 [0,2,0,0,0,0|1,0,1]=4 6587 B14R1.10526 NC(C(O)c1ccccc1)P(O)(O)=O Amb25668475 [0,2,0,0,0,0|1,0,0]=3 6588 B14R1.10526 N[C@@H]([C@H](O)P(O)(O)=O)c1ccccc1 Amb25165879 [0,2,0,0,0,0|2,0,0]=4 6589 B14R1.550 C=C=C(Cc1ccccc1F)C(O)=O Amb25363205 [0,2,0,0,0,0|1,0,1]=4 6590 B14R1.550 C=CC(Nc1ccccc1Br)C(O)=O Amb24471828 [0,2,0,0,0,0|2,0,0]=4 6591 B14R1.550 C=CC(Nc1ccccc1I)C(O)=O Amb25711557 [0,2,0,0,0,0|2,0,0]=4 6592 B14R1.550 CCC(C(=O)C)Cc1ccccc1C Amb17234956 [0,2,0,0,0,0|2,0,0]=4 6593 B14R1.550 CCC(C(=O)C)Cc1ccccc1Cl Amb17240769 [0,2,0,0,0,0|2,0,0]=4 6594 B14R1.550 CCC(C(=O)C)Cc1ccccc1F Amb17235955 [0,2,0,0,0,0|2,0,0]=4 6595 B14R1.550 CCC(C(=O)O)Cc1ccccc1Br Amb17605817 [0,2,0,0,0,0|1,0,0]=3 6596 B14R1.550 CCC(C(=O)O)Oc1ccccc1N Amb17110012 [0,2,0,0,0,0|2,0,0]=4 6597 B14R1.550 CCC(Nc1ccccc1I)C(O)=O Amb24644908 [0,2,0,0,0,0|2,0,0]=4 6598 B14R1.550 COC(Cc1ccccc1Cl)C(O)=O Amb23320999 [0,2,0,0,0,0|1,0,0]=3 6599 B14R1.550 COC(Cc1ccccc1F)C(O)=O Amb23320945 [0,2,0,0,0,0|1,0,0]=3 6600 B14R1.550 Cc1ccccc1CC(CN)C(O)=O Amb20622916 [0,2,0,0,0,0|0,0,0]=2 6601 B14R1.550 Cc1ccccc1CC(OC)C(O)=O Amb23320703 [0,2,0,0,0,0|1,0,0]=3 6602 B14R1.550 Cc1ccccc1NC(CN)C(O)=O Amb25047061 [0,2,0,0,0,0|1,0,0]=3 6603 B14R1.550 Cc1ccccc1NC(CO)C(O)=O Amb24364556 [0,2,0,0,0,0|2,0,0]=4 6604 B14R1.550 N#CC(C(=O)O)Cc1ccccc1C Amb17090110 [0,2,0,0,0,0|0,0,1]=3 6605 B14R1.550 N#CC(C(=O)O)Cc1ccccc1F Amb17090113 [0,2,0,0,0,0|0,0,1]=3 6606 B14R1.550 N#CC(Cc1ccccc1O)C(O)=O Amb24602491 [0,2,0,0,0,0|0,0,1]=3 6607 B14R1.550 NC(=O)C(Cc1ccccc1Cl)CN Amb19327847 [0,2,0,0,0,0|1,0,0]=3 6608 B14R1.550 NCC(Cc1ccccc1Cl)C(O)=O Amb19419125 [0,2,0,0,0,0|0,0,0]=2 6609 B14R1.550 NC\C(=C/c1ccccc1Cl)\C(O)=O Amb25185808 [0,2,0,0,0,0|0,0,2]=4 6610 B14R1.550 NC\C(=C/c1ccccc1F)\C(O)=O Amb25321899 [0,2,0,0,0,0|0,0,2]=4 6611 B14R1.550 NC\C(=C\c1ccccc1F)\C(O)=O Amb25176149 [0,2,0,0,0,0|0,0,2]=4 6612 B14R1.550 OC(=O)C(CO)Nc1ccccc1Br Amb25697966 [0,2,0,0,0,0|2,0,0]=4 6613 B14R1.550 OC(=O)\C(\Cc1ccccc1Cl)=N/O Amb24741771 [0,2,0,0,0,0|0,0,2]=4 6614 B14R1.3135 CC(=O)C(Br)Cc1ccccc1C#N Amb24384596 [0,2,0,0,0,0|2,0,0]=4 6615 B14R1.3135 CCc1ccccc1CC(Br)C(O)=O Amb23320611 [0,2,0,0,0,0|1,0,0]=3 6616 B14R1.3135 CCc1ccccc1NC(C)C(O)=O Amb19033691 [0,2,0,0,0,0|2,0,0]=4 6617 B14R1.3135 CCc1ccccc1\C=C(\N)/C(O)=O Amb25170655 [0,2,0,0,0,0|0,0,2]=4 6618 B14R1.3135 COc1ccccc1CC(=O)C(=O)O Amb1135187 [0,2,0,0,0,0|1,0,1]=4 6619 B14R1.3135 COc1ccccc1CC(Br)C(O)=O Amb23320635 [0,2,0,0,0,0|1,0,0]=3 6620 B14R1.3135 COc1ccccc1CC(C(=O)C)C Amb17235389 [0,2,0,0,0,0|2,0,0]=4 6621 B14R1.3135 COc1ccccc1CC(C(=O)O)O Amb17139587 [0,2,0,0,0,0|1,0,0]=3 6622 B14R1.3135 COc1ccccc1C[C@@H](N)C(O)=O Amb19063345 [0,2,0,0,0,0|0,0,0]=2 6623 B14R1.3135 COc1ccccc1C[C@H](N)C(O)=O Amb22641421 [0,2,0,0,0,0|0,0,0]=2 6624 B14R1.3135 COc1ccccc1N[C@@H](C)C(O)=O Amb24677734 [0,2,0,0,0,0|2,0,0]=4 6625 B14R1.3135 C[C@@H](Oc1ccccc1C#N)C(O)=O Amb25830119 [0,2,0,0,0,0|2,0,0]=4 6626 B14R1.3135 C[C@H](Nc1ccccc1C#N)C(O)=O Amb25798848 [0,2,0,0,0,0|2,0,0]=4 6627 B14R1.3135 N#Cc1ccccc1OC(F)C(O)=O Amb25267391 [0,2,0,0,0,0|2,0,0]=4 6628 B14R1.3135 NC(=O)C(Br)Cc1ccccc1C#N Amb24530463 [0,2,0,0,0,0|2,0,0]=4 6629 B14R1.3135 NC(Cc1c[n]ccc1C#N)C(O)=O Amb24441021 [0,2,0,0,0,0|1,0,0]=3 6630 B14R1.3135 NC(Cc1ccc[n]c1C#N)C(O)=O Amb25322245 [0,2,0,0,0,0|1,0,0]=3 6631 B14R1.3135 NC(Cc1ccccc1C#N)C(O)=O Amb21858527 [0,2,0,0,0,0|0,0,0]=2 6632 B14R1.3135 N[C@H](Cc1c[n]ccc1C#N)C(O)=O Amb25273907 [0,2,0,0,0,0|1,0,0]=3 6633 B14R1.3135 N[C@H](Cc1ccc[n]c1C#N)C(O)=O Amb25831138 [0,2,0,0,0,0|1,0,0]=3 6634 B14R1.3135 O=Cc1ccccc1OC(C(=O)O)C Amb1783954 [0,2,0,0,0,0|2,0,0]=4 6635 B14R1.5881 CC(C)(O)C(N)Cc1ccccc1Br Amb24726732 [0,2,0,0,0,0|1,0,1]=4 6636 B14R1.5881 Cc1ccccc1CC(N)P(C)(C)=O Amb25757950 [0,2,0,0,0,0|2,0,0]=4 6637 B14R1.5881 Cc1ccccc1CC(N)P(O)(O)=O Amb24658263 [0,2,0,0,0,0|1,0,0]=3 6638 B14R1.5882 CC(=O)C(C)(C)Cc1ccccc1F Amb25028926 [0,2,0,0,0,0|2,0,0]=4 6639 B14R1.5882 CC(C)(CN1C=CC=CC1=O)C(O)=O Amb18535445 [0,2,0,0,0,0|2,0,0]=4 6640 B14R1.5882 CC(C)(Cc1ccccc1Br)C(O)=O Amb18586155 [0,2,0,0,0,0|1,0,0]=3 6641 B14R1.5882 CC(C)(Cc1ccccc1Cl)C(N)=O Amb24506537 [0,2,0,0,0,0|2,0,0]=4 6642 B14R1.5882 CC(C)(Sc1ccccc1F)C(O)=O Amb18976791 [0,2,0,0,0,0|2,0,0]=4 6643 B14R1.5882 CC(C)(Sc1ccccc1N)C(O)=O Amb18976866 [0,2,0,0,0,0|2,0,0]=4 6644 B14R1.5882 CC(F)(Cc1ccccc1O)C(O)=O Amb25223949 [0,2,0,0,0,0|1,0,0]=3 6645 B14R1.5882 CC(N)(Cc1[n]cccc1Br)C(O)=O Amb25849965 [0,2,0,0,0,0|1,0,0]=3 6646 B14R1.5882 CC(N)(Cc1[n]cccc1F)C(O)=O Amb25747942 [0,2,0,0,0,0|1,0,0]=3 6647 B14R1.5882 CC(N)(Cc1[n]cccc1O)C(O)=O Amb24591214 [0,2,0,0,0,0|1,0,0]=3 6648 B14R1.5882 CC(N)(Cc1cc[n]cc1Cl)C(O)=O Amb25812869 [0,2,0,0,0,0|1,0,0]=3 6649 B14R1.5882 CC(N)(Cc1ccc[n]c1Br)C(O)=O Amb24691691 [0,2,0,0,0,0|1,0,0]=3 6650 B14R1.5882 CC(N)(Cc1ccc[n]c1Cl)C(O)=O Amb24702382 [0,2,0,0,0,0|1,0,0]=3 6651 B14R1.5882 CC(N)(Cc1ccc[n]c1F)C(O)=O Amb24642948 [0,2,0,0,0,0|1,0,0]=3 6652 B14R1.5882 CC(N)(Cc1cccc[n+]1[O-])C(O)=O Amb25233542 [0,2,0,0,0,0|1,0,0]=3 6653 B14R1.5882 CC(N)(Cc1ccccc1I)C(O)=O Amb24575213 [0,2,0,0,0,0|0,0,0]=2 6654 B14R1.5882 CC(N)(Cc1ccccc1N)C(O)=O Amb18651899 [0,2,0,0,0,0|0,0,0]=2 6655 B14R1.5882 CC(O)(CN1C=CC=CC1=O)C(O)=O Amb23596488 [0,2,0,0,0,0|2,0,0]=4 6656 B14R1.5882 CC(O)(Cc1ccccc1Br)C(O)=O Amb25770677 [0,2,0,0,0,0|1,0,0]=3 6657 B14R1.5882 C[C@@](N)(Cc1ccccc1F)C(O)=O Amb25853608 [0,2,0,0,0,0|0,0,0]=2 6658 B14R1.5882 C[C@@](N)(Cc1ccccc1O)C(O)=O Amb25036864 [0,2,0,0,0,0|0,0,0]=2 6659 B14R1.5882 C[C@@](O)(Cc1ccccc1F)C(O)=O Amb25672596 [0,2,0,0,0,0|1,0,0]=3 6660 B14R1.5882 C[C@](N)(Cc1ccccc1F)C(O)=O Amb24355369 [0,2,0,0,0,0|0,0,0]=2 6661 B14R1.5882 C[C@](N)(Cc1ccccc1O)C(O)=O Amb24499040 [0,2,0,0,0,0|0,0,0]=2 6662 B14R1.5882 C[C@](O)(Cc1ccccc1F)C(O)=O Amb25076779 [0,2,0,0,0,0|1,0,0]=3 6663 B14R1.5882 Cc1[n]cccc1CC(C)(C)C(O)=O Amb24461821 [0,2,0,0,0,0|2,0,0]=4 6664 B14R1.5882 Cc1[n]cccc1CC(C)(N)C(O)=O Amb25698462 [0,2,0,0,0,0|1,0,0]=3 6665 B14R1.5882 Cc1ccc[n]c1CC(C)(C)C(O)=O Amb25127105 [0,2,0,0,0,0|2,0,0]=4 6666 B14R1.5882 Cc1ccccc1CC(C)(O)C(O)=O Amb25683429 [0,2,0,0,0,0|1,0,0]=3 6667 B14R1.5882 Cc1ccccc1C[C@@](C)(N)C(O)=O Amb24390266 [0,2,0,0,0,0|0,0,0]=2 6668 B14R1.5882 Cc1ccccc1C[C@](C)(O)C(O)=O Amb25265236 [0,2,0,0,0,0|1,0,0]=3 6669 B14R1.5882 OC(=O)C(Cc1ccccc1C)(C)C Amb17235386 [0,2,0,0,0,0|1,0,0]=3 6670 B14R1.5882 OC(=O)C(Cc1ccccc1C)(N)C Amb17235614 [0,2,0,0,0,0|0,0,0]=2 6671 B14R1.5882 OC(=O)C(Cc1ccccc1Cl)(C)C Amb17241246 [0,2,0,0,0,0|1,0,0]=3 6672 B14R1.5882 OC(=O)C(Cc1ccccc1Cl)(N)C Amb17241538 [0,2,0,0,0,0|0,0,0]=2 6673 B14R1.5882 OC(=O)C(Cc1ccccc1F)(C)C Amb17236374 [0,2,0,0,0,0|1,0,0]=3 6674 B14R1.5882 OC(=O)C(Cc1ccccc1F)(N)C Amb17236543 [0,2,0,0,0,0|0,0,0]=2 6675 B14R1.5882 OC(=O)C(F)(F)Sc1ccccc1Cl Amb25052365 [0,2,0,0,0,0|2,0,0]=4 6676 B14R1.5882 OC(=O)[C@](Cc1ccccc1Br)(N)C Amb10066902 [0,2,0,0,0,0|0,0,0]=2 6677 B14R1.5882 OC(=O)[C@](Cc1ccccc1I)(N)C Amb10066903 [0,2,0,0,0,0|0,0,0]=2 6678 B14R1.5971 CC(=C)C(N)Cc1c(F)cccc1Cl Amb24623554 [0,2,0,0,0,0|2,0,0]=4 6679 B14R1.5971 CC(=C)C(N)Cc1c(F)cccc1F Amb25033231 [0,2,0,0,0,0|2,0,0]=4 6680 B14R1.5971 CC(=O)C(Br)Cc1c(C)cccc1C Amb25761946 [0,2,0,0,0,0|2,0,0]=4 6681 B14R1.5971 CC(=O)C(Br)Cc1c(F)cccc1F Amb25732849 [0,2,0,0,0,0|2,0,0]=4 6682 B14R1.5971 CC(=O)C(Cl)Cc1c(C)cccc1C Amb25671755 [0,2,0,0,0,0|2,0,0]=4 6683 B14R1.5971 CC(C(=O)C)Cc1c(F)cccc1Cl Amb17241804 [0,2,0,0,0,0|2,0,0]=4 6684 B14R1.5971 CC(C(=O)O)Nc1c(F)cccc1F Amb17402394 [0,2,0,0,0,0|2,0,0]=4 6685 B14R1.5971 CC(C(=O)O)Sc1c(Cl)cccc1Cl Amb1118013 [0,2,0,0,0,0|2,0,0]=4 6686 B14R1.5971 CC(Cc1c(C)cccc1C)C(O)=O Amb24429140 [0,2,0,0,0,0|1,0,0]=3 6687 B14R1.5971 CC(Cc1c(Cl)cccc1Br)C(O)=O Amb24659007 [0,2,0,0,0,0|1,0,0]=3 6688 B14R1.5971 CC(Cc1c(Cl)cccc1Cl)C(O)=O Amb24360048 [0,2,0,0,0,0|1,0,0]=3 6689 B14R1.5971 CC(Cc1c(F)cccc1O)C(O)=O Amb25311434 [0,2,0,0,0,0|1,0,0]=3 6690 B14R1.5971 CC(Oc1c(N)cccc1Br)C(O)=O Amb24475358 [0,2,0,0,0,0|2,0,0]=4 6691 B14R1.5971 CC(Oc1c(N)cccc1Cl)C(O)=O Amb25346830 [0,2,0,0,0,0|2,0,0]=4 6692 B14R1.5971 CC(Oc1c(N)cccc1F)C(O)=O Amb24451453 [0,2,0,0,0,0|2,0,0]=4 6693 B14R1.5971 CC(Sc1c(N)cccc1Cl)C(O)=O Amb18292854 [0,2,0,0,0,0|2,0,0]=4 6694 B14R1.5971 CC1=CC=CC(=O)N1CC(C)C(O)=O Amb18302655 [0,2,0,0,0,0|2,0,0]=4 6695 B14R1.5971 C[C@@H](Nc1c(C)cccc1C)C(O)=O Amb25065370 [0,2,0,0,0,0|2,0,0]=4 6696 B14R1.5971 C[C@H](Nc1c(C)cccc1C)C(O)=O Amb24498073 [0,2,0,0,0,0|2,0,0]=4 6697 B14R1.5971 Cc1cc[n]c(Br)c1C[C@H](N)C(O)=O Amb24453484 [0,2,0,0,0,0|1,0,0]=3 6698 B14R1.5971 Cc1cccc(C)c1CC(Br)C(O)=O Amb23320607 [0,2,0,0,0,0|1,0,0]=3 6699 B14R1.5971 Cc1cccc(C)c1CC(O)C(O)=O Amb24731706 [0,2,0,0,0,0|1,0,0]=3 6700 B14R1.5971 Cc1cccc(C)c1C[C@@H](N)C(O)=O Amb22747546 [0,2,0,0,0,0|0,0,0]=2 6701 B14R1.5971 Cc1cccc(C)c1C[C@H](N)C(O)=O Amb24062379 [0,2,0,0,0,0|0,0,0]=2 6702 B14R1.5971 Cc1cccc(Cl)c1CC(Br)C(C)=O Amb25682735 [0,2,0,0,0,0|2,0,0]=4 6703 B14R1.5971 Cc1cccc(Cl)c1CC(Br)C(N)=O Amb24368279 [0,2,0,0,0,0|2,0,0]=4 6704 B14R1.5971 Cc1cccc(Cl)c1OC(C)C(O)=O Amb25844001 [0,2,0,0,0,0|2,0,0]=4 6705 B14R1.5971 Cc1cccc(F)c1CC(Br)C(C)=O Amb24619354 [0,2,0,0,0,0|2,0,0]=4 6706 B14R1.5971 Cc1cccc(F)c1CC(C)C(O)=O Amb25228030 [0,2,0,0,0,0|1,0,0]=3 6707 B14R1.5971 Cc1cccc(F)c1CC(N)C(O)=O Amb24426809 [0,2,0,0,0,0|0,0,0]=2 6708 B14R1.5971 Cc1cccc(F)c1NC(C)C(O)=O Amb25748515 [0,2,0,0,0,0|2,0,0]=4 6709 B14R1.5971 Cc1cccc(O)c1C[C@@H](N)C(O)=O Amb25278345 [0,2,0,0,0,0|0,0,0]=2 6710 B14R1.5971 Cc1cccc(O)c1C[C@H](N)C(O)=O Amb24551602 [0,2,0,0,0,0|0,0,0]=2 6711 B14R1.5971 NC(=O)C(Br)Cc1c(F)cccc1Br Amb25353250 [0,2,0,0,0,0|2,0,0]=4 6712 B14R1.5971 NC(=O)C(Br)Cc1c(F)cccc1F Amb24659192 [0,2,0,0,0,0|2,0,0]=4 6713 B14R1.5971 NC(=O)C(Cl)Cc1c(F)cccc1F Amb25734596 [0,2,0,0,0,0|2,0,0]=4 6714 B14R1.5971 NC(Cc1c(Br)cccc1Br)C(O)=O Amb25124682 [0,2,0,0,0,0|0,0,0]=2 6715 B14R1.5971 NC(Cc1c(Br)cccc1O)C(O)=O Amb18668186 [0,2,0,0,0,0|0,0,0]=2 6716 B14R1.5971 NC(Cc1c(O)cccc1O)C(O)=O Amb22228380 [0,2,0,0,0,0|0,0,0]=2 6717 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1Br)C(O)=O Amb24392808 [0,2,0,0,0,0|0,0,0]=2 6718 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1Cl)C(O)=O Amb22228372 [0,2,0,0,0,0|0,0,0]=2 6719 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1I)C(O)=O Amb24608649 [0,2,0,0,0,0|0,0,0]=2 6720 B14R1.5971 N[C@@H](Cc1c(F)[n]ccc1I)C(O)=O Amb24400416 [0,2,0,0,0,0|1,0,0]=3 6721 B14R1.5971 N[C@@H](Cc1c(F)c[n]cc1F)C(O)=O Amb24452092 [0,2,0,0,0,0|1,0,0]=3 6722 B14R1.5971 N[C@@H](Cc1c(F)cccc1Br)C(O)=O Amb25076170 [0,2,0,0,0,0|0,0,0]=2 6723 B14R1.5971 N[C@@H](Cc1c(F)cccc1Cl)C(O)=O Amb24521960 [0,2,0,0,0,0|0,0,0]=2 6724 B14R1.5971 N[C@@H](Cc1c(F)cccc1F)C(O)=O Amb19889726 [0,2,0,0,0,0|0,0,0]=2 6725 B14R1.5971 N[C@@H](Cc1c(O)cccc1O)C(O)=O Amb22228382 [0,2,0,0,0,0|0,0,0]=2 6726 B14R1.5971 N[C@H](Cc1c(Br)cccc1O)C(O)=O Amb24686797 [0,2,0,0,0,0|0,0,0]=2 6727 B14R1.5971 N[C@H](Cc1c(Cl)cccc1Br)C(O)=O Amb25817718 [0,2,0,0,0,0|0,0,0]=2 6728 B14R1.5971 N[C@H](Cc1c(Cl)cccc1Cl)C(O)=O Amb22228371 [0,2,0,0,0,0|0,0,0]=2 6729 B14R1.5971 N[C@H](Cc1c(Cl)cccc1I)C(O)=O Amb24424890 [0,2,0,0,0,0|0,0,0]=2 6730 B14R1.5971 N[C@H](Cc1c(F)cccc1Br)C(O)=O Amb24511236 [0,2,0,0,0,0|0,0,0]=2 6731 B14R1.5971 N[C@H](Cc1c(F)cccc1F)C(O)=O Amb19887663 [0,2,0,0,0,0|0,0,0]=2 6732 B14R1.5971 N[C@H](Cc1c(F)cccc1I)C(O)=O Amb25305766 [0,2,0,0,0,0|0,0,0]=2 6733 B14R1.5971 N[C@H](Cc1c(O)cccc1O)C(O)=O Amb22228381 [0,2,0,0,0,0|0,0,0]=2 6734 B14R1.5971 N\C(=C\c1c(F)cccc1F)\C(O)=O Amb25035967 [0,2,0,0,0,0|0,0,2]=4 6735 B14R1.5971 Nc1cccc(Br)c1C[C@@H](N)C(O)=O Amb25711352 [0,2,0,0,0,0|0,0,0]=2 6736 B14R1.5971 Nc1cccc(Br)c1C[C@H](N)C(O)=O Amb24530375 [0,2,0,0,0,0|0,0,0]=2 6737 B14R1.5971 Nc1cccc(Cl)c1CC(N)C(O)=O Amb18657751 [0,2,0,0,0,0|0,0,0]=2 6738 B14R1.5971 Nc1cccc(F)c1C[C@H](N)C(O)=O Amb24428730 [0,2,0,0,0,0|0,0,0]=2 6739 B14R1.5971 O=C(C(=O)O)Cc1c(Cl)cccc1Cl Amb17477772 [0,2,0,0,0,0|1,0,1]=4 6740 B14R1.5971 O=C(C(=O)O)Cc1c(F)cccc1Cl Amb1134065 [0,2,0,0,0,0|1,0,1]=4 6741 B14R1.5971 O=C(C(=O)O)Cc1c(F)cccc1F Amb1128545 [0,2,0,0,0,0|1,0,1]=4 6742 B14R1.5971 OC(=O)C(=O)Cc1c(F)cccc1Br Amb24565546 [0,2,0,0,0,0|1,0,1]=4 6743 B14R1.5971 OC(=O)C(=S)Cc1c(Cl)cccc1Cl Amb22466834 [0,2,0,0,0,0|1,0,1]=4 6744 B14R1.5971 OC(=O)C(F)Cc1c(Cl)cccc1F Amb24563194 [0,2,0,0,0,0|1,0,0]=3 6745 B14R1.5971 OC(=O)C(F)Oc1c(Br)cccc1Br Amb25259689 [0,2,0,0,0,0|2,0,0]=4 6746 B14R1.5971 OC(=O)C(F)Oc1c(Cl)cccc1Cl Amb25679308 [0,2,0,0,0,0|2,0,0]=4 6747 B14R1.5971 OC(=O)C(O)Cc1c(F)cccc1F Amb24459613 [0,2,0,0,0,0|1,0,0]=3 6748 B14R1.5971 OC(=O)C(S)Cc1c(Br)c[n]cc1Br Amb25232716 [0,2,0,0,0,0|2,0,0]=4 6749 B14R1.5971 OC(C(=O)O)Cc1c(F)cccc1Cl Amb17141137 [0,2,0,0,0,0|1,0,0]=3 6750 B14R1.548 CS(=O)(=O)C(CN)Cc1ccccc1 Amb18171708 [0,2,0,0,0,0|1,0,1]=4 6751 B14R1.4438 CC(N)(Cc1ccccc1)P(O)(O)=O Amb25326149 [0,2,0,0,0,0|1,0,0]=3 6752 B14R1.980 CCCC(Oc1ccccc1)C(O)=O Amb19960408 [0,2,0,0,0,0|2,0,0]=4 6753 B14R1.980 CCOC(Cc1ccccc1)C(O)=O Amb23320687 [0,2,0,0,0,0|1,0,0]=3 6754 B14R1.980 NC(=O)N(CCN)Cc1ccccc1 Amb19008181 [0,2,0,0,0,0|2,0,0]=4 6755 B14R1.980 NCCC(Cc1ccccc1)C(O)=O Amb22371119 [0,2,0,0,0,0|0,0,0]=2 6756 B14R1.980 NCCN(C(=O)C)Cc1ccccc1 Amb17047258 [0,2,0,0,0,0|2,0,0]=4 6757 B14R1.980 O=CN[C@H](C(=O)O)Cc1ccccc1 Amb16231666 [0,2,0,0,0,0|0,0,0]=2 6758 B14R1.980 OC(=O)C(Cc1ccccc1)CC=O Amb18817543 [0,2,0,0,0,0|1,0,0]=3 6759 B14R1.980 OC(=O)[C@@H](Cc1ccccc1)NC=O Amb19050931 [0,2,0,0,0,0|0,0,0]=2 6760 B14R1.980 OC(=O)\C(=C\c1ccccc1)\NC=O Amb25065270 [0,2,0,0,0,0|0,0,2]=4 6761 B14R1.4513 CC(=C)C(Nc1ccccc1)C(O)=O Amb25372411 [0,2,0,0,0,0|2,0,0]=4 6762 B14R1.4513 CC(=O)C(Cc1ccccc1)C(C)=O Amb17778962 [0,2,0,0,0,0|2,0,0]=4 6763 B14R1.4513 CC(=O)N(Cc1ccccc1)C(N)=O Amb24469539 [0,2,0,0,0,0|2,0,0]=4 6764 B14R1.4513 CC(=O)[C-](Cc1ccccc1)C(N)=O Amb22464989 [0,2,0,0,0,0|1,0,1]=4 6765 B14R1.4513 CC(=O)\C(\Cc1ccccc1)=C(/C)\N Amb24571680 [0,2,0,0,0,0|1,0,1]=4 6766 B14R1.4513 CC(C(C(=O)O)Cc1ccccc1)C Amb17235377 [0,2,0,0,0,0|1,0,0]=3 6767 B14R1.4513 CC(C(C(=O)O)Cc1cccnc1)C Amb17235613 [0,2,0,0,0,0|2,0,0]=4 6768 B14R1.4513 CC(C(C(=O)O)Nc1ccccc1)C Amb17401789 [0,2,0,0,0,0|2,0,0]=4 6769 B14R1.4513 CC(O)C(Nc1ccccc1)C(O)=O Amb24441561 [0,2,0,0,0,0|2,0,0]=4 6770 B14R1.4513 