0 B11R1.35 C=C(C)C(N)Cn1ccnc1 Amb27455230 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.35 C=C(C)C(N)Cn1cncn1 Amb27618896 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.35 C=C(Cc1ccco1)C(=O)O Amb27985009 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.35 C=C(Cn1ccnc1)C(=O)O Amb26947670 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.35 C=C(Cn1cncn1)C(=O)O Amb27455770 [0,0,0,0,0,0|2,0,2]=4 5 B11R1.35 CC(=O)C(C)Cc1ccco1 Amb17939894 [0,0,0,0,0,0|4,0,0]=4 6 B11R1.35 CC(=O)C(C)Cc1ccns1 Amb35649986 [0,0,0,0,0,0|4,0,0]=4 7 B11R1.35 CC(=O)C(C)Cc1cnsn1 Amb28060237 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.35 CC(=O)C(C)Cc1cscn1 Amb27663866 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.35 CC(=O)C(N)Cc1cncs1 Amb18198886 [0,0,0,0,0,0|2,0,0]=2 10 B11R1.35 CC(=O)C(N)Cn1ccnc1 Amb27173747 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.35 CC(=O)N(C)Cc1cncs1 Amb27850732 [0,0,0,0,0,0|4,0,0]=4 12 B11R1.35 CC(C)C(N)Cc1cncs1 Amb18825496 [0,0,0,0,0,0|3,0,1]=4 13 B11R1.35 CC(CC1=CCCC1)C(=O)O Amb10844012 [0,0,0,0,0,0|3,0,1]=4 14 B11R1.35 CC(Cc1ccco1)C(=O)O Amb33540750 [0,0,0,0,0,0|3,0,0]=3 15 B11R1.35 CC(Cc1cccs1)C(=O)Cl Amb5744094 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.35 CC(Cc1cccs1)C(=O)O Amb5400513 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.35 CC(Cc1cccs1)C(N)=O Amb27760469 [0,0,0,0,0,0|4,0,0]=4 18 B11R1.35 CC(Cc1ccns1)C(=O)O Amb27407099 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.35 CC(Cc1ccns1)C(N)=O Amb27983712 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.35 CC(Cc1ccoc1)C(=O)O Amb26970772 [0,0,0,0,0,0|3,0,0]=3 21 B11R1.35 CC(Cc1ccon1)C(=O)O Amb33042782 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.35 CC(Cc1ccsc1)C(=O)O Amb17605844 [0,0,0,0,0,0|3,0,0]=3 23 B11R1.35 CC(Cc1ccsn1)C(=O)O Amb28385563 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.35 CC(Cc1cnco1)C(=O)O Amb33415283 [0,0,0,0,0,0|2,0,0]=2 25 B11R1.35 CC(Cc1cncs1)C(=O)O Amb26452858 [0,0,0,0,0,0|2,0,0]=2 26 B11R1.35 CC(Cc1cnsc1)C(=O)O Amb35720171 [0,0,0,0,0,0|3,0,0]=3 27 B11R1.35 CC(Cc1cscn1)C(=O)O Amb18292876 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.35 CC(Cc1csnn1)C(=O)O Amb24523177 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.35 CC(Cc1nccs1)C(=O)O Amb17334845 [0,0,0,0,0,0|3,0,1]=4 30 B11R1.35 CC(Cn1cccn1)C(=O)O Amb2569108 [0,0,0,0,0,0|3,0,1]=4 31 B11R1.35 CC(Cn1ccnc1)C(=O)O Amb2797762 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.35 CC(Cn1ccnc1)C(=O)O Amb33012366 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.35 CC(Cn1ccnc1)C(N)=O Amb27400840 [0,0,0,0,0,0|4,0,0]=4 34 B11R1.35 CC(Cn1cncn1)C(=O)O Amb1094136 [0,0,0,0,0,0|2,0,1]=3 35 B11R1.35 CC(Cn1cnnn1)C(=O)O Amb28396898 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.35 CC(Nc1cccs1)C(=O)O Amb27646118 [0,0,0,0,0,0|4,0,0]=4 37 B11R1.35 CC(Nc1cnsc1)C(=O)O Amb29860464 [0,0,0,0,0,0|4,0,0]=4 38 B11R1.35 CC(Nc1nncs1)C(=O)O Amb27852049 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.35 CC(O)C(C)Cc1cncs1 Amb25874510 [0,0,0,0,0,0|3,0,1]=4 40 B11R1.35 CC(O)C(O)Cc1cncs1 Amb27188802 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.35 CC(Sc1cccs1)C(=O)O Amb2611557 [0,0,0,0,0,0|4,0,0]=4 42 B11R1.35 CC(Sc1cnns1)C(=O)O Amb35714023 [0,0,0,0,0,0|4,0,0]=4 43 B11R1.35 CC(Sc1nnco1)C(=O)O Amb17138714 [0,0,0,0,0,0|4,0,0]=4 44 B11R1.35 CC(Sc1nncs1)C(=O)O Amb33543294 [0,0,0,0,0,0|4,0,0]=4 45 B11R1.35 CN(Cc1cncs1)C(N)=O Amb28430163 [0,0,0,0,0,0|4,0,0]=4 46 B11R1.35 C[C@H](Cc1cccs1)C(=O)O Amb10844000 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.35 C[C@H](Nc1cccs1)C(=O)O Amb10603707 [0,0,0,0,0,0|4,0,0]=4 48 B11R1.35 C[C@H](Nc1ccsc1)C(=O)O Amb17912732 [0,0,0,0,0,0|4,0,0]=4 49 B11R1.35 C[C@H](Nn1cncn1)C(=O)O Amb27867192 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.35 C\C(=C/c1cncs1)C(=O)O Amb27803283 [0,0,0,0,0,0|2,0,2]=4 51 B11R1.35 NC(=O)C(N)CC1=CCCC1 Amb28288602 [0,0,0,0,0,0|3,0,1]=4 52 B11R1.35 NC(=O)C(N)CC1=CCCO1 Amb28436452 [0,0,0,0,0,0|3,0,1]=4 53 B11R1.35 NC(=O)C(N)Cc1ccco1 Amb33066014 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.35 NC(=O)C(N)Cc1cccs1 Amb24487730 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.35 NC(=O)C(N)Cc1ccns1 Amb33036542 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.35 NC(=O)C(N)Cc1ccoc1 Amb33308808 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.35 NC(=O)C(N)Cc1ccsc1 Amb25092321 [0,0,0,0,0,0|3,0,0]=3 58 B11R1.35 NC(=O)C(N)Cc1cncs1 Amb24413255 [0,0,0,0,0,0|2,0,0]=2 59 B11R1.35 NC(=O)C(N)Cc1cnns1 Amb33036779 [0,0,0,0,0,0|3,0,0]=3 60 B11R1.35 NC(=O)C(N)Cc1cnsn1 Amb24568650 [0,0,0,0,0,0|2,0,1]=3 61 B11R1.35 NC(=O)C(N)Cc1cscn1 Amb33066289 [0,0,0,0,0,0|2,0,1]=3 62 B11R1.35 NC(=O)C(N)Cc1csnn1 Amb24431085 [0,0,0,0,0,0|3,0,1]=4 63 B11R1.35 NC(=O)C(N)Cc1nccs1 Amb24533629 [0,0,0,0,0,0|3,0,1]=4 64 B11R1.35 NC(=O)C(N)Cn1cccn1 Amb18984349 [0,0,0,0,0,0|3,0,1]=4 65 B11R1.35 NC(=O)C(N)Cn1ccnc1 Amb18293875 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.35 NC(=O)C(N)Cn1ccnn1 Amb35675540 [0,0,0,0,0,0|4,0,0]=4 67 B11R1.35 NC(=O)C(N)Cn1cncn1 Amb18294107 [0,0,0,0,0,0|2,0,1]=3 68 B11R1.35 NC(CC1=CCCC1)C(=O)O Amb2699167 [0,0,0,0,0,0|2,0,1]=3 69 B11R1.35 NC(CC1=CCCO1)C(=O)O Amb27843735 [0,0,0,0,0,0|2,0,1]=3 70 B11R1.35 NC(CC1C=NCO1)C(=O)O Amb27244846 [0,0,0,0,0,0|1,0,2]=3 71 B11R1.35 NC(CC1CC=CC1)C(=O)O Amb25893245 [0,0,0,0,0,0|2,0,2]=4 72 B11R1.35 NC(CN1CC=CC1)C(=O)O Amb27235386 [0,0,0,0,0,0|3,0,1]=4 73 B11R1.35 NC(Cc1ccco1)C(=O)O Amb9724188 [0,0,0,0,0,0|2,0,0]=2 74 B11R1.35 NC(Cc1cccs1)C(=O)O Amb9720695 [0,0,0,0,0,0|2,0,0]=2 75 B11R1.35 NC(Cc1ccno1)C(=O)O Amb25891427 [0,0,0,0,0,0|2,0,0]=2 76 B11R1.35 NC(Cc1ccno1)C(=O)O Amb28652917 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.35 NC(Cc1ccns1)C(=O)O Amb18198297 [0,0,0,0,0,0|2,0,0]=2 78 B11R1.35 NC(Cc1ccoc1)C(=O)O Amb21858415 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb2611710 [0,0,0,0,0,0|2,0,0]=2 80 B11R1.35 NC(Cc1ccsc1)C(=O)O Amb33527048 [0,0,0,0,0,0|2,0,0]=2 81 B11R1.35 NC(Cc1ccsn1)C(=O)O Amb18198296 [0,0,0,0,0,0|2,0,1]=3 82 B11R1.35 NC(Cc1cnco1)C(=O)O Amb33295162 [0,0,0,0,0,0|1,0,0]=1 83 B11R1.35 NC(Cc1cnco1)C(F)F Amb32746089 [0,0,0,0,0,0|3,0,1]=4 84 B11R1.35 NC(Cc1cncs1)C(=O)O Amb18301833 [0,0,0,0,0,0|1,0,0]=1 85 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30584636 [0,0,0,0,0,0|1,0,0]=1 86 B11R1.35 NC(Cc1cncs1)C(=O)O Amb30869600 [0,0,0,0,0,0|1,0,0]=1 87 B11R1.35 NC(Cc1cncs1)C(F)F Amb25920713 [0,0,0,0,0,0|3,0,1]=4 88 B11R1.35 NC(Cc1cnns1)C(=O)O Amb33036593 [0,0,0,0,0,0|2,0,0]=2 89 B11R1.35 NC(Cc1cnoc1)C(=O)O Amb18830802 [0,0,0,0,0,0|2,0,0]=2 90 B11R1.35 NC(Cc1cnon1)C(=O)O Amb18200030 [0,0,0,0,0,0|1,0,1]=2 91 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb24471428 [0,0,0,0,0,0|1,0,1]=2 92 B11R1.35 NC(Cc1cnsn1)C(=O)O Amb33620573 [0,0,0,0,0,0|1,0,1]=2 93 B11R1.35 NC(Cc1cocn1)C(=O)O Amb24409031 [0,0,0,0,0,0|1,0,1]=2 94 B11R1.35 NC(Cc1cocn1)C(=O)O Amb33620562 [0,0,0,0,0,0|1,0,1]=2 95 B11R1.35 NC(Cc1cscn1)C(=O)O Amb33620569 [0,0,0,0,0,0|1,0,1]=2 96 B11R1.35 NC(Cc1cscn1)C(=O)O Amb8631053 [0,0,0,0,0,0|1,0,1]=2 97 B11R1.35 NC(Cc1csnn1)C(=O)O Amb24674512 [0,0,0,0,0,0|2,0,1]=3 98 B11R1.35 NC(Cc1ncco1)C(=O)O Amb18200255 [0,0,0,0,0,0|2,0,1]=3 