0 B13R1.7553 CC(Cc1c(Br)nnn1C)C(=O)O Amb27668209 [0,0,0,0,0,0|4,0,0]=4 1 B13R1.7553 CC(Cc1c(Cl)ncn1C)C(=O)O Amb33481841 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.7553 CC1=C(CC(N)C(=O)O)C(=O)NO1 Amb22732804 [0,0,0,0,0,0|0,0,2]=2 3 B13R1.7553 CC1=C(CC(N)C(=O)O)C(=O)ON1 Amb27858776 [0,0,0,0,0,0|2,0,1]=3 4 B13R1.7553 C\C(=C/c1c(C)noc1C)C(=O)O Amb28316359 [0,0,0,0,0,0|2,0,2]=4 5 B13R1.7553 Cc1ccc(C)n1CC(N)C(=O)O Amb18192636 [0,0,0,0,0,0|4,0,0]=4 6 B13R1.7553 Cc1cnn(C)c1CC(C)C(=O)O Amb27440113 [0,0,0,0,0,0|4,0,0]=4 7 B13R1.7553 Cc1cnn(C)c1CC(N)C(=O)O Amb18192070 [0,0,0,0,0,0|3,0,0]=3 8 B13R1.7553 Cc1cnn(C)c1CC(O)C(=O)O Amb32668571 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.7553 Cc1cnn(C)c1C[C@@H](N)C(=O)O Amb35580810 [0,0,0,0,0,0|3,0,0]=3 10 B13R1.7553 Cc1cnn(C)c1C[C@H](N)C(=O)O Amb35580811 [0,0,0,0,0,0|3,0,0]=3 11 B13R1.7553 Cc1ncn(O)c1CC(N)C(=O)O Amb27760359 [0,0,0,0,0,0|3,0,0]=3 12 B13R1.7553 Cc1noc(C)c1CC(=O)C(=O)O Amb33418362 [0,0,0,0,0,0|2,0,1]=3 13 B13R1.7553 Cc1noc(C)c1CC(C)C(=O)O Amb19337119 [0,0,0,0,0,0|2,0,0]=2 14 B13R1.7553 Cc1noc(C)c1CC(C)C(N)=O Amb27752737 [0,0,0,0,0,0|3,0,0]=3 15 B13R1.7553 Cc1noc(C)c1CC(N)C(=O)O Amb18560927 [0,0,0,0,0,0|1,0,0]=1 16 B13R1.7553 Cc1noc(C)c1CC(N)C(F)F Amb33009589 [0,0,0,0,0,0|3,0,1]=4 17 B13R1.7553 Cc1noc(C)c1CC(O)C(=O)O Amb33418352 [0,0,0,0,0,0|2,0,0]=2 18 B13R1.7553 Cc1noc(C)c1NC(=O)C(=O)O Amb28285755 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.7553 Cc1noc(C)c1\C=C(\F)C(=O)O Amb27415917 [0,0,0,0,0,0|2,0,2]=4 20 B13R1.7553 Cc1onc(Cl)c1CC(N)C(=O)O Amb27220152 [0,0,0,0,0,0|1,0,0]=1 21 B13R1.7553 Cc1onc(O)c1CC(N)C(=O)O Amb10068487 [0,0,0,0,0,0|0,0,0]=0 22 B13R1.7553 Cc1onc(O)c1C[C@@H](N)C(=O)O Amb19930306 [0,0,0,0,0,0|0,0,0]=0 23 B13R1.7553 Cn1cnc(Br)c1CC(N)C(=O)O Amb27608538 [0,0,0,0,0,0|3,0,0]=3 24 B13R1.7553 Cn1cnc(Cl)c1CC(N)C(=O)O Amb33056790 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.7553 Cn1cnc(Cl)c1CC(O)C(=O)O Amb33057142 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.7553 Cn1cnc(S)c1C[C@H](N)C(=O)O Amb26413977 [0,0,0,0,0,0|2,1,0]=3 27 B13R1.7553 Cn1ncc(Br)c1C[C@@H](N)C(=O)O Amb33308745 [0,0,0,0,0,0|4,0,0]=4 28 B13R1.7553 Cn1ncc(Br)c1C[C@H](N)C(=O)O Amb33065608 [0,0,0,0,0,0|4,0,0]=4 29 B13R1.7553 Cn1ncc(Cl)c1CC(N)C(=O)O Amb9777890 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.7553 Cn1ncc(Cl)c1C[C@@H](N)C(=O)O Amb35580800 [0,0,0,0,0,0|4,0,0]=4 31 B13R1.7553 Cn1ncc(Cl)c1C[C@H](N)C(=O)O Amb35580801 [0,0,0,0,0,0|4,0,0]=4 32 B13R1.7553 Cn1nnc(Br)c1CC(N)C(N)=O Amb32941148 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.7553 Cn1nnc(Br)c1CC(O)C(=O)O Amb33353480 [0,0,0,0,0,0|4,0,0]=4 34 B13R1.7553 Cn1nnc(Br)c1C[C@@H](N)C(=O)O Amb32789431 [0,0,0,0,0,0|3,0,0]=3 35 B13R1.7553 Cn1nnc(Br)c1C[C@H](N)C(=O)O Amb33308556 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.145 CC(Cc1cncn1C)C(=O)O Amb26562895 [1,0,0,0,0,0|3,0,0]=4 37 B12R1.145 CC(Cc1cnnn1C)C(=O)O Amb24643427 [1,0,0,0,0,0|3,0,0]=4 38 B12R1.145 Cc1cccn1CC(N)C(=O)O Amb18826692 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.145 Cc1ccoc1CC(N)C(=O)O Amb18826171 [1,0,0,0,0,0|3,0,0]=4 40 B12R1.145 Cc1ccsc1CC(N)C(=O)O Amb3788399 [1,0,0,0,0,0|3,0,0]=4 41 B12R1.145 Cc1ccsc1C[C@@H](N)C(=O)O Amb19069332 [1,0,0,0,0,0|3,0,0]=4 42 B12R1.145 Cc1ccsc1C[C@H](N)C(=O)O Amb26450865 [1,0,0,0,0,0|3,0,0]=4 43 B12R1.145 Cc1cocc1CC(N)C(=O)O Amb18826156 [1,0,0,0,0,0|2,0,0]=3 44 B12R1.145 Cc1cscc1CC(C)C(=O)O Amb33147698 [1,0,0,0,0,0|3,0,0]=4 45 B12R1.145 Cc1cscc1CC(N)C(=O)O Amb33065909 [1,0,0,0,0,0|2,0,0]=3 46 B12R1.145 Cc1cscc1CC(N)C(N)=O Amb33308554 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.145 Cc1cscc1CC(O)C(=O)O Amb33146697 [1,0,0,0,0,0|3,0,0]=4 48 B12R1.145 Cc1cscc1C[C@@H](N)C(=O)O Amb33036557 [1,0,0,0,0,0|2,0,0]=3 49 B12R1.145 Cc1cscc1C[C@H](N)C(=O)O Amb33065918 [1,0,0,0,0,0|2,0,0]=3 50 B12R1.145 Cc1nccn1CC(N)C(=O)O Amb18294531 [1,0,0,0,0,0|3,0,0]=4 51 B12R1.145 Cc1ncsc1CC(N)C(=O)O Amb18822033 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.145 Cc1ncsc1C[C@@H](N)C(=O)O Amb28396540 [1,0,0,0,0,0|3,0,0]=4 53 B12R1.145 Cc1nnsc1CC(C)C(=O)O Amb27983370 [1,0,0,0,0,0|3,0,0]=4 54 B12R1.145 Cc1nnsc1CC(N)C(N)=O Amb33127553 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.145 Cc1nnsc1CC(O)C(=O)O Amb33353275 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.145 Cc1nnsc1C[C@@H](N)C(=O)O Amb27877967 [1,0,0,0,0,0|2,0,0]=3 57 B12R1.145 Cc1nnsc1C[C@H](N)C(=O)O Amb26980262 [1,0,0,0,0,0|2,0,0]=3 58 B12R1.145 Cc1nonc1CC(N)C(=O)O Amb10610297 [1,0,0,0,0,0|2,0,0]=3 59 B12R1.145 Cc1nonc1CC(N)C(=O)O Amb5722544 [1,0,0,0,0,0|2,0,0]=3 60 B12R1.145 Cc1occc1CC(=O)C(=O)O Amb28142996 [1,0,0,0,0,0|2,0,1]=4 61 B12R1.145 Cc1occc1CC(C)C(=O)O Amb27233805 [1,0,0,0,0,0|2,0,0]=3 62 B12R1.145 Cc1occc1CC(N)C(=O)O Amb26526981 [1,0,0,0,0,0|1,0,0]=2 63 B12R1.145 Cc1occc1CC(O)C(=O)O Amb32668569 [1,0,0,0,0,0|2,0,0]=3 64 B12R1.145 Cc1oncc1CC(=O)C(=O)O Amb33361735 [1,0,0,0,0,0|1,0,1]=3 65 B12R1.145 Cc1oncc1CC(C)C(=O)O Amb33361742 [1,0,0,0,0,0|1,0,0]=2 66 B12R1.145 Cc1oncc1CC(N)C(=O)O Amb18825754 [1,0,0,0,0,0|0,0,0]=1 67 B12R1.145 Cc1oncc1CC(N)C(F)F Amb32813922 [1,0,0,0,0,0|2,0,1]=4 68 B12R1.145 Cc1oncc1CC(O)C(=O)O Amb33361702 [1,0,0,0,0,0|1,0,0]=2 69 B12R1.145 Cc1sccc1CC(O)C(=O)O Amb33353289 [1,0,0,0,0,0|2,1,0]=4 70 B12R1.145 Cc1sccc1C[C@@H](N)C(=O)O Amb27482297 [1,0,0,0,0,0|1,1,0]=3 71 B12R1.145 Cn1cccc1CC(N)C(=O)O Amb7796010 [1,0,0,0,0,0|3,0,0]=4 72 B12R1.145 Cn1cccc1C[C@H](N)C(=O)O Amb28248841 