CN(C(C(=O)O)Cc1cccnc1)C Amb17235922 [0,2,0,0,0,0|1,0,0]=3 6771 B14R1.4513 C[C@@H](O)[C@@H](Cc1ccccc1)C(O)=O Amb19883969 [0,2,0,0,0,0|1,0,0]=3 6772 B14R1.4513 NC(=O)C(Nc1ccccc1)C(N)=O Amb24106366 [0,2,0,0,0,0|2,0,0]=4 6773 B14R1.4513 OC(=O)C(Cc1ccccc1)=C(F)F Amb24390374 [0,2,0,0,0,0|1,0,1]=4 6774 B14R1.4513 OC(=O)C(Nc1ccccc1)C(O)=O Amb24106401 [0,2,0,0,0,0|2,0,0]=4 6775 B14R1.8844 C#C[C@](N)(Cc1ccccc1)C(O)=O Amb25336547 [0,2,0,0,0,0|0,0,0]=2 6776 B14R1.8844 CC(CC)(Nc1ccccc1)C(O)=O Amb18306701 [0,2,0,0,0,0|2,0,0]=4 6777 B14R1.8844 CC(Cc1cccc[n]1)(C#N)C(O)=O Amb25348913 [0,2,0,0,0,0|1,0,1]=4 6778 B14R1.8844 CC(Cc1ccccc1)(NC)C(O)=O Amb19036440 [0,2,0,0,0,0|0,0,0]=2 6779 B14R1.8844 CCC(C(=O)O)(Oc1ccccc1)C Amb10783308 [0,2,0,0,0,0|2,0,0]=4 6780 B14R1.8844 C[C@@](Cc1ccccc1)(C#N)C(O)=O Amb24347930 [0,2,0,0,0,0|0,0,1]=3 6781 B14R1.8844 NNC(C(=O)O)(Cc1ccccc1)C Amb17401882 [0,2,0,0,0,0|0,0,0]=2 6782 B14R1.8844 NNC(C(=O)O)(Cc1ccccn1)C Amb17402011 [0,2,0,0,0,0|1,0,0]=3 6783 B14R1.8844 NNC(C(=O)O)(Cc1cccnc1)C Amb17402012 [0,2,0,0,0,0|1,0,0]=3 6784 B14R1.8844 NNC(C(=O)O)(Cc1ccncc1)C Amb17402013 [0,2,0,0,0,0|1,0,0]=3 6785 B14R1.8844 N[C@@](Cc1ccccc1)(CO)C(O)=O Amb22233141 [0,2,0,0,0,0|0,0,0]=2 6786 B12R1.279 N=C\C=C\1/CC(NC=C1)C(O)=O Amb25667044 [0,0,1,1,0,0|1,0,0]=3 6787 B12R1.279 N\C=C\C=1CC(N=CC1)C(O)=O Amb24364718 [0,0,1,1,0,0|1,0,1]=4 6788 B12R1.264 NC(CNc1cc[s]c1)C(O)=O Amb25340607 [0,0,1,1,0,0|2,0,0]=4 6789 B12R1.264 N[C@@H](CSc1ccc[s]1)C(O)=O Amb22351162 [0,0,1,1,0,0|2,0,0]=4 6790 B12R1.264 OC(=O)C(CCc1ccco1)N Amb17470473 [0,0,1,1,0,0|1,0,1]=4 6791 B12R1.264 OC(=O)C(CCc1cccs1)N Amb17470676 [0,0,1,1,0,0|1,0,1]=4 6792 B12R1.1335 OC(=O)C1C=CC=CC=CC=C1 Amb24365960 [0,0,1,1,0,0|1,0,1]=4 6793 B12R1.2197 NC(C1C=CC=CC=C1)C(O)=O Amb25751352 [0,0,1,1,0,0|0,0,0]=2 6794 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [1,0,0,1,0,0|1,0,1]=4 6795 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [1,0,0,1,0,0|1,0,1]=4 6796 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [1,0,0,1,0,0|2,0,0]=4 6797 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [1,0,0,1,0,0|1,0,1]=4 6798 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [1,0,0,1,0,0|1,0,1]=4 6799 B12R2.18 CC1Sc2ccccc2C1=O Amb25032373 [1,0,0,1,0,0|2,0,0]=4 6800 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [1,0,0,1,0,0|1,0,0]=3 6801 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [1,0,0,1,0,0|1,0,1]=4 6802 B12R2.18 NC1=Nc2ccccc2C1=O Amb24078927 [1,0,0,1,0,0|1,0,1]=4 6803 B12R2.18 NC1C(N)Cc2c1cccc2 Amb13953204 [1,0,0,1,0,0|1,0,1]=4 6804 B12R2.18 NC1Cc2[n]cccc2C1O Amb25364253 [1,0,0,1,0,0|1,0,1]=4 6805 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [1,0,0,1,0,0|0,0,0]=2 6806 B12R2.18 NC1Cc2ccccc2C1F Amb24655749 [1,0,0,1,0,0|1,0,1]=4 6807 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [1,0,0,1,0,0|0,0,1]=3 6808 B12R2.18 NC1Oc2ccccc2C1=O Amb24349623 [1,0,0,1,0,0|1,0,0]=3 6809 B12R2.18 NN1Cc2ccccc2C1=N Amb25148309 [1,0,0,1,0,0|2,0,0]=4 6810 B12R2.18 NN1Sc2ccccc2C1=O Amb25376699 [1,0,0,1,0,0|2,0,0]=4 6811 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [1,0,0,1,0,0|0,0,0]=2 6812 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [1,0,0,1,0,0|0,0,0]=2 6813 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [1,0,0,1,0,0|0,0,1]=3 6814 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1N Amb22745804 [1,0,0,1,0,0|1,0,1]=4 6815 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [1,0,0,1,0,0|0,0,1]=3 6816 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb22748292 [1,0,0,1,0,0|1,0,1]=4 6817 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [1,0,0,1,0,0|0,0,1]=3 6818 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [1,0,0,1,0,0|0,0,1]=3 6819 B12R2.18 N[C@H]1Cc2ccccc2[C@@H]1N Amb24624674 [1,0,0,1,0,0|1,0,1]=4 6820 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [1,0,0,1,0,0|0,0,1]=3 6821 B12R2.18 O=C1C(Br)Oc2ccccc21 Amb25835380 [1,0,0,1,0,0|2,0,0]=4 6822 B12R2.18 O=C1C(C)Nc2c1cccc2 Amb17593674 [1,0,0,1,0,0|2,0,0]=4 6823 B12R2.18 O=C1C(Cl)Nc2ccccc21 Amb25059201 [1,0,0,1,0,0|2,0,0]=4 6824 B12R2.18 O=C1C(Cl)Oc2ccccc21 Amb24061516 [1,0,0,1,0,0|2,0,0]=4 6825 B12R2.18 O=C1C(Cl)Sc2ccccc21 Amb24533113 [1,0,0,1,0,0|2,0,0]=4 6826 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [1,0,0,1,0,0|1,0,0]=3 6827 B12R2.18 O=C1C(F)Sc2ccccc21 Amb24690556 [1,0,0,1,0,0|2,0,0]=4 6828 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [1,0,0,1,0,0|1,0,0]=3 6829 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [1,0,0,1,0,0|0,0,0]=2 6830 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [1,0,0,1,0,0|1,0,0]=3 6831 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [1,0,0,1,0,0|1,0,0]=3 6832 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [1,0,0,1,0,0|1,0,1]=4 6833 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [1,0,0,1,0,0|1,0,1]=4 6834 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [1,0,0,1,0,0|0,0,1]=3 6835 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [1,0,0,1,0,0|1,0,0]=3 6836 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [1,0,0,1,0,0|1,0,1]=4 6837 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [1,0,0,1,0,0|2,0,0]=4 6838 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [1,0,0,1,0,0|1,0,1]=4 6839 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [1,0,0,1,0,0|1,0,0]=3 6840 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [1,0,0,1,0,0|1,0,1]=4 6841 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [1,0,0,1,0,0|1,0,1]=4 6842 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [1,0,0,1,0,0|1,0,1]=4 6843 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [1,0,0,1,0,0|1,0,1]=4 6844 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [1,0,0,1,0,0|1,0,1]=4 6845 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [1,0,0,1,0,0|1,0,1]=4 6846 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [1,0,0,1,0,0|0,0,2]=4 6847 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [1,0,0,1,0,0|1,0,1]=4 6848 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [1,0,0,1,0,0|1,0,1]=4 6849 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [1,0,0,1,0,0|1,0,1]=4 6850 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [1,0,0,1,0,0|1,0,1]=4 6851 B12R2.23 NC1CSC1c2ccccc2 Amb25076286 [1,0,0,1,0,0|0,1,1]=4 6852 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [1,0,0,1,0,0|1,0,1]=4 6853 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [1,0,0,1,0,0|2,0,0]=4 6854 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [1,0,0,1,0,0|1,0,1]=4 6855 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [1,0,0,1,0,0|1,0,0]=3 6856 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [1,0,0,1,0,0|2,0,0]=4 6857 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [1,0,0,1,0,0|1,0,1]=4 6858 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [1,0,0,1,0,0|1,0,1]=4 6859 B12R2.24 NC1COc2c(C1)cccc2 Amb2383393 [1,0,0,1,0,0|0,0,1]=3 6860 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [1,0,0,1,0,0|2,0,0]=4 6861 B12R2.24 NC1Cc2ccccc2SC1 Amb18646412 [1,0,0,1,0,0|0,1,1]=4 6862 B12R2.24 N[C@@H]1Cc2ccccc2OC1 Amb22756584 [1,0,0,1,0,0|0,0,1]=3 6863 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [1,0,0,1,0,0|1,0,0]=3 6864 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [1,0,0,1,0,0|1,0,1]=4 6865 B12R2.24 N[C@H]1Cc2ccccc2NC1 Amb25224756 [1,0,0,1,0,0|1,0,1]=4 6866 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb23385337 [1,0,0,1,0,0|0,0,1]=3 6867 B12R2.24 N[C@H]1Cc2ccccc2OC1 Amb24485980 [1,0,0,1,0,0|0,0,1]=3 6868 B12R2.24 OC1Cc2ccccc2OC1 Amb22498287 [1,0,0,1,0,0|1,0,1]=4 6869 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [1,0,0,1,0,0|2,0,0]=4 6870 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [1,0,0,1,0,0|2,0,0]=4 6871 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [1,0,0,1,0,0|1,0,0]=3 6872 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [1,0,0,1,0,0|1,0,0]=3 6873 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [1,0,0,1,0,0|0,0,2]=4 6874 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [1,0,0,1,0,0|1,0,0]=3 6875 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [1,0,0,1,0,0|1,0,0]=3 6876 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [1,0,0,1,0,0|2,0,0]=4 6877 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [1,0,0,1,0,0|1,0,0]=3 6878 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [1,0,0,1,0,0|1,0,0]=3 6879 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [1,0,0,1,0,0|1,0,1]=4 6880 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [1,0,0,1,0,0|1,0,1]=4 6881 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [1,0,0,1,0,0|1,0,1]=4 6882 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [1,0,0,1,0,0|1,0,1]=4 6883 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [1,0,0,1,0,0|1,0,1]=4 6884 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [1,0,0,1,0,0|1,0,1]=4 6885 B12R2.32 O=CC1C=C2C=CC=CN2N1 Amb24486973 [1,0,0,1,0,0|1,0,1]=4 6886 B12R2.32 O=CC1C=c2ccccc2=C1 Amb24100778 [1,0,0,1,0,0|1,0,1]=4 6887 B12R2.32 O=CC1Cc2c[n]ccc2C1 Amb24509571 [1,0,0,1,0,0|2,0,0]=4 6888 B12R2.32 O=CC1Cc2ccc[n]c2C1 Amb25851252 [1,0,0,1,0,0|2,0,0]=4 6889 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [1,0,0,1,0,0|1,0,0]=3 6890 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [1,0,0,1,0,0|1,0,1]=4 6891 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [1,0,0,1,0,0|0,0,2]=4 6892 B12R2.32 OCC1Cc2[n]cccc2N1 Amb25311460 [1,0,0,1,0,0|1,0,1]=4 6893 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [1,0,0,1,0,0|1,0,1]=4 6894 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [1,0,0,1,0,0|1,0,1]=4 6895 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [1,0,0,1,0,0|0,0,1]=3 6896 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [1,0,0,1,0,0|0,0,1]=3 6897 B12R2.32 ONC1Nc2ccccc2O1 Amb24523067 [1,0,0,1,0,0|2,0,0]=4 6898 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [1,0,0,1,0,0|1,0,1]=4 6899 B12R2.37 NC=1C(=O)C1c2ccccc2 Amb24509252 [1,0,0,1,0,0|0,0,2]=4 6900 B12R2.37 N[C@@H]1[C@H]([C@@H]1N)c2ccccc2 Amb24761507 [1,0,0,1,0,0|1,0,1]=4 6901 B12R2.37 N[C@H]1C([C@@H]1N)c2ccccc2 Amb25230184 [1,0,0,1,0,0|1,0,1]=4 6902 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [1,0,0,1,0,0|1,0,1]=4 6903 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [1,0,0,1,0,0|2,0,0]=4 6904 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [1,0,0,1,0,0|1,0,1]=4 6905 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [1,0,0,1,0,0|2,0,0]=4 6906 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [1,0,0,1,0,0|2,0,0]=4 6907 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [1,0,0,1,0,0|2,0,0]=4 6908 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [1,0,0,1,0,0|1,0,0]=3 6909 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [1,0,0,1,0,0|1,0,0]=3 6910 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [1,0,0,1,0,0|1,0,1]=4 6911 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [1,0,0,1,0,0|1,0,1]=4 6912 B12R2.2057 C1OC1CCc2ccccc2 Amb24105379 [1,0,0,1,0,0|1,0,1]=4 6913 B12R2.2403 N[C@]1(O)CCc2ccccc12 Amb24472858 [1,0,0,1,0,0|1,0,1]=4 6914 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [1,0,0,1,0,0|2,0,0]=4 6915 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [1,0,0,1,0,0|2,0,0]=4 6916 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [1,0,0,1,0,0|1,0,1]=4 6917 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [1,0,0,1,0,0|1,0,1]=4 6918 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [1,0,0,1,0,0|1,0,1]=4 6919 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [1,0,0,1,0,0|2,0,0]=4 6920 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [1,0,0,1,0,0|1,0,0]=3 6921 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [1,0,0,1,0,0|1,1,0]=4 6922 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [1,0,0,1,0,0|1,0,0]=3 6923 B12R2.3190 OC(=O)C1=Cc2c1cccc2 Amb17593654 [1,0,0,1,0,0|0,0,2]=4 6924 B12R2.134 NC1C(NC1=O)c2ccco2 Amb18201437 [0,0,0,1,1,0|2,0,0]=4 6925 B12R2.134 N[C@@H]1[C@@H](NC1=O)c2ccco2 Amb24608909 [0,0,0,1,1,0|2,0,0]=4 6926 B12R2.252 OC(=O)C1Cc2c(C1)ccs2 Amb10603806 [0,0,0,1,1,0|2,0,0]=4 6927 B12R2.252 OC(=O)C1Cc2c[s]cc2C1 Amb24365365 [0,0,0,1,1,0|2,0,0]=4 6928 B12R2.252 OC(=O)C1Cc2cc[nH]c2C1 Amb25248942 [0,0,0,1,1,0|2,0,0]=4 6929 B12R2.252 OC(=O)C1Cc2ccoc2C1 Amb25248943 [0,0,0,1,1,0|2,0,0]=4 6930 B12R2.252 OC(=O)C1Cc2cocc2C1 Amb24079325 [0,0,0,1,1,0|2,0,0]=4 6931 B12R2.1354 OC(=O)C1CC1c2ccc[nH]2 Amb25376419 [0,0,0,1,1,0|2,0,0]=4 6932 B12R2.1354 OC(=O)[C@H]1C[C@@H]1c2cc[s]c2 Amb24552420 [0,0,0,1,1,0|2,0,0]=4 6933 B12R2.1354 OC(=O)[C@H]1C[C@@H]1c2ccc[s]2 Amb24552940 [0,0,0,1,1,0|2,0,0]=4 6934 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,1|2,0,0]=4 6935 B14R2.19 O=C1C=C(Cc2ccccc2)NN1 Amb25299854 [0,0,0,1,0,1|1,0,1]=4 6936 B14R2.19 O=C1C=C(Nc2ccccc2)NO1 Amb24741763 [0,0,0,1,0,1|1,0,1]=4 6937 B14R2.19 O=C1CC(Cc2ccccc2)CC1 Amb24455173 [0,0,0,1,0,1|2,0,0]=4 6938 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,1|2,0,0]=4 6939 B14R2.19 O=C1CC[C@@H](Cc2ccccc2)N1 Amb25068439 [0,0,0,1,0,1|2,0,0]=4 6940 B14R2.19 O=C1CC[C@H](Cc2ccccc2)N1 Amb25365168 [0,0,0,1,0,1|2,0,0]=4 6941 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CC1 Amb24723978 [0,0,0,1,0,1|2,0,0]=4 6942 B14R2.19 O=C1NC(Cc2cccc[n]2)CO1 Amb25288331 [0,0,0,1,0,1|2,0,0]=4 6943 B14R2.19 O=C1NC(Cc2ccccc2)=NO1 Amb18184032 [0,0,0,1,0,1|0,0,2]=4 6944 B14R2.19 O=C1NCC(C1)Cc2ccccc2 Amb10608007 [0,0,0,1,0,1|2,0,0]=4 6945 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,1|2,0,0]=4 6946 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,1|2,0,0]=4 6947 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,1|1,1,0]=4 6948 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,1|1,1,0]=4 6949 B14R2.19 O=C1OC(Cc2ccccc2)CS1 Amb25726403 [0,0,0,1,0,1|1,1,0]=4 6950 B14R2.19 O=C1OCC(O1)Sc2ccccc2 Amb25749160 [0,0,0,1,0,1|2,0,0]=4 6951 B14R2.19 O=C1ON=C(C1)Cc2ccccc2 Amb1099037 [0,0,0,1,0,1|0,0,2]=4 6952 B14R2.19 OC1CC(Cc2ccccc2)NC1 Amb23454017 [0,0,0,1,0,1|1,0,1]=4 6953 B14R2.19 O[C@@H]1C[C@@H](Cc2ccccc2)NC1 Amb24670445 [0,0,0,1,0,1|1,0,1]=4 