99 B11R1.35 NC(Cc1nccs1)C(=O)O Amb16227038 [0,0,0,0,0,0|2,0,1]=3 100 B11R1.35 NC(Cc1ncns1)C(=O)O Amb18198056 [0,0,0,0,0,0|1,0,1]=2 101 B11R1.35 NC(Cc1ncns1)C(=O)O Amb35789445 [0,0,0,0,0,0|1,0,1]=2 102 B11R1.35 NC(Cn1cccc1)C(=O)O Amb18200839 [0,0,0,0,0,0|3,0,0]=3 103 B11R1.35 NC(Cn1cccn1)C(=O)O Amb18982290 [0,0,0,0,0,0|2,0,1]=3 104 B11R1.35 NC(Cn1cccn1)C(=O)O Amb6893873 [0,0,0,0,0,0|2,0,1]=3 105 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb18294042 [0,0,0,0,0,0|2,0,0]=2 106 B11R1.35 NC(Cn1ccnc1)C(=O)O Amb32664802 [0,0,0,0,0,0|2,0,0]=2 107 B11R1.35 NC(Cn1cncn1)C(=O)O Amb18982288 [0,0,0,0,0,0|1,0,1]=2 108 B11R1.35 NC(Cn1cncn1)C(=O)O Amb32675131 [0,0,0,0,0,0|1,0,1]=2 109 B11R1.35 NC(Cn1cncn1)C(=O)O Amb6893871 [0,0,0,0,0,0|1,0,1]=2 110 B11R1.35 N[C@@H](CC1=CCCC1)C(=O)O Amb27856498 [0,0,0,0,0,0|2,0,1]=3 111 B11R1.35 N[C@@H](CC1=NC=CC1)C(=O)O Amb27947963 [0,0,0,0,0,0|1,0,2]=3 112 B11R1.35 N[C@@H](CC1=NCN=C1)C(=O)O Amb27955778 [0,0,0,0,0,0|0,0,2]=2 113 B11R1.35 N[C@@H](CC1CC=CC1)C(=O)O Amb30032914 [0,0,0,0,0,0|2,0,2]=4 114 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb10068214 [0,0,0,0,0,0|2,0,0]=2 115 B11R1.35 N[C@@H](Cc1ccco1)C(=O)O Amb31291682 [0,0,0,0,0,0|2,0,0]=2 116 B11R1.35 N[C@@H](Cc1cccs1)C(=O)O Amb10068210 [0,0,0,0,0,0|2,0,0]=2 117 B11R1.35 N[C@@H](Cc1cccs1)C(=O)O Amb22747410 [0,0,0,0,0,0|2,0,0]=2 118 B11R1.35 N[C@@H](Cc1ccno1)C(=O)O Amb25891409 [0,0,0,0,0,0|2,0,0]=2 119 B11R1.35 N[C@@H](Cc1ccns1)C(=O)O Amb29852557 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.35 N[C@@H](Cc1ccoc1)C(=O)O Amb22228970 [0,0,0,0,0,0|2,0,0]=2 121 B11R1.35 N[C@@H](Cc1ccon1)C(=O)O Amb26486882 [0,0,0,0,0,0|2,0,1]=3 122 B11R1.35 N[C@@H](Cc1ccsc1)C(=O)O Amb10068212 [0,0,0,0,0,0|2,0,0]=2 123 B11R1.35 N[C@@H](Cc1cncs1)C(=O)O Amb22745840 [0,0,0,0,0,0|1,0,0]=1 124 B11R1.35 N[C@@H](Cc1cnns1)C(=O)O Amb33066323 [0,0,0,0,0,0|2,0,0]=2 125 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb28043541 [0,0,0,0,0,0|1,0,1]=2 126 B11R1.35 N[C@@H](Cc1cnsn1)C(=O)O Amb33620574 [0,0,0,0,0,0|1,0,1]=2 127 B11R1.35 N[C@@H](Cc1cocn1)C(=O)O Amb27839934 [0,0,0,0,0,0|1,0,1]=2 128 B11R1.35 N[C@@H](Cc1cscn1)C(=O)O Amb10069175 [0,0,0,0,0,0|1,0,1]=2 129 B11R1.35 N[C@@H](Cc1csnn1)C(=O)O Amb27768430 [0,0,0,0,0,0|2,0,1]=3 130 B11R1.35 N[C@@H](Cc1nccs1)C(=O)O Amb19149166 [0,0,0,0,0,0|2,0,1]=3 131 B11R1.35 N[C@@H](Cn1cccn1)C(=O)O Amb8631343 [0,0,0,0,0,0|2,0,1]=3 132 B11R1.35 N[C@@H](Cn1cccn1)C(=O)O Amb8631344 [0,0,0,0,0,0|2,0,1]=3 133 B11R1.35 N[C@@H](Cn1cncn1)C(=O)O Amb17620828 [0,0,0,0,0,0|1,0,1]=2 134 B11R1.35 N[C@@H](Cn1cncn1)C(=O)O Amb33309636 [0,0,0,0,0,0|1,0,1]=2 135 B11R1.35 N[C@@H](Cn1ncnn1)C(=O)O Amb22351166 [0,0,0,0,0,0|2,0,1]=3 136 B11R1.35 N[C@H](CC1=CCCC1)C(=O)O Amb26402835 [0,0,0,0,0,0|2,0,1]=3 137 B11R1.35 N[C@H](CC1CC=CC1)C(=O)O Amb30032915 [0,0,0,0,0,0|2,0,2]=4 138 B11R1.35 N[C@H](CC1N=NN=N1)C(=O)O Amb27602581 [0,0,0,0,0,0|2,0,2]=4 139 B11R1.35 N[C@H](Cc1ccco1)C(=O)O Amb10068215 [0,0,0,0,0,0|2,0,0]=2 140 B11R1.35 N[C@H](Cc1cccs1)C(=O)O Amb10068211 [0,0,0,0,0,0|2,0,0]=2 141 B11R1.35 N[C@H](Cc1ccns1)C(=O)O Amb29852422 [0,0,0,0,0,0|2,0,0]=2 142 B11R1.35 N[C@H](Cc1ccoc1)C(=O)O Amb22228969 [0,0,0,0,0,0|2,0,0]=2 143 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb10068213 [0,0,0,0,0,0|2,0,0]=2 144 B11R1.35 N[C@H](Cc1ccsc1)C(=O)O Amb33725979 [0,0,0,0,0,0|2,0,0]=2 145 B11R1.35 N[C@H](Cc1cncs1)C(=O)O Amb26604609 [0,0,0,0,0,0|1,0,0]=1 146 B11R1.35 N[C@H](Cc1cnns1)C(=O)O Amb33065876 [0,0,0,0,0,0|2,0,0]=2 147 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb25260240 [0,0,0,0,0,0|1,0,1]=2 148 B11R1.35 N[C@H](Cc1cnsn1)C(=O)O Amb33620572 [0,0,0,0,0,0|1,0,1]=2 149 B11R1.35 N[C@H](Cc1cscn1)C(=O)O Amb10069174 [0,0,0,0,0,0|1,0,1]=2 150 B11R1.35 N[C@H](Cc1csnn1)C(=O)O Amb27174873 [0,0,0,0,0,0|2,0,1]=3 151 B11R1.35 N[C@H](Cn1cccn1)C(=O)O Amb27644346 [0,0,0,0,0,0|2,0,1]=3 152 B11R1.35 N[C@H](Cn1ccnc1)C(=O)O Amb25887093 [0,0,0,0,0,0|2,0,0]=2 153 B11R1.35 N[C@H](Cn1cncn1)C(=O)O Amb25843184 [0,0,0,0,0,0|1,0,1]=2 154 B11R1.35 N[C@H](Cn1cncn1)C(=O)O Amb33309641 [0,0,0,0,0,0|1,0,1]=2 155 B11R1.35 N\C(=C/c1ccns1)C(=O)O Amb27883195 [0,0,0,0,0,0|2,0,2]=4 156 B11R1.35 N\C(=C/c1cncs1)C(=O)O Amb35608674 [0,0,0,0,0,0|1,0,2]=3 157 B11R1.35 N\C(=C/c1cnsc1)C(=O)O Amb35715807 [0,0,0,0,0,0|2,0,2]=4 158 B11R1.35 N\C(=C\c1ccco1)C(=O)O Amb27493744 [0,0,0,0,0,0|2,0,2]=4 159 B11R1.35 O=C(O)C(=O)Cc1ccco1 Amb1137668 [0,0,0,0,0,0|3,0,1]=4 160 B11R1.35 O=C(O)C(=O)Cc1cccs1 Amb1135982 [0,0,0,0,0,0|3,0,1]=4 161 B11R1.35 O=C(O)C(=O)Cc1ccns1 Amb30013621 [0,0,0,0,0,0|3,0,1]=4 162 B11R1.35 O=C(O)C(=O)Cc1ccoc1 Amb26072039 [0,0,0,0,0,0|3,0,1]=4 163 B11R1.35 O=C(O)C(=O)Cc1ccsc1 Amb1133942 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.35 O=C(O)C(=O)Cc1cnco1 Amb33415275 [0,0,0,0,0,0|2,0,1]=3 165 B11R1.35 O=C(O)C(=O)Cc1cncs1 Amb27945694 [0,0,0,0,0,0|2,0,1]=3 166 B11R1.35 O=C(O)C(=O)Cc1cscn1 Amb25879054 [0,0,0,0,0,0|2,0,2]=4 167 B11R1.35 O=C(O)C(=S)Cc1ccco1 Amb4026925 [0,0,0,0,0,0|3,0,1]=4 168 B11R1.35 O=C(O)C(=S)Cc1ccsc1 Amb27407692 [0,0,0,0,0,0|3,0,1]=4 169 B11R1.35 O=C(O)C(Br)Cn1cncn1 Amb32692990 [0,0,0,0,0,0|2,0,1]=3 170 B11R1.35 O=C(O)C(Cl)Cn1cccn1 Amb28045938 [0,0,0,0,0,0|3,0,1]=4 171 B11R1.35 O=C(O)C(Cl)Cn1ccnn1 Amb35589174 [0,0,0,0,0,0|4,0,0]=4 172 B11R1.35 O=C(O)C(Cl)Cn1cncn1 Amb26421894 [0,0,0,0,0,0|2,0,1]=3 173 B11R1.35 O=C(O)C(F)Cc1ccns1 Amb35704281 [0,0,0,0,0,0|3,0,0]=3 174 B11R1.35 O=C(O)C(F)Cc1ccoc1 Amb27478909 [0,0,0,0,0,0|3,0,0]=3 175 B11R1.35 O=C(O)C(F)Cc1cncs1 Amb27627166 [0,0,0,0,0,0|2,0,0]=2 176 B11R1.35 O=C(O)C(F)Cc1csnn1 Amb27235087 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.35 O=C(O)C(F)Cn1cccc1 Amb27211041 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.35 O=C(O)C(F)Cn1cccn1 Amb27792436 [0,0,0,0,0,0|3,0,1]=4 179 B11R1.35 O=C(O)C(F)Cn1ccnc1 Amb28385128 [0,0,0,0,0,0|3,0,0]=3 180 B11R1.35 O=C(O)C(F)Cn1cnnn1 Amb27876901 [0,0,0,0,0,0|3,0,1]=4 181 B11R1.35 O=C(O)C(F)Sc1nncs1 Amb27809873 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.35 O=C(O)C(O)Cc1ccco1 Amb17138461 [0,0,0,0,0,0|3,0,0]=3 183 B11R1.35 O=C(O)C(O)Cc1cccs1 Amb17138686 [0,0,0,0,0,0|3,0,0]=3 184 B11R1.35 O=C(O)C(O)Cc1ccns1 Amb33353300 [0,0,0,0,0,0|3,0,0]=3 185 B11R1.35 O=C(O)C(O)Cc1ccoc1 Amb26952187 [0,0,0,0,0,0|3,0,0]=3 186 B11R1.35 O=C(O)C(O)Cc1ccon1 Amb33226161 [0,0,0,0,0,0|3,0,1]=4 187 B11R1.35 O=C(O)C(O)Cc1ccsc1 Amb26887594 [0,0,0,0,0,0|3,0,0]=3 188 B11R1.35 O=C(O)C(O)Cc1cnco1 Amb33226476 [0,0,0,0,0,0|2,0,0]=2 189 B11R1.35 O=C(O)C(O)Cc1cncs1 Amb25986069 [0,0,0,0,0,0|2,0,0]=2 190 B11R1.35 O=C(O)C(O)Cc1cnsc1 Amb33353410 [0,0,0,0,0,0|3,0,0]=3 191 B11R1.35 O=C(O)C(O)Cc1cscn1 Amb33353293 [0,0,0,0,0,0|2,0,1]=3 192 B11R1.35 O=C(O)C(O)Cc1csnn1 Amb28124473 [0,0,0,0,0,0|3,0,1]=4 193 B11R1.35 O=C(O)C(O)Cc1ncco1 Amb28369831 [0,0,0,0,0,0|3,0,1]=4 194 B11R1.35 O=C(O)C(O)Cc1nccs1 Amb26861593 [0,0,0,0,0,0|3,0,1]=4 195 B11R1.35 O=C(O)C(O)Cn1cccn1 Amb27785438 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.35 O=C(O)C(O)Cn1ccnc1 Amb25143971 [0,0,0,0,0,0|3,0,0]=3 197 B11R1.35 O=C(O)C(O)Cn1cncn1 Amb25078637 [0,0,0,0,0,0|2,0,1]=3 198 B11R1.35 O=C(O)C(O)Cn1cncn1 Amb30584812 [0,0,0,0,0,0|2,0,1]=3 199 B11R1.35 O=C(O)C(S)Cc1ccns1 Amb35720414 [0,0,0,0,0,0|3,0,0]=3 