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb18647156 [1,0,0,0,0,0|2,0,0]=3 74 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb31291637 [1,0,0,0,0,0|2,0,0]=3 75 B12R1.145 Cn1cncc1CC(N)C(N)=O Amb33308697 [1,0,0,0,0,0|3,0,0]=4 76 B12R1.145 Cn1cncc1CC(O)C(=O)O Amb33353390 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.145 Cn1cncc1C[C@@H](N)C(=O)O Amb2699163 [1,0,0,0,0,0|2,0,0]=3 78 B12R1.145 Cn1cncc1C[C@H](N)C(=O)O Amb6600147 [1,0,0,0,0,0|2,0,0]=3 79 B12R1.145 Cn1cnnc1CC(N)C(=O)O Amb18825703 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.145 Cn1cnnc1C[C@@H](N)C(=O)O Amb33308742 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.145 Cn1cnnc1C[C@H](N)C(=O)O Amb33308885 [1,0,0,0,0,0|3,0,0]=4 82 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb35788785 [1,0,0,0,0,0|3,0,0]=4 83 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb9777886 [1,0,0,0,0,0|3,0,0]=4 84 B12R1.145 Cn1nccc1C[C@@H](N)C(=O)O Amb35733298 [1,0,0,0,0,0|3,0,0]=4 85 B12R1.145 Cn1nncc1CC(F)C(=O)O Amb27966893 [1,0,0,0,0,0|3,0,0]=4 86 B12R1.145 Cn1nncc1CC(N)C(=O)O Amb26041711 [1,0,0,0,0,0|2,0,0]=3 87 B12R1.145 Cn1nncc1CC(O)C(=O)O Amb32668570 [1,0,0,0,0,0|3,0,0]=4 88 B12R1.145 Cn1nncc1CC(S)C(=O)O Amb28384180 [1,0,0,0,0,0|3,0,0]=4 89 B12R1.145 Cn1nncc1C[C@@H](N)C(=O)O Amb35580808 [1,0,0,0,0,0|2,0,0]=3 90 B12R1.145 Cn1nncc1C[C@H](N)C(=O)O Amb35580809 [1,0,0,0,0,0|2,0,0]=3 91 B12R1.145 Cn1nnnc1CC(N)C(=O)O Amb33066002 [1,0,0,0,0,0|3,0,0]=4 92 B12R1.145 Cn1nnnc1C[C@@H](N)C(=O)O Amb33066222 [1,0,0,0,0,0|3,0,0]=4 93 B12R1.145 Cn1nnnc1C[C@H](N)C(=O)O Amb33036709 [1,0,0,0,0,0|3,0,0]=4 94 B12R1.145 NC(Cc1ccnn1O)C(=O)O Amb27602908 [1,0,0,0,0,0|2,0,0]=3 95 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb25795560 [1,0,0,0,0,0|2,1,0]=4 96 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb33743565 [1,0,0,0,0,0|2,1,0]=4 97 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb24399335 [1,0,0,0,0,0|2,1,0]=4 98 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb33299257 [1,0,0,0,0,0|2,1,0]=4 99 B12R1.145 NC(Cc1cncn1O)C(=O)O Amb27214198 [1,0,0,0,0,0|3,0,0]=4 100 B12R1.145 NC(Cc1conc1O)C(=O)O Amb26032245 [1,0,0,0,0,0|0,0,0]=1 101 B12R1.145 NC(Cc1cscc1Br)C(=O)O Amb27642505 [1,0,0,0,0,0|2,1,0]=4 102 B12R1.145 NC(Cc1nonc1O)C(=O)O Amb28342262 [1,0,0,0,0,0|1,0,0]=2 103 B12R1.145 N[C@@H](Cc1ccsc1Br)C(=O)O Amb25335861 [1,0,0,0,0,0|2,1,0]=4 104 B12R1.145 N[C@@H](Cc1ccsc1Cl)C(=O)O Amb24350624 [1,0,0,0,0,0|2,1,0]=4 105 B12R1.145 N[C@@H](Cc1nonc1O)C(=O)O Amb27666914 [1,0,0,0,0,0|1,0,0]=2 106 B12R1.145 N[C@@H](Cc1scnc1Cl)C(=O)O Amb33036143 [1,0,0,0,0,0|3,0,0]=4 107 B12R1.145 N[C@@H](Cc1sncc1Br)C(=O)O Amb33037097 [1,0,0,0,0,0|3,0,0]=4 108 B12R1.145 N[C@H](Cc1ccsc1Br)C(=O)O Amb24600296 [1,0,0,0,0,0|2,1,0]=4 109 B12R1.145 N[C@H](Cc1ccsc1Cl)C(=O)O Amb28186495 [1,0,0,0,0,0|2,1,0]=4 110 B12R1.145 N[C@H](Cc1scnc1Cl)C(=O)O Amb33065656 [1,0,0,0,0,0|3,0,0]=4 111 B12R1.145 N[C@H](Cc1sncc1Br)C(=O)O Amb32867931 [1,0,0,0,0,0|3,0,0]=4 112 B12R1.895 CC(=O)CCc1c(C)noc1C Amb27861236 [1,0,0,0,0,0|2,0,0]=3 113 B12R1.895 CC(=O)NCc1c(C)noc1C Amb27464037 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.895 CC1=NOC(=O)C1CCC(=O)O Amb6892606 [1,0,0,0,0,0|2,0,1]=4 115 B12R1.895 Cc1cnc(O)n1CCC(=O)O Amb18825720 [1,0,0,0,0,0|2,0,0]=3 116 B12R1.895 Cc1cnn(C)c1CCC(=O)O Amb27798226 [1,0,0,0,0,0|3,0,0]=4 117 B12R1.895 Cc1csc(C)c1CCC(=O)O Amb32712025 [1,0,0,0,0,0|2,1,0]=4 118 B12R1.895 Cc1noc(C)c1CCC(=O)Cl Amb19652016 [1,0,0,0,0,0|2,0,0]=3 119 B12R1.895 Cc1noc(C)c1CCC(=O)O Amb6356106 [1,0,0,0,0,0|1,0,0]=2 120 B12R1.895 Cc1noc(C)c1CCC(C)O Amb33326331 [1,0,0,0,0,0|2,0,1]=4 121 B12R1.895 Cc1noc(C)c1CCC(N)=O Amb535447 [1,0,0,0,0,0|2,0,0]=3 122 B12R1.895 Cc1noc(C)c1CC[C@@H](C)O Amb33326329 [1,0,0,0,0,0|2,0,1]=4 123 B12R1.895 Cc1noc(C)c1CC[C@H](C)O Amb33326330 [1,0,0,0,0,0|2,0,1]=4 124 B12R1.895 Cc1noc(C)c1CC[N+](=O)[O-] Amb33326311 [1,0,0,0,0,0|2,0,1]=4 125 B12R1.895 Cc1noc(C)c1OCC(=O)O Amb33422553 [1,0,0,0,0,0|2,0,0]=3 126 B12R1.895 Cc1noc(C)c1\C=C\C(=O)O Amb415902 [1,0,0,0,0,0|1,0,2]=4 127 B12R1.895 Cc1noc(Cl)c1CCC(=O)O Amb10610223 [1,0,0,0,0,0|2,0,0]=3 128 B12R1.895 Cc1noc(N)c1CCC(=O)O Amb26319176 [1,0,0,0,0,0|2,0,0]=3 129 B12R1.895 Cc1nsc(C)c1CCC(=O)O Amb18822437 [1,0,0,0,0,0|1,1,0]=3 130 B12R1.895 Cn1cnc(Cl)c1CCC(=O)O Amb33056776 [1,0,0,0,0,0|3,0,0]=4 131 B12R1.2217 CCC(N)Cc1c(C)noc1C Amb27642999 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.2217 Cc1noc(C)c1CC(N)CO Amb25968233 [1,0,0,0,0,0|1,0,1]=3 133 B12R1.2217 Cc1noc(C)c1CN(C)C=O Amb27163395 [1,0,0,0,0,0|3,0,0]=4 134 B12R1.2217 Cc1noc(C)c1C\C(N)=N/O Amb24537673 [1,0,0,0,0,0|2,0,1]=4 135 B14R1.4351 CC1=C(C[C@H](N)C(=O)O)C(O)=NC1=O Amb27657782 [0,1,0,0,0,0|1,0,0]=2 136 B14R1.4351 Cc1nn(C)c(C)c1CC(C)C(=O)O Amb19337832 [0,1,0,0,0,0|3,0,0]=4 137 B14R1.4351 Cc1nn(C)c(C)c1CC(N)C(=O)O Amb18560928 [0,1,0,0,0,0|2,0,0]=3 138 B14R1.4351 Cc1nn(C)c(C)c1CC(O)C(=O)O Amb33353425 [0,1,0,0,0,0|3,0,0]=4 139 B14R1.4351 Cc1nn(C)c(Cl)c1CC(N)C(=O)O Amb25185866 [0,1,0,0,0,0|2,0,1]=4 140 B14R1.9322 COC(Cc1c(C)noc1C)C(=O)O Amb33326293 [0,1,0,0,0,0|2,0,0]=3 141 B14R1.11086 CCn1cnc(Cl)c1CC(N)C(=O)O Amb33222789 [0,1,0,0,0,0|3,0,0]=4 142 B14R1.13089 COC(=O)C(O)Cc1c(C)noc1C Amb33326302 [0,1,0,0,0,0|2,0,0]=3 143 B14R1.13384 Cc1noc(C)c1CC(C)(C)C(=O)O Amb33449259 [0,1,0,0,0,0|2,0,0]=3 144 B14R1.13384 Cc1noc(C)c1CC(C)(O)C(=O)O Amb33326285 [0,1,0,0,0,0|2,0,0]=3 145 B14R1.13384 Cc1noc(C)c1CC(F)(F)C(=O)O Amb32807858 [0,1,0,0,0,0|2,0,0]=3 146 B14R1.13387 Cc1cnn(C)c1C(O)C(N)C(=O)O Amb26448023 [0,1,0,0,0,0|3,0,0]=4 147 B14R1.13387 Cc1noc(C)c1C(O)C(N)C(=O)O Amb33418323 [0,1,0,0,0,0|1,0,0]=2 148 B14R1.13387 Cn1cnc(Cl)c1C(O)C(N)C(=O)O Amb33057125 [0,1,0,0,0,0|3,0,0]=4 149 B14R1.13387 Cn1nnc(Br)c1C(O)C(N)C(=O)O Amb27629925 [0,1,0,0,0,0|3,0,0]=4 150 B12R0.339 N[C@@H](CC(C(=O)O)C(=O)O)C(=O)O Amb4025822 [0,0,1,0,0,0|2,0,1]=4 151 B14R2.21106 Cc1noc(C)c1C2CC2C(=O)O Amb33418361 [0,0,0,1,0,0|2,0,0]=3 152 B14R2.21106 Cc1noc(C)c1[C@@H]2C[C@H]2C(=O)O Amb33418313 [0,0,0,1,0,0|2,0,0]=3 153 B14R2.24358 CC(=O)C1CCc2onc(C)c2C1 Amb28461155 [0,0,0,1,0,0|3,0,0]=4 154 B14R2.24358 Cc1nnc2n1CC(C(=O)O)NC2 Amb24060444 [0,0,0,1,0,0|3,0,0]=4 155 B14R2.24358 Cc1nnc2n1CC(C(=O)O)NC2 Amb30066219 [0,0,0,1,0,0|3,0,0]=4 156 B14R2.24358 Cc1nnc2n1CC(C(=O)O)NC2 Amb32664318 [0,0,0,1,0,0|3,0,0]=4 157 B14R2.24358 O=C(O)C1CCc2nnc(O)n2C1 Amb26068285 [0,0,0,1,0,0|3,0,0]=4 158 B14R2.24358 O=C1NNC2=C1CC(C(=O)O)NC2 Amb24342490 [0,0,0,1,0,0|1,0,2]=4 159 B12R1.897 C=C(C(=O)O)c1c(C)noc1C Amb33326314 [0,0,0,0,1,0|2,0,1]=4 160 B12R1.897 Cc1cnn(C)c1C(N)C(=O)O Amb33415024 [0,0,0,0,1,0|3,0,0]=4 161 B12R1.897 Cc1noc(C)c1C(=O)C(=O)O Amb8834287 [0,0,0,0,1,0|2,0,1]=4 162 B12R1.897 Cc1noc(C)c1C(C)C(=O)O Amb13952176 [0,0,0,0,1,0|2,0,0]=3 163 B12R1.897 Cc1noc(C)c1C(C)C(N)=O Amb27595280 [0,0,0,0,1,0|3,0,0]=4 164 B12R1.897 Cc1noc(C)c1C(N)C(=O)O Amb13882677 [0,0,0,0,1,0|1,0,0]=2 165 B12R1.897 Cc1noc(C)c1C(O)C(=O)O Amb33418363 [0,0,0,0,1,0|2,0,0]=3 166 B12R1.897 Cc1noc(C)c1[C@@H](N)C(=O)O Amb27635337 [0,0,0,0,1,0|1,0,0]=2 167 B12R1.897 Cc1nsc(C)c1C(N)C(=O)O Amb18822051 [0,0,0,0,1,0|1,1,0]=3 168 B12R1.897 Cc1onc(O)c1[C@H](N)C(=O)O Amb26604925 [0,0,0,0,1,0|0,0,0]=1 169 B12R1.897 Cn1cnc(Cl)c1C(N)C(=O)O Amb33056785 [0,0,0,0,1,0|3,0,0]=4 170 B12R1.897 NC(C(=O)O)c1c(Cl)cnn1O Amb25858051 [0,0,0,0,1,0|3,0,0]=4 171 B12R1.897 N[C@H](C(=O)O)c1c(Cl)cnn1O Amb28244261 [0,0,0,0,1,0|3,0,0]=4 172 B14R1.4443 Cc1noc(C)c1CCC(C)C(=O)O Amb33422575 [0,0,0,0,0,1|2,0,0]=3 173 B14R1.4443 Cc1noc(C)c1CNC(=O)C(=O)O Amb25345243 [0,0,0,0,0,1|2,0,1]=4 174 B14R1.4443 Cc1noc(C)c1CSC(C)C(=O)O Amb6745698 [0,0,0,0,0,1|2,0,0]=3 175 B14R1.4474 CC1=CN(CC(N)C(=O)O)C(=O)N=C1 Amb28324828 [0,0,0,0,0,1|2,0,1]=4 176 B14R1.4474 Cc1ccc(Br)cc1CC(N)C(=O)O Amb25906302 [0,0,0,0,0,1|3,0,0]=4 177 B14R1.4474 Cc1ccc(Br)cc1C[C@H](N)C(=O)O Amb24664141 [0,0,0,0,0,1|3,0,0]=4 178 B14R1.4474 Cc1ccc(C)c(CC(N)C(=O)O)c1 Amb3788508 [0,0,0,0,0,1|3,0,0]=4 179 B14R1.4474 Cc1ccc(Cl)c(CC(N)C(=O)O)c1 Amb25363453 [0,0,0,0,0,1|3,0,0]=4 180 B14R1.4474 Cc1ccc(Cl)cc1CC(N)C(=O)O Amb27482797 [0,0,0,0,0,1|3,0,0]=4 181 B14R1.4474 Cc1ccc(Cl)cc1C[C@@H](N)C(=O)O Amb25363915 [0,0,0,0,0,1|3,0,0]=4 182 B14R1.4474 Cc1ccc(Cl)cc1C[C@H](N)C(=O)O Amb25786160 [0,0,0,0,0,1|3,0,0]=4 183 B14R1.4474 Cc1ccc(F)c(CC(N)C(=O)O)c1 Amb22011666 [0,0,0,0,0,1|3,0,0]=4 184 B14R1.4474 Cc1ccc(F)c(C[C@@H](N)C(=O)O)c1 Amb27862484 [0,0,0,0,0,1|3,0,0]=4 185 B14R1.4474 Cc1ccc(F)cc1CC(N)C(=O)O Amb22738112 [0,0,0,0,0,1|3,0,0]=4 186 B14R1.4474 Cc1ccc(I)c(CC(N)C(=O)O)c1 Amb27876367 [0,0,0,0,0,1|3,0,0]=4 187 B14R1.4474 Cc1ccc(I)c(C[C@H](N)C(=O)O)c1 Amb27489690 [0,0,0,0,0,1|3,0,0]=4 188 B14R1.4474 Cc1ccc(I)cc1CC(N)C(=O)O Amb27436589 [0,0,0,0,0,1|3,0,0]=4 189 B14R1.4474 Cc1ccc(I)cc1C[C@H](N)C(=O)O Amb25343363 [0,0,0,0,0,1|3,0,0]=4 190 B14R1.4474 Cc1ccc(N)c(C[C@@H](N)C(=O)O)c1 Amb28346827 [0,0,0,0,0,1|3,0,0]=4 191 B14R1.4474 Cc1ccc(N)cc1C[C@@H](N)C(=O)O Amb28043037 [0,0,0,0,0,1|3,0,0]=4 192 B14R1.4474 Cc1ccc(N)cc1C[C@H](N)C(=O)O Amb28239542 [0,0,0,0,0,1|3,0,0]=4 193 B14R1.4474 Cc1ccc(O)c(CC(C)C(=O)O)c1 Amb24652411 [0,0,0,0,0,1|3,0,0]=4 194 B14R1.4474 Cc1ccc(O)c(CC(N)C(=O)O)c1 Amb4013080 [0,0,0,0,0,1|2,0,0]=3 195 B14R1.4474 Cc1ccc(O)c(CC(O)C(=O)O)c1 Amb33225053 [0,0,0,0,0,1|3,0,0]=4 196 B14R1.4474 Cc1ccc(O)cc1CC(C)C(=O)O Amb26464943 [0,0,0,0,0,1|3,0,0]=4 197 B14R1.4474 Cc1ccc(O)cc1CC(N)C(=O)O Amb27461429 [0,0,0,0,0,1|2,0,0]=3 198 B14R1.4474 Cc1cnc(N)c(CC(C)C(=O)O)c1 Amb27406395 [0,0,0,0,0,1|3,0,0]=4 199 B14R1.4474 Cc1cnc(N)c(CC(N)C(=O)O)c1 Amb27873931 [0,0,0,0,0,1|2,0,0]=3 200 B14R1.4474 Cc1cnc(O)nc1N[C@@H](C)C(=O)O Amb27401981 [0,0,0,0,0,1|3,0,0]=4 201 B14R1.4474 NC(Cc1cc(Br)ccc1O)C(=O)O Amb28343250 [0,0,0,0,0,1|3,0,0]=4 202 B14R1.4474 NC(Cc1cc(Br)cnc1Cl)C(=O)O Amb25905945 [0,0,0,0,0,1|3,0,0]=4 203 B14R1.4474 NC(Cc1cc(Br)cnc1F)C(=O)O Amb33477771 [0,0,0,0,0,1|3,0,0]=4 204 B14R1.4474 NC(Cc1cc(Cl)ccc1O)C(=O)O Amb19000855 [0,0,0,0,0,1|3,0,0]=4 205 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb27841448 [0,0,0,0,0,1|3,0,0]=4 206 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb33620550 [0,0,0,0,0,1|3,0,0]=4 207 B14R1.4474 NC(Cc1cc(Cl)cnc1Cl)C(=O)O Amb33741518 [0,0,0,0,0,1|3,0,0]=4 208 B14R1.4474 NC(Cc1cc(Cl)cnc1F)C(=O)O Amb27462027 [0,0,0,0,0,1|3,0,0]=4 209 B14R1.4474 NC(Cc1cc(Cl)cnc1O)C(=O)O Amb27814150 [0,0,0,0,0,1|2,0,0]=3 210 B14R1.4474 NC(Cc1cc(Cl)ncc1Br)C(=O)O Amb27647717 [0,0,0,0,0,1|3,0,0]=4 211 B14R1.4474 NC(Cc1cc(Cl)ncc1Cl)C(=O)O Amb25995250 [0,0,0,0,0,1|3,0,0]=4 212 B14R1.4474 NC(Cc1cc(Cl)nnc1Cl)C(=O)O Amb33258876 [0,0,0,0,0,1|3,0,0]=4 213 B14R1.4474 NC(Cc1cc(F)ccc1O)C(=O)O Amb26468792 [0,0,0,0,0,1|3,0,0]=4 214 B14R1.4474 NC(Cc1cc(F)cnc1Cl)C(=O)O Amb25212912 [0,0,0,0,0,1|3,0,0]=4 215 B14R1.4474 NC(Cc1cc(I)ccc1O)C(=O)O Amb28053923 [0,0,0,0,0,1|3,0,0]=4 216 B14R1.4474 NC(Cc1cc(O)ccc1O)C(=O)O Amb17595220 [0,0,0,0,0,1|3,0,0]=4 217 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1O)C(=O)O Amb27181750 [0,0,0,0,0,1|3,0,0]=4 218 B14R1.4474 N[C@@H](Cc1cc(Cl)cnc1O)C(=O)O Amb27400517 [0,0,0,0,0,1|2,0,0]=3 219 B14R1.4474 N[C@@H](Cc1cc(O)ccc1F)C(=O)O Amb26872180 [0,0,0,0,0,1|3,0,0]=4 220 B14R1.4474 N[C@H](Cc1cc(Br)cnc1Cl)C(=O)O Amb27848953 [0,0,0,0,0,1|3,0,0]=4 221 B14R1.4474 N[C@H](Cc1cc(Br)cnc1O)C(=O)O Amb27465718 [0,0,0,0,0,1|2,0,0]=3 222 B14R1.4474 N[C@H](Cc1cc(Cl)ncc1Br)C(=O)O Amb28187029 [0,0,0,0,0,1|3,0,0]=4 223 B14R1.4474 N[C@H](Cc1cc(Cl)ncc1Cl)C(=O)O Amb28186514 [0,0,0,0,0,1|3,0,0]=4 224 B14R1.4474 N[C@H](Cc1cc(O)ccc1Br)C(=O)O Amb27957293 [0,0,0,0,0,1|3,0,0]=4 225 B14R1.4474 N[C@H](Cc1cc(O)ccc1Cl)C(=O)O Amb27418201 [0,0,0,0,0,1|3,0,0]=4 226 B14R1.4474 N[C@H](Cc1cc(O)ccc1O)C(=O)O Amb22228355 [0,0,0,0,0,1|3,0,0]=4 227 B14R1.4474 Nc1cc(C[C@@H](N)C(=O)O)c(Br)cn1 Amb27390232 [0,0,0,0,0,1|3,0,0]=4 228 B14R1.4474 Nc1ccc(O)cc1C[C@@H](N)C(=O)O Amb27173277 [0,0,0,0,0,1|3,0,0]=4 229 B14R1.4474 Nc1ncc(Br)cc1CC(N)C(=O)O Amb28323276 [0,0,0,0,0,1|3,0,0]=4 230 B14R1.4474 Nc1ncc(Cl)cc1CC(N)C(=O)O Amb27425407 [0,0,0,0,0,1|3,0,0]=4 231 B14R1.4474 Nc1ncc(Cl)cc1C[C@H](N)C(=O)O Amb27459758 [0,0,0,0,0,1|3,0,0]=4 232 B14R1.5971 Cc1cccc(C)c1CC(N)C(=O)O Amb3788509 [0,0,0,0,0,1|3,0,0]=4 233 B14R1.5971 Cc1cccc(C)c1C[C@H](N)C(=O)O Amb24062379 [0,0,0,0,0,1|3,0,0]=4 234 B14R1.5971 Cc1cccc(Cl)c1CC(N)C(=O)O Amb27586826 [0,0,0,0,0,1|3,0,0]=4 235 B14R1.5971 Cc1cccc(Cl)c1C[C@H](N)C(=O)O Amb28254244 [0,0,0,0,0,1|3,0,0]=4 236 B14R1.5971 Cc1cccc(F)c1CC(N)C(=O)O Amb24426809 [0,0,0,0,0,1|3,0,0]=4 237 B14R1.5971 Cc1ccnc(Br)c1CC(N)C(=O)O Amb27476341 [0,0,0,0,0,1|2,0,0]=3 238 B14R1.5971 Cc1ccnc(Br)c1C[C@@H](N)C(=O)O Amb27392076 [0,0,0,0,0,1|2,0,0]=3 239 B14R1.5971 Cc1ccnc(N)c1CC(C)C(=O)O Amb27971549 [0,0,0,0,0,1|3,0,0]=4 240 B14R1.5971 NC(Cc1c(Cl)cncc1Cl)C(=O)O Amb26899759 [0,0,0,0,0,1|3,0,0]=4 241 B14R1.5971 NC(Cc1c(Cl)cncc1Cl)C(=O)O Amb33299495 [0,0,0,0,0,1|3,0,0]=4 242 B14R1.5971 NC(Cc1c(Cl)ncnc1Cl)C(=O)O Amb33262288 [0,0,0,0,0,1|3,0,0]=4 243 B14R1.5971 NC(Cc1c(F)cncc1F)C(=O)O Amb27419681 [0,0,0,0,0,1|3,0,0]=4 244 B14R1.5971 NC(Cc1c(F)cncc1F)C(=O)O Amb33733600 [0,0,0,0,0,1|3,0,0]=4 245 B14R1.5971 NC(Cc1c(O)cccc1Br)C(=O)O Amb18668186 [0,0,0,0,0,1|3,0,0]=4 246 B14R1.5971 NC(Cc1c(O)cccc1Cl)C(=O)O Amb27873041 [0,0,0,0,0,1|3,0,0]=4 247 B14R1.5971 NC(Cc1c(O)cccc1F)C(=O)O Amb27793287 [0,0,0,0,0,1|3,0,0]=4 248 B14R1.5971 NC(Cc1c(O)cccc1O)C(=O)O Amb22228380 [0,0,0,0,0,1|3,0,0]=4 249 B14R1.5971 N[C@@H](Cc1c(Br)cncc1Br)C(=O)O Amb27491305 [0,0,0,0,0,1|3,0,0]=4 250 B14R1.5971 N[C@@H](Cc1c(Cl)cncc1Cl)C(=O)O Amb28323128 [0,0,0,0,0,1|3,0,0]=4 251 B14R1.5971 N[C@H](Cc1c(O)cccc1F)C(=O)O Amb27264654 [0,0,0,0,0,1|3,0,0]=4 252 B11R1.35 CC(Cc1ccoc1)C(=O)O Amb26970772 [2,0,0,0,0,0|2,0,0]=4 253 B11R1.35 CC(Cc1cnsc1)C(=O)O Amb35720171 [2,0,0,0,0,0|1,1,0]=4 254 B11R1.35 NC(=O)C(N)Cc1ccoc1 Amb33308808 [2,0,0,0,0,0|2,0,0]=4 255 B11R1.35 NC(Cc1ccno1)C(=O)O Amb25891427 [2,0,0,0,0,0|2,0,0]=4 256 B11R1.35 NC(Cc1ccno1)C(=O)O Amb28652917 [2,0,0,0,0,0|2,0,0]=4 257 B11R1.35 NC(Cc1ccns1)C(=O)O Amb18198297 [2,0,0,0,0,0|2,0,0]=4 258 B11R1.35 NC(Cc1ccoc1)C(=O)O Amb21858415 [2,0,0,0,0,0|1,0,0]=3 259 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb2611710 [2,0,0,0,0,0|1,1,0]=4 260 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb33527048 [2,0,0,0,0,0|1,1,0]=4 261 B11R1.35 NC(Cc1cnco1)C(=O)O Amb33295162 [2,0,0,0,0,0|2,0,0]=4 262 B11R1.35 NC(Cc1cncs1)C(=O)O Amb18301833 [2,0,0,0,0,0|2,0,0]=4 263 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30584636 [2,0,0,0,0,0|2,0,0]=4 264 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30869600 [2,0,0,0,0,0|2,0,0]=4 265 B11R1.35 NC(Cc1cnns1)C(=O)O Amb33036593 [2,0,0,0,0,0|2,0,0]=4 266 B11R1.35 NC(Cc1cnoc1)C(=O)O Amb18830802 [2,0,0,0,0,0|0,0,0]=2 267 B11R1.35 NC(Cc1cnon1)C(=O)O Amb18200030 [2,0,0,0,0,0|1,0,0]=3 268 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb24471428 [2,0,0,0,0,0|1,1,0]=4 269 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb33620573 [2,0,0,0,0,0|1,1,0]=4 270 B11R1.35 NC(Cc1cocn1)C(=O)O Amb24409031 [2,0,0,0,0,0|2,0,0]=4 271 B11R1.35 NC(Cc1cocn1)C(=O)O Amb33620562 [2,0,0,0,0,0|2,0,0]=4 272 B11R1.35 NC(Cc1csnn1)C(=O)O Amb24674512 [2,0,0,0,0,0|1,1,0]=4 273 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb18294042 [2,0,0,0,0,0|2,0,0]=4 274 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb32664802 [2,0,0,0,0,0|2,0,0]=4 275 B11R1.35 N[C@@H](CC1=NCN=C1)C(=O)O Amb27955778 [2,0,0,0,0,0|2,0,0]=4 276 B11R1.35 N[C@@H](Cc1ccno1)C(=O)O Amb25891409 [2,0,0,0,0,0|2,0,0]=4 277 B11R1.35 N[C@@H](Cc1ccns1)C(=O)O Amb29852557 [2,0,0,0,0,0|2,0,0]=4 278 B11R1.35 N[C@@H](Cc1ccoc1)C(=O)O Amb22228970 [2,0,0,0,0,0|1,0,0]=3 279 B11R1.35 N[C@@H](Cc1ccon1)C(=O)O Amb26486882 [2,0,0,0,0,0|2,0,0]=4 280 B11R1.35 N[C@@H](Cc1ccsc1)C(=O)O Amb10068212 [2,0,0,0,0,0|1,1,0]=4 281 B11R1.35 N[C@@H](Cc1cncs1)C(=O)O Amb22745840 [2,0,0,0,0,0|2,0,0]=4 282 B11R1.35 N[C@@H](Cc1cnns1)C(=O)O Amb33066323 [2,0,0,0,0,0|2,0,0]=4 283 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb28043541 [2,0,0,0,0,0|1,1,0]=4 284 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb33620574 [2,0,0,0,0,0|1,1,0]=4 285 B11R1.35 N[C@@H](Cc1cocn1)C(=O)O Amb27839934 [2,0,0,0,0,0|2,0,0]=4 286 B11R1.35 N[C@@H](Cc1csnn1)C(=O)O Amb27768430 [2,0,0,0,0,0|1,1,0]=4 287 B11R1.35 N[C@H](Cc1ccns1)C(=O)O Amb29852422 [2,0,0,0,0,0|2,0,0]=4 288 B11R1.35 N[C@H](Cc1ccoc1)C(=O)O Amb22228969 [2,0,0,0,0,0|1,0,0]=3 289 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb10068213 [2,0,0,0,0,0|1,1,0]=4 290 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb33725979 [2,0,0,0,0,0|1,1,0]=4 291 