6954 B14R2.19 Oc1c[nH]c(Cc2ccccc2)[n]1 Amb24675070 [0,0,0,1,0,1|1,0,1]=4 6955 B14R2.598 CC1CC(=O)NC1c2ccccc2 Amb24715638 [0,0,0,1,0,1|2,0,0]=4 6956 B14R2.598 CC1N=C(N)OC1c2ccccc2 Amb22055741 [0,0,0,1,0,1|2,0,0]=4 6957 B14R2.598 CC1NC(=O)OC1c2cc[n]cc2 Amb25765525 [0,0,0,1,0,1|2,0,0]=4 6958 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,0,0,1,0,1|1,0,0]=3 6959 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,0,0,1,0,1|2,0,0]=4 6960 B14R2.598 CC1OC(=O)OC1c2ccccc2 Amb25263220 [0,0,0,1,0,1|1,0,0]=3 6961 B14R2.598 C[C@@H]1CC(=O)C[C@@H]1c2ccccc2 Amb25373264 [0,0,0,1,0,1|2,0,0]=4 6962 B14R2.598 C[C@@H]1CC(=O)C[C@H]1c2ccccc2 Amb24584459 [0,0,0,1,0,1|2,0,0]=4 6963 B14R2.598 C[C@@H]1CC(=O)N[C@H]1c2ccccc2 Amb24585758 [0,0,0,1,0,1|2,0,0]=4 6964 B14R2.598 C[C@@H]1N=C(N)O[C@@H]1c2ccccc2 Amb25275397 [0,0,0,1,0,1|2,0,0]=4 6965 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2cc[n]cc2 Amb25265359 [0,0,0,1,0,1|2,0,0]=4 6966 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,0,0,1,0,1|1,0,0]=3 6967 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,0,0,1,0,1|1,0,0]=3 6968 B14R2.598 C[C@@H]1NC(=S)O[C@H]1c2ccccc2 Amb25179922 [0,0,0,1,0,1|1,1,0]=4 6969 B14R2.598 C[C@@H]1OC(=O)N[C@@H]1c2ccccc2 Amb25226668 [0,0,0,1,0,1|2,0,0]=4 6970 B14R2.598 C[C@@H]1OC(=O)N[C@H]1c2ccccc2 Amb25220629 [0,0,0,1,0,1|2,0,0]=4 6971 B14R2.598 C[C@H]1CC(=O)C[C@H]1c2ccccc2 Amb24583010 [0,0,0,1,0,1|2,0,0]=4 6972 B14R2.598 C[C@H]1CC(=O)N[C@@H]1c2ccccc2 Amb25231239 [0,0,0,1,0,1|2,0,0]=4 6973 B14R2.598 C[C@H]1NC(=O)OC1c2ccccc2 Amb24534608 [0,0,0,1,0,1|1,0,0]=3 6974 B14R2.598 C[C@H]1NC(=O)S[C@@H]1c2ccccc2 Amb24599009 [0,0,0,1,0,1|1,1,0]=4 6975 B14R2.598 C[C@H]1NC(=O)S[C@H]1c2ccccc2 Amb24610222 [0,0,0,1,0,1|1,1,0]=4 6976 B14R2.598 NC1CC(=O)NC1c2ccccc2 Amb18065621 [0,0,0,1,0,1|1,0,0]=3 6977 B14R2.598 O=C1C[C@@H](Cl)[C@@H](O1)c2ccccc2 Amb25210899 [0,0,0,1,0,1|1,0,0]=3 6978 B14R2.598 O=C1O[C@H](c2ccccc2)C(=O)O1 Amb25073739 [0,0,0,1,0,1|1,0,1]=4 6979 B14R2.598 OC1CC(=O)CC1c2ccccc2 Amb24545651 [0,0,0,1,0,1|2,0,0]=4 6980 B14R2.598 OC1CC(=O)OC1c2ccccc2 Amb25831819 [0,0,0,1,0,1|1,0,0]=3 6981 B14R2.598 OC1OC(=O)CC1c2ccccc2 Amb25058513 [0,0,0,1,0,1|2,0,0]=4 6982 B14R2.598 OC1OC(=O)C[C@H]1c2ccccc2 Amb24748335 [0,0,0,1,0,1|2,0,0]=4 6983 B14R2.598 OC1OC(=O)OC1c2ccccc2 Amb25788943 [0,0,0,1,0,1|1,0,0]=3 6984 B14R2.598 O[C@@H]1CC(=O)N[C@H]1c2ccccc2 Amb24558586 [0,0,0,1,0,1|2,0,0]=4 6985 B14R2.598 O[C@@H]1CC(=O)O[C@@H]1c2ccccc2 Amb24671435 [0,0,0,1,0,1|1,0,0]=3 6986 B14R2.642 CC1Cc2ccccc2C1C(O)=O Amb18127734 [0,0,0,1,0,1|1,0,0]=3 6987 B14R2.642 CC1Oc2ccccc2C1C(O)=O Amb25287233 [0,0,0,1,0,1|2,0,0]=4 6988 B14R2.642 CC=1Cc2ccccc2C1C(O)=O Amb18127221 [0,0,0,1,0,1|1,0,1]=4 6989 B14R2.642 C[C@H]1Cc2ccccc2[C@H]1C(O)=O Amb24558175 [0,0,0,1,0,1|1,0,0]=3 6990 B14R2.642 NC(=O)C1C(N)Cc2ccccc21 Amb25743913 [0,0,0,1,0,1|1,0,0]=3 6991 B14R2.642 Nc1[n]c2ccccc2[n]1C(O)=O Amb24078483 [0,0,0,1,0,1|1,0,1]=4 6992 B14R2.642 Nc1[s]c2ccccc2c1C(O)=O Amb24710310 [0,0,0,1,0,1|1,0,1]=4 6993 B14R2.642 Nc1oc2ccccc2c1C(O)=O Amb25381130 [0,0,0,1,0,1|1,0,1]=4 6994 B14R2.642 OC(=O)C1=C(Cl)Cc2ccccc12 Amb25772788 [0,0,0,1,0,1|1,0,1]=4 6995 B14R2.642 OC(=O)C1C(O)Cc2ccccc21 Amb24366682 [0,0,0,1,0,1|1,0,0]=3 6996 B14R2.642 OC(=O)[C@@H]1[C@@H](O)Cc2ccccc21 Amb25321980 [0,0,0,1,0,1|1,0,0]=3 6997 B14R2.738 CC1Cc2ccccc2NC(=O)C1 Amb24490332 [0,0,0,1,0,1|2,0,0]=4 6998 B14R2.738 C[C@@H]1Cc2ccccc2NC(=O)C1 Amb24490233 [0,0,0,1,0,1|2,0,0]=4 6999 B14R2.738 N[C@@H]1Cc2ccccc2NC(=O)C1 Amb24659280 [0,0,0,1,0,1|1,0,0]=3 7000 B14R2.738 N[C@H]1Cc2ccccc2NC(=O)C1 Amb25848478 [0,0,0,1,0,1|1,0,0]=3 7001 B14R2.764 CC(=O)C1OC1Cc2ccccc2 Amb24706975 [0,0,0,1,0,1|2,0,0]=4 7002 B14R2.764 CC(=O)[C@@H]1O[C@H]1Cc2ccccc2 Amb24512629 [0,0,0,1,0,1|2,0,0]=4 7003 B14R2.764 NC(=O)C1CC1Cc2ccccc2 Amb25802442 [0,0,0,1,0,1|2,0,0]=4 7004 B14R2.764 OC(=O)C1CC1Cc2ccc[n]c2 Amb23453734 [0,0,0,1,0,1|2,0,0]=4 7005 B14R2.764 OC(=O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,1|1,0,0]=3 7006 B14R2.764 OC(=O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,1|1,0,0]=3 7007 B14R2.764 OC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25173187 [0,0,0,1,0,1|2,0,0]=4 7008 B14R2.768 CC(=O)NC1Cc2c(C1)cccc2 Amb2031411 [0,0,0,1,0,1|2,0,0]=4 7009 B14R2.768 CC(=O)OC1Cc2ccccc2C1 Amb22234649 [0,0,0,1,0,1|2,0,0]=4 7010 B14R2.768 CC(=O)SC1Cc2ccccc2C1 Amb24590122 [0,0,0,1,0,1|2,0,0]=4 7011 B14R2.768 CC(C)=CC1Cc2ccccc2N1 Amb24488854 [0,0,0,1,0,1|2,0,0]=4 7012 B14R2.768 CC(O)CC1Cc2ccccc2N1 Amb24627881 [0,0,0,1,0,1|1,0,1]=4 7013 B14R2.768 NC(=O)OC1Cc2ccccc2C1 Amb25775009 [0,0,0,1,0,1|2,0,0]=4 7014 B14R2.768 O=C(Cl)CC1Cc2ccccc2C1 Amb25694239 [0,0,0,1,0,1|2,0,0]=4 7015 B14R2.768 OC(=O)CC1CN2C=CC=CC2=N1 Amb22396495 [0,0,0,1,0,1|1,0,1]=4 7016 B14R2.768 OC(=O)CC1Cc2c(O1)cccc2 Amb17606149 [0,0,0,1,0,1|1,0,0]=3 7017 B14R2.768 OC(=O)CC1Cc2ccccc2S1 Amb18189899 [0,0,0,1,0,1|1,0,0]=3 7018 B14R2.768 OC(=O)CC1Sc2ccccc2S1 Amb24741852 [0,0,0,1,0,1|2,0,0]=4 7019 B14R2.768 OC(=O)CC=1Cc2ccccc2C1 Amb18127210 [0,0,0,1,0,1|1,0,1]=4 7020 B14R2.768 OC(=O)CN1Cc2c(C1)cccc2 Amb13948972 [0,0,0,1,0,1|2,0,0]=4 7021 B14R2.768 OC(=O)Cc1[nH]c2ccccc2[n]1 Amb22495289 [0,0,0,1,0,1|1,0,1]=4 7022 B14R2.768 OC(=O)Cc1cc2c([nH]1)cccc2 Amb10071586 [0,0,0,1,0,1|0,0,2]=4 7023 B14R2.790 CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24273291 [0,0,0,1,0,1|2,0,0]=4 7024 B14R2.790 NC(=O)C[C@@H]1O[C@@H]1c2ccccc2 Amb24562883 [0,0,0,1,0,1|2,0,0]=4 7025 B14R2.790 NC(=O)NC1CC1c2ccccc2 Amb18180588 [0,0,0,1,0,1|2,0,0]=4 7026 B14R2.790 NC(=O)N[C@@H]1C[C@@H]1c2ccccc2 Amb24519168 [0,0,0,1,0,1|2,0,0]=4 7027 B14R2.790 NC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24602073 [0,0,0,1,0,1|2,0,0]=4 7028 B14R2.790 OC(=O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,1|1,0,0]=3 7029 B14R2.790 OC(=O)CC1CC1c2cccnc2 Amb17233252 [0,0,0,1,0,1|2,0,0]=4 7030 B14R2.790 OC(=O)CC1OC1c2ccccc2 Amb25794476 [0,0,0,1,0,1|1,0,0]=3 7031 B14R2.790 OC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,1|1,0,0]=3 7032 B14R2.790 OC(=O)C[C@H]1C[C@@H]1c2ccccc2 Amb25209939 [0,0,0,1,0,1|1,0,0]=3 7033 B14R2.4586 CC1C(C1C(O)=O)c2ccccc2 Amb24440802 [0,0,0,1,0,1|1,0,0]=3 7034 B14R2.4586 C[C@@H]1[C@@H]([C@@H]1C(O)=O)c2ccccc2 Amb25209963 [0,0,0,1,0,1|1,0,0]=3 7035 B14R2.4586 C[C@@H]1[C@H]([C@@H]1C(O)=O)c2ccccc2 Amb25274087 [0,0,0,1,0,1|1,0,0]=3 7036 B14R2.4586 C[C@H]1[C@H]([C@H]1C(O)=O)c2ccccc2 Amb24591205 [0,0,0,1,0,1|1,0,0]=3 7037 B14R2.4586 OC(=O)C1C(C1Br)c2ccccc2 Amb25292716 [0,0,0,1,0,1|1,0,0]=3 7038 B14R2.31 O=C1CCC1CCc2ccccc2 Amb24492658 [0,0,0,1,0,1|2,0,0]=4 7039 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,0,0,1,0,1|2,0,0]=4 7040 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,0,0,1,0,1|2,0,0]=4 7041 B14R2.31 O=C1CC[C@H]1CCc2ccccc2 Amb24364139 [0,0,0,1,0,1|2,0,0]=4 7042 B14R2.31 O=C1COC1CCc2ccccc2 Amb24492472 [0,0,0,1,0,1|2,0,0]=4 7043 B14R2.31 OC1CNC1CCc2ccccc2 Amb25104936 [0,0,0,1,0,1|1,0,1]=4 7044 B14R2.31 O[C@H]1CN[C@@H]1CCc2ccccc2 Amb25176202 [0,0,0,1,0,1|1,0,1]=4 7045 B14R2.260 C=C1CC(OC1=O)c2ccccc2 Amb24534660 [0,0,0,1,0,1|1,0,1]=4 7046 B14R2.260 CC1CC(NC1=O)c2ccccc2 Amb25250684 [0,0,0,1,0,1|2,0,0]=4 7047 B14R2.260 CC1CN(N=C1O)c2ccccc2 Amb1804743 [0,0,0,1,0,1|2,0,0]=4 7048 B14R2.260 CC1NC(NC1=O)c2ccccc2 Amb24636264 [0,0,0,1,0,1|2,0,0]=4 7049 B14R2.260 CC1OC(NC1=O)c2ccccc2 Amb10562255 [0,0,0,1,0,1|2,0,0]=4 7050 B14R2.260 CC1SC(NC1=O)c2ccccc2 Amb2223062 [0,0,0,1,0,1|2,0,0]=4 7051 B14R2.260 C[C@@H]1C[C@@H](CC1=O)c2ccccc2 Amb24631132 [0,0,0,1,0,1|2,0,0]=4 7052 B14R2.260 C[C@@H]1NC(OC1=O)c2ccccc2 Amb25238712 [0,0,0,1,0,1|1,0,0]=3 7053 B14R2.260 C[C@@H]1O[C@@H](NC1=O)c2ccccc2 Amb24513100 [0,0,0,1,0,1|2,0,0]=4 7054 B14R2.260 NC1CC(NC1=O)c2ccccc2 Amb23590809 [0,0,0,1,0,1|1,0,0]=3 7055 B14R2.260 NC1CC(OC1=O)c2ccccc2 Amb17470561 [0,0,0,1,0,1|0,0,0]=2 7056 B14R2.260 O=C1OC(CC1=O)c2ccccc2 Amb25718939 [0,0,0,1,0,1|1,0,1]=4 7057 B14R2.260 O=C1OC(CC1Cl)c2ccccc2 Amb24710095 [0,0,0,1,0,1|1,0,0]=3 7058 B14R2.260 O=C1O[C@@H](CC1=O)c2ccccc2 Amb25833624 [0,0,0,1,0,1|1,0,1]=4 7059 B14R2.260 OC1=CC(OC1=O)c2ccccc2 Amb23571856 [0,0,0,1,0,1|1,0,1]=4 7060 B14R2.260 OC1CC(=NC1=O)c2ccccc2 Amb25357649 [0,0,0,1,0,1|2,0,0]=4 7061 B14R2.260 OC1CC(NC1=O)c2ccccc2 Amb25325087 [0,0,0,1,0,1|2,0,0]=4 7062 B14R2.260 OC1CC(OC1=O)c2ccccc2 Amb24414844 [0,0,0,1,0,1|1,0,0]=3 7063 B14R2.260 O[C@@H]1CC(OC1=O)c2ccccc2 Amb25846190 [0,0,0,1,0,1|1,0,0]=3 7064 B14R2.260 O[C@@H]1C[C@H](OC1=O)c2ccccc2 Amb25176996 [0,0,0,1,0,1|1,0,0]=3 7065 B14R2.260 O[C@H]1C[C@@H](OC1=O)c2ccccc2 Amb24520002 [0,0,0,1,0,1|1,0,0]=3 7066 B14R2.427 CC1C(Cc2ccccc2)NC1=O Amb24647838 [0,0,0,1,0,1|2,0,0]=4 7067 B14R2.427 C[C@@H]1[C@H](NC1=O)Sc2ccccc2 Amb24512994 [0,0,0,1,0,1|2,0,0]=4 7068 B14R2.427 C[C@H]1[C@H](NC1=O)Sc2ccccc2 Amb25317654 [0,0,0,1,0,1|2,0,0]=4 7069 B14R2.427 NC1C(Cc2ccccc2)NC1=O Amb18196732 [0,0,0,1,0,1|1,0,0]=3 7070 B14R2.427 N[C@H]1[C@H](NC1=O)Oc2ccccc2 Amb24621902 [0,0,0,1,0,1|1,0,0]=3 7071 B14R2.427 OC1C(Cc2ccccc2)NC1=O Amb24453779 [0,0,0,1,0,1|2,0,0]=4 7072 B14R2.741 CC1CCc2ccccc2NC1=O Amb24434952 [0,0,0,1,0,1|2,0,0]=4 7073 B14R2.741 CC1CNc2c(NC1=O)cccc2 Amb1665015 [0,0,0,1,0,1|2,0,0]=4 7074 B14R2.741 CC1CSc2ccccc2NC1=O Amb24463948 [0,0,0,1,0,1|2,0,0]=4 7075 B14R2.741 CC1NCc2ccccc2CC1=O Amb25223185 [0,0,0,1,0,1|2,0,0]=4 7076 B14R2.741 CC1SCc2ccccc2NC1=O Amb25055872 [0,0,0,1,0,1|2,0,0]=4 7077 B14R2.741 C[C@@H]1CCc2ccccc2NC1=O Amb25743449 [0,0,0,1,0,1|2,0,0]=4 7078 B14R2.741 C[C@@H]1CSc2ccccc2NC1=O Amb25108327 [0,0,0,1,0,1|2,0,0]=4 7079 B14R2.741 C[C@H]1CSc2ccccc2NC1=O Amb24392094 [0,0,0,1,0,1|2,0,0]=4 7080 B14R2.741 C[C@H]1NCc2ccccc2NC1=O Amb25279479 [0,0,0,1,0,1|2,0,0]=4 7081 B14R2.741 NC1CCC2=CC=CNC2=NC1=O Amb24729085 [0,0,0,1,0,1|2,0,0]=4 7082 B14R2.741 NC1CCc2[n]cccc2NC1=O Amb25189845 [0,0,0,1,0,1|2,0,0]=4 7083 B14R2.741 NC1CNc2ccccc2NC1=O Amb24573286 [0,0,0,1,0,1|1,0,0]=3 7084 B14R2.741 NC1CNc2ccccc2SC1=O Amb24710062 [0,0,0,1,0,1|0,1,0]=3 7085 B14R2.741 NC1COc2[n]cccc2NC1=O Amb25249231 [0,0,0,1,0,1|2,0,0]=4 7086 B14R2.741 NC1COc2ccccc2NC1=O Amb21962443 [0,0,0,1,0,1|1,0,0]=3 7087 B14R2.741 N[C@@H]1COc2ccccc2NC1=O Amb24708380 [0,0,0,1,0,1|1,0,0]=3 7088 B14R2.741 N[C@H]1CNc2ccccc2NC1=O Amb25294307 [0,0,0,1,0,1|1,0,0]=3 7089 B14R2.741 N[C@H]1COc2[n]cccc2NC1=O Amb25200076 [0,0,0,1,0,1|2,0,0]=4 7090 B14R2.741 O=C1Nc2ccccc2CCC1Cl Amb21964387 [0,0,0,1,0,1|2,0,0]=4 7091 B14R2.741 O=C1Nc2ccccc2OCC1C Amb17570221 [0,0,0,1,0,1|2,0,0]=4 7092 B14R2.741 O=C1Nc2ccccc2OCC1Cl Amb24726288 [0,0,0,1,0,1|2,0,0]=4 7093 B14R2.741 O=C1Nc2ccccc2SCC1N Amb10066885 [0,0,0,1,0,1|1,0,0]=3 7094 B14R2.741 OC1CCc2ccccc2NC1=O Amb25226835 [0,0,0,1,0,1|2,0,0]=4 7095 B14R2.741 OC1COc2ccccc2NC1=O Amb25324480 [0,0,0,1,0,1|2,0,0]=4 7096 B14R2.741 O[C@@H]1COc2ccccc2NC1=O Amb24682139 [0,0,0,1,0,1|2,0,0]=4 7097 B14R2.741 O[C@H]1CCc2ccccc2NC1=O Amb24642515 [0,0,0,1,0,1|2,0,0]=4 7098 B14R2.779 NC(=O)C1CC(C1)c2ccccc2 Amb24396903 [0,0,0,1,0,1|2,0,0]=4 7099 B14R2.779 OC(=O)C1CC(C1)c2ccccc2 Amb13951336 [0,0,0,1,0,1|1,0,0]=3 7100 B14R2.779 OC(=O)C1CN(C1)c2cccc[n]2 Amb22297689 [0,0,0,1,0,1|2,0,0]=4 7101 B14R2.779 OC(=O)[C@@H]1C[C@H](C1)c2ccccc2 Amb24607374 [0,0,0,1,0,1|1,0,0]=3 7102 B14R2.781 CC(=C)C1CCc2ccccc2N1 Amb25041020 [0,0,0,1,0,1|2,0,0]=4 7103 B14R2.781 CC(=C)C1COc2ccccc2N1 Amb24488858 [0,0,0,1,0,1|2,0,0]=4 7104 B14R2.781 CC(=O)C1CNc2ccccc2O1 Amb25155762 [0,0,0,1,0,1|2,0,0]=4 7105 B14R2.781 CC(=O)C1COc2c(S1)cccc2 Amb17570722 [0,0,0,1,0,1|2,0,0]=4 7106 B14R2.781 CC(=O)C1Cc2ccccc2NC1 Amb25376919 [0,0,0,1,0,1|2,0,0]=4 7107 B14R2.781 CC(=O)C1Cc2ccccc2OC1 Amb24670907 [0,0,0,1,0,1|2,0,0]=4 7108 B14R2.781 CC(=O)[C@@H]1COc2ccccc2O1 Amb25853616 [0,0,0,1,0,1|2,0,0]=4 7109 B14R2.781 CC(O)C1CCc2ccccc2N1 Amb24691645 [0,0,0,1,0,1|1,0,1]=4 7110 B14R2.781 NC(=O)C1CCc2ccccc2O1 Amb24097305 [0,0,0,1,0,1|2,0,0]=4 7111 B14R2.781 NC(=O)C1COc2c(O1)cccc2 Amb1208479 [0,0,0,1,0,1|2,0,0]=4 7112 B14R2.781 NC(=O)C1COc2ccccc2N1 Amb25065179 [0,0,0,1,0,1|1,0,0]=3 7113 B14R2.781 NC(=O)C1CSc2ccccc2O1 Amb25742121 [0,0,0,1,0,1|2,0,0]=4 7114 B14R2.781 NC(=O)C1Cc2ccccc2CO1 Amb22643156 [0,0,0,1,0,1|2,0,0]=4 7115 B14R2.781 NC(=O)C1Cc2ccccc2NC1 Amb19313064 [0,0,0,1,0,1|2,0,0]=4 7116 B14R2.781 NC(=O)[C@@H]1CCc2ccccc2O1 Amb24182081 [0,0,0,1,0,1|2,0,0]=4 7117 B14R2.781 NC(=O)[C@H]1Cc2ccccc2CN1 Amb25255218 [0,0,0,1,0,1|2,0,0]=4 7118 B14R2.781 O=C(Cl)C1Cc2ccccc2CN1 Amb24641488 [0,0,0,1,0,1|2,0,0]=4 7119 B14R2.781 O=C(Cl)[C@@H]1CCc2ccccc2O1 Amb24496956 [0,0,0,1,0,1|2,0,0]=4 7120 B14R2.781 OC(=O)C1=Cc2c(OC1)cccc2 Amb1215611 [0,0,0,1,0,1|1,0,1]=4 7121 B14R2.781 OC(=O)C1C=Cc2c(C1)cccc2 Amb17470503 [0,0,0,1,0,1|1,0,1]=4 7122 B14R2.781 OC(=O)C1C=Cc2ccccc2O1 Amb25700939 [0,0,0,1,0,1|1,0,1]=4 7123 B14R2.781 OC(=O)C1CCc2[n]cccc2N1 Amb25736328 [0,0,0,1,0,1|1,0,0]=3 7124 B14R2.781 OC(=O)C1CCc2c(N1)cccc2 Amb10604189 [0,0,0,1,0,1|0,0,0]=2 7125 B14R2.781 OC(=O)C1CCc2c[n]ccc2N1 Amb25192114 [0,0,0,1,0,1|1,0,0]=3 7126 B14R2.781 OC(=O)C1CCc2cc[n]cc2N1 Amb25337666 [0,0,0,1,0,1|1,0,0]=3 7127 B14R2.781 OC(=O)C1CCc2ccc[n]c2N1 Amb25684702 [0,0,0,1,0,1|1,0,0]=3 7128 B14R2.781 OC(=O)C1CCc2ccc[n]c2O1 Amb25786537 [0,0,0,1,0,1|2,0,0]=4 7129 B14R2.781 OC(=O)C1CCc2ccccc2N1 Amb18560475 [0,0,0,1,0,1|0,0,0]=2 7130 B14R2.781 OC(=O)C1CNc2c(O1)cccn2 Amb16230770 [0,0,0,1,0,1|2,0,0]=4 7131 B14R2.781 OC(=O)C1CNc2ccccc2N1 Amb25074609 [0,0,0,1,0,1|0,0,0]=2 7132 B14R2.781 OC(=O)C1CNc2ccccc2O1 Amb22266726 [0,0,0,1,0,1|1,0,0]=3 7133 B14R2.781 OC(=O)C1COc2c(C1)cccc2 Amb1657619 [0,0,0,1,0,1|1,0,0]=3 7134 B14R2.781 OC(=O)C1COc2c(S1)cccc2 Amb17570762 [0,0,0,1,0,1|1,0,0]=3 7135 B14R2.781 OC(=O)C1COc2ccccc2N1 Amb18061976 [0,0,0,1,0,1|0,0,0]=2 7136 B14R2.781 OC(=O)C1COc2ccccc2O1 Amb24060687 [0,0,0,1,0,1|1,0,0]=3 7137 B14R2.781 OC(=O)C1CSc2c(C1)cccc2 Amb17595111 [0,0,0,1,0,1|1,0,0]=3 7138 B14R2.781 OC(=O)C1CSc2c(O1)cccc2 Amb13951585 [0,0,0,1,0,1|1,0,0]=3 7139 B14R2.781 OC(=O)C1Cc2[n]cccc2CC1 Amb18196206 [0,0,0,1,0,1|2,0,0]=4 7140 B14R2.781 OC(=O)C1Cc2[n]cccc2CN1 Amb24416838 [0,0,0,1,0,1|2,0,0]=4 7141 B14R2.781 OC(=O)C1Cc2c[n]ccc2CC1 Amb18196192 [0,0,0,1,0,1|2,0,0]=4 7142 B14R2.781 OC(=O)C1Cc2ccc[n]c2CC1 Amb21856877 [0,0,0,1,0,1|2,0,0]=4 7143 B14R2.781 OC(=O)C1Cc2ccc[n]c2OC1 Amb24496960 [0,0,0,1,0,1|2,0,0]=4 7144 B14R2.781 OC(=O)C1Cc2ccccc2CN1 Amb22494613 [0,0,0,1,0,1|1,0,0]=3 7145 B14R2.781 OC(=O)C1Cc2ccccc2CO1 Amb22642211 [0,0,0,1,0,1|1,0,0]=3 7146 B14R2.781 OC(=O)C1Cc2ccccc2NC1 Amb22436789 [0,0,0,1,0,1|1,0,0]=3 7147 B14R2.781 OC(=O)C1NCc2c(C1)cccc2 Amb1058838 [0,0,0,1,0,1|1,0,0]=3 7148 B14R2.781 OC(=O)C1OCc2ccccc2O1 Amb24693894 [0,0,0,1,0,1|1,0,0]=3 7149 B14R2.781 OC(=O)C=1CCc2ccccc2C1 Amb18127224 [0,0,0,1,0,1|1,0,1]=4 7150 B14R2.781 OC(=O)C=1CNc2ccccc2C1 Amb24513665 [0,0,0,1,0,1|1,0,1]=4 7151 B14R2.781 OC(=O)C=1CSc2ccccc2C1 Amb25060752 [0,0,0,1,0,1|1,0,1]=4 7152 B14R2.781 OC(=O)C=1CSc2ccccc2N1 Amb24727714 [0,0,0,1,0,1|0,0,2]=4 7153 B14R2.781 OC(=O)C=1Cc2ccccc2CC1 Amb18127205 [0,0,0,1,0,1|1,0,1]=4 7154 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb19887699 [0,0,0,1,0,1|0,0,0]=2 7155 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb22754395 [0,0,0,1,0,1|0,0,0]=2 7156 B14R2.781 OC(=O)[C@@H]1CNc2[n]cccc2O1 Amb24181920 [0,0,0,1,0,1|2,0,0]=4 7157 B14R2.781 OC(=O)[C@@H]1Cc2ccccc2CO1 Amb24365966 [0,0,0,1,0,1|1,0,0]=3 7158 B14R2.781 OC(=O)[C@@H]1Cc2ccccc2OC1 Amb25074534 [0,0,0,1,0,1|1,0,0]=3 7159 B14R2.781 OC(=O)[C@H]1CCc2ccccc2N1 Amb19888454 [0,0,0,1,0,1|0,0,0]=2 7160 B14R2.781 OC(=O)[C@H]1CCc2ccccc2O1 Amb25807936 [0,0,0,1,0,1|1,0,0]=3 7161 B14R2.781 OC(=O)[C@H]1CNc2ccccc2N1 Amb25043219 [0,0,0,1,0,1|0,0,0]=2 7162 B14R2.781 OC(=O)[C@H]1COc2ccccc2O1 Amb19889734 [0,0,0,1,0,1|1,0,0]=3 7163 B14R2.781 OC(=O)[C@H]1Cc2ccccc2OC1 Amb24376637 [0,0,0,1,0,1|1,0,0]=3 7164 B14R2.781 [O-]C(=O)C1CCc2c(O1)cccc2 Amb10553838 [0,0,0,1,0,1|1,0,1]=4 7165 B14R2.786 CC(=O)C1(C)CC1c2ccccc2 Amb25231294 [0,0,0,1,0,1|2,0,0]=4 7166 B14R2.786 CC(=O)[C@]1(C)C[C@@H]1c2ccccc2 Amb24617250 [0,0,0,1,0,1|2,0,0]=4 7167 B14R2.786 CC1(C[C@@H]1c2ccccc2)C(O)=O Amb25684837 [0,0,0,1,0,1|1,0,0]=3 7168 B14R2.786 CC1(OC1c2ccccc2)C(=O)Cl Amb24366113 [0,0,0,1,0,1|2,0,0]=4 7169 B14R2.786 C[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb24552946 [0,0,0,1,0,1|1,0,0]=3 7170 B14R2.786 C[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb25179070 [0,0,0,1,0,1|1,0,0]=3 7171 B14R2.786 C[C@@]1(O[C@@H]1c2ccccc2)C(=O)Cl Amb24559917 [0,0,0,1,0,1|2,0,0]=4 7172 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(N)=O Amb24512281 [0,0,0,1,0,1|2,0,0]=4 7173 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb25022674 [0,0,0,1,0,1|1,0,0]=3 7174 B14R2.786 C[C@]1(O[C@H]1c2ccccc2)C(N)=O Amb24591298 [0,0,0,1,0,1|2,0,0]=4 7175 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb19374730 [0,0,0,1,0,1|0,0,0]=2 7176 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb22546302 [0,0,0,1,0,1|0,0,0]=2 7177 B14R2.786 N[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb25359928 [0,0,0,1,0,1|0,0,0]=2 7178 B14R2.786 N[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519858 [0,0,0,1,0,1|0,0,0]=2 7179 B14R2.786 N[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519225 [0,0,0,1,0,1|0,0,0]=2 7180 B14R2.786 OC(=O)C1(C)CC1c2ccccc2 Amb17335110 [0,0,0,1,0,1|1,0,0]=3 7181 B14R2.786 OC(=O)C1(C)CC1c2ccccn2 Amb17335160 [0,0,0,1,0,1|2,0,0]=4 7182 B14R2.786 OC(=O)C1(C)CC1c2cccnc2 Amb17335161 [0,0,0,1,0,1|2,0,0]=4 7183 B14R2.786 OC(=O)C1(C)CC1c2ccncc2 Amb17335162 [0,0,0,1,0,1|2,0,0]=4 7184 B14R2.786 OC(=O)C1(F)CC1c2cc[n]cc2 Amb24555916 [0,0,0,1,0,1|2,0,0]=4 7185 B14R2.786 OC(=O)C1(F)CC1c2ccc[n]c2 Amb25085602 [0,0,0,1,0,1|2,0,0]=4 7186 B14R2.786 OC(=O)[C@@]1(F)C[C@@H]1c2ccccc2 Amb24538836 [0,0,0,1,0,1|1,0,0]=3 7187 B14R2.9535 CC(=O)C1(Cl)CCc2ccccc12 Amb24359039 [0,0,0,1,0,1|2,0,0]=4 7188 B14R2.9535 CC(=O)C1(O)CCc2ccccc12 Amb25282827 [0,0,0,1,0,1|2,0,0]=4 7189 B14R2.9535 CC1(COc2ccccc12)C(O)=O Amb25102512 [0,0,0,1,0,1|1,0,0]=3 7190 B14R2.9535 NC(=O)C1(N)CCc2ccccc12 Amb18278302 [0,0,0,1,0,1|1,0,0]=3 7191 B14R2.9535 NC(=O)C1(O)CCc2ccccc12 Amb18186063 [0,0,0,1,0,1|2,0,0]=4 7192 B14R2.9535 NC1(CCc2[n]cccc12)C(O)=O Amb24369030 [0,0,0,1,0,1|1,0,0]=3 7193 B14R2.9535 NC1(CCc2cc[n]cc12)C(O)=O Amb24697657 [0,0,0,1,0,1|1,0,0]=3 7194 B14R2.9535 NC1(CCc2ccc[n]c12)C(O)=O Amb24377111 [0,0,0,1,0,1|1,0,0]=3 7195 B14R2.9535 N[C@]1(COc2ccccc12)C(O)=O Amb24453199 [0,0,0,1,0,1|0,0,0]=2 7196 B14R2.9535 OC(=O)C1(C)CCc2c1cccc2 Amb10843978 [0,0,0,1,0,1|1,0,0]=3 7197 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10601665 [0,0,0,1,0,1|0,0,0]=2 7198 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10610396 [0,0,0,1,0,1|0,0,0]=2 7199 B14R2.9535 OC(=O)C1(O)CCc2ccccc12 Amb18944703 [0,0,0,1,0,1|1,0,0]=3 7200 B14R2.9535 OC(=O)C1(O)COc2ccccc12 Amb24569519 [0,0,0,1,0,1|1,0,0]=3 7201 B14R2.45467 CC(=C)C(N)C1Cc2ccccc21 Amb25679342 [0,0,0,1,0,1|2,0,0]=4 7202 B14R2.946 Nc1ccc(CC2CCC2=O)cc1 Amb24444689 [0,1,0,1,0,0|2,0,0]=4 7203 B14R2.4400 CC1C(CC1=O)c2ccc(Br)cc2 Amb25328176 [0,1,0,1,0,0|2,0,0]=4 7204 B14R2.4400 CC1C(NC1=O)c2ccc(Br)cc2 Amb25365933 [0,1,0,1,0,0|2,0,0]=4 7205 B14R2.4400 Cc1ccc(cc1)C2CC(=O)C2C Amb24489301 [0,1,0,1,0,0|2,0,0]=4 7206 B14R2.4400 Cc1ccc(cc1)[C@H]2NC(=O)[C@H]2C Amb25324455 [0,1,0,1,0,0|2,0,0]=4 7207 B14R2.4400 NC1C(NC1=O)c2ccc(Br)cc2 Amb18730235 [0,1,0,1,0,0|1,0,0]=3 7208 B14R2.4400 O=C1N[C@H]([C@@H]1Cl)c2ccc(Cl)cc2 Amb24615395 [0,1,0,1,0,0|2,0,0]=4 7209 B14R2.4400 OC1C(NC1=O)c2ccc(Cl)cc2 Amb25841023 [0,1,0,1,0,0|2,0,0]=4 7210 B14R2.4400 Oc1ccc(cc1)C2NC(=O)C2Cl Amb25758789 [0,1,0,1,0,0|2,0,0]=4 7211 B14R2.4402 CC(=O)C1CC1c2ccc(I)cc2 Amb24444973 [0,1,0,1,0,0|2,0,0]=4 7212 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)Cl Amb2406920 [0,1,0,1,0,0|2,0,0]=4 7213 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)F Amb2415814 [0,1,0,1,0,0|2,0,0]=4 7214 B14R2.4402 CC(=O)C1OC1c2ccc(O)cc2 Amb24370156 [0,1,0,1,0,0|2,0,0]=4 7215 B14R2.4402 Cc1ccc(cc1)C2CC2C(=O)Cl Amb25670775 [0,1,0,1,0,0|2,0,0]=4 7216 B14R2.4402 Cc1ccc(cc1)C2CC2C(N)=O Amb25690823 [0,1,0,1,0,0|2,0,0]=4 7217 B14R2.4402 Cc1ccc(cc1)C2OC2C(C)=O Amb24619633 [0,1,0,1,0,0|2,0,0]=4 7218 B14R2.4402 Cc1ccc(cc1)C2OC2C(N)=O Amb24433890 [0,1,0,1,0,0|2,0,0]=4 7219 B14R2.4402 Cc1ccc(cc1)C2OC2C(O)=O Amb19929991 [0,1,0,1,0,0|1,0,0]=3 7220 B14R2.4402 Cc1ccc(cc1)[C@@H]2C[C@@H]2C(O)=O Amb24512171 [0,1,0,1,0,0|1,0,0]=3 7221 B14R2.4402 Cc1ccc(cc1)[C@H]2C[C@H]2C(N)=O Amb24519396 [0,1,0,1,0,0|2,0,0]=4 7222 B14R2.4402 Cc1ccc(cc1)[C@H]2O[C@@H]2C(C)=O Amb24582585 [0,1,0,1,0,0|2,0,0]=4 7223 B14R2.4402 NC(=O)C1CC1c2ccc(Cl)cc2 Amb25108306 [0,1,0,1,0,0|2,0,0]=4 7224 B14R2.4402 NC(=O)C1CC1c2ccc(F)cc2 Amb21811908 [0,1,0,1,0,0|2,0,0]=4 7225 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb25311929 [0,1,0,1,0,0|2,0,0]=4 7226 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb24743435 [0,1,0,1,0,0|2,0,0]=4 7227 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24650188 [0,1,0,1,0,0|2,0,0]=4 7228 B14R2.4402 Nc1ccc(cc1)[C@@H]2C[C@H]2C(O)=O Amb25799160 [0,1,0,1,0,0|1,0,0]=3 7229 B14R2.4402 Nc1ccc(cc1)[C@H]2C[C@@H]2C(O)=O Amb25176098 [0,1,0,1,0,0|1,0,0]=3 7230 B14R2.4402 O=C(Cl)C1CC1c2ccc(F)cc2 Amb24738452 [0,1,0,1,0,0|2,0,0]=4 7231 B14R2.4402 OC(=O)C1CC1c2ccc(Br)c[n]2 Amb24440529 [0,1,0,1,0,0|2,0,0]=4 7232 B14R2.4402 OC(=O)C1CC1c2ccc(F)c[n]2 Amb25725062 [0,1,0,1,0,0|2,0,0]=4 7233 B14R2.4402 OC(=O)C1CC1c2ccc(I)cc2 Amb25343384 [0,1,0,1,0,0|1,0,0]=3 7234 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)Cl Amb1935060 [0,1,0,1,0,0|1,0,0]=3 7235 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)F Amb17073012 [0,1,0,1,0,0|1,0,0]=3 7236 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)O Amb17568130 [0,1,0,1,0,0|1,0,0]=3 7237 B14R2.4402 OC(=O)C1OC1c2ccc(Br)cc2 Amb19929977 [0,1,0,1,0,0|1,0,0]=3 7238 B14R2.4402 OC(=O)C1OC1c2ccc(Cl)cc2 Amb19929982 [0,1,0,1,0,0|1,0,0]=3 7239 B14R2.4402 OC(=O)C1OC1c2ccc(F)cc2 Amb19929985 [0,1,0,1,0,0|1,0,0]=3 7240 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb25175756 [0,1,0,1,0,0|1,0,0]=3 7241 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24742590 [0,1,0,1,0,0|1,0,0]=3 7242 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24557857 [0,1,0,1,0,0|1,0,0]=3 7243 B14R2.4402 OC(=O)[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb24571724 [0,1,0,1,0,0|1,0,0]=3 7244 B14R2.4402 OC(=O)[C@@H]1O[C@H]1c2ccc(Cl)cc2 Amb24602468 [0,1,0,1,0,0|1,0,0]=3 7245 B14R2.4402 OC(=O)[C@H]1C[C@@H]1c2ccc(F)cc2 Amb24600834 [0,1,0,1,0,0|1,0,0]=3 7246 B14R2.4402 OC(=O)[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb24739770 [0,1,0,1,0,0|1,0,0]=3 7247 B14R2.4402 Oc1ccc(cc1)[C@H]2C[C@H]2C(O)=O Amb25236047 [0,1,0,1,0,0|1,0,0]=3 7248 B14R2.4529 Brc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1094011 [0,1,0,1,0,0|0,0,2]=4 7249 B14R2.4529 Brc1ccc2c(c1)cc([nH]2)C(=O)O Amb2234812 [0,1,0,1,0,0|0,0,2]=4 7250 B14R2.4529 Brc1ccc2c(c1)nc([nH]2)C(=O)O Amb10070853 [0,1,0,1,0,0|1,0,1]=4 7251 B14R2.4529 CC(=O)C1Cc2cc(Br)ccc2C1 Amb24732080 [0,1,0,1,0,0|2,0,0]=4 7252 B14R2.4529 CC(=O)C1Cc2cc(Cl)ccc2O1 Amb24742723 [0,1,0,1,0,0|2,0,0]=4 7253 B14R2.4529 CC(=O)C1Cc2cc(F)ccc2C1 Amb22494081 [0,1,0,1,0,0|2,0,0]=4 7254 B14R2.4529 Cc1cc2CC(Cc2[n]c1)C(O)=O Amb18196184 [0,1,0,1,0,0|2,0,0]=4 7255 B14R2.4529 Cc1cc2CC(Cc2c[n]1)C(O)=O Amb25273226 [0,1,0,1,0,0|2,0,0]=4 7256 B14R2.4529 Cc1cc2CC(Cc2cc1)C(O)=O Amb25762849 [0,1,0,1,0,0|1,0,0]=3 7257 B14R2.4529 Cc1cc2NC(Cc2cc1)C(O)=O Amb25137184 [0,1,0,1,0,0|0,0,0]=2 7258 B14R2.4529 Cc1cc2N[C@@H](Cc2cc1)C(O)=O Amb25743962 [0,1,0,1,0,0|0,0,0]=2 7259 B14R2.4529 Cc1cc2OC(Cc2cc1)C(O)=O Amb22755246 [0,1,0,1,0,0|1,0,0]=3 7260 B14R2.4529 Cc1cc2SC(Cc2cc1)C(N)=O Amb25838333 [0,1,0,1,0,0|2,0,0]=4 7261 B14R2.4529 Cc1ccc2CC(Cc2c1)C(C)=O Amb24721713 [0,1,0,1,0,0|2,0,0]=4 7262 B14R2.4529 Cc1ccc2N[C@@H](Cc2c1)C(O)=O Amb25293968 [0,1,0,1,0,0|0,0,0]=2 7263 B14R2.4529 Cc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1106155 [0,1,0,1,0,0|0,0,2]=4 7264 B14R2.4529 Cc1ccc2c(c1)cc([nH]2)C(=O)O Amb1853352 [0,1,0,1,0,0|0,0,2]=4 7265 B14R2.4529 Clc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1227045 [0,1,0,1,0,0|0,0,2]=4 7266 B14R2.4529 Clc1ccc2c(c1)[nH]c(n2)C(=O)O Amb1102597 [0,1,0,1,0,0|1,0,1]=4 7267 B14R2.4529 Clc1ccc2c(c1)cc([nH]2)C(=O)O Amb1124439 [0,1,0,1,0,0|0,0,2]=4 7268 B14R2.4529 Fc1ccc2c(c1)[nH]c(c2)C(=O)O Amb2235022 [0,1,0,1,0,0|0,0,2]=4 7269 B14R2.4529 Fc1ccc2c(c1)[nH]c(n2)C(=O)O Amb1102547 [0,1,0,1,0,0|1,0,1]=4 7270 B14R2.4529 Fc1ccc2c(c1)cc([nH]2)C(=O)O Amb1131240 [0,1,0,1,0,0|0,0,2]=4 7271 B14R2.4529 Ic1ccc2c(c1)[nH]c(c2)C(=O)O Amb2235876 [0,1,0,1,0,0|0,0,2]=4 7272 B14R2.4529 NC(=O)C1Cc2cc(Br)ccc2O1 Amb24474084 [0,1,0,1,0,0|2,0,0]=4 7273 B14R2.4529 NC(=O)C1Cc2cc(Cl)ccc2N1 Amb23586323 [0,1,0,1,0,0|1,0,0]=3 7274 B14R2.4529 NC(=O)C1Cc2cc(F)ccc2N1 Amb25697105 [0,1,0,1,0,0|1,0,0]=3 7275 B14R2.4529 Nc1cc2N[C@H](Cc2cc1)C(O)=O Amb24641574 [0,1,0,1,0,0|0,0,0]=2 7276 B14R2.4529 Nc1cc2[nH]c(cc2cc1)C(O)=O Amb18196971 [0,1,0,1,0,0|0,0,2]=4 7277 B14R2.4529 Nc1cc2[n]c([nH]c2cc1)C(O)=O Amb22500033 [0,1,0,1,0,0|1,0,1]=4 7278 B14R2.4529 Nc1ccc2N[C@@H](Cc2c1)C(O)=O Amb24331856 [0,1,0,1,0,0|0,0,0]=2 7279 B14R2.4529 Nc1ccc2OC(Cc2c1)C(O)=O Amb18670745 [0,1,0,1,0,0|1,0,0]=3 7280 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)C Amb10607438 [0,1,0,1,0,0|0,0,0]=2 7281 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)C Amb13949031 [0,1,0,1,0,0|0,0,0]=2 7282 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)Cl Amb10607441 [0,1,0,1,0,0|0,0,0]=2 7283 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)Cl Amb11012593 [0,1,0,1,0,0|0,0,0]=2 7284 B14R2.4529 OC(=O)C1Cc2c(O1)ccc(c2)C Amb17605544 [0,1,0,1,0,0|1,0,0]=3 7285 B14R2.4529 OC(=O)C1Cc2c(S1)cc(cc2)Cl Amb2372509 [0,1,0,1,0,0|1,0,0]=3 7286 B14R2.4529 OC(=O)C1Cc2c(S1)cc(cc2)F Amb17606057 [0,1,0,1,0,0|1,0,0]=3 7287 B14R2.4529 OC(=O)C1Cc2c(S1)ccc(c2)F Amb2372511 [0,1,0,1,0,0|1,0,0]=3 7288 B14R2.4529 OC(=O)C1Cc2cc(Br)c[n]c2C1 Amb25332005 [0,1,0,1,0,0|2,0,0]=4 7289 B14R2.4529 OC(=O)C1Cc2cc(Br)ccc2C1 Amb18156517 [0,1,0,1,0,0|1,0,0]=3 7290 B14R2.4529 OC(=O)C1Cc2cc(Br)ccc2O1 Amb22751595 [0,1,0,1,0,0|1,0,0]=3 7291 B14R2.4529 OC(=O)C1Cc2cc(F)c[n]c2N1 Amb25669200 [0,1,0,1,0,0|1,0,0]=3 7292 B14R2.4529 OC(=O)C1Cc2cc(F)ccc2C1 Amb24055929 [0,1,0,1,0,0|1,0,0]=3 7293 B14R2.4529 OC(=O)C1Cc2cc(F)ccc2N1 Amb23538786 [0,1,0,1,0,0|0,0,0]=2 7294 B14R2.4529 OC(=O)C1Cc2cc(I)ccc2O1 Amb22751604 [0,1,0,1,0,0|1,0,0]=3 7295 B14R2.4529 OC(=O)C1Cc2cc(S)ccc2O1 Amb24739285 [0,1,0,1,0,0|1,0,0]=3 7296 B14R2.4529 OC(=O)C1Cc2ccc(Br)cc2N1 Amb18561156 [0,1,0,1,0,0|0,0,0]=2 7297 B14R2.4529 OC(=O)C1Cc2ccc(Cl)cc2N1 Amb18561158 [0,1,0,1,0,0|0,0,0]=2 7298 B14R2.4529 OC(=O)C1Cc2ccc(Cl)cc2O1 Amb22751591 [0,1,0,1,0,0|1,0,0]=3 7299 B14R2.4529 OC(=O)C1Cc2ccc(F)cc2N1 Amb24740897 [0,1,0,1,0,0|0,0,0]=2 7300 B14R2.4529 OC(=O)C1Cc2ccc(F)cc2O1 Amb22755265 [0,1,0,1,0,0|1,0,0]=3 7301 B14R2.4529 OC(=O)C1Cc2ccc(I)cc2N1 Amb25377147 [0,1,0,1,0,0|0,0,0]=2 7302 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Br)ccc2C1 Amb25675093 [0,1,0,1,0,0|1,0,0]=3 7303 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Br)ccc2N1 Amb24331855 [0,1,0,1,0,0|0,0,0]=2 7304 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Cl)ccc2N1 Amb24331853 [0,1,0,1,0,0|0,0,0]=2 7305 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 Amb25775019 [0,1,0,1,0,0|1,0,0]=3 7306 B14R2.4529 OC(=O)[C@@H]1Cc2cc(F)ccc2N1 Amb24574098 [0,1,0,1,0,0|0,0,0]=2 7307 B14R2.4529 OC(=O)[C@@H]1Cc2cc(I)ccc2N1 Amb25733578 [0,1,0,1,0,0|0,0,0]=2 7308 B14R2.4529 OC(=O)[C@@H]1Cc2ccc(Br)cc2N1 Amb25067972 [0,1,0,1,0,0|0,0,0]=2 7309 B14R2.4529 OC(=O)[C@@H]1Cc2ccc(I)cc2N1 Amb25809045 [0,1,0,1,0,0|0,0,0]=2 7310 B14R2.4529 OC(=O)[C@H]1Cc2cc(Br)ccc2N1 Amb24494019 [0,1,0,1,0,0|0,0,0]=2 7311 B14R2.4529 OC(=O)[C@H]1Cc2cc(F)ccc2N1 Amb24494197 [0,1,0,1,0,0|0,0,0]=2 7312 B14R2.4529 OC(=O)[C@H]1Cc2ccc(I)cc2N1 Amb24436041 [0,1,0,1,0,0|0,0,0]=2 7313 B14R2.4529 OC(=O)c1[nH]c2cc(Cl)ccc2[n]1 Amb22284161 [0,1,0,1,0,0|1,0,1]=4 7314 B14R2.4529 OC(=O)c1[nH]c2cc(F)ccc2[n]1 Amb22284152 [0,1,0,1,0,0|1,0,1]=4 7315 B14R2.4529 Oc1ccc2CC(Nc2c1)C(O)=O Amb24649443 [0,1,0,1,0,0|0,0,0]=2 7316 B14R2.4529 Oc1ccc2CC(Oc2c1)C(O)=O Amb21837686 [0,1,0,1,0,0|1,0,0]=3 7317 B14R2.4529 Oc1ccc2C[C@@H](Nc2c1)C(O)=O Amb25082481 [0,1,0,1,0,0|0,0,0]=2 7318 B14R2.4529 