200 B11R1.35 O=C(O)C(S)Cc1nccs1 Amb28079481 [0,0,0,0,0,0|3,0,1]=4 201 B11R1.35 O=C(O)[C@H](O)Cc1cccs1 Amb25962724 [0,0,0,0,0,0|3,0,0]=3 202 B10R1.27 CC(C=O)Cc1cncs1 Amb35612875 [1,0,0,0,0,0|2,0,0]=3 203 B10R1.27 CC(C=O)Cc1cnsc1 Amb35716922 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.27 CC(C=O)Cc1cocn1 Amb28049871 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.27 CC(C=O)Cn1ccnc1 Amb27438609 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.27 CC(CO)Cc1cncs1 Amb27823187 [1,0,0,0,0,0|2,0,1]=4 207 B10R1.27 CN(C=O)Cc1cncs1 Amb27776157 [1,0,0,0,0,0|3,0,0]=4 208 B10R1.27 C[C@H](C=O)Cc1ccco1 Amb27861368 [1,0,0,0,0,0|3,0,0]=4 209 B10R1.27 NC(CO)Cc1ccco1 Amb17062680 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.27 NC(CO)Cc1cccs1 Amb17062681 [1,0,0,0,0,0|2,0,1]=4 211 B10R1.27 NC(CO)Cc1cccs1 Amb33330277 [1,0,0,0,0,0|2,0,1]=4 212 B10R1.27 NC(CO)Cc1ccns1 Amb28055397 [1,0,0,0,0,0|2,0,1]=4 213 B10R1.27 NC(CO)Cc1ccoc1 Amb24627260 [1,0,0,0,0,0|2,0,1]=4 214 B10R1.27 NC(CO)Cc1ccsc1 Amb27413429 [1,0,0,0,0,0|2,0,1]=4 215 B10R1.27 NC(CO)Cc1cnco1 Amb33414852 [1,0,0,0,0,0|1,0,1]=3 216 B10R1.27 NC(CO)Cc1cncs1 Amb24104437 [1,0,0,0,0,0|1,0,1]=3 217 B10R1.27 NC(CO)Cc1cncs1 Amb32663827 [1,0,0,0,0,0|1,0,1]=3 218 B10R1.27 NC(CO)Cc1cscn1 Amb24697508 [1,0,0,0,0,0|1,0,2]=4 219 B10R1.27 NC(CO)Cn1ccnc1 Amb27799379 [1,0,0,0,0,0|2,0,1]=4 220 B10R1.27 N\C(Cc1cncs1)=N/O Amb27803465 [1,0,0,0,0,0|2,0,1]=4 221 B10R1.27 O=CC(F)Cc1ccoc1 Amb27595657 [1,0,0,0,0,0|3,0,0]=4 222 B10R1.27 O=CC(O)Cc1ccco1 Amb27174865 [1,0,0,0,0,0|3,0,0]=4 223 B10R1.27 O=CC(O)Cc1ccns1 Amb35649839 [1,0,0,0,0,0|3,0,0]=4 224 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [1,0,0,0,0,0|3,0,0]=4 225 B10R1.66 CC(=O)CCc1cccs1 Amb5740049 [1,0,0,0,0,0|3,0,0]=4 226 B10R1.66 CC(=O)CCc1ccoc1 Amb27425020 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.66 CC(=O)CCc1ccsc1 Amb33532312 [1,0,0,0,0,0|3,0,0]=4 228 B10R1.66 CC(=O)CCc1cnco1 Amb18832107 [1,0,0,0,0,0|2,0,0]=3 229 B10R1.66 CC(=O)CCc1cncs1 Amb27469825 [1,0,0,0,0,0|2,0,0]=3 230 B10R1.66 CC(=O)CCc1cnsc1 Amb27855513 [1,0,0,0,0,0|3,0,0]=4 231 B10R1.66 CC(=O)CCc1cscn1 Amb25133415 [1,0,0,0,0,0|2,0,1]=4 232 B10R1.66 CC(=O)CCc1nnco1 Amb27169119 [1,0,0,0,0,0|3,0,0]=4 233 B10R1.66 CC(=O)CCn1cncn1 Amb7777315 [1,0,0,0,0,0|2,0,1]=4 234 B10R1.66 CC(=O)NCc1cncs1 Amb27955071 [1,0,0,0,0,0|3,0,0]=4 235 B10R1.66 CC(O)CCc1cnco1 Amb33414823 [1,0,0,0,0,0|2,0,1]=4 236 B10R1.66 CC(O)CCc1cncs1 Amb25700591 [1,0,0,0,0,0|2,0,1]=4 237 B10R1.66 C[C@@H](O)CCc1cnco1 Amb33414821 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.66 C[C@@H](O)CCc1cncs1 Amb33269146 [1,0,0,0,0,0|2,0,1]=4 239 B10R1.66 C[C@H](O)CCc1cnco1 Amb33414822 [1,0,0,0,0,0|2,0,1]=4 240 B10R1.66 C[C@H](O)CCc1cncs1 Amb33225052 [1,0,0,0,0,0|2,0,1]=4 241 B10R1.66 NC(=O)CCc1cncs1 Amb27881697 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.66 NC(=O)CCn1ccnc1 Amb4322794 [1,0,0,0,0,0|3,0,0]=4 243 B10R1.66 NC(=O)NCc1cncs1 Amb27954834 [1,0,0,0,0,0|3,0,0]=4 244 B10R1.66 O=C(Cl)CCc1cccs1 Amb23440823 [1,0,0,0,0,0|3,0,0]=4 245 B10R1.66 O=C(Cl)CCc1ccoc1 Amb27636729 [1,0,0,0,0,0|3,0,0]=4 246 B10R1.66 O=C(Cl)CCc1ccsc1 Amb28041943 [1,0,0,0,0,0|3,0,0]=4 247 B10R1.66 O=C(Cl)CCc1cncs1 Amb28135731 [1,0,0,0,0,0|2,0,0]=3 248 B10R1.66 O=C(Cl)OCc1cncs1 Amb33297341 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.66 O=C(O)C#Cc1cnco1 Amb33168946 [1,0,0,0,0,0|1,0,2]=4 250 B10R1.66 O=C(O)C#Cc1cncs1 Amb24537958 [1,0,0,0,0,0|1,0,2]=4 251 B10R1.66 O=C(O)CCC1=CCCC1 Amb27591549 [1,0,0,0,0,0|2,0,1]=4 252 B10R1.66 O=C(O)CCc1ccco1 Amb1153073 [1,0,0,0,0,0|2,0,0]=3 253 B10R1.66 O=C(O)CCc1cccs1 Amb1154297 [1,0,0,0,0,0|2,0,0]=3 254 B10R1.66 O=C(O)CCc1ccno1 Amb1092001 [1,0,0,0,0,0|2,0,0]=3 255 B10R1.66 O=C(O)CCc1ccns1 Amb18830640 [1,0,0,0,0,0|2,0,0]=3 256 B10R1.66 O=C(O)CCc1ccoc1 Amb18643489 [1,0,0,0,0,0|2,0,0]=3 257 B10R1.66 O=C(O)CCc1ccon1 Amb8009421 [1,0,0,0,0,0|2,0,1]=4 258 B10R1.66 O=C(O)CCc1ccsc1 Amb1153814 [1,0,0,0,0,0|2,0,0]=3 259 B10R1.66 O=C(O)CCc1ccsn1 Amb18830643 [1,0,0,0,0,0|2,0,1]=4 260 B10R1.66 O=C(O)CCc1cnco1 Amb22011672 [1,0,0,0,0,0|1,0,0]=2 261 B10R1.66 O=C(O)CCc1cncs1 Amb18830641 [1,0,0,0,0,0|1,0,0]=2 262 B10R1.66 O=C(O)CCc1cncs1 Amb32661213 [1,0,0,0,0,0|1,0,0]=2 263 B10R1.66 O=C(O)CCc1cnns1 Amb24436641 [1,0,0,0,0,0|2,0,0]=3 264 B10R1.66 O=C(O)CCc1cnoc1 Amb8009420 [1,0,0,0,0,0|2,0,0]=3 265 B10R1.66 O=C(O)CCc1cnon1 Amb18202653 [1,0,0,0,0,0|1,0,1]=3 266 B10R1.66 O=C(O)CCc1cnsc1 Amb35719984 [1,0,0,0,0,0|2,0,0]=3 267 B10R1.66 O=C(O)CCc1cocn1 Amb17399866 [1,0,0,0,0,0|1,0,1]=3 268 B10R1.66 O=C(O)CCc1cscn1 Amb33528760 [1,0,0,0,0,0|1,0,1]=3 269 B10R1.66 O=C(O)CCc1csnn1 Amb27640978 [1,0,0,0,0,0|2,0,1]=4 270 B10R1.66 O=C(O)CCc1ncco1 Amb17399867 [1,0,0,0,0,0|2,0,1]=4 271 B10R1.66 O=C(O)CCc1nccs1 Amb33528763 [1,0,0,0,0,0|2,0,1]=4 272 B10R1.66 O=C(O)CCc1ncns1 Amb18830503 [1,0,0,0,0,0|1,0,1]=3 273 B10R1.66 O=C(O)CCc1ncon1 Amb23592186 [1,0,0,0,0,0|2,0,1]=4 274 B10R1.66 O=C(O)CCc1ncsn1 Amb18830498 [1,0,0,0,0,0|2,0,1]=4 275 B10R1.66 O=C(O)CCc1nnco1 Amb17138394 [1,0,0,0,0,0|2,0,0]=3 276 B10R1.66 O=C(O)CCn1cc[nH+]c1 Amb4252703 [1,0,0,0,0,0|2,0,1]=4 277 B10R1.66 O=C(O)CCn1cccc1 Amb1130611 [1,0,0,0,0,0|3,0,0]=4 278 B10R1.66 O=C(O)CCn1cccn1 Amb1159216 [1,0,0,0,0,0|2,0,1]=4 279 B10R1.66 O=C(O)CCn1cccn1 Amb22586761 [1,0,0,0,0,0|2,0,1]=4 280 B10R1.66 O=C(O)CCn1ccnc1 Amb1159316 [1,0,0,0,0,0|2,0,0]=3 281 B10R1.66 O=C(O)CCn1ccnc1 Amb3318874 [1,0,0,0,0,0|2,0,0]=3 282 B10R1.66 O=C(O)CCn1ccnn1 Amb32758747 [1,0,0,0,0,0|3,0,0]=4 283 B10R1.66 O=C(O)CCn1ccnn1 Amb6892171 [1,0,0,0,0,0|3,0,0]=4 284 B10R1.66 O=C(O)CCn1cncn1 Amb1041440 [1,0,0,0,0,0|1,0,1]=3 285 B10R1.66 O=C(O)CCn1cnnc1 Amb17621994 [1,0,0,0,0,0|3,0,0]=4 286 B10R1.66 O=C(O)CCn1cnnc1 Amb22587401 [1,0,0,0,0,0|3,0,0]=4 287 B10R1.66 O=C(O)CCn1cnnn1 Amb1063474 [1,0,0,0,0,0|2,0,1]=4 288 B10R1.66 O=C(O)CCn1ncnn1 Amb6316136 [1,0,0,0,0,0|2,0,1]=4 289 B10R1.66 O=C(O)CNc1ccco1 Amb27846560 [1,0,0,0,0,0|3,0,0]=4 290 B10R1.66 O=C(O)CNc1cccs1 Amb26516474 [1,0,0,0,0,0|3,0,0]=4 291 B10R1.66 O=C(O)CNc1ccsc1 Amb25322129 [1,0,0,0,0,0|3,0,0]=4 292 B10R1.66 O=C(O)CNc1nncs1 Amb25737188 [1,0,0,0,0,0|3,0,0]=4 293 B10R1.66 O=C(O)COc1ccco1 Amb28050105 [1,0,0,0,0,0|3,0,0]=4 294 B10R1.66 O=C(O)COc1cccs1 Amb27233232 [1,0,0,0,0,0|3,0,0]=4 295 B10R1.66 O=C(O)COc1ccoc1 Amb33360335 [1,0,0,0,0,0|3,0,0]=4 296 B10R1.66 O=C(O)COc1ccsc1 Amb18126122 [1,0,0,0,0,0|3,0,0]=4 297 B10R1.66 O=C(O)COc1cnco1 Amb33319560 [1,0,0,0,0,0|2,0,0]=3 298 B10R1.66 O=C(O)COc1cncs1 Amb33268052 [1,0,0,0,0,0|2,0,0]=3 299 B10R1.66 O=C(O)COc1cnon1 Amb18831519 [1,0,0,0,0,0|2,0,1]=4 300 B10R1.66 O=C(O)COc1cscn1 Amb33417306 [1,0,0,0,0,0|2,0,1]=4 301 B10R1.66 O=C(O)COc1nnco1 Amb8010850 [1,0,0,0,0,0|3,0,0]=4 302 B10R1.66 O=C(O)CSc1ccco1 Amb27975289 [1,0,0,0,0,0|3,0,0]=4 303 B10R1.66 O=C(O)CSc1cccs1 Amb2796029 [1,0,0,0,0,0|3,0,0]=4 304 B10R1.66 O=C(O)CSc1ccsc1 Amb2611518 [1,0,0,0,0,0|3,0,0]=4 305 B10R1.66 O=C(O)CSc1cnns1 Amb35714022 [1,0,0,0,0,0|3,0,0]=4 306 B10R1.66 O=C(O)CSc1cnsn1 Amb27858863 [1,0,0,0,0,0|2,0,1]=4 307 B10R1.66 O=C(O)CSc1nnco1 Amb8471794 [1,0,0,0,0,0|3,0,0]=4 308 B10R1.66 O=C(O)CSc1nncs1 Amb33543061 [1,0,0,0,0,0|3,0,0]=4 309 B10R1.66 O=C(O)\C=C\c1cnco1 Amb32954265 [1,0,0,0,0,0|1,0,2]=4 310 B10R1.66 O=C(O)\C=C\c1cncs1 Amb33473685 [1,0,0,0,0,0|1,0,2]=4 311 B10R1.66 O=C([O-])CCc1cccs1 Amb33512993 [1,0,0,0,0,0|2,0,1]=4 312 B10R1.66 O=[N+]([O-])CCc1cnco1 Amb33414796 [1,0,0,0,0,0|2,0,1]=4 313 B10R1.66 O=[N+]([O-])CCc1cncs1 Amb33456690 [1,0,0,0,0,0|2,0,1]=4 314 B12R1.104 CC(=O)N(N)Cc1cnc(Cl)s1 Amb27966163 [0,1,0,0,0,0|3,0,0]=4 315 B12R1.104 CC(Cc1cc(Br)co1)C(=O)O Amb33431191 [0,1,0,0,0,0|3,0,0]=4 316 B12R1.104 CC(Cc1cc(Br)cs1)C(=O)O Amb18981859 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.104 CC(Cc1cc(Cl)cs1)C(=O)O Amb24569327 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.104 CC(Cc1ccc(Br)o1)C(=O)O Amb25297998 [0,1,0,0,0,0|3,0,0]=4 319 B12R1.104 CC(Cc1ccc(Br)s1)C(=O)O Amb18290324 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.104 CC(Cc1ccc(Cl)o1)C(=O)O Amb28142508 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.104 CC(Cc1ccc(Cl)s1)C(=O)O Amb18290306 [0,1,0,0,0,0|3,0,0]=4 322 B12R1.104 CC(Cc1cn(C)cn1)C(=O)O Amb26051636 [0,1,0,0,0,0|1,0,2]=4 323 B12R1.104 CC(Cc1cnc(Cl)s1)C(=O)O Amb26072679 [0,1,0,0,0,0|2,0,0]=3 324 B12R1.104 CC(Cc1cnn(C)c1)C(=O)O Amb18986552 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.104 CC(Cc1cnn(C)n1)C(=O)O Amb27645111 [0,1,0,0,0,0|2,0,1]=4 326 B12R1.104 CC(Cc1csc(Br)c1)C(=O)O Amb27867943 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.104 CC(Cc1csc(Br)n1)C(=O)O Amb33334938 [0,1,0,0,0,0|2,0,1]=4 328 B12R1.104 CC(Cc1csc(Cl)c1)C(=O)O Amb25032087 [0,1,0,0,0,0|3,0,0]=4 329 B12R1.104 Cc1cc(CC(C)C(=O)O)on1 Amb33327221 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.104 Cc1cc(CC(F)C(=O)O)sn1 Amb35704282 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.104 Cc1cc(CC(N)C(=O)O)co1 Amb18826155 [0,1,0,0,0,0|2,0,0]=3 332 B12R1.104 Cc1cc(CC(N)C(=O)O)no1 Amb18825740 [0,1,0,0,0,0|2,0,1]=4 333 B12R1.104 Cc1cc(CC(N)C(=O)O)on1 Amb8439770 [0,1,0,0,0,0|2,0,0]=3 334 B12R1.104 Cc1cc(CC(N)C(N)=O)cs1 Amb25884795 [0,1,0,0,0,0|3,0,0]=4 335 B12R1.104 Cc1cc(CC(O)C(=O)O)cs1 Amb28288979 [0,1,0,0,0,0|3,0,0]=4 336 B12R1.104 Cc1cc(CC(O)C(=O)O)on1 Amb33327191 [0,1,0,0,0,0|3,0,0]=4 337 B12R1.104 Cc1cc(CC(O)C(=O)O)sn1 Amb33353267 [0,1,0,0,0,0|3,0,0]=4 338 B12R1.104 Cc1cc(CC(S)C(=O)O)cs1 Amb28121769 [0,1,0,0,0,0|3,0,0]=4 339 B12R1.104 Cc1cc(CC(S)C(=O)O)sn1 Amb29856250 [0,1,0,0,0,0|3,0,0]=4 340 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)cs1 Amb24446585 [0,1,0,0,0,0|2,0,0]=3 341 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)on1 Amb30621868 [0,1,0,0,0,0|2,0,0]=3 342 B12R1.104 Cc1cc(C[C@@H](N)C(=O)O)sn1 Amb29852558 [0,1,0,0,0,0|2,0,0]=3 343 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)cs1 Amb25877757 [0,1,0,0,0,0|2,0,0]=3 344 B12R1.104 Cc1cc(C[C@H](N)C(=O)O)sn1 Amb29852559 [0,1,0,0,0,0|2,0,0]=3 345 B12R1.104 Cc1ccc(CC(C)C(=O)O)o1 Amb17605842 [0,1,0,0,0,0|3,0,0]=4 346 B12R1.104 Cc1ccc(CC(C)C(=O)O)s1 Amb17605840 [0,1,0,0,0,0|3,0,0]=4 347 B12R1.104 Cc1ccc(CC(F)C(=O)O)s1 Amb27776268 [0,1,0,0,0,0|3,0,0]=4 348 B12R1.104 Cc1ccc(CC(N)C(=O)O)o1 Amb6267158 [0,1,0,0,0,0|2,0,0]=3 349 B12R1.104 Cc1ccc(CC(N)C(=O)O)s1 Amb3788396 [0,1,0,0,0,0|2,0,0]=3 350 B12R1.104 Cc1ccc(CC(N)C(N)=O)o1 Amb33065551 [0,1,0,0,0,0|3,0,0]=4 351 B12R1.104 Cc1ccc(CC(O)C(=O)O)o1 Amb32668561 [0,1,0,0,0,0|3,0,0]=4 352 B12R1.104 Cc1ccc(CC(O)C(=O)O)s1 Amb32668563 [0,1,0,0,0,0|3,0,0]=4 353 B12R1.104 Cc1ccc(C[C@@H](N)C(=O)O)o1 Amb18801199 [0,1,0,0,0,0|2,0,0]=3 354 B12R1.104 Cc1ccc(C[C@H](N)C(=O)O)o1 Amb24380249 [0,1,0,0,0,0|2,0,0]=3 355 B12R1.104 Cc1ccn(CC(N)C(=O)O)n1 Amb27964954 [0,1,0,0,0,0|2,0,1]=4 356 B12R1.104 Cc1cnc(CC(N)C(=O)O)s1 Amb27427824 [0,1,0,0,0,0|2,0,1]=4 357 B12R1.104 Cc1cnc(C[C@@H](N)C(=O)O)s1 Amb27208416 [0,1,0,0,0,0|2,0,1]=4 358 B12R1.104 Cc1cnc(C[C@H](N)C(=O)O)s1 Amb27427822 [0,1,0,0,0,0|2,0,1]=4 359 B12R1.104 Cc1cnn(CC(N)C(=O)O)c1 Amb18984357 [0,1,0,0,0,0|2,0,1]=4 360 B12R1.104 Cc1cnn(CC(N)C(=O)O)c1 Amb33553000 [0,1,0,0,0,0|2,0,1]=4 361 B12R1.104 Cc1coc(CC(N)C(=O)O)n1 Amb18825741 [0,1,0,0,0,0|2,0,1]=4 362 B12R1.104 Cc1coc(CC(O)C(=O)O)c1 Amb33353263 [0,1,0,0,0,0|3,0,0]=4 363 B12R1.104 Cc1csc(CC(C)C(=O)O)c1 Amb18822839 [0,1,0,0,0,0|3,0,0]=4 364 B12R1.104 Cc1csc(CC(N)C(=O)O)c1 Amb18822423 [0,1,0,0,0,0|2,0,0]=3 365 B12R1.104 Cc1csc(CC(O)C(=O)O)c1 Amb33427637 [0,1,0,0,0,0|3,0,0]=4 366 B12R1.104 Cc1csc(C[C@@H](N)C(=O)O)n1 Amb24450434 [0,1,0,0,0,0|2,0,1]=4 367 B12R1.104 Cc1csc(C[C@H](N)C(=O)O)n1 Amb25770644 [0,1,0,0,0,0|2,0,1]=4 368 B12R1.104 Cc1nc(CC(C)C(=O)O)cs1 Amb26513553 [0,1,0,0,0,0|2,0,1]=4 369 B12R1.104 Cc1nc(CC(N)C(=O)O)cs1 Amb17065744 [0,1,0,0,0,0|1,0,1]=3 370 B12R1.104 Cc1nc(CC(N)C(=O)O)no1 Amb18198697 [0,1,0,0,0,0|2,0,1]=4 371 B12R1.104 Cc1nc(CC(N)C(N)=O)cs1 Amb24434791 [0,1,0,0,0,0|2,0,1]=4 372 B12R1.104 Cc1nc(CC(O)C(=O)O)cs1 Amb26910902 [0,1,0,0,0,0|2,0,1]=4 373 B12R1.104 Cc1nc(CC(S)C(=O)O)cs1 Amb27809569 [0,1,0,0,0,0|2,0,1]=4 374 B12R1.104 Cc1nc(C[C@@H](N)C(=O)O)cs1 Amb25667151 [0,1,0,0,0,0|1,0,1]=3 375 B12R1.104 Cc1nc(C[C@H](N)C(=O)O)cs1 Amb26024394 [0,1,0,0,0,0|1,0,1]=3 376 B12R1.104 Cc1ncc(CC(=O)C(=O)O)s1 Amb25714990 [0,1,0,0,0,0|2,0,1]=4 377 B12R1.104 Cc1ncc(CC(C)C(=O)O)s1 Amb18302886 [0,1,0,0,0,0|2,0,0]=3 378 B12R1.104 Cc1ncc(CC(N)C(=O)O)s1 Amb18822037 [0,1,0,0,0,0|1,0,0]=2 379 B12R1.104 Cc1ncc(CC(N)C(N)=O)s1 Amb33308601 [0,1,0,0,0,0|2,0,0]=3 380 B12R1.104 Cc1ncc(CC(O)C(=O)O)s1 Amb33353490 [0,1,0,0,0,0|2,0,0]=3 381 B12R1.104 Cc1ncc(C[C@@H](N)C(=O)O)s1 Amb27146199 [0,1,0,0,0,0|1,0,0]=2 382 B12R1.104 Cc1ncc(C[C@H](N)C(=O)O)s1 Amb24346493 [0,1,0,0,0,0|1,0,0]=2 383 B12R1.104 Cc1ncc(\C=C(\N)C(=O)O)s1 Amb35641003 [0,1,0,0,0,0|1,0,2]=4 384 B12R1.104 Cc1ncn(CC(Br)C(=O)O)n1 Amb32692991 [0,1,0,0,0,0|2,0,1]=4 385 B12R1.104 Cc1nnc(CC(C)C(=O)O)o1 Amb17400316 [0,1,0,0,0,0|3,0,0]=4 386 B12R1.104 Cc1nnc(CC(C)C(=O)O)s1 Amb35599833 [0,1,0,0,0,0|3,0,0]=4 387 B12R1.104 Cc1nnc(CC(N)C(=O)O)o1 Amb18198700 [0,1,0,0,0,0|2,0,0]=3 388 B12R1.104 Cc1nnc(CC(N)C(=O)O)s1 Amb32789409 [0,1,0,0,0,0|2,0,0]=3 389 B12R1.104 Cc1nnc(CC(N)C(=O)O)s1 Amb33330760 [0,1,0,0,0,0|2,0,0]=3 390 B12R1.104 Cc1nnc(CC(N)C(N)=O)s1 Amb33066167 [0,1,0,0,0,0|3,0,0]=4 391 B12R1.104 Cc1nnc(CC(O)C(=O)O)s1 Amb35599900 [0,1,0,0,0,0|3,0,0]=4 392 B12R1.104 Cc1nnc(C[C@@H](N)C(=O)O)s1 Amb33308661 [0,1,0,0,0,0|2,0,0]=3 393 B12R1.104 Cc1nnc(C[C@H](N)C(=O)O)o1 Amb27770913 [0,1,0,0,0,0|2,0,0]=3 394 B12R1.104 Cc1nnc(C[C@H](N)C(=O)O)s1 Amb33036441 [0,1,0,0,0,0|2,0,0]=3 395 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb19429078 [0,1,0,0,0,0|2,0,0]=3 396 B12R1.104 Cn1cc(CC(N)C(=O)O)cn1 Amb6715945 [0,1,0,0,0,0|2,0,0]=3 397 B12R1.104 Cn1cc(CC(N)C(=O)O)nn1 Amb19000860 [0,1,0,0,0,0|1,0,2]=4 398 B12R1.104 Cn1cc(CC(N)C(N)=O)cn1 Amb27168358 [0,1,0,0,0,0|3,0,0]=4 399 B12R1.104 Cn1cc(CC(O)C(=O)O)cn1 Amb27196865 [0,1,0,0,0,0|3,0,0]=4 400 B12R1.104 Cn1cc(CC(S)C(=O)O)cn1 Amb18968266 [0,1,0,0,0,0|3,0,0]=4 401 B12R1.104 Cn1cc(C[C@@H](N)C(=O)O)cn1 Amb18801206 [0,1,0,0,0,0|2,0,0]=3 402 B12R1.104 Cn1cc(C[C@@H](N)C(=O)O)nn1 Amb24699416 [0,1,0,0,0,0|1,0,2]=4 403 B12R1.104 Cn1cc(C[C@H](N)C(=O)O)cn1 Amb25740928 [0,1,0,0,0,0|2,0,0]=3 404 B12R1.104 Cn1cc(C[C@H](N)C(=O)O)nn1 Amb25737135 [0,1,0,0,0,0|1,0,2]=4 405 B12R1.104 Cn1ccc(CC(N)C(=O)O)c1 Amb18563843 [0,1,0,0,0,0|1,0,1]=3 406 