B11R1.35 N[C@H](Cc1cncs1)C(=O)O Amb26604609 [2,0,0,0,0,0|2,0,0]=4 292 B11R1.35 N[C@H](Cc1cnns1)C(=O)O Amb33065876 [2,0,0,0,0,0|2,0,0]=4 293 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb25260240 [2,0,0,0,0,0|1,1,0]=4 294 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb33620572 [2,0,0,0,0,0|1,1,0]=4 295 B11R1.35 N[C@H](Cc1csnn1)C(=O)O Amb27174873 [2,0,0,0,0,0|1,1,0]=4 296 B11R1.35 N[C@H](Cn1ccnc1)C(=O)O Amb25887093 [2,0,0,0,0,0|2,0,0]=4 297 B11R1.35 O=C(O)C(F)Cc1ccoc1 Amb27478909 [2,0,0,0,0,0|2,0,0]=4 298 B11R1.35 O=C(O)C(O)Cc1ccoc1 Amb26952187 [2,0,0,0,0,0|2,0,0]=4 299 B11R1.35 O=C(O)C(O)Cc1cnsc1 Amb33353410 [2,0,0,0,0,0|1,1,0]=4 300 B11R1.90 CC(=O)CCc1ccoc1C Amb26553050 [2,0,0,0,0,0|2,0,0]=4 301 B11R1.90 CC(=O)CCc1cnoc1C Amb33361882 [2,0,0,0,0,0|1,0,0]=3 302 B11R1.90 Cc1cncn1CCC(=O)O Amb9901687 [2,0,0,0,0,0|2,0,0]=4 303 B11R1.90 Cc1cnsc1CCC(=O)O Amb18198609 [2,0,0,0,0,0|2,0,0]=4 304 B11R1.90 Cc1cocc1CCC(=O)O Amb24628818 [2,0,0,0,0,0|2,0,0]=4 305 B11R1.90 Cc1cscc1CCC(=O)O Amb33469921 [2,0,0,0,0,0|2,0,0]=4 306 B11R1.90 Cc1nncn1CCC(=O)O Amb18893420 [2,0,0,0,0,0|2,0,0]=4 307 B11R1.90 Cc1nnsc1CCC(=O)O Amb28239590 [2,0,0,0,0,0|2,0,0]=4 308 B11R1.90 Cc1nocc1CCC(=O)O Amb18200518 [2,0,0,0,0,0|1,0,0]=3 309 B11R1.90 Cc1nonc1CCC(=O)O Amb18200254 [2,0,0,0,0,0|2,0,0]=4 310 B11R1.90 Cc1occc1OCC(=O)O Amb33274283 [2,0,0,0,0,0|2,0,0]=4 311 B11R1.90 Cc1ocnc1CCC(=O)O Amb18200534 [2,0,0,0,0,0|2,0,0]=4 312 B11R1.90 Cc1oncc1CCC(=O)O Amb18200543 [2,0,0,0,0,0|0,0,0]=2 313 B11R1.90 Cc1oncc1CCC(C)O Amb33362394 [2,0,0,0,0,0|1,0,1]=4 314 B11R1.90 Cc1oncc1CC[C@@H](C)O Amb33361923 [2,0,0,0,0,0|1,0,1]=4 315 B11R1.90 Cc1oncc1CC[C@H](C)O Amb33361924 [2,0,0,0,0,0|1,0,1]=4 316 B11R1.90 Cc1oncc1CC[N+](=O)[O-] Amb33361402 [2,0,0,0,0,0|1,0,1]=4 317 B11R1.90 Cc1oncc1OCC(=O)O Amb33361121 [2,0,0,0,0,0|1,0,0]=3 318 B11R1.90 Cc1oncc1\C=C\C(=O)O Amb33361682 [2,0,0,0,0,0|0,0,2]=4 319 B11R1.90 Cc1onnc1CCC(=O)O Amb27791114 [2,0,0,0,0,0|1,0,0]=3 320 B11R1.90 Cc1sccc1CCC(=O)O Amb18198905 [2,0,0,0,0,0|1,1,0]=4 321 B11R1.90 Cc1sncc1CCC(=O)O Amb18825426 [2,0,0,0,0,0|0,1,0]=3 322 B11R1.90 Cn1cncc1CCC(=O)O Amb33551071 [2,0,0,0,0,0|2,0,0]=4 323 B11R1.90 Cn1nncc1CCC(=O)O Amb25075001 [2,0,0,0,0,0|2,0,0]=4 324 B11R1.90 Nc1oncc1CCC(=O)O Amb27209688 [2,0,0,0,0,0|1,0,0]=3 325 B11R1.90 O=C(O)CCC1=CCOC1=O Amb27596612 [2,0,0,0,0,0|2,0,0]=4 326 B11R1.90 O=C(O)CCC1=CONC1=O Amb27637001 [2,0,0,0,0,0|0,0,2]=4 327 B11R1.90 O=C(O)CCC1C=NOC1=O Amb27438724 [2,0,0,0,0,0|1,0,1]=4 328 B11R1.90 O=C(O)CCc1ccoc1Br Amb33470231 [2,0,0,0,0,0|2,0,0]=4 329 B11R1.90 O=C(O)CCc1ccoc1Cl Amb33470229 [2,0,0,0,0,0|2,0,0]=4 330 B11R1.90 O=C(O)CCn1ccnc1O Amb18200269 [2,0,0,0,0,0|2,0,0]=4 331 B11R1.228 Cc1occc1CC(N)CO Amb33275083 [2,0,0,0,0,0|1,0,1]=4 332 B11R1.228 Cc1oncc1CC(N)CO Amb33361661 [2,0,0,0,0,0|0,0,1]=3 333 B11R1.465 CCCCc1c(O)noc1C Amb3428039 [2,0,0,0,0,0|1,0,1]=4 334 B11R1.465 Cc1noc(C)c1CCC=O Amb33422576 [2,0,0,0,0,0|1,0,0]=3 335 B11R1.465 Cc1noc(C)c1CCCO Amb25100855 [2,0,0,0,0,0|1,0,1]=4 336 B11R1.465 Cc1onc(O)c1CCCN Amb18125988 [2,0,0,0,0,0|1,0,1]=4 337 B11R1.495 Cc1noc(C)c1CC(C)N Amb8010753 [2,0,0,0,0,0|1,0,1]=4 338 B11R1.495 Cc1noc(C)c1CC(C)O Amb33418336 [2,0,0,0,0,0|2,0,0]=4 339 B11R1.495 Cc1noc(C)c1CC(N)=O Amb6888122 [2,0,0,0,0,0|1,0,1]=4 340 B11R1.495 Cc1noc(C)c1C[C@@H](C)N Amb33326327 [2,0,0,0,0,0|1,0,1]=4 341 B11R1.495 Cc1noc(C)c1C[C@@H](C)O Amb33326324 [2,0,0,0,0,0|2,0,0]=4 342 B11R1.495 Cc1noc(C)c1C[C@H](C)N Amb33326326 [2,0,0,0,0,0|1,0,1]=4 343 B11R1.495 Cc1noc(C)c1C[C@H](C)O Amb33326325 [2,0,0,0,0,0|2,0,0]=4 344 B11R1.495 Cc1onc(O)c1CC(N)=O Amb25858124 [2,0,0,0,0,0|0,0,1]=3 345 B13R1.196 Cc1cscc1C(O)C(N)C(=O)O Amb33146300 [1,1,0,0,0,0|2,0,0]=4 346 B13R1.196 Cc1nnsc1C(O)C(N)C(=O)O Amb27965120 [1,1,0,0,0,0|2,0,0]=4 347 B13R1.196 Cc1occc1C(O)C(N)C(=O)O Amb26951797 [1,1,0,0,0,0|1,0,0]=3 348 B13R1.196 Cc1oncc1C(O)C(N)C(=O)O Amb33361663 [1,1,0,0,0,0|0,0,0]=2 349 B13R1.196 Cc1sccc1C(O)C(N)C(=O)O Amb27876003 [1,1,0,0,0,0|1,1,0]=4 350 B13R1.196 Cn1cncc1C(O)C(N)C(=O)O Amb26948472 [1,1,0,0,0,0|2,0,0]=4 351 B13R1.196 Cn1nncc1C(O)C(N)C(=O)O Amb24624791 [1,1,0,0,0,0|2,0,0]=4 352 B13R1.421 COC(Cc1ccoc1C)C(=O)O Amb33274703 [1,1,0,0,0,0|2,0,0]=4 353 B13R1.421 COC(Cc1cnoc1C)C(=O)O Amb33361386 [1,1,0,0,0,0|1,0,0]=3 354 B13R1.704 COC(=O)C(N)Cc1cncn1C Amb33069588 [1,1,0,0,0,0|2,0,0]=4 355 B13R1.704 COC(=O)C(N)Cc1cscc1C Amb33065616 [1,1,0,0,0,0|2,0,0]=4 356 B13R1.704 COC(=O)C(N)Cc1nonc1C Amb33746359 [1,1,0,0,0,0|2,0,0]=4 357 B13R1.704 COC(=O)C(N)Cc1snnc1C Amb33036569 [1,1,0,0,0,0|2,0,0]=4 358 B13R1.704 COC(=O)C(O)Cc1ccoc1C Amb33274712 [1,1,0,0,0,0|2,0,0]=4 359 B13R1.704 COC(=O)C(O)Cc1cnoc1C Amb33361393 [1,1,0,0,0,0|1,0,0]=3 360 B13R1.772 Cc1occc1CC(C)(C)C(=O)O Amb33275060 [1,1,0,0,0,0|2,0,0]=4 361 B13R1.772 Cc1occc1CC(C)(O)C(=O)O Amb33274371 [1,1,0,0,0,0|2,0,0]=4 362 B13R1.772 Cc1occc1CC(F)(F)C(=O)O Amb32743174 [1,1,0,0,0,0|2,0,0]=4 363 B13R1.772 Cc1oncc1CC(C)(C)C(=O)O Amb33225132 [1,1,0,0,0,0|1,0,0]=3 364 B13R1.772 Cc1oncc1CC(C)(O)C(=O)O Amb33361377 [1,1,0,0,0,0|1,0,0]=3 365 B13R1.772 Cc1oncc1CC(F)(F)C(=O)O Amb32813949 [1,1,0,0,0,0|1,0,0]=3 366 B13R1.2801 CCc1nonc1CC(N)C(=O)O Amb18191408 [1,1,0,0,0,0|2,0,0]=4 367 B13R1.2801 CCn1cncc1CC(N)C(=O)O Amb32953896 [1,1,0,0,0,0|2,0,0]=4 368 B13R1.2801 CCn1cncc1C[C@H](N)C(=O)O Amb33952430 [1,1,0,0,0,0|2,0,0]=4 369 B13R1.2801 COc1nonc1CC(N)C(=O)O Amb18191179 [1,1,0,0,0,0|1,0,0]=3 370 B13R1.2801 COc1nscc1CC(N)C(=O)O Amb32867915 [1,1,0,0,0,0|0,1,0]=3 371 B13R1.2801 