Oc1ccc2NC(Cc2c1)C(O)=O Amb25044784 [0,1,0,1,0,0|0,0,0]=2 7319 B14R2.4529 Oc1ccc2N[C@@H](Cc2c1)C(O)=O Amb25131207 [0,1,0,1,0,0|0,0,0]=2 7320 B14R2.4529 Oc1ccc2N[C@H](Cc2c1)C(O)=O Amb24411023 [0,1,0,1,0,0|0,0,0]=2 7321 B14R2.4529 Oc1ccc2OC(Cc2c1)C(O)=O Amb21864638 [0,1,0,1,0,0|1,0,0]=3 7322 B14R2.4529 Oc1ccc2[nH]c([n]c2c1)C(O)=O Amb21858278 [0,1,0,1,0,0|1,0,1]=4 7323 B14R2.4529 Oc1ccc2c(c1)[nH]c(c2)C(=O)O Amb10879705 [0,1,0,1,0,0|0,0,2]=4 7324 B14R2.8239 CC1Cc2cc(Br)ccc2NC1=O Amb18061644 [0,1,0,1,0,0|2,0,0]=4 7325 B14R2.8239 CC1Cc2cc(O)ccc2OC1=O Amb25729135 [0,1,0,1,0,0|1,0,0]=3 7326 B14R2.8239 CN1Cc2cc(Br)ccc2OC1=O Amb17844347 [0,1,0,1,0,0|2,0,0]=4 7327 B14R2.8239 Cc1cc2N=C(N)C(=O)Oc2cc1 Amb18647952 [0,1,0,1,0,0|1,0,1]=4 7328 B14R2.8239 Cc1ccc2CC(N)C(=O)Nc2[n]1 Amb23571831 [0,1,0,1,0,0|2,0,0]=4 7329 B14R2.8239 Cc1ccc2C[C@H](N)C(=O)Nc2[n]1 Amb25311224 [0,1,0,1,0,0|2,0,0]=4 7330 B14R2.8239 Cc1ccc2NC(=O)C(N)Cc2c1 Amb24085839 [0,1,0,1,0,0|1,0,0]=3 7331 B14R2.8239 Cc1ccc2NC(=O)C(O)Cc2c1 Amb25037192 [0,1,0,1,0,0|2,0,0]=4 7332 B14R2.8239 N=C1Cc2ccc(O)cc2OC1=O Amb24544658 [0,1,0,1,0,0|0,0,2]=4 7333 B14R2.8239 NC1=Cc2cc(Br)ccc2OC1=O Amb25116013 [0,1,0,1,0,0|0,0,2]=4 7334 B14R2.8239 NC1=Cc2cc(O)ccc2OC1=O Amb25189956 [0,1,0,1,0,0|0,0,2]=4 7335 B14R2.8239 NC1=Cc2ccc(F)cc2OC1=O Amb25127899 [0,1,0,1,0,0|0,0,2]=4 7336 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb19958301 [0,1,0,1,0,0|0,0,2]=4 7337 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb22899519 [0,1,0,1,0,0|0,0,2]=4 7338 B14R2.8239 NC1=Nc2cc(Cl)ccc2OC1=O Amb24309782 [0,1,0,1,0,0|1,0,1]=4 7339 B14R2.8239 NC1Cc2cc(Br)ccc2NC1=O Amb22549344 [0,1,0,1,0,0|1,0,0]=3 7340 B14R2.8239 NC1Cc2cc(Cl)ccc2NC1=O Amb22740164 [0,1,0,1,0,0|1,0,0]=3 7341 B14R2.8239 NC1Cc2ccc(I)cc2NC1=O Amb25352559 [0,1,0,1,0,0|1,0,0]=3 7342 B14R2.8239 NC1Cc2ccc(O)cc2NC1=O Amb22751306 [0,1,0,1,0,0|1,0,0]=3 7343 B14R2.8239 Nc1cc2NC(=O)C(Cl)Cc2cc1 Amb22370894 [0,1,0,1,0,0|2,0,0]=4 7344 B14R2.8239 O=C1Nc2cc(C)ccc2CC1C Amb17335059 [0,1,0,1,0,0|2,0,0]=4 7345 B14R2.8239 O=C1Nc2cc(C)ccc2CC1N Amb17470551 [0,1,0,1,0,0|1,0,0]=3 7346 B14R2.8239 O=C1Nc2cc(Cl)ccc2CC1N Amb10602231 [0,1,0,1,0,0|1,0,0]=3 7347 B14R2.8239 O=C1Nc2cc(F)ccc2CC1N Amb17470621 [0,1,0,1,0,0|1,0,0]=3 7348 B14R2.8239 O=C1Nc2ccc(cc2CC1C)C Amb17335060 [0,1,0,1,0,0|2,0,0]=4 7349 B14R2.8239 O=C1Nc2ccc(cc2CC1C)N Amb17400550 [0,1,0,1,0,0|2,0,0]=4 7350 B14R2.8239 O=C1Oc2ccc(cc2NC1C)C Amb17217251 [0,1,0,1,0,0|2,0,0]=4 7351 B14R2.8239 O=C1Oc2ccc(cc2NC1C)Cl Amb17217250 [0,1,0,1,0,0|2,0,0]=4 7352 B14R2.8239 OC1Cc2cc(Br)ccc2NC1=O Amb22899291 [0,1,0,1,0,0|2,0,0]=4 7353 B14R2.8239 OC1Cc2cc(F)ccc2NC1=O Amb24474999 [0,1,0,1,0,0|2,0,0]=4 7354 B14R2.8239 OC1Cc2ccc(F)cc2NC1=O Amb25246611 [0,1,0,1,0,0|2,0,0]=4 7355 B14R2.8239 O[C@@H]1Cc2cc(F)ccc2NC1=O Amb25806703 [0,1,0,1,0,0|2,0,0]=4 7356 B14R2.8239 O[C@@H]1Cc2ccc(F)cc2NC1=O Amb24642426 [0,1,0,1,0,0|2,0,0]=4 7357 B14R2.8239 O[C@H]1Cc2cc(F)ccc2NC1=O Amb24352306 [0,1,0,1,0,0|2,0,0]=4 7358 B14R2.8239 Oc1cc2CC(=O)C(=O)Oc2cc1 Amb24492602 [0,1,0,1,0,0|1,0,1]=4 7359 B14R2.29037 CC1CC2(C=CC(=O)C=C2)OC1=O Amb24492776 [0,1,0,1,0,0|1,0,1]=4 7360 B14R2.29037 OC1CC2(C=CC(=O)C=C2)OC1=O Amb25762079 [0,1,0,1,0,0|1,0,1]=4 7361 B14R2.30 O=C1C=CCC1Cc2ccccc2 Amb25767734 [0,1,0,1,0,0|2,0,0]=4 7362 B14R2.30 O=C1C=CC[C@H]1Cc2ccccc2 Amb25142619 [0,1,0,1,0,0|2,0,0]=4 7363 B14R2.30 O=C1CC=CC1Cc2ccccc2 Amb25718271 [0,1,0,1,0,0|2,0,0]=4 7364 B14R2.30 O=C1CCC[C@H]1Cc2ccccc2 Amb25767011 [0,1,0,1,0,0|2,0,0]=4 7365 B14R2.30 O=C1CCN[C@@H]1Cc2ccccc2 Amb18197192 [0,1,0,1,0,0|1,0,0]=3 7366 B14R2.30 O=C1CCN[C@H]1Cc2ccccc2 Amb24489314 [0,1,0,1,0,0|1,0,0]=3 7367 B14R2.30 O=C1CNCN1Cc2ccccc2 Amb23558083 [0,1,0,1,0,0|2,0,0]=4 7368 B14R2.30 O=C1CSCC1Cc2ccccc2 Amb24534698 [0,1,0,1,0,0|1,1,0]=4 7369 B14R2.30 O=C1NCCC1Cc2ccccc2 Amb22643153 [0,1,0,1,0,0|2,0,0]=4 7370 B14R2.30 O=C1NCSC1Cc2ccccc2 Amb24418410 [0,1,0,1,0,0|2,0,0]=4 7371 B14R2.30 O=C1OCCC1Nc2ccccc2 Amb25743171 [0,1,0,1,0,0|2,0,0]=4 7372 B14R2.30 O=C1OCCN1Cc2ccccc2 Amb25808956 [0,1,0,1,0,0|2,0,0]=4 7373 B14R2.30 OC1CCNC1Cc2ccccc2 Amb25775108 [0,1,0,1,0,0|1,0,1]=4 7374 B14R2.30 OC1CCN[C@@H]1Cc2ccccc2 Amb18195900 [0,1,0,1,0,0|1,0,1]=4 7375 B14R2.30 OC1CCN[C@H]1Cc2ccccc2 Amb24489269 [0,1,0,1,0,0|1,0,1]=4 7376 B14R2.30 O[C@@H]1CCN[C@@H]1Cc2ccccc2 Amb24649744 [0,1,0,1,0,0|1,0,1]=4 7377 B14R2.30 O[C@@H]1CNC[C@H]1Cc2ccccc2 Amb22747057 [0,1,0,1,0,0|1,0,1]=4 7378 B14R2.30 O[C@H]1CNC[C@@H]1Cc2ccccc2 Amb24615154 [0,1,0,1,0,0|1,0,1]=4 7379 B14R2.30 Oc1[n][nH]cc1Cc2ccccc2 Amb23515252 [0,1,0,1,0,0|1,0,1]=4 7380 B14R2.447 CC1C(C(C)C1=O)c2ccccc2 Amb25698912 [0,1,0,1,0,0|2,0,0]=4 7381 B14R2.447 CN1C(C(Cl)C1=O)c2ccccc2 Amb24663002 [0,1,0,1,0,0|2,0,0]=4 7382 B14R2.447 CN1C(C(N)C1=O)c2ccccc2 Amb23555352 [0,1,0,1,0,0|1,0,0]=3 7383 B14R2.447 CN1[C@@H]([C@@H](N)C1=O)c2ccccc2 Amb25231965 [0,1,0,1,0,0|1,0,0]=3 7384 B14R2.727 CC1(Cc2ccccc2)CCC1=O Amb25053062 [0,1,0,1,0,0|2,0,0]=4 7385 B14R2.727 CC1(Cc2ccccc2)CNC1=O Amb25825202 [0,1,0,1,0,0|2,0,0]=4 7386 B14R2.727 C[C@@]1(Cc2ccccc2)CNC1=O Amb25309688 [0,1,0,1,0,0|2,0,0]=4 7387 B14R2.727 C[C@]1(Cc2ccccc2)CNC1=O Amb24462811 [0,1,0,1,0,0|2,0,0]=4 7388 B14R2.958 C=CC(=O)C1OC1c2ccccc2 Amb25807537 [0,1,0,1,0,0|2,0,0]=4 7389 B14R2.958 C=CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24633398 [0,1,0,1,0,0|2,0,0]=4 7390 B14R2.958 CCC(=O)C1CC1c2ccccc2 Amb24534293 [0,1,0,1,0,0|2,0,0]=4 7391 B14R2.958 CCC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25322800 [0,1,0,1,0,0|2,0,0]=4 7392 B14R2.958 CCC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24612438 [0,1,0,1,0,0|2,0,0]=4 7393 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25226125 [0,1,0,1,0,0|2,0,0]=4 7394 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,1,0,1,0,0|2,0,0]=4 7395 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24605065 [0,1,0,1,0,0|2,0,0]=4 7396 B14R2.958 COC(=O)C1CC1c2cc[n]cc2 Amb25355787 [0,1,0,1,0,0|2,0,0]=4 7397 B14R2.958 COC(=O)C1CC1c2ccc[n]c2 Amb25852071 [0,1,0,1,0,0|2,0,0]=4 7398 B14R2.958 COC(=O)C1N=C1c2ccccc2 Amb22325239 [0,1,0,1,0,0|0,0,2]=4 7399 B14R2.958 COC(=O)N1CC1c2ccccc2 Amb1039317 [0,1,0,1,0,0|2,0,0]=4 7400 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2cccc[n]2 Amb24617301 [0,1,0,1,0,0|2,0,0]=4 7401 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,1,0,1,0,0|1,0,0]=3 7402 B14R2.958 N=C(NO)C1CC1c2ccccc2 Amb25312724 [0,1,0,1,0,0|2,0,0]=4 7403 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,1,0,1,0,0|2,0,0]=4 7404 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,1,0,1,0,0|2,0,0]=4 7405 B14R2.958 NNC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24501421 [0,1,0,1,0,0|2,0,0]=4 7406 B14R2.958 O=C(CBr)C1CC1c2ccccc2 Amb25220775 [0,1,0,1,0,0|2,0,0]=4 7407 B14R2.958 ONC(=O)C1CC1c2ccc[n]c2 Amb25331855 [0,1,0,1,0,0|2,0,0]=4 7408 B14R2.958 ONC(=O)C1CC1c2ccccc2 Amb25332697 [0,1,0,1,0,0|1,0,0]=3 7409 B14R2.958 ONC(=O)[C@@H]1C[C@H]1c2ccc[n]c2 Amb24434028 [0,1,0,1,0,0|2,0,0]=4 7410 B14R2.972 C#CC(=O)C1Cc2ccccc2C1 Amb24471193 [0,1,0,1,0,0|2,0,0]=4 7411 B14R2.972 C#CC(=O)C1Cc2ccccc2N1 Amb25836668 [0,1,0,1,0,0|1,0,0]=3 7412 B14R2.972 C#CC(=O)C1Cc2ccccc2O1 Amb25816154 [0,1,0,1,0,0|2,0,0]=4 7413 B14R2.972 C=CC(=O)C1Cc2ccccc2O1 Amb24763538 [0,1,0,1,0,0|2,0,0]=4 7414 B14R2.972 C=CC(O)C1Cc2ccccc2N1 Amb24518928 [0,1,0,1,0,0|1,0,1]=4 7415 B14R2.972 CCC(=O)C1Cc2ccccc2S1 Amb24730289 [0,1,0,1,0,0|2,0,0]=4 7416 B14R2.972 CCC(O)C1Cc2ccccc2N1 Amb25332920 [0,1,0,1,0,0|1,0,1]=4 7417 B14R2.972 COC(=O)C1Cc2[n]cccc2N1 Amb24374696 [0,1,0,1,0,0|1,0,0]=3 7418 B14R2.972 COC(=O)C1Cc2c[n]ccc2C1 Amb24612597 [0,1,0,1,0,0|2,0,0]=4 7419 B14R2.972 COC(=O)C1Cc2ccc[n]c2C1 Amb25230634 [0,1,0,1,0,0|2,0,0]=4 7420 B14R2.972 COC(=O)C1Cc2ccc[n]c2N1 Amb25108180 [0,1,0,1,0,0|1,0,0]=3 7421 B14R2.972 COC(=O)C1Cc2ccccc2C1 Amb21859222 [0,1,0,1,0,0|1,0,0]=3 7422 B14R2.972 COC(=O)C=1Cc2ccccc2C1 Amb25776174 [0,1,0,1,0,0|1,0,1]=4 7423 B14R2.972 COC(=O)[C@@H]1Cc2[n]cccc2N1 Amb24400077 [0,1,0,1,0,0|1,0,0]=3 7424 B14R2.972 COC(=O)[C@@H]1Cc2ccc[n]c2N1 Amb24376203 [0,1,0,1,0,0|1,0,0]=3 7425 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb18180641 [0,1,0,1,0,0|0,0,0]=2 7426 B14R2.972 COC(=O)[C@H]1Cc2ccccc2N1 Amb25751911 [0,1,0,1,0,0|0,0,0]=2 7427 B14R2.972 COC(=O)c1[nH]c2ccccc2[n]1 Amb22899964 [0,1,0,1,0,0|1,0,1]=4 7428 B14R2.972 COC(=O)c1cc2c([nH]1)cccc2 Amb1030871 [0,1,0,1,0,0|0,0,2]=4 7429 B14R2.972 N#CC(O)C1Cc2ccccc2N1 Amb24468271 [0,1,0,1,0,0|1,0,1]=4 7430 B14R2.972 NCC(O)C1Cc2ccccc2N1 Amb24429448 [0,1,0,1,0,0|1,0,1]=4 7431 B14R2.972 NNC(=O)C1Cc2ccccc2C1 Amb25694155 [0,1,0,1,0,0|2,0,0]=4 7432 B14R2.972 NNC(=O)C1Cc2ccccc2N1 Amb25837045 [0,1,0,1,0,0|1,0,0]=3 7433 B14R2.972 O=C(CBr)C1Cc2ccccc2C1 Amb24463502 [0,1,0,1,0,0|2,0,0]=4 7434 B14R2.972 O=C(CBr)C1Cc2ccccc2S1 Amb25075428 [0,1,0,1,0,0|2,0,0]=4 7435 B14R2.972 O=C(CCl)C1Cc2ccccc2C1 Amb25721869 [0,1,0,1,0,0|2,0,0]=4 7436 B14R2.972 O=C(CCl)C1Cc2ccccc2O1 Amb24104135 [0,1,0,1,0,0|2,0,0]=4 7437 B14R2.972 O=C(CCl)C1Cc2ccccc2S1 Amb25081602 [0,1,0,1,0,0|2,0,0]=4 7438 B14R2.972 OC(C=O)C1Cc2ccccc2N1 Amb25794775 [0,1,0,1,0,0|0,0,1]=3 7439 B14R2.972 OCC(=O)c1cc2ccccc2[nH]1 Amb24744518 [0,1,0,1,0,0|0,0,2]=4 7440 B14R2.972 ONC(=O)C1Cc2ccccc2N1 Amb25803952 [0,1,0,1,0,0|0,0,0]=2 7441 B14R2.972 ONC(=O)c1cc2ccccc2[nH]1 Amb24658826 [0,1,0,1,0,0|0,0,2]=4 7442 B14R2.1128 CCC1Cc2ccccc2NC1=O Amb17335061 [0,1,0,1,0,0|2,0,0]=4 7443 B14R2.1128 CCC1Nc2ccccc2OC1=O Amb24415409 [0,1,0,1,0,0|2,0,0]=4 7444 B14R2.1128 CNC1Cc2ccccc2CC1O Amb25211322 [0,1,0,1,0,0|1,0,1]=4 7445 B14R2.1128 CN[C@H]1Cc2ccccc2C[C@@H]1O Amb24664218 [0,1,0,1,0,0|1,0,1]=4 7446 B14R2.1128 N#CC1Cc2ccccc2CC1=O Amb24467104 [0,1,0,1,0,0|1,0,1]=4 7447 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [0,1,0,1,0,0|0,0,2]=4 7448 B14R2.1128 NCC1Cc2ccccc2NC1=O Amb19149340 [0,1,0,1,0,0|1,0,0]=3 7449 B14R2.1128 NCC1Oc2ccccc2NC1=O Amb17335218 [0,1,0,1,0,0|2,0,0]=4 7450 B14R2.1128 ONC1=Nc2ccccc2OC1=O Amb20641490 [0,1,0,1,0,0|1,0,1]=4 7451 B14R2.4514 C=C1C(COC1=O)c2ccccc2 Amb24417074 [0,1,0,1,0,0|1,0,1]=4 7452 B14R2.4514 CC1C(=O)ON=C1c2ccccc2 Amb25675398 [0,1,0,1,0,0|1,0,1]=4 7453 B14R2.4514 CC1C(C=CC1=O)c2ccccc2 Amb25859267 [0,1,0,1,0,0|2,0,0]=4 7454 B14R2.4514 CC1C(CCC1=O)c2ccccc2 Amb24051457 [0,1,0,1,0,0|2,0,0]=4 7455 B14R2.4514 CC1C(CNC1=O)c2ccccc2 Amb24312552 [0,1,0,1,0,0|2,0,0]=4 7456 B14R2.4514 CC1C(OCC1=O)c2ccccc2 Amb25370856 [0,1,0,1,0,0|1,0,0]=3 7457 B14R2.4514 CC1COC(C1N)c2ccccc2 Amb25698365 [0,1,0,1,0,0|1,0,1]=4 7458 B14R2.4514 CN1C(COC1=O)c2ccccc2 Amb25191541 [0,1,0,1,0,0|2,0,0]=4 7459 B14R2.4514 CN1[C@H](COC1=O)c2ccccc2 Amb24362005 [0,1,0,1,0,0|2,0,0]=4 7460 B14R2.4514 C[C@H]1[C@@H](CCC1=O)c2ccccc2 Amb25327910 [0,1,0,1,0,0|2,0,0]=4 7461 B14R2.4514 C[C@H]1[C@@H](OCC1=O)c2ccccc2 Amb24512682 [0,1,0,1,0,0|1,0,0]=3 7462 B14R2.4514 N[C@@H]1[C@H](ONC1=O)c2ccccc2 Amb24744776 [0,1,0,1,0,0|0,0,0]=2 7463 B14R2.4514 O=C1CCC(C1Cl)c2ccccc2 Amb25300341 [0,1,0,1,0,0|2,0,0]=4 7464 B14R2.4514 O=C1ONN(C1Br)c2ccccc2 Amb25804192 [0,1,0,1,0,0|2,0,0]=4 7465 B14R2.4514 OC1C(C=CC1=O)c2ccccc2 Amb25262773 [0,1,0,1,0,0|2,0,0]=4 7466 B14R2.4514 OC1C(CNC1=O)c2ccccc2 Amb24490122 [0,1,0,1,0,0|2,0,0]=4 7467 B14R2.4514 OC1C(NNC1=O)c2ccccc2 Amb24475814 [0,1,0,1,0,0|2,0,0]=4 7468 B14R2.8188 CC1=C(N)C(=O)Oc2ccccc21 Amb18127405 [0,1,0,1,0,0|0,0,2]=4 7469 B14R2.8188 CC1C(=O)Oc2ccccc2C1=O Amb25834411 [0,1,0,1,0,0|1,0,1]=4 7470 B14R2.8188 CC1C(C)c2ccccc2NC1=O Amb25131133 [0,1,0,1,0,0|2,0,0]=4 7471 B14R2.8188 CC1C(O)c2ccccc2NC1=O Amb24496802 [0,1,0,1,0,0|2,0,0]=4 7472 B14R2.8188 CC1Cc2ccccc2C(O)C1=C Amb24661281 [0,1,0,1,0,0|2,0,0]=4 7473 B14R2.8188 CC1Oc2ccccc2[C@@H](O)[C@H]1N Amb25252104 [0,1,0,1,0,0|1,0,1]=4 7474 B14R2.8188 CC1Oc2ccccc2[C@H](O)[C@@H]1N Amb24688326 [0,1,0,1,0,0|1,0,1]=4 7475 B14R2.8188 CC=1Cc2ccccc2C(=O)C1O Amb25066311 [0,1,0,1,0,0|1,0,1]=4 7476 B14R2.8188 CN1C(=O)C(C)Cc2ccccc12 Amb18061650 [0,1,0,1,0,0|2,0,0]=4 7477 B14R2.8188 CN1C(=O)C(N)Cc2ccc[n]c12 Amb24626066 [0,1,0,1,0,0|2,0,0]=4 7478 B14R2.8188 CN1C(=O)C(N)Cc2ccccc12 Amb18559243 [0,1,0,1,0,0|1,0,0]=3 7479 B14R2.8188 CN1C(=O)C(N)Sc2ccccc12 Amb18636521 [0,1,0,1,0,0|2,0,0]=4 7480 B14R2.8188 CN1C(=O)C(O)Cc2ccccc12 Amb25788945 [0,1,0,1,0,0|2,0,0]=4 7481 B14R2.8188 CN1C(=O)[C@@H](N)Cc2ccccc12 Amb25691482 [0,1,0,1,0,0|1,0,0]=3 7482 B14R2.8188 CN1C(=O)[C@H](N)Cc2ccccc12 Amb25035451 [0,1,0,1,0,0|1,0,0]=3 7483 B14R2.8188 CN1C(O)c2ccccc2OC1=O Amb25115917 [0,1,0,1,0,0|2,0,0]=4 7484 B14R2.8188 C[C@@H]1[C@@H](C)c2ccccc2NC1=O Amb24661172 [0,1,0,1,0,0|2,0,0]=4 7485 B14R2.8188 C[C@@H]1[C@H](N)C(=O)Nc2ccccc21 Amb24649017 [0,1,0,1,0,0|1,0,0]=3 7486 B14R2.8188 NC1=C(O)c2ccccc2OC1=O Amb18127826 [0,1,0,1,0,0|0,0,2]=4 7487 B14R2.8188 NC1C(=O)Oc2ccccc2C1=O Amb25363267 [0,1,0,1,0,0|0,0,1]=3 7488 B14R2.8188 NC1Cc2cc[n]cc2N(O)C1=O Amb24579515 [0,1,0,1,0,0|1,0,0]=3 7489 B14R2.8188 NC1Cc2ccccc2C(F)C1=O Amb24581010 [0,1,0,1,0,0|1,0,0]=3 7490 B14R2.8188 NC1Cc2ccccc2N(O)C1=O Amb22372298 [0,1,0,1,0,0|0,0,0]=2 7491 B14R2.8188 NC=1C(=O)Oc2ccccc2C1N Amb18647951 [0,1,0,1,0,0|0,0,2]=4 7492 B14R2.8188 N[C@@H]1Cc2ccccc2N(O)C1=O Amb22746376 [0,1,0,1,0,0|0,0,0]=2 7493 B14R2.8188 N[C@@H]1Cc2ccccc2[C@@H](Cl)[C@@H]1O Amb24557803 [0,1,0,1,0,0|1,0,1]=4 7494 B14R2.8188 N[C@H]1Cc2ccccc2N(O)C1=O Amb25039392 [0,1,0,1,0,0|0,0,0]=2 7495 B14R2.8188 O=C1Oc2ccccc2C(C1Br)Br Amb2137043 [0,1,0,1,0,0|1,0,0]=3 7496 B14R2.8188 OC1Sc2ccccc2N(O)C1=O Amb25837921 [0,1,0,1,0,0|2,0,0]=4 7497 B14R2.8188 ON1C(O)Cc2ccccc2C1=O Amb25787390 [0,1,0,1,0,0|2,0,0]=4 7498 B14R2.8188 O[C@H]1Oc2ccccc2N(O)C1=O Amb24412905 [0,1,0,1,0,0|2,0,0]=4 7499 B14R2.8188 O[C@H]1[C@@H](O)c2ccccc2NC1=O Amb24611199 [0,1,0,1,0,0|2,0,0]=4 7500 B14R2.10659 CC1(Cc2ccccc12)C(=O)OC Amb25341517 [0,1,0,1,0,0|1,0,0]=3 7501 B14R2.17474 CCC1(O)C(N)Cc2ccccc12 Amb24459783 [0,1,0,1,0,0|1,0,1]=4 7502 B14R2.17474 CC[C@@]1(O)[C@@H](N)Cc2ccccc12 Amb25212314 [0,1,0,1,0,0|1,0,1]=4 7503 B14R2.4473 CC1C(CC1=O)c2cccc(Br)c2 Amb24563280 [0,1,0,1,0,0|2,0,0]=4 7504 B14R2.4473 CC1C(NC1=O)c2cccc(Br)c2 Amb25158423 [0,1,0,1,0,0|2,0,0]=4 7505 B14R2.4473 CC1C(NC1=O)c2cccc(F)c2 Amb25744303 [0,1,0,1,0,0|2,0,0]=4 7506 B14R2.4473 