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb30622858 [0,1,0,0,0,0|2,0,1]=4 407 B12R1.104 Cn1ccc(CC(N)C(=O)O)n1 Amb6890914 [0,1,0,0,0,0|2,0,1]=4 408 B12R1.104 Cn1ccc(C[C@@H](N)C(=O)O)n1 Amb28456301 [0,1,0,0,0,0|2,0,1]=4 409 B12R1.104 Cn1ccc(C[C@H](N)C(=O)O)n1 Amb28244347 [0,1,0,0,0,0|2,0,1]=4 410 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb16233066 [0,1,0,0,0,0|0,0,2]=3 411 B12R1.104 Cn1cnc(CC(N)C(=O)O)c1 Amb32651823 [0,1,0,0,0,0|0,0,2]=3 412 B12R1.104 Cn1cnc(CC(N)C(=O)O)n1 Amb18825702 [0,1,0,0,0,0|1,0,2]=4 413 B12R1.104 Cn1cnc(CC(O)C(=O)O)c1 Amb32668566 [0,1,0,0,0,0|1,0,2]=4 414 B12R1.104 Cn1cnc(CC(O)C(=O)O)c1 Amb33527780 [0,1,0,0,0,0|1,0,2]=4 415 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22747829 [0,1,0,0,0,0|0,0,2]=3 416 B12R1.104 Cn1cnc(C[C@@H](N)C(=O)O)c1 Amb22801373 [0,1,0,0,0,0|0,0,2]=3 417 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb22349466 [0,1,0,0,0,0|0,0,2]=3 418 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb2698980 [0,1,0,0,0,0|0,0,2]=3 419 B12R1.104 Cn1cnc(C[C@H](N)C(=O)O)c1 Amb8629064 [0,1,0,0,0,0|0,0,2]=3 420 B12R1.104 Cn1ncc(CC(F)C(=O)O)n1 Amb28317534 [0,1,0,0,0,0|2,0,1]=4 421 B12R1.104 Cn1ncc(CC(N)C(N)=O)n1 Amb27222188 [0,1,0,0,0,0|2,0,1]=4 422 B12R1.104 Cn1ncc(CC(O)C(=O)O)n1 Amb27144353 [0,1,0,0,0,0|2,0,1]=4 423 B12R1.104 Cn1ncc(C[C@@H](N)C(=O)O)n1 Amb25910534 [0,1,0,0,0,0|1,0,1]=3 424 B12R1.104 Cn1ncc(C[C@H](N)C(=O)O)n1 Amb24456288 [0,1,0,0,0,0|1,0,1]=3 425 B12R1.104 Cn1nnc(CC(N)C(=O)O)n1 Amb27874216 [0,1,0,0,0,0|2,0,1]=4 426 B12R1.104 Cn1nnc(C[C@@H](N)C(=O)O)n1 Amb27391747 [0,1,0,0,0,0|2,0,1]=4 427 B12R1.104 Cn1nnc(C[C@H](N)C(=O)O)n1 Amb25378201 [0,1,0,0,0,0|2,0,1]=4 428 B12R1.104 NC(=O)C(N)Cc1cc(Br)cs1 Amb24699965 [0,1,0,0,0,0|3,0,0]=4 429 B12R1.104 NC(=O)C(N)Cc1ccc(Br)o1 Amb27198829 [0,1,0,0,0,0|3,0,0]=4 430 B12R1.104 NC(=O)C(N)Cc1ccc(Br)s1 Amb26333365 [0,1,0,0,0,0|3,0,0]=4 431 B12R1.104 NC(=O)C(N)Cc1ccc(Cl)s1 Amb25793775 [0,1,0,0,0,0|3,0,0]=4 432 B12R1.104 NC(=O)C(N)Cc1coc(Br)c1 Amb26042457 [0,1,0,0,0,0|3,0,0]=4 433 B12R1.104 NC(=O)C(N)Cc1csc(Cl)c1 Amb26842308 [0,1,0,0,0,0|3,0,0]=4 434 B12R1.104 NC(=O)C(N)Cc1csc(Cl)n1 Amb33066256 [0,1,0,0,0,0|2,0,1]=4 435 B12R1.104 NC(Cc1cc(Br)co1)C(=O)O Amb26915240 [0,1,0,0,0,0|2,0,0]=3 436 B12R1.104 NC(Cc1cc(Br)cs1)C(=O)O Amb7783541 [0,1,0,0,0,0|2,0,0]=3 437 B12R1.104 NC(Cc1cc(Cl)cs1)C(=O)O Amb27803431 [0,1,0,0,0,0|2,0,0]=3 438 B12R1.104 NC(Cc1ccc(Br)o1)C(=O)O Amb6269286 [0,1,0,0,0,0|2,0,0]=3 439 B12R1.104 NC(Cc1ccc(Br)s1)C(=O)O Amb3791488 [0,1,0,0,0,0|2,0,0]=3 440 B12R1.104 NC(Cc1ccc(Cl)o1)C(=O)O Amb19000858 [0,1,0,0,0,0|2,0,0]=3 441 B12R1.104 NC(Cc1ccc(Cl)s1)C(=O)O Amb6267566 [0,1,0,0,0,0|2,0,0]=3 442 B12R1.104 NC(Cc1cnc(Br)s1)C(=O)O Amb27965453 [0,1,0,0,0,0|1,0,0]=2 443 B12R1.104 NC(Cc1cnc(Cl)s1)C(=O)O Amb25995163 [0,1,0,0,0,0|1,0,0]=2 444 B12R1.104 NC(Cc1coc(Br)c1)C(=O)O Amb25807466 [0,1,0,0,0,0|2,0,0]=3 445 B12R1.104 NC(Cc1csc(Br)c1)C(=O)O Amb26317142 [0,1,0,0,0,0|2,0,0]=3 446 B12R1.104 NC(Cc1csc(Br)n1)C(=O)O Amb33334914 [0,1,0,0,0,0|1,0,1]=3 447 B12R1.104 NC(Cc1csc(Cl)c1)C(=O)O Amb28062223 [0,1,0,0,0,0|2,0,0]=3 448 B12R1.104 NC(Cc1csc(Cl)c1)C(=O)O Amb33743920 [0,1,0,0,0,0|2,0,0]=3 449 B12R1.104 NC(Cc1csc(Cl)n1)C(=O)O Amb33308855 [0,1,0,0,0,0|1,0,1]=3 450 B12R1.104 NC(Cc1ncc(Br)s1)C(=O)O Amb33435429 [0,1,0,0,0,0|2,0,1]=4 451 B12R1.104 NC(Cc1ncc(Cl)s1)C(=O)O Amb27448242 [0,1,0,0,0,0|2,0,1]=4 452 B12R1.104 NC(Cn1cc(Br)cn1)C(=O)O Amb18984365 [0,1,0,0,0,0|2,0,1]=4 453 B12R1.104 NC(Cn1cc(Br)cn1)C(=O)O Amb24271207 [0,1,0,0,0,0|2,0,1]=4 454 B12R1.104 NC(Cn1cc(Cl)cn1)C(=O)O Amb18984361 [0,1,0,0,0,0|2,0,1]=4 455 B12R1.104 NC(Cn1cc(Cl)cn1)C(=O)O Amb24271206 [0,1,0,0,0,0|2,0,1]=4 456 B12R1.104 NC(Cn1cc(I)cn1)C(=O)O Amb25151054 [0,1,0,0,0,0|2,0,1]=4 457 B12R1.104 N[C@@H](CC1=CNC(=S)N1)C(=O)O Amb19133014 [0,1,0,0,0,0|0,0,1]=2 458 B12R1.104 N[C@@H](CC1=NC(=S)N=C1)C(=O)O Amb24401476 [0,1,0,0,0,0|0,0,1]=2 459 B12R1.104 N[C@@H](Cc1cc(Br)co1)C(=O)O Amb27778491 [0,1,0,0,0,0|2,0,0]=3 460 B12R1.104 N[C@@H](Cc1cc(Br)cs1)C(=O)O Amb27175091 [0,1,0,0,0,0|2,0,0]=3 461 B12R1.104 N[C@@H](Cc1ccc(Br)o1)C(=O)O Amb24488678 [0,1,0,0,0,0|2,0,0]=3 462 B12R1.104 N[C@@H](Cc1ccc(Br)s1)C(=O)O Amb22746252 [0,1,0,0,0,0|2,0,0]=3 463 B12R1.104 N[C@@H](Cc1ccc(Cl)o1)C(=O)O Amb27596523 [0,1,0,0,0,0|2,0,0]=3 464 B12R1.104 N[C@@H](Cc1ccc(Cl)s1)C(=O)O Amb25885904 [0,1,0,0,0,0|2,0,0]=3 465 B12R1.104 N[C@@H](Cc1coc(Br)c1)C(=O)O Amb24690262 [0,1,0,0,0,0|2,0,0]=3 466 B12R1.104 N[C@@H](Cc1csc(Cl)c1)C(=O)O Amb25138005 [0,1,0,0,0,0|2,0,0]=3 467 B12R1.104 N[C@@H](Cc1csc(Cl)n1)C(=O)O Amb33308794 [0,1,0,0,0,0|1,0,1]=3 468 B12R1.104 N[C@@H](Cc1ncc(Br)s1)C(=O)O Amb33065987 [0,1,0,0,0,0|2,0,1]=4 469 B12R1.104 N[C@@H](Cc1ncc(Cl)s1)C(=O)O Amb28206528 [0,1,0,0,0,0|2,0,1]=4 470 B12R1.104 N[C@H](CC1=CC(=O)ON1)C(=O)O Amb27869994 [0,1,0,0,0,0|2,0,0]=3 471 B12R1.104 N[C@H](CC1=CNC(=S)N1)C(=O)O Amb25827584 [0,1,0,0,0,0|0,0,1]=2 472 B12R1.104 N[C@H](CC1=NOC(=O)C1)C(=O)O Amb27614693 [0,1,0,0,0,0|3,0,0]=4 473 B12R1.104 N[C@H](Cc1cc(Br)cs1)C(=O)O Amb24431257 [0,1,0,0,0,0|2,0,0]=3 474 B12R1.104 N[C@H](Cc1ccc(Br)o1)C(=O)O Amb25791878 [0,1,0,0,0,0|2,0,0]=3 475 B12R1.104 N[C@H](Cc1ccc(Br)s1)C(=O)O Amb27425316 [0,1,0,0,0,0|2,0,0]=3 476 B12R1.104 N[C@H](Cc1ccc(Cl)s1)C(=O)O Amb24462225 [0,1,0,0,0,0|2,0,0]=3 477 B12R1.104 N[C@H](Cc1coc(Br)c1)C(=O)O Amb25986220 [0,1,0,0,0,0|2,0,0]=3 478 B12R1.104 N[C@H](Cc1csc(Cl)c1)C(=O)O Amb24735847 [0,1,0,0,0,0|2,0,0]=3 479 B12R1.104 N[C@H](Cc1csc(Cl)n1)C(=O)O Amb33308525 [0,1,0,0,0,0|1,0,1]=3 480 B12R1.104 N[C@H](Cc1ncc(Br)s1)C(=O)O Amb33065417 [0,1,0,0,0,0|2,0,1]=4 481 B12R1.104 N[C@H](Cc1ncc(Cl)s1)C(=O)O Amb28127148 [0,1,0,0,0,0|2,0,1]=4 482 B12R1.104 Nc1nc(CC(N)C(=O)O)cs1 Amb25109207 [0,1,0,0,0,0|1,0,1]=3 483 B12R1.104 Nc1nc(CC(N)C(=O)O)cs1 Amb33803281 [0,1,0,0,0,0|1,0,1]=3 484 B12R1.104 O=C(O)C(=O)Cc1cnc(Cl)s1 Amb33220950 [0,1,0,0,0,0|2,0,1]=4 485 B12R1.104 O=C(O)C(F)Cc1cc(Br)cs1 Amb27653807 [0,1,0,0,0,0|3,0,0]=4 486 B12R1.104 O=C(O)C(F)Cc1csc(Br)c1 Amb28197357 [0,1,0,0,0,0|3,0,0]=4 487 B12R1.104 O=C(O)C(O)Cc1cc(Br)co1 Amb33431513 [0,1,0,0,0,0|3,0,0]=4 488 B12R1.104 O=C(O)C(O)Cc1cc(Br)cs1 Amb26022797 [0,1,0,0,0,0|3,0,0]=4 489 B12R1.104 O=C(O)C(O)Cc1cc(Cl)cs1 Amb33353486 [0,1,0,0,0,0|3,0,0]=4 490 B12R1.104 O=C(O)C(O)Cc1ccc(Br)o1 Amb27768369 [0,1,0,0,0,0|3,0,0]=4 491 B12R1.104 O=C(O)C(O)Cc1ccc(Br)s1 Amb24376472 [0,1,0,0,0,0|3,0,0]=4 492 B12R1.104 O=C(O)C(O)Cc1ccc(Cl)o1 Amb33258328 [0,1,0,0,0,0|3,0,0]=4 493 B12R1.104 O=C(O)C(O)Cc1ccc(Cl)s1 Amb24483662 [0,1,0,0,0,0|3,0,0]=4 494 B12R1.104 O=C(O)C(O)Cc1cnc(Cl)s1 Amb33220953 [0,1,0,0,0,0|2,0,0]=3 495 B12R1.104 O=C(O)C(O)Cc1coc(Br)c1 Amb27226516 [0,1,0,0,0,0|3,0,0]=4 496 B12R1.104 O=C(O)C(O)Cc1csc(Br)c1 Amb33353269 [0,1,0,0,0,0|3,0,0]=4 497 B12R1.104 O=C(O)C(O)Cc1csc(Br)n1 Amb33334947 [0,1,0,0,0,0|2,0,1]=4 498 B12R1.108 CNC(=O)[C@H](N)Cc1ccco1 Amb28384625 [0,1,0,0,0,0|3,0,0]=4 499 B12R1.108 COC(=O)C(C)Cn1cncn1 Amb9400099 [0,1,0,0,0,0|2,0,1]=4 500 B12R1.108 COC(=O)C(N)CC1=CCCC1 Amb33309187 [0,1,0,0,0,0|2,0,1]=4 501 B12R1.108 COC(=O)C(N)Cc1ccco1 Amb33308805 [0,1,0,0,0,0|2,0,0]=3 502 B12R1.108 COC(=O)C(N)Cc1cccs1 Amb32665943 [0,1,0,0,0,0|2,0,0]=3 503 B12R1.108 COC(=O)C(N)Cc1cccs1 Amb33330278 [0,1,0,0,0,0|2,0,0]=3 