COc1nscc1CC(N)C(N)=O Amb33036998 [1,1,0,0,0,0|1,1,0]=4 372 B13R1.2801 COc1nscc1CC(O)C(=O)O Amb33353386 [1,1,0,0,0,0|1,1,0]=4 373 B13R1.2801 COc1nscc1C[C@@H](N)C(=O)O Amb33036488 [1,1,0,0,0,0|0,1,0]=3 374 B13R1.2801 COc1nscc1C[C@H](N)C(=O)O Amb33309053 [1,1,0,0,0,0|0,1,0]=3 375 B13R1.3481 Cc1cc(CC(C)C(=O)O)c(C)o1 Amb33141855 [1,1,0,0,0,0|2,0,0]=4 376 B13R1.3481 Cc1cc(CC(N)C(=O)O)c(C)o1 Amb26958505 [1,1,0,0,0,0|1,0,0]=3 377 B13R1.3481 Cc1cc(CC(N)C(=O)O)c(C)s1 Amb18995881 [1,1,0,0,0,0|1,1,0]=4 378 B13R1.3481 Cc1cc(CC(O)C(=O)O)c(C)o1 Amb33344695 [1,1,0,0,0,0|2,0,0]=4 379 B13R1.3481 Cc1cc(C[C@@H](N)C(=O)O)c(C)s1 Amb19084965 [1,1,0,0,0,0|1,1,0]=4 380 B13R1.3481 Cc1cc(C[C@H](N)C(=O)O)c(C)s1 Amb28239338 [1,1,0,0,0,0|1,1,0]=4 381 B13R1.3481 Cc1cn(CC(N)C(=O)O)c(O)n1 Amb35597108 [1,1,0,0,0,0|2,0,0]=4 382 B13R1.3481 Cc1nn(C)cc1CC(N)C(=O)O Amb18192055 [1,1,0,0,0,0|1,0,1]=4 383 B13R1.3481 Cc1nn(C)cc1CC(N)C(=O)O Amb33338908 [1,1,0,0,0,0|1,0,1]=4 384 B13R1.3481 Cc1nn(C)cc1C[C@@H](N)C(=O)O Amb26314140 [1,1,0,0,0,0|1,0,1]=4 385 B13R1.3481 Cc1nn(C)cc1C[C@H](N)C(=O)O Amb24668721 [1,1,0,0,0,0|1,0,1]=4 386 B13R1.3481 Cc1sc(Cl)cc1CC(N)C(=O)O Amb33734284 [1,1,0,0,0,0|1,1,0]=4 387 B13R1.3481 Cc1sc(Cl)cc1CC(N)C(=O)O Amb33734662 [1,1,0,0,0,0|1,1,0]=4 388 B13R1.3481 Cn1cc(C[C@@H](N)C(=O)O)c(Br)n1 Amb33127529 [1,1,0,0,0,0|2,0,0]=4 389 B13R1.3481 Cn1cc(C[C@H](N)C(=O)O)c(Br)n1 Amb33065547 [1,1,0,0,0,0|2,0,0]=4 390 B13R1.5896 Cc1c(CC(C)C(=O)O)cnn1C Amb27415852 [1,1,0,0,0,0|2,0,0]=4 391 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb28555943 [1,1,0,0,0,0|1,0,0]=3 392 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb35751801 [1,1,0,0,0,0|1,0,0]=3 393 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb6888415 [1,1,0,0,0,0|1,0,0]=3 394 B13R1.5896 Cc1c(CC(N)C(N)=O)cnn1C Amb33309200 [1,1,0,0,0,0|2,0,0]=4 395 B13R1.5896 Cc1c(CC(O)C(=O)O)cnn1C Amb32668572 [1,1,0,0,0,0|2,0,0]=4 396 B13R1.5896 Cc1c(C[C@@H](N)C(=O)O)cnn1C Amb26963466 [1,1,0,0,0,0|1,0,0]=3 397 B13R1.5896 Cc1c(C[C@H](N)C(=O)O)cnn1C Amb25044003 [1,1,0,0,0,0|1,0,0]=3 398 B13R1.5896 Cc1c(O)noc1CC(N)C(=O)O Amb2699203 [1,1,0,0,0,0|2,0,0]=4 399 B13R1.5896 Cc1c(O)noc1C[C@@H](N)C(=O)O Amb2699216 [1,1,0,0,0,0|2,0,0]=4 400 B13R1.5896 Cc1c(O)noc1C[C@H](N)C(=O)O Amb2699217 [1,1,0,0,0,0|2,0,0]=4 401 B13R1.5896 Cc1ncc(CC(N)C(=O)O)n1C Amb18823347 [1,1,0,0,0,0|2,0,0]=4 402 B13R1.5896 Cc1ncc(C[C@@H](N)C(=O)O)n1C Amb35656362 [1,1,0,0,0,0|2,0,0]=4 403 B13R1.5896 Cc1ncc(C[C@H](N)C(=O)O)n1C Amb35656363 [1,1,0,0,0,0|2,0,0]=4 404 B13R1.5896 Cc1ncn(CC(N)C(=O)O)c1C Amb18296533 [1,1,0,0,0,0|2,0,0]=4 405 B13R1.2042 COC(=O)CCc1c(C)noc1C Amb19074288 [1,1,0,0,0,0|1,0,0]=3 406 B13R1.2042 COC(=O)CCc1c(C)noc1Cl Amb11193863 [1,1,0,0,0,0|2,0,0]=4 407 B13R1.2042 COC(=O)CCc1c(C)noc1O Amb28556125 [1,1,0,0,0,0|2,0,0]=4 408 B13R1.2042 Cc1noc(C)c1CC\C(N)=N/O Amb6889926 [1,1,0,0,0,0|2,0,0]=4 409 B13R1.2042 Cc1noc(C)c1CNC(=O)CO Amb28315003 [1,1,0,0,0,0|2,0,0]=4 410 B13R1.3467 Cc1nc(O)n(CCC(=O)O)c1C Amb18191721 [1,1,0,0,0,0|2,0,0]=4 411 B13R1.3467 Cc1nn(C)c(C)c1CCC(=O)O Amb1158075 [1,1,0,0,0,0|2,0,0]=4 412 B13R1.3467 Cc1nn(C)c(C)c1CCC(=O)O Amb13948983 [1,1,0,0,0,0|2,0,0]=4 413 B13R1.3467 Cc1oc(C)c(CCC(=O)O)c1C Amb33470254 [1,1,0,0,0,0|2,0,0]=4 414 B13R1.5887 Cc1noc(C)c1C(C)CC(=O)O Amb8011501 [1,1,0,0,0,0|1,0,0]=3 415 B13R1.5887 Cc1noc(C)c1C(C)CC(N)=O Amb27218842 [1,1,0,0,0,0|2,0,0]=4 416 B13R1.5887 Cc1noc(C)c1C(N)CC(=O)O Amb25326916 [1,1,0,0,0,0|1,0,0]=3 417 B13R1.5887 Cc1noc(C)c1C(N)CC(N)=O Amb27655467 [1,1,0,0,0,0|2,0,0]=4 418 B13R1.5887 Cc1noc(C)c1C(O)CC(=O)O Amb18191433 [1,1,0,0,0,0|1,0,0]=3 419 B13R1.5887 Cc1noc(C)c1[C@@H](O)CC(=O)O Amb33418312 [1,1,0,0,0,0|1,0,0]=3 420 B13R1.5887 Cc1noc(C)c1[C@H](O)CC(=O)O Amb33418311 [1,1,0,0,0,0|1,0,0]=3 421 B13R1.8241 Cc1noc(C)c1CC(C)(N)CO Amb33326305 [1,1,0,0,0,0|1,0,1]=4 422 B13R1.3102 CCc1cnn(O)c1[C@H](N)C(=O)O Amb27461541 [0,1,0,0,1,0|2,0,0]=4 423 B13R1.3102 COc1noc(C)c1C(N)C(=O)O Amb28041928 [0,1,0,0,1,0|0,0,0]=2 424 B13R1.3488 Cc1nn(C)c(C)c1C(N)C(=O)O Amb10610113 [0,1,0,0,1,0|2,0,0]=4 425 B13R1.3488 Cc1nn(C)c(C)c1C(N)C(=O)O Amb22586995 [0,1,0,0,1,0|2,0,0]=4 426 B13R1.3488 Cc1nn(C)c(C)c1C(N)C(=O)O Amb2341433 [0,1,0,0,1,0|2,0,0]=4 427 B13R1.3488 Cc1nn(C)c(C)c1C(N)C(=O)O Amb2371217 [0,1,0,0,1,0|2,0,0]=4 428 B13R1.3488 Cc1nn(C)c(C)c1[C@@H](N)C(=O)O Amb9677507 [0,1,0,0,1,0|2,0,0]=4 429 B13R1.3488 Cc1nn(C)c(C)c1[C@H](N)C(=O)O Amb9677506 [0,1,0,0,1,0|2,0,0]=4 430 B13R1.6336 CCC(C(=O)O)c1c(C)noc1C Amb13952337 [0,1,0,0,1,0|2,0,0]=4 431 B13R1.6336 COC(C(=O)O)c1c(C)noc1C Amb28076280 [0,1,0,0,1,0|2,0,0]=4 432 B13R1.6336 Cc1noc(C)c1C(CN)C(=O)O Amb18822992 [0,1,0,0,1,0|1,0,0]=3 433 B13R1.7550 Cc1noc(C)c1C(C)(C)C(=O)O Amb25345194 [0,1,0,0,1,0|2,0,0]=4 434 B13R1.7550 Cc1noc(C)c1C(F)(F)C(=O)O Amb24663231 [0,1,0,0,1,0|2,0,0]=4 435 B13R1.7550 Cc1onc(O)c1C(C)(N)C(=O)O Amb27635203 [0,1,0,0,1,0|0,0,0]=2 436 B13R1.3887 N[C@@H](CC1=C(O)C(=O)C1=O)C(=O)O Amb27760437 [0,1,0,0,1,0|2,0,0]=4 437 B15R1.13542 CCC(SCc1c(C)noc1C)C(=O)O Amb17501357 [0,1,0,0,0,1|2,0,0]=4 438 B15R1.23307 Cc1noc(C)c1CSC(C)(C)C(=O)O Amb17501499 [0,1,0,0,0,1|2,0,0]=4 439 B15R1.3793 COc1ccc(C)cc1CC(N)C(=O)O Amb3788999 [0,1,0,0,0,1|2,0,0]=4 440 B15R1.3793 COc1ncc(Br)cc1CC(N)C(=O)O Amb33451149 [0,1,0,0,0,1|2,0,0]=4 441 B15R1.4602 COc1ccc(O)c(CC(N)C(=O)O)c1 Amb19035359 [0,1,0,0,0,1|2,0,0]=4 442 B15R1.8394 Cc1cc(O)c(CC(N)C(=O)O)cc1C Amb33172482 [0,1,0,0,0,1|2,0,0]=4 443 B15R1.8394 Cc1cc(O)c(O)cc1CC(N)C(=O)O Amb33379035 [0,1,0,0,0,1|2,0,0]=4 444 B15R1.8394 