NC1C(NC1=O)c2cccc(Br)c2 Amb18730227 [0,1,0,1,0,0|1,0,0]=3 7507 B14R2.4476 Cc1cc(ccc1)C2CC2C(N)=O Amb24490097 [0,1,0,1,0,0|2,0,0]=4 7508 B14R2.4476 Cc1cc(ccc1)C2OC2C(O)=O Amb19929990 [0,1,0,1,0,0|1,0,0]=3 7509 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(N)=O Amb24648756 [0,1,0,1,0,0|2,0,0]=4 7510 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(O)=O Amb24567212 [0,1,0,1,0,0|1,0,0]=3 7511 B14R2.4476 Cc1cccc(c1)[C@@H]2C[C@H]2C(C)=O Amb25262717 [0,1,0,1,0,0|2,0,0]=4 7512 B14R2.4476 NC(=O)C1CC1c2cc(Cl)ccc2 Amb25738001 [0,1,0,1,0,0|2,0,0]=4 7513 B14R2.4476 NC(=O)C1CC1c2cc(F)ccc2 Amb24677885 [0,1,0,1,0,0|2,0,0]=4 7514 B14R2.4476 NC(=O)C1CC1c2cccc(c2)Br Amb13322380 [0,1,0,1,0,0|2,0,0]=4 7515 B14R2.4476 NC(=O)[C@@H]1O[C@H]1c2cc(Cl)ccc2 Amb24643185 [0,1,0,1,0,0|2,0,0]=4 7516 B14R2.4476 Nc1cc(ccc1)C2CC2C(O)=O Amb25238282 [0,1,0,1,0,0|1,0,0]=3 7517 B14R2.4476 OC(=O)C1CC1c2cccc(F)[n]2 Amb24366615 [0,1,0,1,0,0|2,0,0]=4 7518 B14R2.4476 OC(=O)C1CC1c2cccc(c2)O Amb17568185 [0,1,0,1,0,0|1,0,0]=3 7519 B14R2.4476 OC(=O)C1OC1c2cc(Br)ccc2 Amb19929979 [0,1,0,1,0,0|1,0,0]=3 7520 B14R2.4476 OC(=O)C1OC1c2cc(Cl)ccc2 Amb19929981 [0,1,0,1,0,0|1,0,0]=3 7521 B14R2.4476 OC(=O)C1OC1c2cc(F)ccc2 Amb19929984 [0,1,0,1,0,0|1,0,0]=3 7522 B14R2.4476 OC(=O)[C@@H]1CC1c2cc(Br)ccc2 Amb24058242 [0,1,0,1,0,0|1,0,0]=3 7523 B14R2.4476 OC(=O)[C@@H]1C[C@H]1c2cc(F)ccc2 Amb25322492 [0,1,0,1,0,0|1,0,0]=3 7524 B14R2.4476 OC(=O)[C@H]1C[C@@H]1c2cc(Cl)ccc2 Amb25322133 [0,1,0,1,0,0|1,0,0]=3 7525 B14R2.4476 Oc1cccc(c1)[C@H]2C[C@@H]2C(O)=O Amb24738654 [0,1,0,1,0,0|1,0,0]=3 7526 B14R2.7969 Cc1c[n]cc2CC(Cc21)C(O)=O Amb18196183 [0,1,0,1,0,0|2,0,0]=4 7527 B14R2.7969 Cc1cccc2CC(Nc21)C(O)=O Amb25689483 [0,1,0,1,0,0|0,0,0]=2 7528 B14R2.7969 Cc1cccc2CC(Oc21)C(O)=O Amb22755216 [0,1,0,1,0,0|1,0,0]=3 7529 B14R2.7969 Cc1cccc2C[C@H](Nc21)C(O)=O Amb25328482 [0,1,0,1,0,0|0,0,0]=2 7530 B14R2.7969 Cc1cccc2NC(Cc21)C(O)=O Amb25758824 [0,1,0,1,0,0|0,0,0]=2 7531 B14R2.7969 Cc1cccc2N[C@H](Cc21)C(O)=O Amb25726903 [0,1,0,1,0,0|0,0,0]=2 7532 B14R2.7969 Cc1cccc2OC(Cc21)C(O)=O Amb22755232 [0,1,0,1,0,0|1,0,0]=3 7533 B14R2.7969 Cc1cccc2OC(Oc21)C(O)=O Amb25322124 [0,1,0,1,0,0|2,0,0]=4 7534 B14R2.7969 NC(=O)C1Cc2cccc(Cl)c2O1 Amb25320710 [0,1,0,1,0,0|2,0,0]=4 7535 B14R2.7969 Nc1cccc2CC(Cc21)C(O)=O Amb25736233 [0,1,0,1,0,0|1,0,0]=3 7536 B14R2.7969 Nc1cccc2CC(Nc21)C(O)=O Amb24440929 [0,1,0,1,0,0|0,0,0]=2 7537 B14R2.7969 Nc1cccc2CC(Oc21)C(O)=O Amb24685607 [0,1,0,1,0,0|1,0,0]=3 7538 B14R2.7969 Nc1cccc2NC(Cc21)C(O)=O Amb25758657 [0,1,0,1,0,0|0,0,0]=2 7539 B14R2.7969 Nc1cccc2N[C@H](Cc21)C(O)=O Amb25786215 [0,1,0,1,0,0|0,0,0]=2 7540 B14R2.7969 Nc1cccc2[nH]c([n]c21)C(O)=O Amb24664532 [0,1,0,1,0,0|1,0,1]=4 7541 B14R2.7969 Nc1cccc2[nH]c(cc21)C(O)=O Amb22494133 [0,1,0,1,0,0|0,0,2]=4 7542 B14R2.7969 OC(=O)C1Cc2c(Cl)cccc2N1 Amb24381409 [0,1,0,1,0,0|0,0,0]=2 7543 B14R2.7969 OC(=O)C1Cc2c(I)cccc2N1 Amb25351458 [0,1,0,1,0,0|0,0,0]=2 7544 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2C1 Amb18156516 [0,1,0,1,0,0|1,0,0]=3 7545 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2N1 Amb25296472 [0,1,0,1,0,0|0,0,0]=2 7546 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2S1 Amb24386012 [0,1,0,1,0,0|1,0,0]=3 7547 B14R2.7969 OC(=O)C1Cc2cccc(Cl)c2C1 Amb24740757 [0,1,0,1,0,0|1,0,0]=3 7548 B14R2.7969 OC(=O)C1Cc2cccc(Cl)c2O1 Amb22235978 [0,1,0,1,0,0|1,0,0]=3 7549 B14R2.7969 OC(=O)C1Cc2cccc(F)c2O1 Amb19148286 [0,1,0,1,0,0|1,0,0]=3 7550 B14R2.7969 OC(=O)C1Nc2cccc(Br)c2O1 Amb22235983 [0,1,0,1,0,0|1,0,0]=3 7551 B14R2.7969 OC(=O)C1Sc2c(C1)c(C)ccc2 Amb17606054 [0,1,0,1,0,0|1,0,0]=3 7552 B14R2.7969 OC(=O)C1Sc2c(C1)c(Cl)ccc2 Amb17606055 [0,1,0,1,0,0|1,0,0]=3 7553 B14R2.7969 OC(=O)C1Sc2c(C1)c(F)ccc2 Amb2372510 [0,1,0,1,0,0|1,0,0]=3 7554 B14R2.7969 OC(=O)C=1Cc2cccc(F)c2C1 Amb25174454 [0,1,0,1,0,0|1,0,1]=4 7555 B14R2.7969 OC(=O)[C@@H]1Cc2c(Br)cccc2N1 Amb25062422 [0,1,0,1,0,0|0,0,0]=2 7556 B14R2.7969 OC(=O)[C@@H]1Cc2c(F)cccc2N1 Amb24385948 [0,1,0,1,0,0|0,0,0]=2 7557 B14R2.7969 OC(=O)[C@@H]1Cc2cccc(F)c2N1 Amb24341239 [0,1,0,1,0,0|0,0,0]=2 7558 B14R2.7969 OC(=O)[C@H]1Cc2c(Br)cccc2N1 Amb25067361 [0,1,0,1,0,0|0,0,0]=2 7559 B14R2.7969 OC(=O)[C@H]1Cc2c(I)cccc2N1 Amb25067860 [0,1,0,1,0,0|0,0,0]=2 7560 B14R2.7969 OC(=O)[C@H]1Cc2cccc(I)c2N1 Amb25301749 [0,1,0,1,0,0|0,0,0]=2 7561 B14R2.7969 OC(=O)c1[nH]c2c(Br)cccc2[n]1 Amb25670164 [0,1,0,1,0,0|1,0,1]=4 7562 B14R2.7969 OC(=O)c1[nH]c2cccc(Cl)c2[n]1 Amb24529364 [0,1,0,1,0,0|1,0,1]=4 7563 B14R2.7969 OC(=O)c1[nH]c2cccc(I)c2[n]1 Amb25267935 [0,1,0,1,0,0|1,0,1]=4 7564 B14R2.7969 OC(=O)c1[nH]c2cccc(S)c2[n]1 Amb25270326 [0,1,0,1,0,0|1,0,1]=4 7565 B14R2.7969 OC(=O)c1cc2c([nH]1)c(Br)ccc2 Amb2236047 [0,1,0,1,0,0|0,0,2]=4 7566 B14R2.7969 OC(=O)c1cc2c([nH]1)c(C)ccc2 Amb1132816 [0,1,0,1,0,0|0,0,2]=4 7567 B14R2.7969 OC(=O)c1cc2c([nH]1)c(Cl)ccc2 Amb2236135 [0,1,0,1,0,0|0,0,2]=4 7568 B14R2.7969 OC(=O)c1cc2c([nH]1)c(F)ccc2 Amb1136408 [0,1,0,1,0,0|0,0,2]=4 7569 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2Br Amb1243238 [0,1,0,1,0,0|0,0,2]=4 7570 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2C Amb1227669 [0,1,0,1,0,0|0,0,2]=4 7571 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2Cl Amb1088976 [0,1,0,1,0,0|0,0,2]=4 7572 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2F Amb1675280 [0,1,0,1,0,0|0,0,2]=4 7573 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2O Amb10879707 [0,1,0,1,0,0|0,0,2]=4 7574 B14R2.7969 OC(=O)c1nc2c([nH]1)cccc2C Amb10603797 [0,1,0,1,0,0|1,0,1]=4 7575 B14R2.7969 Oc1cccc2CC(Cc12)C(O)=O Amb22233765 [0,1,0,1,0,0|1,0,0]=3 7576 B14R2.7969 Oc1cccc2CC(Nc12)C(O)=O Amb25858200 [0,1,0,1,0,0|0,0,0]=2 7577 B14R2.7969 Oc1cccc2CC(Oc12)C(O)=O Amb23555615 [0,1,0,1,0,0|1,0,0]=3 7578 B14R2.7969 Oc1cccc2C[C@@H](Nc12)C(O)=O Amb24641425 [0,1,0,1,0,0|0,0,0]=2 7579 B14R2.7969 Oc1cccc2NC(Cc12)C(O)=O Amb25210916 [0,1,0,1,0,0|0,0,0]=2 7580 B14R2.7969 Oc1cccc2OC(Cc12)C(O)=O Amb25697111 [0,1,0,1,0,0|1,0,0]=3 7581 B14R2.7969 Oc1cccc2[n]c([nH]c12)C(O)=O Amb24078497 [0,1,0,1,0,0|1,0,1]=4 7582 B14R2.28472 CC1Cc2cccc(O)c2OC1=O Amb24378495 [0,1,0,1,0,0|1,0,0]=3 7583 B14R2.28472 Cc1cccc2C[C@@H](O)C(=O)Nc21 Amb24466235 [0,1,0,1,0,0|2,0,0]=4 7584 B14R2.28472 Cc1cccc2NC(=O)C(O)Cc21 Amb24533435 [0,1,0,1,0,0|2,0,0]=4 7585 B14R2.28472 NC1=Cc2cccc(N)c2OC1=O Amb25138617 [0,1,0,1,0,0|0,0,2]=4 7586 B14R2.28472 NC1=Cc2cccc(O)c2OC1=O Amb18127813 [0,1,0,1,0,0|0,0,2]=4 7587 B14R2.28472 NC1Cc2c(Br)cccc2NC1=O Amb25315450 [0,1,0,1,0,0|1,0,0]=3 7588 B14R2.28472 NC1Cc2c(O)cccc2NC1=O Amb25720225 [0,1,0,1,0,0|1,0,0]=3 7589 B14R2.28472 NC1Cc2cccc(F)c2NC1=O Amb25230033 [0,1,0,1,0,0|1,0,0]=3 7590 B14R2.28472 Nc1cccc2CC(N)C(=O)Nc12 Amb25714359 [0,1,0,1,0,0|1,0,0]=3 7591 B14R2.28472 Nc1cccc2NC(=O)C(O)Cc21 Amb24738442 [0,1,0,1,0,0|2,0,0]=4 7592 B14R2.28472 Nc1cccc2NC(=O)[C@@H](O)Cc21 Amb25276333 [0,1,0,1,0,0|2,0,0]=4 7593 B14R2.28472 O=C1Nc2c(CC1C)cccc2C Amb17335058 [0,1,0,1,0,0|2,0,0]=4 7594 B14R2.28472 O=C1Nc2cccc(c2CC1N)C Amb17470552 [0,1,0,1,0,0|1,0,0]=3 7595 B14R2.28472 O=C1Nc2cccc(c2CC1N)Cl Amb17470947 [0,1,0,1,0,0|1,0,0]=3 7596 B14R2.28472 O=C1Nc2cccc(c2CC1N)F Amb17470622 [0,1,0,1,0,0|1,0,0]=3 7597 B14R2.28472 O[C@@H]1Cc2c(F)cccc2NC1=O Amb25357446 [0,1,0,1,0,0|2,0,0]=4 7598 B14R2.335 O[C@@H]([C@H]1OCC1=O)c2ccccc2 Amb25261807 [0,1,0,1,0,0|2,0,0]=4 7599 B14R2.335 O[C@H]([C@H]1CNC1=O)c2ccccc2 Amb25302360 [0,1,0,1,0,0|2,0,0]=4 7600 B14R2.450 CC(=C)C1Cc2ccccc2N1N Amb25248940 [0,1,0,1,0,0|2,0,0]=4 7601 B14R2.450 CC(=C)C1Nc2ccccc2C1C Amb24756845 [0,1,0,1,0,0|2,0,0]=4 7602 B14R2.450 CC(=O)C1Cc2ccccc2C1=O Amb18803911 [0,1,0,1,0,0|2,0,0]=4 7603 B14R2.450 CC(=O)C1Nc2c(C1=O)cccc2 Amb17594440 [0,1,0,1,0,0|1,0,1]=4 7604 B14R2.450 CC(=O)C1Oc2ccccc2C1O Amb25767041 [0,1,0,1,0,0|2,0,0]=4 7605 B14R2.450 CC(O)C1Cc2ccccc2N1N Amb25681508 [0,1,0,1,0,0|1,0,1]=4 7606 B14R2.450 CC1C(Cc2ccccc21)C(N)=O Amb24452453 [0,1,0,1,0,0|2,0,0]=4 7607 B14R2.450 CC1C(Cc2ccccc21)C(O)=O Amb18127727 [0,1,0,1,0,0|1,0,0]=3 7608 B14R2.450 CC1C(Sc2ccccc21)C(O)=O Amb25331829 [0,1,0,1,0,0|1,0,0]=3 7609 B14R2.450 CN1[C@@H](Cc2ccccc12)C(N)=O Amb24749566 [0,1,0,1,0,0|1,0,0]=3 7610 B14R2.450 C[C@@H]1[C@H](Cc2ccccc21)C(O)=O Amb24655063 [0,1,0,1,0,0|1,0,0]=3 7611 B14R2.450 C[C@H]1C(Cc2ccccc21)C(N)=O Amb24417733 [0,1,0,1,0,0|2,0,0]=4 7612 B14R2.450 C[C@H]1[C@@H](Cc2ccccc21)C(N)=O Amb24601809 [0,1,0,1,0,0|2,0,0]=4 7613 B14R2.450 NC(=O)C1Cc2ccccc2C1=O Amb25111277 [0,1,0,1,0,0|2,0,0]=4 7614 B14R2.450 NC(=O)C1Cc2ccccc2C1N Amb25806042 [0,1,0,1,0,0|1,0,0]=3 7615 B14R2.450 NC(=O)C1Oc2ccccc2C1N Amb24727051 [0,1,0,1,0,0|2,0,0]=4 7616 B14R2.450 NC1C(Cc2ccccc21)C(O)=O Amb22230227 [0,1,0,1,0,0|0,0,0]=2 7617 B14R2.450 N[C@H]1[C@@H](Cc2ccccc21)C(O)=O Amb25260069 [0,1,0,1,0,0|0,0,0]=2 7618 B14R2.450 N[C@H]1[C@H](Cc2ccccc21)C(O)=O Amb24519859 [0,1,0,1,0,0|0,0,0]=2 7619 B14R2.450 Nc1c([nH]c2ccccc21)C(O)=O Amb18127614 [0,1,0,1,0,0|0,0,2]=4 7620 B14R2.450 Nc1c(oc2ccccc21)C(O)=O Amb18118466 [0,1,0,1,0,0|1,0,1]=4 7621 B14R2.450 OC(=O)C1Nc2c(C1=O)cccc2 Amb17594502 [0,1,0,1,0,0|0,0,1]=3 7622 B14R2.450 OC(=O)C1Nc2ccccc2C1S Amb24495084 [0,1,0,1,0,0|0,0,0]=2 7623 B14R2.450 OC(=O)C1Oc2ccccc2S1=O Amb25779265 [0,1,0,1,0,0|2,0,0]=4 7624 B14R2.450 OC(=O)C1Sc2ccccc2C1=O Amb18130070 [0,1,0,1,0,0|1,0,1]=4 7625 B14R2.450 OC(=O)[C@@H]1Cc2c([C@@H]1N)cccc2 Amb1993730 [0,1,0,1,0,0|0,0,0]=2 7626 B14R2.450 OC(=O)[C@@H]1Cc2c([C@@H]1N)cccc2 Amb1993769 [0,1,0,1,0,0|0,0,0]=2 7627 B14R2.450 OC(=O)[C@@H]1Oc2ccccc2S1=O Amb25288144 [0,1,0,1,0,0|2,0,0]=4 7628 B14R2.450 OC(=O)c1[nH]c2c(c1Br)cccc2 Amb1200063 [0,1,0,1,0,0|0,0,2]=4 7629 B14R2.450 OC(=O)c1[nH]c2ccccc2c1F Amb19894479 [0,1,0,1,0,0|0,0,2]=4 7630 B14R2.450 OC(=O)c1[nH]c2ccccc2c1S Amb18130014 [0,1,0,1,0,0|0,0,2]=4 7631 B14R2.450 OC(=O)c1cc2c(n1C)cccc2 Amb1832457 [0,1,0,1,0,0|0,0,2]=4 7632 B14R2.657 CC1(CC(=O)C1C)c2ccccc2 Amb24667993 [0,1,0,1,0,0|2,0,0]=4 7633 B14R2.657 CC1(NC(=O)C1C)c2ccccc2 Amb24341426 [0,1,0,1,0,0|2,0,0]=4 7634 B14R2.657 CC1(NC(=O)C1O)c2ccccc2 Amb24682163 [0,1,0,1,0,0|2,0,0]=4 7635 B14R2.780 CC(=O)C1CCC1c2ccccc2 Amb24548830 [0,1,0,1,0,0|2,0,0]=4 7636 B14R2.780 CC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24724006 [0,1,0,1,0,0|2,0,0]=4 7637 B14R2.780 OC(=O)C1CCN1c2ccccc2 Amb24444949 [0,1,0,1,0,0|2,0,0]=4 7638 B14R2.780 OC(=O)C1CSC1c2ccccc2 Amb24624933 [0,1,0,1,0,0|1,0,0]=3 7639 B14R2.780 OC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24550645 [0,1,0,1,0,0|1,0,0]=3 7640 B14R2.780 OC(=O)[C@@H]1CC[C@H]1c2ccccc2 Amb24622779 [0,1,0,1,0,0|1,0,0]=3 7641 B14R2.780 OC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,1,0,1,0,0|0,0,0]=2 7642 B14R2.780 OC(=O)[C@H]1NC[C@@H]1c2ccccc2 Amb24550614 [0,1,0,1,0,0|0,0,0]=2 7643 B14R2.9520 CC1(CC1C(O)=O)c2cc[n]cc2 Amb18285807 [0,1,0,1,0,0|2,0,0]=4 7644 B14R2.9520 CC1(CC1C(O)=O)c2ccc[n]c2 Amb18285805 [0,1,0,1,0,0|2,0,0]=4 7645 B14R2.9520 CC1(CC1C(O)=O)c2cccc[n]2 Amb18285801 [0,1,0,1,0,0|2,0,0]=4 7646 B14R2.9520 CC1(OC1C(=O)Cl)c2ccccc2 Amb25799596 [0,1,0,1,0,0|2,0,0]=4 7647 B14R2.9520 CC1(OC1C(N)=O)c2ccccc2 Amb24426189 [0,1,0,1,0,0|2,0,0]=4 7648 B14R2.9520 C[C@@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24512054 [0,1,0,1,0,0|2,0,0]=4 7649 B14R2.9520 C[C@@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25176089 [0,1,0,1,0,0|1,0,0]=3 7650 B14R2.9520 C[C@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24602361 [0,1,0,1,0,0|2,0,0]=4 7651 B14R2.9520 C[C@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25366533 [0,1,0,1,0,0|1,0,0]=3 7652 B14R2.9520 OC(=O)C1OC1(C)c2ccccc2 Amb17594529 [0,1,0,1,0,0|1,0,0]=3 7653 B14R2.9520 OC(=O)[C@@H]1C[C@@]1(F)c2ccccc2 Amb25213297 [0,1,0,1,0,0|1,0,0]=3 7654 B14R2.9520 OC(=O)[C@@H]1C[C@]1(F)c2ccccc2 Amb24538835 [0,1,0,1,0,0|1,0,0]=3 7655 B14R2.639 CC1(N)Cc2ccccc2NC1=O Amb25744535 [0,1,0,1,0,0|1,0,0]=3 7656 B14R2.639 CC1(O)Cc2ccccc2NC1=O Amb25667949 [0,1,0,1,0,0|2,0,0]=4 7657 B14R2.789 CC(=O)C1(C)Cc2ccccc2C1 Amb25054863 [0,1,0,1,0,0|2,0,0]=4 7658 B14R2.789 CC(=O)C1(N)Cc2ccccc2O1 Amb22275814 [0,1,0,1,0,0|1,0,0]=3 7659 B14R2.789 CC(=O)[C@]1(C)Cc2ccccc2O1 Amb24492542 [0,1,0,1,0,0|2,0,0]=4 7660 B14R2.789 CC1(C=c2ccccc2=C1)C(O)=O Amb24061298 [0,1,0,1,0,0|1,0,1]=4 7661 B14R2.789 CC1(Cc2ccccc2N1)C(O)=O Amb24443112 [0,1,0,1,0,0|0,0,0]=2 7662 B14R2.789 CC1(Cc2ccccc2O1)C(O)=O Amb18128109 [0,1,0,1,0,0|1,0,0]=3 7663 B14R2.789 CC1(Oc2ccccc2O1)C(O)=O Amb24357775 [0,1,0,1,0,0|2,0,0]=4 7664 B14R2.789 NC(=O)C1(N)Cc2ccccc2C1 Amb18278307 [0,1,0,1,0,0|1,0,0]=3 7665 B14R2.789 NC(=O)C1(N)Cc2ccccc2C1 Amb19374206 [0,1,0,1,0,0|1,0,0]=3 7666 B14R2.789 NC(=O)C1(O)Cc2ccccc2C1 Amb18808955 [0,1,0,1,0,0|2,0,0]=4 7667 B14R2.789 NC1(Cc2[n]cc[n]c2C1)C(O)=O Amb18194851 [0,1,0,1,0,0|2,0,0]=4 7668 B14R2.789 OC(=O)C1(C)Cc2c(C1)cccc2 Amb10843969 [0,1,0,1,0,0|1,0,0]=3 7669 B14R2.789 OC(=O)C1(O)Cc2ccccc2C1 Amb18944711 [0,1,0,1,0,0|1,0,0]=3 7670 B14R2.5441 CC1C(CC1=O)c2ccccc2Br Amb25328177 [0,1,0,1,0,0|2,0,0]=4 7671 B14R2.5441 CC1C(CC1=O)c2ccccc2F Amb25180650 [0,1,0,1,0,0|2,0,0]=4 7672 B14R2.5441 CC1C(CC1=O)c2ccccc2I Amb25679749 [0,1,0,1,0,0|2,0,0]=4 7673 B14R2.5441 NC1C(NC1=O)c2ccccc2Br Amb18730236 [0,1,0,1,0,0|1,0,0]=3 7674 B14R2.5441 O=C1N[C@H]([C@@H]1Cl)c2ccccc2Cl Amb25240044 [0,1,0,1,0,0|2,0,0]=4 7675 B14R2.5443 CC(=O)[C@H]1C[C@@H]1c2ccccc2F Amb24617571 [0,1,0,1,0,0|2,0,0]=4 7676 B14R2.5443 Cc1ccccc1C2OC2C(O)=O Amb19929989 [0,1,0,1,0,0|1,0,0]=3 7677 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(C)=O Amb24761426 [0,1,0,1,0,0|2,0,0]=4 7678 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(O)=O Amb25367196 [0,1,0,1,0,0|1,0,0]=3 7679 B14R2.5443 NC(=O)C1CC1c2ccccc2Br Amb25854838 [0,1,0,1,0,0|2,0,0]=4 7680 B14R2.5443 NC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24519397 [0,1,0,1,0,0|2,0,0]=4 7681 B14R2.5443 OC(=O)C1CC1c2[n]cccc2F Amb25188017 [0,1,0,1,0,0|2,0,0]=4 7682 B14R2.5443 OC(=O)C1CC1c2ccccc2Cl Amb17073010 [0,1,0,1,0,0|1,0,0]=3 7683 B14R2.5443 OC(=O)C1CC1c2ccccc2F Amb17073011 [0,1,0,1,0,0|1,0,0]=3 7684 B14R2.5443 OC(=O)C1OC1c2ccccc2Br Amb19929978 [0,1,0,1,0,0|1,0,0]=3 7685 B14R2.5443 OC(=O)C1OC1c2ccccc2Cl Amb19929980 [0,1,0,1,0,0|1,0,0]=3 7686 B14R2.5443 OC(=O)C1OC1c2ccccc2F Amb19929983 [0,1,0,1,0,0|1,0,0]=3 