504 B12R1.108 COC(=O)C(N)Cc1ccno1 Amb33726912 [0,1,0,0,0,0|2,0,0]=3 505 B12R1.108 COC(=O)C(N)Cc1ccns1 Amb33036458 [0,1,0,0,0,0|2,0,0]=3 506 B12R1.108 COC(=O)C(N)Cc1ccoc1 Amb33127528 [0,1,0,0,0,0|2,0,0]=3 507 B12R1.108 COC(=O)C(N)Cc1ccsc1 Amb33036796 [0,1,0,0,0,0|2,0,0]=3 508 B12R1.108 COC(=O)C(N)Cc1ccsc1 Amb33607446 [0,1,0,0,0,0|2,0,0]=3 509 B12R1.108 COC(=O)C(N)Cc1cncs1 Amb32670883 [0,1,0,0,0,0|1,0,0]=2 510 B12R1.108 COC(=O)C(N)Cc1cnns1 Amb33065816 [0,1,0,0,0,0|2,0,0]=3 511 B12R1.108 COC(=O)C(N)Cc1cnsn1 Amb33066097 [0,1,0,0,0,0|1,0,1]=3 512 B12R1.108 COC(=O)C(N)Cc1cscn1 Amb33309061 [0,1,0,0,0,0|1,0,1]=3 513 B12R1.108 COC(=O)C(N)Cc1csnn1 Amb33069955 [0,1,0,0,0,0|2,0,1]=4 514 B12R1.108 COC(=O)C(N)Cc1nccs1 Amb33042858 [0,1,0,0,0,0|2,0,1]=4 515 B12R1.108 COC(=O)C(N)Cn1cccc1 Amb33746606 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.108 COC(=O)C(N)Cn1cccn1 Amb18788967 [0,1,0,0,0,0|2,0,1]=4 517 B12R1.108 COC(=O)C(N)Cn1cccn1 Amb30584858 [0,1,0,0,0,0|2,0,1]=4 518 B12R1.108 COC(=O)C(N)Cn1ccnc1 Amb33553060 [0,1,0,0,0,0|2,0,0]=3 519 B12R1.108 COC(=O)C(N)Cn1ccnn1 Amb22642648 [0,1,0,0,0,0|3,0,0]=4 520 B12R1.108 COC(=O)C(N)Cn1ccnn1 Amb35745641 [0,1,0,0,0,0|3,0,0]=4 521 B12R1.108 COC(=O)C(N)Cn1cncn1 Amb18789184 [0,1,0,0,0,0|1,0,1]=3 522 B12R1.108 COC(=O)C(N)Cn1cncn1 Amb30584856 [0,1,0,0,0,0|1,0,1]=3 523 B12R1.108 COC(=O)C(O)Cc1ccco1 Amb17138659 [0,1,0,0,0,0|3,0,0]=4 524 B12R1.108 COC(=O)C(O)Cc1cccs1 Amb17139129 [0,1,0,0,0,0|3,0,0]=4 525 B12R1.108 COC(=O)C(O)Cc1ccoc1 Amb33474605 [0,1,0,0,0,0|3,0,0]=4 526 B12R1.108 COC(=O)C(O)Cc1ccsc1 Amb33448426 [0,1,0,0,0,0|3,0,0]=4 527 B12R1.108 COC(=O)C(O)Cc1cnco1 Amb33319966 [0,1,0,0,0,0|2,0,0]=3 528 B12R1.108 COC(=O)C(O)Cc1cncs1 Amb32954442 [0,1,0,0,0,0|2,0,0]=3 529 B12R1.108 COC(=O)C(O)Cc1cscn1 Amb33319263 [0,1,0,0,0,0|2,0,1]=4 530 B12R1.108 COC(=O)C([NH3+])CC1=C[NH2+]C=N1 Amb9786726 [0,1,0,0,0,0|0,0,3]=4 531 B12R1.108 COC(=O)[C@@H](N)Cc1cccs1 Amb19149172 [0,1,0,0,0,0|2,0,0]=3 532 B12R1.108 COC(=O)[C@H](N)Cc1cscn1 Amb34157789 [0,1,0,0,0,0|1,0,1]=3 533 B12R1.108 NNC(=O)C(N)Cn1ccnc1 Amb33803136 [0,1,0,0,0,0|3,0,0]=4 534 B12R1.120 CC(C(=O)O)C(C)c1ccco1 Amb18199302 [0,1,0,0,0,0|3,0,0]=4 535 B12R1.120 CC(C(=O)O)C(C)c1cccs1 Amb18822834 [0,1,0,0,0,0|3,0,0]=4 536 B12R1.120 CC(C(=O)O)C(C)c1ccsc1 Amb27615249 [0,1,0,0,0,0|3,0,0]=4 537 B12R1.120 CC(C(=O)O)C(C)c1cncs1 Amb18822430 [0,1,0,0,0,0|2,0,0]=3 538 B12R1.120 CC(C(=O)O)C(C)c1cnsc1 Amb35720173 [0,1,0,0,0,0|3,0,0]=4 539 B12R1.120 CC(C(=O)O)C(N)c1ccsc1 Amb28324127 [0,1,0,0,0,0|3,0,0]=4 540 B12R1.120 CC(C(=O)O)C(O)c1ccco1 Amb27667048 [0,1,0,0,0,0|3,0,0]=4 541 B12R1.120 CC(C(=O)O)C(O)c1cccs1 Amb18990634 [0,1,0,0,0,0|3,0,0]=4 542 B12R1.120 CC(C(=O)O)C(O)c1ccns1 Amb35704293 [0,1,0,0,0,0|3,0,0]=4 543 B12R1.120 CC(C(N)C(=O)O)n1cccn1 Amb33129054 [0,1,0,0,0,0|2,0,1]=4 544 B12R1.120 CC(C(N)C(=O)O)n1ccnc1 Amb33129053 [0,1,0,0,0,0|2,0,0]=3 545 B12R1.120 CC(C(N)C(=O)O)n1cncn1 Amb33129055 [0,1,0,0,0,0|1,0,1]=3 546 B12R1.120 CC(C(N)C(N)=O)n1ccnc1 Amb33129106 [0,1,0,0,0,0|3,0,0]=4 547 B12R1.120 CC(C(N)C(N)=O)n1cncn1 Amb33129108 [0,1,0,0,0,0|2,0,1]=4 548 B12R1.120 CC(c1ccco1)C(N)C(=O)O Amb35663086 [0,1,0,0,0,0|2,0,0]=3 549 B12R1.120 CC(c1cccs1)C(N)C(=O)O Amb35660777 [0,1,0,0,0,0|2,0,0]=3 550 B12R1.120 CC(c1ccoc1)C(N)C(=O)O Amb35663085 [0,1,0,0,0,0|2,0,0]=3 551 B12R1.120 CC(c1ccsc1)C(F)C(=O)O Amb27969593 [0,1,0,0,0,0|3,0,0]=4 552 B12R1.120 CC(c1ccsc1)C(N)C(=O)O Amb30040033 [0,1,0,0,0,0|2,0,0]=3 553 B12R1.120 CC(c1nccs1)C(N)C(=O)O Amb29892394 [0,1,0,0,0,0|2,0,1]=4 554 B12R1.120 C[C@@H](C(=O)O)[C@@H](O)c1cccs1 Amb28124104 [0,1,0,0,0,0|3,0,0]=4 555 B12R1.120 NC(C(=O)O)C(O)c1ccco1 Amb2699161 [0,1,0,0,0,0|2,0,0]=3 556 B12R1.120 NC(C(=O)O)C(O)c1cccs1 Amb18649596 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.120 NC(C(=O)O)C(O)c1ccns1 Amb35730833 [0,1,0,0,0,0|2,0,0]=3 558 B12R1.120 NC(C(=O)O)C(O)c1ccoc1 Amb24411867 [0,1,0,0,0,0|2,0,0]=3 559 B12R1.120 NC(C(=O)O)C(O)c1ccon1 Amb33198342 [0,1,0,0,0,0|2,0,1]=4 560 B12R1.120 NC(C(=O)O)C(O)c1ccsc1 Amb25273231 [0,1,0,0,0,0|2,0,0]=3 561 B12R1.120 NC(C(=O)O)C(O)c1cnco1 Amb33414853 [0,1,0,0,0,0|1,0,0]=2 562 B12R1.120 NC(C(=O)O)C(O)c1cncs1 Amb18821128 [0,1,0,0,0,0|1,0,0]=2 563 B12R1.120 NC(C(=O)O)C(O)c1cscn1 Amb26943513 [0,1,0,0,0,0|1,0,1]=3 564 B12R1.120 NC(C(=O)O)C(O)c1csnn1 Amb28120470 [0,1,0,0,0,0|2,0,1]=4 565 B12R1.120 NC(C(=O)O)C(O)c1nccs1 Amb26562085 [0,1,0,0,0,0|2,0,1]=4 566 B12R1.120 N[C@@H](C(=O)O)[C@@H](O)c1cccs1 Amb27863494 [0,1,0,0,0,0|2,0,0]=3 567 B12R1.120 N[C@@H](c1ccco1)[C@@H](O)C(=O)O Amb27209254 [0,1,0,0,0,0|3,0,0]=4 568 B12R1.120 N[C@H](C(=O)O)[C@@H](O)c1ccco1 Amb27862565 [0,1,0,0,0,0|2,0,0]=3 569 B12R1.120 N[C@H](C(=O)O)[C@@H](O)c1cccs1 Amb27444659 [0,1,0,0,0,0|2,0,0]=3 570 B12R1.120 N[C@H](C(=O)O)[C@H](O)c1cccs1 Amb27491025 [0,1,0,0,0,0|2,0,0]=3 571 B12R1.120 N[C@H](c1ccco1)[C@H](O)C(=O)O Amb27462481 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.120 N[C@H](c1cccs1)[C@H](O)C(=O)O Amb27631516 [0,1,0,0,0,0|3,0,0]=4 573 B12R1.120 O=C(O)C(F)C(O)c1ccns1 Amb35704294 [0,1,0,0,0,0|3,0,0]=4 574 B12R1.145 CC(=O)C(C)Cc1cncn1C Amb35709680 [0,1,0,0,0,0|2,0,0]=3 575 B12R1.145 CC(Cc1cccn1C)C(=O)O Amb27626329 [0,1,0,0,0,0|2,0,0]=3 576 B12R1.145 CC(Cc1ccnn1C)C(=O)O Amb27159626 [0,1,0,0,0,0|3,0,0]=4 577 B12R1.145 CC(Cc1cncn1C)C(=O)O Amb26562895 [0,1,0,0,0,0|1,0,0]=2 578 B12R1.145 CC(Cc1cnnn1C)C(=O)O Amb24643427 [0,1,0,0,0,0|2,0,0]=3 579 B12R1.145 CC(Cc1cscc1Br)C(=O)O Amb28143561 [0,1,0,0,0,0|3,0,0]=4 580 B12R1.145 CC(Cc1nccn1C)C(=O)O Amb18826685 [0,1,0,0,0,0|3,0,0]=4 581 B12R1.145 CC(Cc1ncnn1C)C(=O)O Amb27806775 [0,1,0,0,0,0|2,0,1]=4 582 B12R1.145 CC(Cc1nncn1C)C(=O)O Amb27398416 [0,1,0,0,0,0|2,0,0]=3 583 B12R1.145 CC(Cc1nnnn1C)C(=O)O Amb35632819 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.145 CC(Cc1sccc1Br)C(=O)O Amb18981853 [0,1,0,0,0,0|3,0,0]=4 585 B12R1.145 CC(Cc1sccc1Cl)C(=O)O Amb25303584 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.145 CC(O)C(C)Cc1cncn1C Amb32945956 [0,1,0,0,0,0|2,0,1]=4 587 B12R1.145 CC(O)C(O)Cc1cncn1C Amb35725019 [0,1,0,0,0,0|2,0,1]=4 588 B12R1.145 CC(Sc1nncn1C)C(=O)O Amb1140965 [0,1,0,0,0,0|3,0,0]=4 589 B12R1.145 C\C(=C/c1cncn1C)C(=O)O Amb27784756 [0,1,0,0,0,0|1,0,2]=4 590 B12R1.145 Cc1cccn1CC(N)C(=O)O Amb18826692 [0,1,0,0,0,0|3,0,0]=4 591 B12R1.145 Cc1ccnn1CC(N)C(=O)O Amb25724699 [0,1,0,0,0,0|2,0,1]=4 592 B12R1.145 Cc1ccoc1CC(C)C(=O)O Amb25304965 [0,1,0,0,0,0|3,0,0]=4 593 B12R1.145 Cc1ccoc1CC(N)C(=O)O Amb18826171 [0,1,0,0,0,0|2,0,0]=3 594 B12R1.145 Cc1ccoc1CC(O)C(=O)O Amb33353274 [0,1,0,0,0,0|3,0,0]=4 595 B12R1.145 Cc1ccsc1CC(C)C(=O)O Amb27159627 [0,1,0,0,0,0|3,0,0]=4 596 B12R1.145 Cc1ccsc1CC(F)C(=O)O Amb28430315 [0,1,0,0,0,0|3,0,0]=4 597 B12R1.145 Cc1ccsc1CC(N)C(=O)O Amb3788399 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.145 Cc1ccsc1CC(O)C(=O)O Amb32668562 [0,1,0,0,0,0|3,0,0]=4 599 B12R1.145 Cc1ccsc1C[C@@H](N)C(=O)O Amb19069332 [0,1,0,0,0,0|2,0,0]=3 600 B12R1.145 Cc1ccsc1C[C@H](N)C(=O)O Amb26450865 [0,1,0,0,0,0|2,0,0]=3 601 B12R1.145 Cc1cocc1CC(N)C(=O)O Amb18826156 [0,1,0,0,0,0|2,0,0]=3 602 B12R1.145 Cc1cscc1CC(C)C(=O)O Amb33147698 [0,1,0,0,0,0|3,0,0]=4 603 B12R1.145 Cc1cscc1CC(N)C(=O)O Amb33065909 [0,1,0,0,0,0|2,0,0]=3 604 