Cc1cc(O)c(O)cc1CC(N)C(=O)O Amb33379036 [0,1,0,0,0,1|2,0,0]=4 445 B15R1.8418 Cc1ccc(O)c(C(O)C(N)C(=O)O)c1 Amb33269012 [0,1,0,0,0,1|2,0,0]=4 446 B15R1.1605 COc1cccc(C)c1CC(N)C(=O)O Amb33358409 [0,1,0,0,0,1|2,0,0]=4 447 B15R1.1605 COc1cncc(Br)c1CC(N)C(=O)O Amb33478372 [0,1,0,0,0,1|2,0,0]=4 448 B15R1.3552 Cc1cc(C)c(C[C@@H](N)C(=O)O)c(O)c1 Amb24117980 [0,1,0,0,0,1|2,0,0]=4 449 B15R1.4288 CCn1nc(C)c(CC(N)C(=O)O)c1C Amb33359991 [0,2,0,0,0,0|2,0,0]=4 450 B15R1.20028 COc1c(CC(N)C(=O)O)c(C)nn1C Amb33172707 [0,2,0,0,0,0|1,0,1]=4 451 B15R1.22906 Cc1nn(C)c(C)c1C(C)C(N)C(=O)O Amb30040144 [0,2,0,0,0,0|2,0,0]=4 452 B15R1.22906 Cc1nn(C)c(C)c1C(O)C(N)C(=O)O Amb25299788 [0,2,0,0,0,0|2,0,0]=4 453 B15R1.18336 COc1nsc(OC)c1CC(O)C(=O)O Amb33353266 [0,2,0,0,0,0|1,1,0]=4 454 B15R1.60292 Cc1noc(C)c1C(C)(C)C(N)C(=O)O Amb33418317 [0,2,0,0,0,0|1,0,0]=3 455 B15R1.60292 Cc1noc(C)c1C(C)(C)C(O)C(=O)O Amb33418337 [0,2,0,0,0,0|2,0,0]=4 456 B13R1.202 Cc1cnccc1CC(N)C(=O)O Amb3788313 [0,0,1,1,0,0|2,0,0]=4 457 B13R1.202 Cc1cnccc1C[C@@H](N)C(=O)O Amb25063835 [0,0,1,1,0,0|2,0,0]=4 458 B13R1.202 Cc1cnccc1C[C@H](N)C(=O)O Amb24390165 [0,0,1,1,0,0|2,0,0]=4 459 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb25965738 [0,0,1,1,0,0|1,0,1]=4 460 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb35747686 [0,0,1,1,0,0|1,0,1]=4 461 B13R1.202 N[C@@H](Cc1cccnc1O)C(=O)O Amb27488704 [0,0,1,1,0,0|1,0,1]=4 462 B13R1.202 N[C@H](Cc1cccnc1O)C(=O)O Amb27173186 [0,0,1,1,0,0|1,0,1]=4 463 B13R2.430 O=C(O)C1CCc2occc2C1 Amb27215536 [1,0,0,1,0,0|2,0,0]=4 464 B13R2.430 O=C(O)C1Cc2ccsc2CN1 Amb26371688 [1,0,0,1,0,0|1,1,0]=4 465 B13R2.430 O=C(O)C1Cn2cnnc2CN1 Amb32667867 [1,0,0,1,0,0|2,0,0]=4 466 B13R2.430 O=C(O)C1Cn2cnnc2CN1 Amb32682059 [1,0,0,1,0,0|2,0,0]=4 467 B13R2.3437 Cc1occc1C2CC2C(=O)O Amb26527040 [1,0,0,1,0,0|2,0,0]=4 468 B13R2.3437 Cc1occc1[C@@H]2C[C@H]2C(=O)O Amb33473276 [1,0,0,1,0,0|2,0,0]=4 469 B13R2.3437 Cc1oncc1C2CC2C(=O)O Amb33361733 [1,0,0,1,0,0|1,0,0]=3 470 B13R2.3437 Cc1oncc1[C@@H]2C[C@H]2C(=O)O Amb33361701 [1,0,0,1,0,0|1,0,0]=3 471 B13R2.3749 O=C(O)C1NCC2ON=C(O)C21 Amb27253657 [0,0,0,1,1,0|0,0,2]=4 472 B13R2.3749 O=C(O)C1SCc2onc(O)c21 Amb18191150 [0,0,0,1,1,0|1,0,0]=3 473 B13R2.3749 O=C(O)[C@@H]1NC[C@H]2ON=C(O)[C@H]21 Amb27204653 [0,0,0,1,1,0|0,0,2]=4 474 B15R2.7174 O=C(O)C1Cc2cc(O)ccc2CN1 Amb2699741 [0,0,0,1,0,1|2,0,0]=4 475 B15R2.7174 O=C(O)C1Cc2cc(O)ccc2CN1 Amb2777847 [0,0,0,1,0,1|2,0,0]=4 476 B15R2.42559 Cc1cnc2c(c1)CC(N)(C(=O)O)C2 Amb18817374 [0,0,0,1,0,1|2,0,0]=4 477 B15R2.42559 N[C@@]1(C(=O)O)Cc2ccc(O)cc2C1 Amb28041885 [0,0,0,1,0,1|2,0,0]=4 478 B15R2.61353 O=C(O)[C@@H]1Cc2c(O)cccc2CN1 Amb28288363 [0,0,0,1,0,1|2,0,0]=4 479 B15R2.61376 Cc1cncc2c1CC(N)(C(=O)O)C2 Amb18817373 [0,0,0,1,0,1|2,0,0]=4 480 B15R2.49965 O=C(O)CC1CCc2onc(O)c2C1 Amb18812674 [0,0,0,1,0,1|1,0,0]=3 481 B15R2.42478 Cc1noc(C)c1CC2(C(=O)O)CC2 Amb33418304 [0,1,0,1,0,0|2,0,0]=4 482 B15R2.91531 COc1noc2c1CC(C(=O)O)NC2 Amb28323601 [0,1,0,1,0,0|0,0,0]=2 483 B11R1.89 C=C(C(=O)O)c1cnoc1C Amb33361408 [1,0,0,0,1,0|1,0,1]=4 484 B11R1.89 Cc1cnoc1C(N)C(=O)O Amb27958718 [1,0,0,0,1,0|2,0,0]=4 485 B11R1.89 Cc1cscc1C(N)C(=O)O Amb27167582 [1,0,0,0,1,0|2,0,0]=4 486 B11R1.89 Cc1nnsc1C(N)C(=O)O Amb27781742 [1,0,0,0,1,0|2,0,0]=4 487 B11R1.89 Cc1nonc1C(N)C(=O)O Amb18200036 [1,0,0,0,1,0|2,0,0]=4 488 B11R1.89 Cc1occc1C(C)C(=O)O Amb18125673 [1,0,0,0,1,0|2,0,0]=4 489 B11R1.89 Cc1occc1C(N)C(=O)O Amb28388760 [1,0,0,0,1,0|1,0,0]=3 490 B11R1.89 Cc1occc1C(O)C(=O)O Amb18200288 [1,0,0,0,1,0|2,0,0]=4 491 B11R1.89 Cc1oncc1C(=O)C(=O)O Amb18200563 [1,0,0,0,1,0|1,0,1]=4 492 B11R1.89 Cc1oncc1C(C)C(=O)O Amb33361744 [1,0,0,0,1,0|1,0,0]=3 493 B11R1.89 Cc1oncc1C(N)C(=O)O Amb33361984 [1,0,0,0,1,0|0,0,0]=2 494 B11R1.89 Cc1oncc1C(O)C(=O)O Amb33361736 [1,0,0,0,1,0|1,0,0]=3 495 B11R1.89 Cn1cncc1C(N)C(=O)O Amb26081320 [1,0,0,0,1,0|2,0,0]=4 496 B11R1.89 Cn1cncc1[C@H](N)C(=O)O Amb27776950 [1,0,0,0,1,0|2,0,0]=4 497 B11R1.89 NC(C(=O)O)c1ccoc1F Amb27164231 [1,0,0,0,1,0|2,0,0]=4 498 B11R1.89 NC(C(=O)O)c1cocc1F Amb27176306 [1,0,0,0,1,0|2,0,0]=4 499 B11R1.89 NC(C(=O)O)c1cscc1O Amb27454616 [1,0,0,0,1,0|1,1,0]=4 500 B11R1.89 N[C@@H](C(=O)O)C1=CNOC1=O Amb27642090 [1,0,0,0,1,0|1,0,1]=4 501 B11R1.89 N[C@@H](C(=O)O)c1ccnn1O Amb27398468 [1,0,0,0,1,0|2,0,0]=4 502 B11R1.89 N[C@H](C(=O)O)C1=CNOC1=O Amb25958046 [1,0,0,0,1,0|1,0,1]=4 503 B11R1.89 N[C@H](C(=O)O)c1ccnn1O Amb28312952 [1,0,0,0,1,0|2,0,0]=4 504 B11R1.89 Nc1occc1C(N)C(=O)O Amb27163509 [1,0,0,0,1,0|2,0,0]=4 505 B11R1.875 Cc1noc(C)c1C(C)C=O Amb33326308 [1,0,0,0,1,0|2,0,0]=4 506 B11R1.875 Cc1noc(C)c1C(N)CO Amb33418633 [1,0,0,0,1,0|1,0,1]=4 507 B11R1.875 Cc1noc(C)c1[C@@H](N)CO Amb33418314 [1,0,0,0,1,0|1,0,1]=4 508 B11R1.875 Cc1noc(C)c1[C@H](N)CO Amb33418315 [1,0,0,0,1,0|1,0,1]=4 509 B13R1.148 Cc1cc(CC(N)C(=O)O)ccn1 Amb18824521 [1,0,0,0,0,1|2,0,0]=4 510 B13R1.148 Cc1cc(C[C@@H](N)C(=O)O)ccn1 Amb24409497 [1,0,0,0,0,1|2,0,0]=4 511 B13R1.148 Cc1cc(C[C@H](N)C(=O)O)ccn1 Amb28316516 [1,0,0,0,0,1|2,0,0]=4 512 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb33551326 [1,0,0,0,0,1|2,0,0]=4 513 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb3788275 [1,0,0,0,0,1|2,0,0]=4 514 B13R1.148 Cc1cccc(CC(N)C(=O)O)n1 Amb3788309 [1,0,0,0,0,1|2,0,0]=4 515 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)c1 Amb8397009 [1,0,0,0,0,1|2,0,0]=4 516 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)n1 Amb25117997 [1,0,0,0,0,1|2,0,0]=4 517 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)c1 Amb8397006 [1,0,0,0,0,1|2,0,0]=4 