7687 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2C Amb16233255 [0,1,0,1,0,0|1,0,0]=3 7688 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24571313 [0,1,0,1,0,0|1,0,0]=3 7689 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccncc2Cl Amb16233312 [0,1,0,1,0,0|2,0,0]=4 7690 B14R2.5443 Oc1ccccc1C2CC2C(O)=O Amb24455728 [0,1,0,1,0,0|1,0,0]=3 7691 B14R2.3129 OS(=O)(=O)C1Cc2ccccc2N1 Amb25834326 [0,1,0,1,0,0|1,0,0]=3 7692 B14R2.15 C=C[C@H]1[C@@H](NC1=O)c2ccccc2 Amb24560959 [0,1,0,1,0,0|2,0,0]=4 7693 B14R2.15 CCC1C(=O)NC1c2ccccc2 Amb2388317 [0,1,0,1,0,0|2,0,0]=4 7694 B14R2.15 COC1C(CC1=O)c2ccccc2 Amb24492362 [0,1,0,1,0,0|2,0,0]=4 7695 B14R2.15 COC1C(NC1=O)c2ccccc2 Amb25298522 [0,1,0,1,0,0|2,0,0]=4 7696 B14R2.15 CO[C@H]1[C@H](NC1=O)c2ccccc2 Amb24512837 [0,1,0,1,0,0|2,0,0]=4 7697 B14R2.737 CC1NC(=O)C1Cc2ccccc2 Amb24493901 [0,1,0,1,0,0|2,0,0]=4 7698 B14R2.737 C[C@H]1NC(=O)C1Cc2ccccc2 Amb24462781 [0,1,0,1,0,0|2,0,0]=4 7699 B14R2.737 C[C@H]1NC(=O)[C@H]1Cc2ccccc2 Amb24588441 [0,1,0,1,0,0|2,0,0]=4 7700 B14R2.737 OC1CC(=O)C1Cc2ccccc2 Amb24453981 [0,1,0,1,0,0|2,0,0]=4 7701 B14R2.788 CC(=O)C1(Cc2ccccc2)CC1 Amb18560528 [0,1,0,1,0,0|2,0,0]=4 7702 B14R2.788 OC(=O)C1(CC1)Cc2ccccc2 Amb17335122 [0,1,0,1,0,0|1,0,0]=3 7703 B14R2.788 OC(=O)C1(CC1)Oc2ccccc2 Amb23525074 [0,1,0,1,0,0|2,0,0]=4 7704 B14R2.788 OC(=O)C1(CC1)Sc2ccccc2 Amb17595112 [0,1,0,1,0,0|2,0,0]=4 7705 B14R2.788 OC(=O)C1(Cc2ccc[n]c2)CC1 Amb25140752 [0,1,0,1,0,0|2,0,0]=4 7706 B14R2.788 OC(=O)C1(Cc2cccc[n]2)CC1 Amb25778110 [0,1,0,1,0,0|2,0,0]=4 7707 B14R2.788 OC(=O)[C@]1(Cc2ccccc2)CO1 Amb25100998 [0,1,0,1,0,0|1,0,0]=3 7708 B14R3.403 O=C1C2CC1Cc3ccccc32 Amb24532566 [0,0,0,2,0,0|2,0,0]=4 7709 B14R3.630 O=C1C[C@@H]2[C@H]1Oc3ccccc32 Amb25179598 [0,0,0,2,0,0|2,0,0]=4 7710 B14R3.630 O=C1NC2C1Cc3ccccc32 Amb25808812 [0,0,0,2,0,0|2,0,0]=4 7711 B14R3.630 O=C1N[C@@H]2[C@H]1Cc3c2cccc3 Amb1993731 [0,0,0,2,0,0|2,0,0]=4 7712 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,0,0,0,1,0|1,0,1]=4 7713 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,0,0,0,1,0|1,0,1]=4 7714 B10R1.15 C=CC(N)c1cc[n]cc1 Amb25789567 [1,0,0,0,1,0|2,0,0]=4 7715 B10R1.15 C=CC(N)c1cccc[n]1 Amb24561652 [1,0,0,0,1,0|2,0,0]=4 7716 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,0,0,0,1,0|1,0,0]=3 7717 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,0,0,0,1,0|1,0,0]=3 7718 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,0,0,0,1,0|2,0,0]=4 7719 B10R1.15 C=C[C@@H](N)c1cccc[n]1 Amb25146457 [1,0,0,0,1,0|2,0,0]=4 7720 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,0,0,0,1,0|2,0,0]=4 7721 B10R1.15 C=C[C@H](N)c1cccc[n]1 Amb25237215 [1,0,0,0,1,0|2,0,0]=4 7722 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,0,0,0,1,0|2,0,0]=4 7723 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [1,0,0,0,1,0|2,0,0]=4 7724 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,1,0|1,0,1]=4 7725 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,0,0,0,1,0|1,0,1]=4 7726 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,1,0|1,0,1]=4 7727 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,1,0|1,0,1]=4 7728 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,0,0,0,1,0|2,0,0]=4 7729 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,0,0,0,1,0|1,0,0]=3 7730 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,0,0,0,1,0|2,0,0]=4 7731 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,0,0,0,1,0|2,0,0]=4 7732 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,0,0,0,1,0|1,0,0]=3 7733 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,0,0,0,1,0|2,0,0]=4 7734 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,0,0,0,1,0|2,0,0]=4 7735 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,0,0,0,1,0|2,0,0]=4 7736 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,0,0,0,1,0|1,0,1]=4 7737 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [1,0,0,0,1,0|1,0,1]=4 7738 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,0,0,0,1,0|1,0,1]=4 7739 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,0,0,0,1,0|1,0,1]=4 7740 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,0,0,0,1,0|1,0,1]=4 7741 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,0,0,0,1,0|1,0,1]=4 7742 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,0,0,0,1,0|1,0,1]=4 7743 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,0,0,0,1,0|1,0,1]=4 7744 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,0,0,0,1,0|1,0,1]=4 7745 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,0,0,0,1,0|0,1,1]=4 7746 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,1,0|1,0,1]=4 7747 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,0,0,0,1,0|1,0,1]=4 7748 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,0,0,0,1,0|1,0,1]=4 7749 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,0,0,0,1,0|1,0,1]=4 7750 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,1,0|1,0,1]=4 7751 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,1,0|1,0,1]=4 7752 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,0,0,0,1,0|1,0,1]=4 7753 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,0,0,0,1,0|1,0,1]=4 7754 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,0,0,0,1,0|1,0,1]=4 7755 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,0,0,0,1,0|0,1,1]=4 7756 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,0,0,0,1,0|1,0,1]=4 7757 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,0,0,0,1,0|1,0,1]=4 7758 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,0,0,0,1,0|1,0,1]=4 7759 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,0,0,0,1,0|1,0,1]=4 7760 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,0,0,0,1,0|0,1,1]=4 7761 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,0,0,0,1,0|1,0,1]=4 7762 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,0,0,0,1,0|0,0,1]=3 7763 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,0,0,0,1,0|1,0,1]=4 7764 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,0,0,0,1,0|1,0,1]=4 7765 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,0,0,0,1,0|1,0,0]=3 7766 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,0,0,0,1,0|1,0,0]=3 7767 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,0,0,0,1,0|1,0,0]=3 7768 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,0,0,0,1,0|1,0,0]=3 7769 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,0,0,0,1,0|1,0,0]=3 7770 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,1,0|1,0,1]=4 7771 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,1,0|1,0,1]=4 7772 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,0,0,0,1,0|1,0,1]=4 7773 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,0,0,0,1,0|1,0,1]=4 7774 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,0,0,0,1,0|1,0,1]=4 7775 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,0,0,0,1,0|1,0,1]=4 7776 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [1,0,0,0,1,0|2,0,0]=4 7777 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,0,0,0,1,0|2,0,0]=4 7778 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,0,0,0,1,0|1,0,1]=4 7779 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,0,0,0,1,0|1,0,1]=4 7780 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,0,0,0,1,0|1,0,1]=4 7781 B10R1.27 C=CC(N)Cc1ccc[s]1 Amb24740329 [1,0,0,0,1,0|2,0,0]=4 7782 B10R1.27 CC(C[n]1cccc1)C=O Amb25337670 [1,0,0,0,1,0|2,0,0]=4 7783 B10R1.27 CC(Cc1c[s]cc1)C=O Amb18644680 [1,0,0,0,1,0|2,0,0]=4 7784 B10R1.27 CC(Cc1ccc[s]1)C=O Amb18644678 [1,0,0,0,1,0|2,0,0]=4 7785 B10R1.27 CC(Cc1ccco1)C=O Amb18643240 [1,0,0,0,1,0|2,0,0]=4 7786 B10R1.27 CC(Cc1cocc1)C=O Amb24715294 [1,0,0,0,1,0|2,0,0]=4 7787 B10R1.27 NC(CO)Cc1ccc[nH]1 Amb25293337 [1,0,0,0,1,0|1,0,1]=4 7788 B10R1.27 NC(CO)Cc1cocc1 Amb24627260 [1,0,0,0,1,0|1,0,1]=4 7789 B10R1.27 N[C@@H](CO)Cc1c[s]cc1 Amb24547320 [1,0,0,0,1,0|1,0,1]=4 7790 B10R1.27 N[C@@H](Cc1c[n]c[nH]1)C=O Amb24430087 [1,0,0,0,1,0|2,0,0]=4 7791 B10R1.27 N[C@H](CO)Cc1ccc[s]1 Amb25306299 [1,0,0,0,1,0|1,0,1]=4 7792 B10R1.27 OC(Cc1cocc1)C=O Amb24380070 [1,0,0,0,1,0|2,0,0]=4 7793 B10R1.27 OCC(Cc1ccco1)N Amb17062680 [1,0,0,0,1,0|1,0,1]=4 7794 B10R1.27 OCC(Cc1cccs1)N Amb17062681 [1,0,0,0,1,0|1,0,1]=4 7795 B10R1.66 CC(=O)CC[n]1cccc1 Amb25138234 [1,0,0,0,1,0|2,0,0]=4 7796 B10R1.66 CC(=O)CCc1cc[nH]c1 Amb18223260 [1,0,0,0,1,0|2,0,0]=4 7797 B10R1.66 CC(=O)CCc1ccc[nH]1 Amb24505108 [1,0,0,0,1,0|2,0,0]=4 7798 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [1,0,0,0,1,0|2,0,0]=4 7799 B10R1.66 NC(=O)CCc1ccoc1 Amb24722346 [1,0,0,0,1,0|2,0,0]=4 7800 B10R1.66 O=C(Cl)CCc1ccc[s]1 Amb23440823 [1,0,0,0,1,0|2,0,0]=4 7801 B10R1.66 OC(=O)CCC=1CC=CC1 Amb25264551 [1,0,0,0,1,0|0,0,1]=3 7802 B10R1.66 OC(=O)CC[n]1c[nH+]cc1 Amb19861387 [1,0,0,0,1,0|2,0,0]=4 7803 B10R1.66 OC(=O)CC[n]1ccc[n]1 Amb22586761 [1,0,0,0,1,0|2,0,0]=4 7804 B10R1.66 OC(=O)CCc1[nH]cc[n]1 Amb23401501 [1,0,0,0,1,0|2,0,0]=4 7805 B10R1.66 OC(=O)CCc1c[nH]c[n]1 Amb22370608 [1,0,0,0,1,0|2,0,0]=4 7806 B10R1.66 OC(=O)CCc1c[nH]cn1 Amb10070816 [1,0,0,0,1,0|2,0,0]=4 7807 B10R1.66 OC(=O)CCc1c[nH]nc1 Amb10607666 [1,0,0,0,1,0|2,0,0]=4 7808 B10R1.66 OC(=O)CCc1c[n]c[s]1 Amb18830641 [1,0,0,0,1,0|2,0,0]=4 7809 B10R1.66 OC(=O)CCc1c[n]co1 Amb22011672 [1,0,0,0,1,0|2,0,0]=4 7810 B10R1.66 OC(=O)CCc1cc[nH]c1 Amb18562783 [1,0,0,0,1,0|1,0,0]=3 7811 B10R1.66 OC(=O)CCc1cc[n][nH]1 Amb18202888 [1,0,0,0,1,0|2,0,0]=4 7812 B10R1.66 OC(=O)CCc1cc[n][s]1 Amb18830640 [1,0,0,0,1,0|2,0,0]=4 7813 B10R1.66 OC(=O)CCc1cc[s][n]1 Amb18830643 [1,0,0,0,1,0|2,0,0]=4 7814 B10R1.66 OC(=O)CCc1ccc[nH]1 Amb10602142 [1,0,0,0,1,0|1,0,0]=3 7815 B10R1.66 OC(=O)CCc1ccco1 Amb1153073 [1,0,0,0,1,0|1,0,0]=3 7816 B10R1.66 OC(=O)CCc1cccs1 Amb1154297 [1,0,0,0,1,0|1,0,0]=3 7817 B10R1.66 OC(=O)CCc1ccno1 Amb1092001 [1,0,0,0,1,0|2,0,0]=4 7818 B10R1.66 OC(=O)CCc1ccoc1 Amb18643489 [1,0,0,0,1,0|1,0,0]=3 7819 B10R1.66 OC(=O)CCc1cocn1 Amb17399866 [1,0,0,0,1,0|2,0,0]=4 7820 B10R1.66 OC(=O)CCc1cscc1 Amb1153814 [1,0,0,0,1,0|1,0,0]=3 7821 B10R1.66 OC(=O)CCc1ncco1 Amb17399867 [1,0,0,0,1,0|2,0,0]=4 7822 B10R1.66 OC(=O)CCn1cccc1 Amb1130611 [1,0,0,0,1,0|1,0,0]=3 7823 B10R1.66 OC(=O)CCn1cccn1 Amb1159216 [1,0,0,0,1,0|2,0,0]=4 7824 B10R1.66 OC(=O)CCn1cncc1 Amb1159316 [1,0,0,0,1,0|2,0,0]=4 7825 B10R1.66 OC(=O)CN[n]1cccc1 Amb25042233 [1,0,0,0,1,0|2,0,0]=4 7826 B10R1.66 OC(=O)CNc1cc[s]c1 Amb25322129 [1,0,0,0,1,0|2,0,0]=4 7827 B10R1.66 OC(=O)COc1cc[s]c1 Amb18126122 [1,0,0,0,1,0|2,0,0]=4 7828 B10R1.66 OC(=O)CSc1c[nH]cc1 Amb17593930 [1,0,0,0,1,0|2,0,0]=4 7829 B10R1.66 OC(=O)CSc1ccc[nH]1 Amb18644915 [1,0,0,0,1,0|2,0,0]=4 7830 B10R1.23 CC(=O)C(N)c1cc[nH]c1 Amb25042145 [0,0,0,0,2,0|2,0,0]=4 7831 B10R1.23 CC(=O)C(N)c1ccc[s]1 Amb25836886 [0,0,0,0,2,0|2,0,0]=4 7832 B10R1.23 CC(C(O)=O)C=1CC=CC1 Amb24480439 [0,0,0,0,2,0|1,0,1]=4 7833 B10R1.23 CC(C(O)=O)c1cc[nH]c1 Amb18064932 [0,0,0,0,2,0|2,0,0]=4 7834 B10R1.23 CC(C(O)=O)c1cc[s]c1 Amb18284449 [0,0,0,0,2,0|2,0,0]=4 7835 B10R1.23 CC(C(O)=O)c1ccc[nH]1 Amb18643379 [0,0,0,0,2,0|2,0,0]=4 7836 B10R1.23 CC(n1cccc1)C(=O)O Amb1058873 [0,0,0,0,2,0|2,0,0]=4 7837 B10R1.23 C[C@H](C(O)=O)c1ccc[s]1 Amb24710020 [0,0,0,0,2,0|2,0,0]=4 7838 B10R1.23 C[C@H](n1cccc1)C(=O)O Amb2236277 [0,0,0,0,2,0|2,0,0]=4 7839 B10R1.23 NC(=O)C(N)c1c[s]cc1 Amb18949670 [0,0,0,0,2,0|2,0,0]=4 7840 B10R1.23 NC(=O)C(c1ccco1)N Amb17334171 [0,0,0,0,2,0|2,0,0]=4 7841 B10R1.23 NC(=O)C(c1cccs1)N Amb17334394 [0,0,0,0,2,0|2,0,0]=4 7842 B10R1.23 NC(=O)[C@@H](N)c1c[s]cc1 Amb24402944 [0,0,0,0,2,0|2,0,0]=4 7843 B10R1.23 NC(=O)[C@H](N)c1ccc[s]1 Amb25197626 [0,0,0,0,2,0|2,0,0]=4 7844 B10R1.23 NC(C(O)=O)c1[n]cc[s]1 Amb25761284 [0,0,0,0,2,0|2,0,0]=4 7845 B10R1.23 NC(C(O)=O)c1c[nH]c[n]1 Amb18202749 [0,0,0,0,2,0|2,0,0]=4 7846 B10R1.23 NC(C(O)=O)c1c[n][s]c1 Amb25101327 [0,0,0,0,2,0|2,0,0]=4 7847 B10R1.23 NC(C(O)=O)c1c[n]c[s]1 Amb18830497 [0,0,0,0,2,0|2,0,0]=4 7848 B10R1.23 NC(C(O)=O)c1c[s]c[n]1 Amb18645003 [0,0,0,0,2,0|2,0,0]=4 7849 B10R1.23 NC(C(O)=O)c1cc[nH]c1 Amb18862405 [0,0,0,0,2,0|1,0,0]=3 7850 B10R1.23 NC(C(O)=O)c1cc[n][s]1 Amb18199897 [0,0,0,0,2,0|2,0,0]=4 7851 B10R1.23 NC(C(O)=O)c1cc[n]o1 Amb25843218 [0,0,0,0,2,0|2,0,0]=4 7852 B10R1.23 NC(C(O)=O)c1cc[s][n]1 Amb24467851 [0,0,0,0,2,0|2,0,0]=4 7853 B10R1.23 NC(C(O)=O)c1ccc[nH]1 Amb18831925 [0,0,0,0,2,0|1,0,0]=3 7854 B10R1.23 NC(c1c[s]cc1)P(O)=O Amb25731986 [0,0,0,0,2,0|2,0,0]=4 7855 B10R1.23 NC(c1ccc[s]1)P(O)=O Amb25375779 [0,0,0,0,2,0|2,0,0]=4 7856 B10R1.23 N[C@@H](C(O)=O)c1[nH]cc[n]1 Amb24359279 [0,0,0,0,2,0|2,0,0]=4 7857 B10R1.23 N[C@@H](C(O)=O)c1c[n][s]c1 Amb24702828 [0,0,0,0,2,0|2,0,0]=4 7858 B10R1.23 N[C@@H](C(O)=O)c1cc[n]o1 Amb24332272 [0,0,0,0,2,0|2,0,0]=4 7859 B10R1.23 N[C@@H](C(O)=O)c1cc[s]c1 Amb22750704 [0,0,0,0,2,0|1,0,0]=3 7860 B10R1.23 N[C@@H](C(O)=O)c1ccc[s]1 Amb22747193 [0,0,0,0,2,0|1,0,0]=3 7861 B10R1.23 N[C@@H](C(O)=O)c1ccco1 Amb25068121 [0,0,0,0,2,0|1,0,0]=3 7862 B10R1.23 N[C@@H](C(O)=O)c1ccoc1 Amb25684655 [0,0,0,0,2,0|1,0,0]=3 7863 B10R1.23 N[C@H](C(O)=O)c1[n]cc[s]1 Amb25705057 [0,0,0,0,2,0|2,0,0]=4 7864 B10R1.23 N[C@H](C(O)=O)c1c[nH]c[n]1 Amb24746747 [0,0,0,0,2,0|2,0,0]=4 7865 B10R1.23 N[C@H](C(O)=O)c1cc[nH]c1 Amb25063304 [0,0,0,0,2,0|1,0,0]=3 7866 B10R1.23 OC(=O)C(Br)c1ccc[s]1 Amb18658431 [0,0,0,0,2,0|2,0,0]=4 7867 B10R1.23 OC(=O)C(Cl)c1cc[nH]c1 Amb18563480 [0,0,0,0,2,0|2,0,0]=4 7868 B10R1.23 OC(=O)C(F)c1ccco1 Amb25825778 [0,0,0,0,2,0|2,0,0]=4 7869 B10R1.23 OC(=O)C(O)c1c[nH]cc1 Amb18862454 [0,0,0,0,2,0|2,0,0]=4 7870 B10R1.23 OC(=O)C(O)c1c[s]cc1 Amb18952015 [0,0,0,0,2,0|2,0,0]=4 7871 B10R1.23 OC(=O)C(O)c1ccc[nH]1 Amb24480945 [0,0,0,0,2,0|2,0,0]=4 7872 B10R1.23 OC(=O)C(c1ccco1)C Amb17087431 [0,0,0,0,2,0|2,0,0]=4 7873 B10R1.23 OC(=O)C(c1cccs1)C Amb10844027 [0,0,0,0,2,0|2,0,0]=4 7874 B10R1.23 OC(=O)C(c1cccs1)Cl Amb17233234 [0,0,0,0,2,0|2,0,0]=4 7875 B10R1.23 OC(=O)C(c1cccs1)N Amb1840251 [0,0,0,0,2,0|1,0,0]=3 7876 B10R1.23 OC(=O)C(c1cccs1)O Amb17232241 [0,0,0,0,2,0|2,0,0]=4 7877 B10R1.23 OC(=O)C(c1cocc1)O Amb10810585 [0,0,0,0,2,0|2,0,0]=4 7878 B10R1.23 OC(=O)C(c1cscc1)N Amb2425141 [0,0,0,0,2,0|1,0,0]=3 7879 B10R1.23 OC(=O)[C@@H](O)c1c[s]cc1 Amb25074325 [0,0,0,0,2,0|2,0,0]=4 7880 