B12R1.145 Cc1cscc1CC(N)C(N)=O Amb33308554 [0,1,0,0,0,0|3,0,0]=4 605 B12R1.145 Cc1cscc1CC(O)C(=O)O Amb33146697 [0,1,0,0,0,0|3,0,0]=4 606 B12R1.145 Cc1cscc1C[C@@H](N)C(=O)O Amb33036557 [0,1,0,0,0,0|2,0,0]=3 607 B12R1.145 Cc1cscc1C[C@H](N)C(=O)O Amb33065918 [0,1,0,0,0,0|2,0,0]=3 608 B12R1.145 Cc1nccn1CC(C)C(=O)O Amb2504508 [0,1,0,0,0,0|3,0,0]=4 609 B12R1.145 Cc1nccn1CC(C)C(=O)O Amb9677400 [0,1,0,0,0,0|3,0,0]=4 610 B12R1.145 Cc1nccn1CC(F)C(=O)O Amb27842404 [0,1,0,0,0,0|3,0,0]=4 611 B12R1.145 Cc1nccn1CC(N)C(=O)O Amb18294531 [0,1,0,0,0,0|2,0,0]=3 612 B12R1.145 Cc1nccn1CC(N)C(N)=O Amb18984342 [0,1,0,0,0,0|3,0,0]=4 613 B12R1.145 Cc1ncsc1CC(=O)C(=O)O Amb32877657 [0,1,0,0,0,0|2,0,1]=4 614 B12R1.145 Cc1ncsc1CC(C)C(=O)O Amb25213367 [0,1,0,0,0,0|2,0,0]=3 615 B12R1.145 Cc1ncsc1CC(F)C(=O)O Amb27206734 [0,1,0,0,0,0|2,0,0]=3 616 B12R1.145 Cc1ncsc1CC(N)C(=O)O Amb18822033 [0,1,0,0,0,0|1,0,0]=2 617 B12R1.145 Cc1ncsc1CC(O)C(=O)O Amb33353370 [0,1,0,0,0,0|2,0,0]=3 618 B12R1.145 Cc1ncsc1C[C@@H](N)C(=O)O Amb28396540 [0,1,0,0,0,0|1,0,0]=2 619 B12R1.145 Cc1ncsc1\C=C(\N)C(=O)O Amb35608671 [0,1,0,0,0,0|1,0,2]=4 620 B12R1.145 Cc1nnsc1CC(C)C(=O)O Amb27983370 [0,1,0,0,0,0|3,0,0]=4 621 B12R1.145 Cc1nnsc1CC(N)C(N)=O Amb33127553 [0,1,0,0,0,0|3,0,0]=4 622 B12R1.145 Cc1nnsc1CC(O)C(=O)O Amb33353275 [0,1,0,0,0,0|3,0,0]=4 623 B12R1.145 Cc1nnsc1C[C@@H](N)C(=O)O Amb27877967 [0,1,0,0,0,0|2,0,0]=3 624 B12R1.145 Cc1nnsc1C[C@H](N)C(=O)O Amb26980262 [0,1,0,0,0,0|2,0,0]=3 625 B12R1.145 Cc1nonc1CC(N)C(=O)O Amb10610297 [0,1,0,0,0,0|1,0,1]=3 626 B12R1.145 Cc1nonc1CC(N)C(=O)O Amb5722544 [0,1,0,0,0,0|1,0,1]=3 627 B12R1.145 Cc1occc1CC(C)C(=O)O Amb27233805 [0,1,0,0,0,0|3,0,0]=4 628 B12R1.145 Cc1occc1CC(N)C(=O)O Amb26526981 [0,1,0,0,0,0|2,0,0]=3 629 B12R1.145 Cc1occc1CC(O)C(=O)O Amb32668569 [0,1,0,0,0,0|3,0,0]=4 630 B12R1.145 Cc1oncc1CC(C)C(=O)O Amb33361742 [0,1,0,0,0,0|3,0,0]=4 631 B12R1.145 Cc1oncc1CC(N)C(=O)O Amb18825754 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.145 Cc1oncc1CC(O)C(=O)O Amb33361702 [0,1,0,0,0,0|3,0,0]=4 633 B12R1.145 Cc1sccc1CC(O)C(=O)O Amb33353289 [0,1,0,0,0,0|3,0,0]=4 634 B12R1.145 Cc1sccc1C[C@@H](N)C(=O)O Amb27482297 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.145 Cn1cccc1CC(=O)C(=O)O Amb33315162 [0,1,0,0,0,0|2,0,1]=4 636 B12R1.145 Cn1cccc1CC(F)C(=O)O Amb28142519 [0,1,0,0,0,0|2,0,0]=3 637 B12R1.145 Cn1cccc1CC(N)C(=O)O Amb7796010 [0,1,0,0,0,0|1,0,0]=2 638 B12R1.145 Cn1cccc1CC(O)C(=O)O Amb33315155 [0,1,0,0,0,0|2,0,0]=3 639 B12R1.145 Cn1cccc1C[C@H](N)C(=O)O Amb28248841 [0,1,0,0,0,0|1,0,0]=2 640 B12R1.145 Cn1ccnc1CC(N)C(=O)O Amb18302430 [0,1,0,0,0,0|2,0,0]=3 641 B12R1.145 Cn1ccnc1CC(N)C(N)=O Amb33036535 [0,1,0,0,0,0|3,0,0]=4 642 B12R1.145 Cn1ccnc1CC(O)C(=O)O Amb26372150 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.145 Cn1ccnc1CC(S)C(=O)O Amb27184841 [0,1,0,0,0,0|3,0,0]=4 644 B12R1.145 Cn1ccnc1C[C@@H](N)C(=O)O Amb32788599 [0,1,0,0,0,0|2,0,0]=3 645 B12R1.145 Cn1ccnc1C[C@H](N)C(=O)O Amb33037063 [0,1,0,0,0,0|2,0,0]=3 646 B12R1.145 Cn1cncc1CC(=O)C(=O)O Amb26981696 [0,1,0,0,0,0|1,0,1]=3 647 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb18647156 [0,1,0,0,0,0|0,0,0]=1 648 B12R1.145 Cn1cncc1CC(N)C(=O)O Amb31291637 [0,1,0,0,0,0|0,0,0]=1 649 B12R1.145 Cn1cncc1CC(N)C(F)F Amb33403829 [0,1,0,0,0,0|2,0,1]=4 650 B12R1.145 Cn1cncc1CC(N)C(N)=O Amb33308697 [0,1,0,0,0,0|1,0,0]=2 651 B12R1.145 Cn1cncc1CC(O)C(=O)O Amb33353390 [0,1,0,0,0,0|1,0,0]=2 652 B12R1.145 Cn1cncc1C[C@@H](N)C(=O)O Amb2699163 [0,1,0,0,0,0|0,0,0]=1 653 B12R1.145 Cn1cncc1C[C@H](N)C(=O)O Amb6600147 [0,1,0,0,0,0|0,0,0]=1 654 B12R1.145 Cn1cncc1\C=C(\N)C(=O)O Amb35601938 [0,1,0,0,0,0|0,0,2]=3 655 B12R1.145 Cn1cnnc1CC(N)C(=O)O Amb18825703 [0,1,0,0,0,0|1,0,0]=2 656 B12R1.145 Cn1cnnc1CC(N)C(N)=O Amb33309046 [0,1,0,0,0,0|2,0,0]=3 657 B12R1.145 Cn1cnnc1C[C@@H](N)C(=O)O Amb33308742 [0,1,0,0,0,0|1,0,0]=2 658 B12R1.145 Cn1cnnc1C[C@H](N)C(=O)O Amb33308885 [0,1,0,0,0,0|1,0,0]=2 659 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb35788785 [0,1,0,0,0,0|2,0,0]=3 660 B12R1.145 Cn1nccc1CC(N)C(=O)O Amb9777886 [0,1,0,0,0,0|2,0,0]=3 661 B12R1.145 Cn1nccc1CC(O)C(=O)O Amb26640716 [0,1,0,0,0,0|3,0,0]=4 662 B12R1.145 Cn1nccc1CC(S)C(=O)O Amb27197536 [0,1,0,0,0,0|3,0,0]=4 663 B12R1.145 Cn1nccc1C[C@@H](N)C(=O)O Amb35733298 [0,1,0,0,0,0|2,0,0]=3 664 B12R1.145 Cn1ncnc1CC(N)C(=O)O Amb18825704 [0,1,0,0,0,0|1,0,1]=3 665 B12R1.145 Cn1ncnc1CC(N)C(N)=O Amb25886606 [0,1,0,0,0,0|2,0,1]=4 666 B12R1.145 Cn1ncnc1C[C@@H](N)C(=O)O Amb25366880 [0,1,0,0,0,0|1,0,1]=3 667 B12R1.145 Cn1ncnc1C[C@H](N)C(=O)O Amb27391256 [0,1,0,0,0,0|1,0,1]=3 668 B12R1.145 Cn1nncc1CC(=O)C(=O)O Amb24650147 [0,1,0,0,0,0|2,0,1]=4 669 B12R1.145 Cn1nncc1CC(F)C(=O)O Amb27966893 [0,1,0,0,0,0|2,0,0]=3 670 B12R1.145 Cn1nncc1CC(N)C(=O)O Amb26041711 [0,1,0,0,0,0|1,0,0]=2 671 B12R1.145 Cn1nncc1CC(O)C(=O)O Amb32668570 [0,1,0,0,0,0|2,0,0]=3 672 B12R1.145 Cn1nncc1CC(S)C(=O)O Amb28384180 [0,1,0,0,0,0|2,0,0]=3 673 B12R1.145 Cn1nncc1C[C@@H](N)C(=O)O Amb35580808 [0,1,0,0,0,0|1,0,0]=2 674 B12R1.145 Cn1nncc1C[C@H](N)C(=O)O Amb35580809 [0,1,0,0,0,0|1,0,0]=2 675 B12R1.145 Cn1nnnc1CC(N)C(=O)O Amb33066002 [0,1,0,0,0,0|2,0,0]=3 676 B12R1.145 Cn1nnnc1CC(N)C(N)=O Amb33066132 [0,1,0,0,0,0|3,0,0]=4 677 B12R1.145 Cn1nnnc1C[C@@H](N)C(=O)O Amb33066222 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.145 Cn1nnnc1C[C@H](N)C(=O)O Amb33036709 [0,1,0,0,0,0|2,0,0]=3 679 B12R1.145 NC(=O)C(N)Cc1ccsc1Br Amb25181478 [0,1,0,0,0,0|3,0,0]=4 680 B12R1.145 NC(=O)C(N)Cc1ccsc1Cl Amb33309234 [0,1,0,0,0,0|3,0,0]=4 681 B12R1.145 NC(=O)C(N)Cc1ncsc1Cl Amb33309131 [0,1,0,0,0,0|2,0,1]=4 682 B12R1.145 NC(=O)C(N)Cc1sccc1Br Amb25131511 [0,1,0,0,0,0|3,0,0]=4 683 B12R1.145 NC(=O)C(N)Cc1sccc1Cl Amb25738868 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.145 NC(=O)C(N)Cc1scnc1Cl Amb33036751 [0,1,0,0,0,0|2,0,0]=3 685 B12R1.145 NC(=O)C(N)Cc1sncc1Br Amb33127580 [0,1,0,0,0,0|3,0,0]=4 686 B12R1.145 NC(CC1=NSNC1=O)C(=O)O Amb24365948 [0,1,0,0,0,0|1,0,2]=4 687 B12R1.145 NC(Cc1ccnn1O)C(=O)O Amb27602908 [0,1,0,0,0,0|2,0,0]=3 688 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb25795560 [0,1,0,0,0,0|2,0,0]=3 689 B12R1.145 NC(Cc1ccsc1Br)C(=O)O Amb33743565 [0,1,0,0,0,0|2,0,0]=3 690 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb24399335 [0,1,0,0,0,0|2,0,0]=3 691 B12R1.145 NC(Cc1ccsc1Cl)C(=O)O Amb33299257 [0,1,0,0,0,0|2,0,0]=3 692 B12R1.145 NC(Cc1cncn1O)C(=O)O Amb27214198 [0,1,0,0,0,0|0,0,0]=1 693 B12R1.145 NC(Cc1conc1O)C(=O)O Amb26032245 [0,1,0,0,0,0|2,0,0]=3 694 B12R1.145 NC(Cc1cscc1Br)C(=O)O Amb27642505 [0,1,0,0,0,0|2,0,0]=3 695 B12R1.145 NC(Cc1ncsc1Cl)C(=O)O Amb33036885 [0,1,0,0,0,0|1,0,1]=3 696 B12R1.145 NC(Cc1ncsc1Cl)C(=O)O Amb33803973 [0,1,0,0,0,0|1,0,1]=3 697 B12R1.145 NC(Cc1nonc1O)C(=O)O Amb28342262 [0,1,0,0,0,0|1,0,1]=3 698 B12R1.145 NC(Cc1occc1Br)C(=O)O Amb28456942 [0,1,0,0,0,0|2,0,0]=3 699 B12R1.145 NC(Cc1sccc1Br)C(=O)O Amb27410749 [0,1,0,0,0,0|2,0,0]=3 700 B12R1.145 NC(Cc1sccc1Cl)C(=O)O Amb28132824 [0,1,0,0,0,0|2,0,0]=3 701 B12R1.145 N[C@@H](CC1=NSNC1=O)C(=O)O Amb27409051 [0,1,0,0,0,0|1,0,2]=4 702 B12R1.145 N[C@@H](CC1CC=CC1=O)C(=O)O Amb27975228 [0,1,0,0,0,0|2,0,1]=4 703 B12R1.145 N[C@@H](Cc1ccsc1Br)C(=O)O Amb25335861 [0,1,0,0,0,0|2,0,0]=3 704 