518 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)n1 Amb27190836 [1,0,0,0,0,1|2,0,0]=4 519 B13R1.148 Cc1cncc(CC(C)C(=O)O)c1 Amb25898497 [1,0,0,0,0,1|2,0,0]=4 520 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb18193896 [1,0,0,0,0,1|1,0,0]=3 521 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb33620537 [1,0,0,0,0,1|1,0,0]=3 522 B13R1.148 Cc1cncc(CC(N)C(N)=O)c1 Amb27160949 [1,0,0,0,0,1|2,0,0]=4 523 B13R1.148 Cc1cncc(CC(O)C(=O)O)c1 Amb33318319 [1,0,0,0,0,1|2,0,0]=4 524 B13R1.148 Cc1cncc(C[C@@H](C)C(=O)O)c1 Amb33738122 [1,0,0,0,0,1|2,0,0]=4 525 B13R1.148 Cc1cncc(C[C@@H](N)C(=O)O)c1 Amb26318555 [1,0,0,0,0,1|1,0,0]=3 526 B13R1.148 Cc1cncc(C[C@H](C)C(=O)O)c1 Amb33744909 [1,0,0,0,0,1|2,0,0]=4 527 B13R1.148 Cc1cncc(C[C@H](N)C(=O)O)c1 Amb25864934 [1,0,0,0,0,1|1,0,0]=3 528 B13R1.148 Cc1nccc(C[C@@H](N)C(=O)O)n1 Amb33309118 [1,0,0,0,0,1|2,0,0]=4 529 B13R1.148 Cc1nccc(C[C@H](N)C(=O)O)n1 Amb33036772 [1,0,0,0,0,1|2,0,0]=4 530 B13R1.148 NC(Cc1cc(O)ncn1)C(=O)O Amb35747953 [1,0,0,0,0,1|2,0,0]=4 531 B13R1.148 NC(Cc1cccc(O)c1)C(=O)O Amb9727593 [1,0,0,0,0,1|2,0,0]=4 532 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb25068866 [1,0,0,0,0,1|2,0,0]=4 533 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb33734846 [1,0,0,0,0,1|2,0,0]=4 534 B13R1.148 NC(Cc1ccnc(Cl)c1)C(=O)O Amb25301408 [1,0,0,0,0,1|2,0,0]=4 535 B13R1.148 NC(Cc1ccnc(Cl)n1)C(=O)O Amb33036794 [1,0,0,0,0,1|2,0,0]=4 536 B13R1.148 NC(Cc1ccnc(O)c1)C(=O)O Amb33743902 [1,0,0,0,0,1|1,0,0]=3 537 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33733905 [1,0,0,0,0,1|1,1,0]=4 538 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33742683 [1,0,0,0,0,1|1,1,0]=4 539 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb26850411 [1,0,0,0,0,1|2,0,0]=4 540 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb33527128 [1,0,0,0,0,1|2,0,0]=4 541 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb26424973 [1,0,0,0,0,1|2,0,0]=4 542 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb33299384 [1,0,0,0,0,1|2,0,0]=4 543 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb26347287 [1,0,0,0,0,1|2,0,0]=4 544 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb33620579 [1,0,0,0,0,1|2,0,0]=4 545 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb24377085 [1,0,0,0,0,1|2,0,0]=4 546 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb33620577 [1,0,0,0,0,1|2,0,0]=4 547 B13R1.148 NC(Cc1cncc(S)c1)C(=O)O Amb35789190 [1,0,0,0,0,1|2,0,0]=4 548 B13R1.148 N[C@@H](Cc1cccc(O)c1)C(=O)O Amb6295781 [1,0,0,0,0,1|2,0,0]=4 549 B13R1.148 N[C@@H](Cc1ccnc(Cl)c1)C(=O)O Amb26988815 [1,0,0,0,0,1|2,0,0]=4 550 B13R1.148 N[C@@H](Cc1ccnc(Cl)n1)C(=O)O Amb33308876 [1,0,0,0,0,1|2,0,0]=4 551 B13R1.148 N[C@@H](Cc1ccnc(F)c1)C(=O)O Amb28076584 [1,0,0,0,0,1|2,0,0]=4 552 B13R1.148 N[C@@H](Cc1ccnc(O)c1)C(=O)O Amb27270877 [1,0,0,0,0,1|1,0,0]=3 553 B13R1.148 N[C@@H](Cc1cncc(Br)c1)C(=O)O Amb24418099 [1,0,0,0,0,1|2,0,0]=4 554 B13R1.148 N[C@@H](Cc1cncc(Cl)c1)C(=O)O Amb26855853 [1,0,0,0,0,1|2,0,0]=4 555 B13R1.148 N[C@@H](Cc1cncc(F)c1)C(=O)O Amb27609591 [1,0,0,0,0,1|2,0,0]=4 556 B13R1.148 N[C@H](Cc1cccc(O)c1)C(=O)O Amb8396995 [1,0,0,0,0,1|2,0,0]=4 557 B13R1.148 N[C@H](Cc1ccnc(Cl)c1)C(=O)O Amb27592823 [1,0,0,0,0,1|2,0,0]=4 558 B13R1.148 N[C@H](Cc1ccnc(Cl)n1)C(=O)O Amb33066258 [1,0,0,0,0,1|2,0,0]=4 559 B13R1.148 N[C@H](Cc1ccnc(F)c1)C(=O)O Amb27596543 [1,0,0,0,0,1|2,0,0]=4 560 B13R1.148 N[C@H](Cc1ccnc(O)c1)C(=O)O Amb28317768 [1,0,0,0,0,1|1,0,0]=3 561 B13R1.148 N[C@H](Cc1cncc(Br)c1)C(=O)O Amb26005016 [1,0,0,0,0,1|2,0,0]=4 562 B13R1.148 N[C@H](Cc1cncc(Cl)c1)C(=O)O Amb26867986 [1,0,0,0,0,1|2,0,0]=4 563 B13R1.148 N[C@H](Cc1cncc(F)c1)C(=O)O Amb25679683 [1,0,0,0,0,1|2,0,0]=4 564 B13R1.148 N[C@H](Cc1cncc(O)c1)C(=O)O Amb28317767 [1,0,0,0,0,1|2,0,0]=4 565 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb28316362 [1,0,0,0,0,1|2,0,0]=4 566 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb33299370 [1,0,0,0,0,1|2,0,0]=4 567 B13R1.148 Nc1cc(C[C@@H](N)C(=O)O)ccn1 Amb28365832 [1,0,0,0,0,1|2,0,0]=4 568 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb28200132 [1,0,0,0,0,1|2,0,0]=4 569 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb33741539 [1,0,0,0,0,1|2,0,0]=4 570 B13R1.148 Nc1cncc(C[C@H](N)C(=O)O)c1 Amb28456538 [1,0,0,0,0,1|2,0,0]=4 571 B13R1.148 Nc1nccc(C[C@H](N)C(=O)O)n1 Amb25966577 [1,0,0,0,0,1|2,0,0]=4 572 B13R1.169 Cc1occc1CCC(C)C(=O)O Amb33274349 [1,0,0,0,0,1|2,0,0]=4 573 B13R1.169 Cc1oncc1CCC(C)C(=O)O Amb33361145 [1,0,0,0,0,1|1,0,0]=3 574 B13R1.893 Cc1cc(CCC(=O)O)c(C)nn1 Amb23560288 [1,0,0,0,0,1|2,0,0]=4 575 B13R1.893 Cc1ccc(O)c(CCC(=O)O)c1 Amb18553089 [1,0,0,0,0,1|2,0,0]=4 576 B13R1.893 Cc1ccc(O)cc1CCC(=O)O Amb25353110 [1,0,0,0,0,1|2,0,0]=4 577 B13R1.893 Cc1cnc(N)c(CCC(=O)O)c1 Amb27772045 [1,0,0,0,0,1|2,0,0]=4 578 B13R1.893 Cc1ncc(C)c(CCC(=O)O)n1 Amb18824526 [1,0,0,0,0,1|2,0,0]=4 579 B13R1.3529 Cc1noc(C)c1CCCC(=O)O Amb33360702 [1,0,0,0,0,1|1,0,0]=3 580 B13R1.3529 Cc1noc(C)c1CSCC(=O)O Amb288492 [1,0,0,0,0,1|1,0,0]=3 581 B13R1.3787 Cc1ccnc(Cl)c1CCC(=O)O Amb27608652 [1,0,0,0,0,1|2,0,0]=4 582 B13R1.3787 Cc1ccnc(N)c1CCC(=O)O Amb28368966 [1,0,0,0,0,1|2,0,0]=4 583 B13R1.3787 Cc1ncnc(C)c1CCC(=O)O Amb18973965 [1,0,0,0,0,1|2,0,0]=4 584 B13R1.3789 Cc1ccnc(Br)c1C(N)C(=O)O Amb28368409 [0,0,0,0,1,1|2,0,0]=4 585 B13R1.3789 Cc1ccnc(Br)c1[C@H](N)C(=O)O Amb27402624 [0,0,0,0,1,1|2,0,0]=4 586 B13R1.3789 Cc1ncnc(C)c1C(N)C(=O)O Amb18193192 [0,0,0,0,1,1|2,0,0]=4 587 B13R1.3789 Cc1ncnc(O)c1C(C)C(=O)O Amb27878789 [0,0,0,0,1,1|2,0,0]=4