B10R1.23 OC(=O)[C@@H](c1cccs1)C Amb10844019 [0,0,0,0,2,0|2,0,0]=4 7881 B10R1.23 OC(=O)[C@@H](c1cscc1)C Amb10844020 [0,0,0,0,2,0|2,0,0]=4 7882 B10R1.23 OC(=O)[C@H](O)c1ccco1 Amb24445445 [0,0,0,0,2,0|2,0,0]=4 7883 B10R1.23 OC(=O)[C@H](c1cscc1)C Amb10844030 [0,0,0,0,2,0|2,0,0]=4 7884 B10R1.23 OC(=O)[C@H](c1cscc1)N Amb16232233 [0,0,0,0,2,0|1,0,0]=3 7885 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [1,0,0,0,0,1|2,0,0]=4 7886 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [1,0,0,0,0,1|2,0,0]=4 7887 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [1,0,0,0,0,1|2,0,0]=4 7888 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [1,0,0,0,0,1|2,0,0]=4 7889 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [1,0,0,0,0,1|2,0,0]=4 7890 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [1,0,0,0,0,1|2,0,0]=4 7891 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [1,0,0,0,0,1|2,0,0]=4 7892 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [1,0,0,0,0,1|2,0,0]=4 7893 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [1,0,0,0,0,1|2,0,0]=4 7894 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [1,0,0,0,0,1|2,0,0]=4 7895 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [1,0,0,0,0,1|2,0,0]=4 7896 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,1|1,0,1]=4 7897 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,1|1,0,1]=4 7898 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [1,0,0,0,0,1|2,0,0]=4 7899 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [1,0,0,0,0,1|2,0,0]=4 7900 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [1,0,0,0,0,1|2,0,0]=4 7901 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [1,0,0,0,0,1|2,0,0]=4 7902 B12R1.252 CC(=O)SCCc1ccccn1 Amb17619708 [1,0,0,0,0,1|2,0,0]=4 7903 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [1,0,0,0,0,1|1,0,1]=4 7904 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,1|2,0,0]=4 7905 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [1,0,0,0,0,1|1,0,1]=4 7906 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [1,0,0,0,0,1|1,0,1]=4 7907 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [1,0,0,0,0,1|2,0,0]=4 7908 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [1,0,0,0,0,1|1,0,1]=4 7909 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [1,0,0,0,0,1|1,0,1]=4 7910 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [1,0,0,0,0,1|1,0,1]=4 7911 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,1|1,0,0]=3 7912 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [1,0,0,0,0,1|2,0,0]=4 7913 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [1,0,0,0,0,1|2,0,0]=4 7914 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [1,0,0,0,0,1|2,0,0]=4 7915 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [1,0,0,0,0,1|2,0,0]=4 7916 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [1,0,0,0,0,1|2,0,0]=4 7917 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [1,0,0,0,0,1|2,0,0]=4 7918 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [1,0,0,0,0,1|2,0,0]=4 7919 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [1,0,0,0,0,1|2,0,0]=4 7920 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [1,0,0,0,0,1|1,0,1]=4 7921 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [1,0,0,0,0,1|1,0,1]=4 7922 B12R1.252 NC(=O)NCCc1ccc[n]c1 Amb19515015 [1,0,0,0,0,1|2,0,0]=4 7923 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,1|1,0,0]=3 7924 B12R1.252 NC(=O)NCCc1ccncc1 Amb10553043 [1,0,0,0,0,1|2,0,0]=4 7925 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [1,0,0,0,0,1|2,0,0]=4 7926 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,1|2,0,0]=4 7927 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [1,0,0,0,0,1|1,0,1]=4 7928 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [1,0,0,0,0,1|1,1,0]=4 7929 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [1,0,0,0,0,1|1,1,0]=4 7930 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [1,0,0,0,0,1|1,1,0]=4 7931 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [1,0,0,0,0,1|1,1,0]=4 7932 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [1,0,0,0,0,1|1,0,0]=3 7933 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [1,0,0,0,0,1|1,0,1]=4 7934 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [1,0,0,0,0,1|1,0,0]=3 7935 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [1,0,0,0,0,1|1,0,1]=4 7936 B12R1.252 OC(=O)C#CCc1c[n]ccc1 Amb24684542 [1,0,0,0,0,1|1,0,1]=4 7937 B12R1.252 OC(=O)C#CCc1cc[n]cc1 Amb25299055 [1,0,0,0,0,1|1,0,1]=4 7938 B12R1.252 OC(=O)C#CCc1cccc[n]1 Amb25700659 [1,0,0,0,0,1|1,0,1]=4 7939 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [1,0,0,0,0,1|0,0,2]=4 7940 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [1,0,0,0,0,1|0,0,2]=4 7941 B12R1.252 OC(=O)CC#Cc1c[n]ccc1 Amb25159668 [1,0,0,0,0,1|1,0,1]=4 7942 B12R1.252 OC(=O)CC#Cc1cc[n]cc1 Amb24423393 [1,0,0,0,0,1|1,0,1]=4 7943 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [1,0,0,0,0,1|0,0,1]=3 7944 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [1,0,0,0,0,1|0,0,0]=2 7945 B12R1.252 OC(=O)CCCc1[n]ccc[n]1 Amb18862661 [1,0,0,0,0,1|2,0,0]=4 7946 B12R1.252 OC(=O)CCCc1c[n]c[n]c1 Amb18827885 [1,0,0,0,0,1|2,0,0]=4 7947 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [1,0,0,0,0,1|1,0,0]=3 7948 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [1,0,0,0,0,1|1,0,0]=3 7949 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,1|0,0,0]=2 7950 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [1,0,0,0,0,1|1,0,0]=3 7951 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [1,0,0,0,0,1|1,0,0]=3 7952 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [1,0,0,0,0,1|1,0,0]=3 7953 B12R1.252 OC(=O)CCNc1c[n]c[n]c1 Amb18933238 [1,0,0,0,0,1|2,0,0]=4 7954 B12R1.252 OC(=O)CCNc1cc[n]c[n]1 Amb19011486 [1,0,0,0,0,1|2,0,0]=4 7955 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [1,0,0,0,0,1|1,0,0]=3 7956 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,1|0,0,0]=2 7957 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [1,0,0,0,0,1|1,0,0]=3 7958 B12R1.252 OC(=O)CCNc1ncccn1 Amb1109664 [1,0,0,0,0,1|2,0,0]=4 7959 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,1|0,0,0]=2 7960 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,1|0,0,0]=2 7961 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [1,0,0,0,0,1|1,0,0]=3 7962 B12R1.252 OC(=O)CNCc1c[n]cc[n]1 Amb19030033 [1,0,0,0,0,1|2,0,0]=4 7963 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [1,0,0,0,0,1|1,0,0]=3 7964 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [1,0,0,0,0,1|1,0,0]=3 7965 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [1,0,0,0,0,1|1,0,0]=3 7966 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [1,0,0,0,0,1|1,0,0]=3 7967 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [1,0,0,0,0,1|1,0,0]=3 7968 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,1|1,0,0]=3 7969 B12R1.252 OC(=O)CONc1cccc[n]1 Amb24497875 [1,0,0,0,0,1|2,0,0]=4 7970 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [1,0,0,0,0,1|1,0,0]=3 7971 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [1,0,0,0,0,1|1,0,0]=3 7972 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [1,0,0,0,0,1|1,0,0]=3 7973 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,1|0,0,0]=2 7974 B12R1.252 OC(=O)C\C=C\c1cc[n]cc1 Amb24571194 [1,0,0,0,0,1|1,0,1]=4 7975 B12R1.252 OC(=O)C\C=C\c1cccc[n]1 Amb25073201 [1,0,0,0,0,1|1,0,1]=4 7976 B12R1.252 OC(=O)C\N=C/c1cc[n]cc1 Amb25273885 [1,0,0,0,0,1|1,0,1]=4 7977 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [1,0,0,0,0,1|0,0,1]=3 7978 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [1,0,0,0,0,1|1,0,1]=4 7979 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [1,0,0,0,0,1|1,0,1]=4 7980 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [1,0,0,0,0,1|0,0,2]=4 7981 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [1,0,0,0,0,1|0,0,2]=4 7982 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [1,0,0,0,0,1|0,0,2]=4 7983 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [1,0,0,0,0,1|0,0,1]=3 7984 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [1,0,0,0,0,1|1,0,1]=4 7985 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [1,0,0,0,0,1|1,0,1]=4 7986 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [1,0,0,0,0,1|0,0,1]=3 7987 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,1|0,0,1]=3 7988 B12R1.260 CC(Cc1ccco1)CC(=O)O Amb17334712 [0,0,0,0,1,1|2,0,0]=4 7989 B12R1.260 CC(Cc1cccs1)CC(=O)O Amb17335692 [0,0,0,0,1,1|2,0,0]=4 7990 B12R1.260 NC(Cc1c[n]c[s]1)CC(O)=O Amb18822048 [0,0,0,0,1,1|2,0,0]=4 7991 B12R1.260 NC(Cc1cc[nH]c1)CC(O)=O Amb18862760 [0,0,0,0,1,1|1,0,0]=3 7992 B12R1.260 NC(Cc1ccco1)CC(=O)O Amb17470474 [0,0,0,0,1,1|1,0,0]=3 7993 B12R1.260 NC(Cc1cccs1)CC(=O)O Amb17470677 [0,0,0,0,1,1|1,0,0]=3 7994 B12R1.260 N[C@@H](Cc1cc[s]c1)CC(O)=O Amb24106405 [0,0,0,0,1,1|1,0,0]=3 7995 B12R1.260 N[C@@H](Cc1ccc[s]1)CC(O)=O Amb22756754 [0,0,0,0,1,1|1,0,0]=3 7996 B12R1.260 N[C@H](Cc1ccc[s]1)CC(O)=O Amb24106410 [0,0,0,0,1,1|1,0,0]=3 7997 B12R1.260 OC(=O)CC(Br)Cc1ccc[s]1 Amb18111161 [0,0,0,0,1,1|2,0,0]=4 7998 B12R1.260 OC(=O)CC(Cl)Cc1ccc[s]1 Amb18111160 [0,0,0,0,1,1|2,0,0]=4 7999 B14R1.423 CC(=O)O\N=C(/N)\Cc1ccccc1 Amb23247777 [0,0,0,0,0,2|1,0,1]=4 8000 B14R1.423 CC(C#CC(O)=O)Oc1ccccc1 Amb24601847 [0,0,0,0,0,2|2,0,0]=4 8001 B14R1.423 CN(Cc1ccccc1)CCC(=O)O Amb15740934 [0,0,0,0,0,2|2,0,0]=4 8002 B14R1.423 CN(Cc1ccccc1)\C=C\C(O)=O Amb24591316 [0,0,0,0,0,2|2,0,0]=4 8003 B14R1.423 NC(Cc1ccccc1)C#CC(O)=O Amb25124720 [0,0,0,0,0,2|0,0,0]=2 8004 B14R1.423 N[C@@H](Cc1ccccc1)C#CC(O)=O Amb25858142 [0,0,0,0,0,2|0,0,0]=2 8005 B14R1.423 N[C@@H](Cc1ccccc1)CCC(O)=O Amb22754385 [0,0,0,0,0,2|0,0,0]=2 8006 B14R1.423 N\C(=N/c1ccccc1)\SCC(=O)O Amb17595657 [0,0,0,0,0,2|1,0,1]=4 8007 B14R1.423 O=C(Cc1ccccc1)NCC(=O)O Amb1218287 [0,0,0,0,0,2|1,0,1]=4 8008 B14R1.423 OC(=O)CSC(=S)Cc1ccccc1 Amb23483000 [0,0,0,0,0,2|1,0,1]=4 8009 B14R1.818 CC(=O)CC(O)OCc1ccccc1 Amb25802890 [0,0,0,0,0,2|2,0,0]=4 8010 B14R1.818 CC(=O)C[C@@H](N)C#Cc1ccccc1 Amb25664270 [0,0,0,0,0,2|1,0,1]=4 8011 B14R1.818 CC(=O)NC(C)CNc1ccccc1 Amb25750704 [0,0,0,0,0,2|2,0,0]=4 8012 B14R1.818 CC(CC(=O)N)NCc1ccccc1 Amb17235456 [0,0,0,0,0,2|2,0,0]=4 8013 B14R1.818 CC(CC(N)=O)OCc1ccccc1 Amb25249681 [0,0,0,0,0,2|2,0,0]=4 8014 B14R1.818 CC(CCc1ccccc1)NC(N)=O Amb19078987 [0,0,0,0,0,2|2,0,0]=4 8015 B14R1.818 C[C@@H](CC(N)=O)NCc1ccccc1 Amb24566940 [0,0,0,0,0,2|2,0,0]=4 8016 B14R1.818 C[C@@H](CC(N)=O)OCc1ccccc1 Amb24498301 [0,0,0,0,0,2|2,0,0]=4 8017 B14R1.818 C[C@@H](CC(O)=O)NCc1ccccc1 Amb25124067 [0,0,0,0,0,2|1,0,0]=3 8018 B14R1.818 C[C@@H](CC(O)=O)OCc1ccccc1 Amb24335959 [0,0,0,0,0,2|1,0,0]=3 8019 B14R1.818 C\C(=C/C(=O)O)\COc1ccccc1 Amb17235343 [0,0,0,0,0,2|1,0,1]=4 8020 B14R1.818 C\C(\CCc1ccccc1)=C\C(O)=O Amb22095783 [0,0,0,0,0,2|1,0,1]=4 8021 B14R1.818 C\C(\CNc1ccccc1)=C\C(O)=O Amb24405272 [0,0,0,0,0,2|1,0,1]=4 8022 B14R1.818 N=C(CC(O)=O)NCc1ccccc1 Amb24366621 [0,0,0,0,0,2|0,0,2]=4 8023 B14R1.818 NC(CC(=O)O)CCc1ccccc1 Amb1993736 [0,0,0,0,0,2|0,0,0]=2 8024 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb19887670 [0,0,0,0,0,2|0,0,0]=2 8025 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb22746249 [0,0,0,0,0,2|0,0,0]=2 8026 B14R1.818 N[C@H](CCc1ccccc1)CC(O)=O Amb19888418 [0,0,0,0,0,2|0,0,0]=2 8027 B14R1.818 O=C(CC(=O)O)CCc1ccccc1 Amb17235338 [0,0,0,0,0,2|1,0,1]=4 8028 B14R1.818 O=C(CC(=O)O)NCc1ccccc1 Amb17401704 [0,0,0,0,0,2|1,0,1]=4 8029 B14R1.818 OC(CC(=O)O)CCc1ccccc1 Amb17235897 [0,0,0,0,0,2|1,0,0]=3 8030 B14R1.6449 CC(=C)C(N)COCc1ccccc1 Amb24726739 [0,0,0,0,0,2|2,0,0]=4 8031 B14R1.6449 CC(=O)C(C)CC#Cc1ccccc1 Amb19070058 [0,0,0,0,0,2|2,0,0]=4 8032 B14R1.6449 CC(=O)[C@@H](C)COCc1ccccc1 Amb24544010 [0,0,0,0,0,2|2,0,0]=4 8033 B14R1.6449 CC(C(=O)O)CCOc1ccccc1 Amb17235913 [0,0,0,0,0,2|1,0,0]=3 8034 B14R1.6449 CC(CC#Cc1ccccc1)C(O)=O Amb24687303 [0,0,0,0,0,2|1,0,0]=3 8035 B14R1.6449 CC(CNCc1ccccc1)C(O)=O Amb20623866 [0,0,0,0,0,2|1,0,0]=3 8036 B14R1.6449 CC(NNCc1ccccc1)C(O)=O Amb25360955 [0,0,0,0,0,2|1,0,0]=3 8037 B14R1.6449 CC(NOCc1ccccc1)C(N)=O Amb25689964 [0,0,0,0,0,2|2,0,0]=4 8038 B14R1.6449 CC(NOCc1ccccc1)C(O)=O Amb18652109 [0,0,0,0,0,2|1,0,0]=3 8039 B14R1.6449 CC(N\C=C\c1ccccc1)C(O)=O Amb24374012 [0,0,0,0,0,2|1,0,1]=4 8040 B14R1.6449 C[C@@H](C(=O)O)COCc1ccccc1 Amb10844261 [0,0,0,0,0,2|1,0,0]=3 8041 B14R1.6449 C[C@H](C(=O)O)COCc1ccccc1 Amb10844264 [0,0,0,0,0,2|1,0,0]=3 8042 B14R1.6449 C\C(=N/NCc1ccccc1)\C(O)=O Amb18651177 [0,0,0,0,0,2|1,0,1]=4 8043 B14R1.6449 C\C(=N\OCc1ccccc1)\C(O)=O Amb23512428 [0,0,0,0,0,2|1,0,1]=4 8044 B14R1.6449 NC(=O)C(Cl)COCc1ccccc1 Amb25103271 [0,0,0,0,0,2|2,0,0]=4 8045 B14R1.6449 NC(=O)C(N)COCc1ccccc1 Amb25809213 [0,0,0,0,0,2|1,0,0]=3 8046 B14R1.6449 NC(CC#Cc1ccccc1)C(O)=O Amb19020422 [0,0,0,0,0,2|0,0,0]=2 8047 B14R1.6449 NC(CCCc1ccccc1)C(O)=O Amb19342362 [0,0,0,0,0,2|0,0,0]=2 8048 B14R1.6449 N[C@@H](CCCc1ccccc1)C(O)=O Amb20241024 [0,0,0,0,0,2|0,0,0]=2 8049 B14R1.6449 N[C@@H](C\C=C\c1ccccc1)C(O)=O Amb22746168 [0,0,0,0,0,2|0,0,0]=2 8050 B14R1.6449 N[C@H](CC#Cc1ccccc1)C(O)=O Amb24535741 [0,0,0,0,0,2|0,0,0]=2 8051 B14R1.6449 N[C@H](COCc1ccccc1)C(O)=O Amb19944297 [0,0,0,0,0,2|0,0,0]=2 8052 B14R1.6449 OC(=O)C(Br)COCc1ccccc1 Amb18668071 [0,0,0,0,0,2|1,0,0]=3 8053 B14R1.6449 OC(=O)C(Cl)COCc1ccccc1 Amb25734789 [0,0,0,0,0,2|1,0,0]=3 8054 B14R1.6449 OC(=O)C(O)C=C=Cc1ccccc1 Amb25701736 [0,0,0,0,0,2|1,0,1]=4 8055 B14R1.6449 OC(=O)C(SCCc1ccncc1)C Amb17619709 [0,0,0,0,0,2|2,0,0]=4 8056 B14R1.6449 OC(=O)[C@@H](Cl)COCc1ccccc1 Amb25752794 [0,0,0,0,0,2|1,0,0]=3 8057 B14R1.6449 OC(=O)[C@@H](N\C=C\c1ccccc1)C Amb16231751 [0,0,0,0,0,2|1,0,1]=4 8058 B14R1.6449 OC(=O)[C@@H](O)CNCc1ccccc1 Amb24650939 [0,0,0,0,0,2|1,0,0]=3 8059 B14R1.6449 OC(=O)[C@@H](O)COCc1ccccc1 Amb25088415 [0,0,0,0,0,2|1,0,0]=3 8060 B14R1.6449 OC(=O)[C@@H](S)CNCc1ccccc1 Amb25381284 [0,0,0,0,0,2|1,0,0]=3 8061 B14R1.6449 OC(=O)[C@H](Cl)COCc1ccccc1 Amb25309625 [0,0,0,0,0,2|1,0,0]=3 8062 B14R1.6449 OC(=O)[C@H](O)COCc1ccccc1 Amb24428781 [0,0,0,0,0,2|1,0,0]=3 8063 B14R1.10072 N[C@@H](CC=1C=CC=CC=CC1)C(O)=O Amb24563813 [0,0,0,0,0,2|0,0,0]=2