B12R1.145 N[C@@H](Cc1ccsc1Cl)C(=O)O Amb24350624 [0,1,0,0,0,0|2,0,0]=3 705 B12R1.145 N[C@@H](Cc1ncsc1Cl)C(=O)O Amb33065882 [0,1,0,0,0,0|1,0,1]=3 706 B12R1.145 N[C@@H](Cc1nonc1O)C(=O)O Amb27666914 [0,1,0,0,0,0|1,0,1]=3 707 B12R1.145 N[C@@H](Cc1sccc1Br)C(=O)O Amb24615699 [0,1,0,0,0,0|2,0,0]=3 708 B12R1.145 N[C@@H](Cc1sccc1Cl)C(=O)O Amb25267667 [0,1,0,0,0,0|2,0,0]=3 709 B12R1.145 N[C@@H](Cc1scnc1Cl)C(=O)O Amb33036143 [0,1,0,0,0,0|1,0,0]=2 710 B12R1.145 N[C@@H](Cc1sncc1Br)C(=O)O Amb33037097 [0,1,0,0,0,0|2,0,0]=3 711 B12R1.145 N[C@H](Cc1ccsc1Br)C(=O)O Amb24600296 [0,1,0,0,0,0|2,0,0]=3 712 B12R1.145 N[C@H](Cc1ccsc1Cl)C(=O)O Amb28186495 [0,1,0,0,0,0|2,0,0]=3 713 B12R1.145 N[C@H](Cc1ncsc1Cl)C(=O)O Amb33308574 [0,1,0,0,0,0|1,0,1]=3 714 B12R1.145 N[C@H](Cc1sccc1Br)C(=O)O Amb26976119 [0,1,0,0,0,0|2,0,0]=3 715 B12R1.145 N[C@H](Cc1sccc1Cl)C(=O)O Amb28123220 [0,1,0,0,0,0|2,0,0]=3 716 B12R1.145 N[C@H](Cc1scnc1Cl)C(=O)O Amb33065656 [0,1,0,0,0,0|1,0,0]=2 717 B12R1.145 N[C@H](Cc1sncc1Br)C(=O)O Amb32867931 [0,1,0,0,0,0|2,0,0]=3 718 B12R1.145 O=C(O)C(F)Cc1ccsc1Cl Amb27845252 [0,1,0,0,0,0|3,0,0]=4 719 B12R1.145 O=C(O)C(F)Cc1cscc1Br Amb27867945 [0,1,0,0,0,0|3,0,0]=4 720 B12R1.145 O=C(O)C(F)Cc1occc1Br Amb27780216 [0,1,0,0,0,0|3,0,0]=4 721 B12R1.145 O=C(O)C(O)Cc1ccsc1Br Amb27657975 [0,1,0,0,0,0|3,0,0]=4 722 B12R1.145 O=C(O)C(O)Cc1ccsc1Cl Amb33353362 [0,1,0,0,0,0|3,0,0]=4 723 B12R1.145 O=C(O)C(O)Cc1cscc1Br Amb33353261 [0,1,0,0,0,0|3,0,0]=4 724 B12R1.145 O=C(O)C(O)Cc1cscc1Cl Amb33353478 [0,1,0,0,0,0|3,0,0]=4 725 B12R1.145 O=C(O)C(O)Cc1occc1Br Amb33353341 [0,1,0,0,0,0|3,0,0]=4 726 B12R1.145 O=C(O)C(O)Cc1sccc1Br Amb25071900 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.145 O=C(O)C(O)Cc1sccc1Cl Amb26923733 [0,1,0,0,0,0|3,0,0]=4 728 B12R1.145 O=C(O)C(O)Cc1scnc1Cl Amb33353330 [0,1,0,0,0,0|2,0,0]=3 729 B12R1.145 O=C(O)C(O)Cc1sncc1Br Amb33353354 [0,1,0,0,0,0|3,0,0]=4 730 B12R1.298 CCC(Cc1ccco1)C(=O)O Amb5744031 [0,1,0,0,0,0|3,0,0]=4 731 B12R1.298 CCC(Cc1cccs1)C(=O)O Amb5744032 [0,1,0,0,0,0|3,0,0]=4 732 B12R1.298 CCC(Cc1ccsc1)C(=O)O Amb17605845 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.298 CNC(Cn1cccn1)C(=O)O Amb18788966 [0,1,0,0,0,0|2,0,1]=4 734 B12R1.298 CNC(Cn1ccnc1)C(=O)O Amb18788964 [0,1,0,0,0,0|2,0,0]=3 735 B12R1.298 CNC(Cn1ccnc1)C(N)=O Amb18788802 [0,1,0,0,0,0|3,0,0]=4 736 B12R1.298 CNC(Cn1cncn1)C(=O)O Amb18789183 [0,1,0,0,0,0|1,0,1]=3 737 B12R1.298 CNC(Cn1cncn1)C(N)=O Amb18788976 [0,1,0,0,0,0|2,0,1]=4 738 B12R1.298 COC(Cc1ccco1)C(=O)O Amb33360945 [0,1,0,0,0,0|3,0,0]=4 739 B12R1.298 COC(Cc1cccs1)C(=O)O Amb33361315 [0,1,0,0,0,0|3,0,0]=4 740 B12R1.298 COC(Cc1ccoc1)C(=O)O Amb33360377 [0,1,0,0,0,0|3,0,0]=4 741 B12R1.298 COC(Cc1ccsc1)C(=O)O Amb33428907 [0,1,0,0,0,0|3,0,0]=4 742 B12R1.298 COC(Cc1cnco1)C(=O)O Amb33319959 [0,1,0,0,0,0|2,0,0]=3 743 B12R1.298 COC(Cc1cncs1)C(=O)O Amb33268778 [0,1,0,0,0,0|2,0,0]=3 744 B12R1.298 COC(Cc1cscn1)C(=O)O Amb33417835 [0,1,0,0,0,0|2,0,1]=4 745 B12R1.298 N#CC(Cc1ccco1)C(=O)O Amb17090105 [0,1,0,0,0,0|2,0,1]=4 746 B12R1.298 N#CC(Cc1cccs1)C(=O)O Amb17090106 [0,1,0,0,0,0|2,0,1]=4 747 B12R1.298 N#CC(Cc1ccns1)C(=O)O Amb35621331 [0,1,0,0,0,0|2,0,1]=4 748 B12R1.298 N#CC(Cc1ccoc1)C(=O)O Amb35584079 [0,1,0,0,0,0|2,0,1]=4 749 B12R1.298 N#CC(Cc1ccsc1)C(=O)O Amb35584086 [0,1,0,0,0,0|2,0,1]=4 750 B12R1.298 N#CC(Cc1cncs1)C(=O)O Amb35584087 [0,1,0,0,0,0|1,0,1]=3 751 B12R1.298 N#CC(Cc1cnns1)C(=O)O Amb35584090 [0,1,0,0,0,0|2,0,1]=4 752 B12R1.298 N#CC(Cc1cnsn1)C(=O)O Amb29875747 [0,1,0,0,0,0|1,0,2]=4 753 B12R1.298 N#CC(Cc1cscn1)C(=O)O Amb35584088 [0,1,0,0,0,0|1,0,2]=4 754 B12R1.298 NCC(Cc1ccco1)C(=O)O Amb5744246 [0,1,0,0,0,0|2,0,0]=3 755 B12R1.298 NCC(Cc1ccco1)C(N)=O Amb9211714 [0,1,0,0,0,0|3,0,0]=4 756 B12R1.298 NCC(Cc1cccs1)C(=O)O Amb28555777 [0,1,0,0,0,0|2,0,0]=3 757 B12R1.298 NCC(Cc1cccs1)C(=O)O Amb5744247 [0,1,0,0,0,0|2,0,0]=3 758 B12R1.298 NCC(Nc1ccsc1)C(=O)O Amb28124232 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.1373 CC(C)(Cc1ccco1)C(=O)O Amb18303224 [0,1,0,0,0,0|3,0,0]=4 760 B12R1.1373 CC(C)(Cc1cccs1)C(=O)O Amb18999501 [0,1,0,0,0,0|3,0,0]=4 761 B12R1.1373 CC(C)(Cc1ccns1)C(=O)O Amb35651444 [0,1,0,0,0,0|3,0,0]=4 762 B12R1.1373 CC(C)(Cc1ccoc1)C(=O)O Amb25336532 [0,1,0,0,0,0|3,0,0]=4 763 B12R1.1373 CC(C)(Cc1ccsc1)C(=O)O Amb18302688 [0,1,0,0,0,0|3,0,0]=4 764 B12R1.1373 CC(C)(Cc1cnco1)C(=O)O Amb33414833 [0,1,0,0,0,0|2,0,0]=3 765 B12R1.1373 CC(C)(Cc1cncs1)C(=O)O Amb25751685 [0,1,0,0,0,0|2,0,0]=3 766 B12R1.1373 CC(C)(Cc1cnsn1)C(=O)O Amb28346141 [0,1,0,0,0,0|2,0,1]=4 767 B12R1.1373 CC(C)(Cc1cscn1)C(=O)O Amb18300537 [0,1,0,0,0,0|2,0,1]=4 768 B12R1.1373 CC(C)(Cn1ccnc1)C(=O)O Amb28186336 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.1373 CC(C)(Cn1cncn1)C(=O)O Amb27401238 [0,1,0,0,0,0|2,0,1]=4 770 B12R1.1373 CC(F)(Cn1ccnc1)C(=O)O Amb27201940 [0,1,0,0,0,0|3,0,0]=4 771 B12R1.1373 CC(N)(Cc1ccco1)C(=O)O Amb17232695 [0,1,0,0,0,0|2,0,0]=3 772 B12R1.1373 CC(N)(Cc1cccs1)C(=O)O Amb17234195 [0,1,0,0,0,0|2,0,0]=3 773 B12R1.1373 CC(N)(Cc1cccs1)C(N)=O Amb29859697 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.1373 CC(N)(Cc1ccsc1)C(N)=O Amb35690846 [0,1,0,0,0,0|3,0,0]=4 775 B12R1.1373 CC(N)(Cn1cccn1)C(=O)O Amb18984348 [0,1,0,0,0,0|2,0,1]=4 776 B12R1.1373 CC(N)(Cn1cccn1)C(=O)O Amb30584857 [0,1,0,0,0,0|2,0,1]=4 777 B12R1.1373 CC(N)(Cn1ccnc1)C(=O)O Amb18294519 [0,1,0,0,0,0|2,0,0]=3 778 B12R1.1373 CC(N)(Cn1ccnc1)C(N)=O Amb18294530 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.1373 CC(N)(Cn1cncn1)C(=O)O Amb18984352 [0,1,0,0,0,0|1,0,1]=3 780 B12R1.1373 CC(N)(Cn1cncn1)C(=O)O Amb24271208 [0,1,0,0,0,0|1,0,1]=3 781 B12R1.1373 CC(N)(Cn1cncn1)C(N)=O Amb18984353 [0,1,0,0,0,0|2,0,1]=4 782 B12R1.1373 CC(O)(Cc1ccco1)C(=O)O Amb33360942 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.1373 CC(O)(Cc1cccs1)C(=O)O Amb33361314 [0,1,0,0,0,0|3,0,0]=4 784 B12R1.1373 CC(O)(Cc1ccoc1)C(=O)O Amb33360373 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.1373 CC(O)(Cc1ccsc1)C(=O)O Amb33428904 [0,1,0,0,0,0|3,0,0]=4 786 B12R1.1373 CC(O)(Cc1cnco1)C(=O)O Amb33319955 [0,1,0,0,0,0|2,0,0]=3 787 B12R1.1373 CC(O)(Cc1cncs1)C(=O)O Amb33268774 [0,1,0,0,0,0|2,0,0]=3 788 B12R1.1373 CC(O)(Cc1cscn1)C(=O)O Amb33417830 [0,1,0,0,0,0|2,0,1]=4 789 B12R1.1373 CC(O)(Cn1ccnc1)C(=O)O Amb27668519 [0,1,0,0,0,0|3,0,0]=4 790 B12R1.1373 CC(O)(Cn1cncn1)C(=O)O Amb27426909 [0,1,0,0,0,0|2,0,1]=4 791 B12R1.1373 O=C(O)C(F)(F)Cc1ccco1 Amb33170639 [0,1,0,0,0,0|3,0,0]=4 792 B12R1.1373 O=C(O)C(F)(F)Cc1cccs1 Amb33170640 [0,1,0,0,0,0|3,0,0]=4 793 B12R1.1373 O=C(O)C(F)(F)Cc1ccns1 Amb33170992 [0,1,0,0,0,0|3,0,0]=4 794 B12R1.1373 O=C(O)C(F)(F)Cc1ccoc1 Amb33170638 [0,1,0,0,0,0|3,0,0]=4 795 B12R1.1373 O=C(O)C(F)(F)Cc1ccsc1 Amb33170641 [0,1,0,0,0,0|3,0,0]=4 796 B12R1.1373 O=C(O)C(F)(F)Cc1cnco1 Amb32745782 [0,1,0,0,0,0|2,0,0]=3 797 B12R1.1373 O=C(O)C(F)(F)Cc1cncs1 Amb33171198 [0,1,0,0,0,0|2,0,0]=3 798 B12R1.1373 O=C(O)C(F)(F)Cc1cnsc1 Amb33170987 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.1373 O=C(O)C(F)(F)Cc1cscn1 Amb33170972 [0,1,0,0,0,0|2,0,1]=4 800 B12R1.1373 O=C(O)C(F)(F)Cn1ccnc1 Amb26444606 [0,1,0,0,0,0|3,0,0]=4 801 B12R1.1373 O=C(O)C(F)(F)Cn1cncn1 Amb28199004 [0,1,0,0,0,0|2,0,1]=4 802 B10R0.26 CCNC(=O)CC(N)C(=O)O Amb27990016 [0,0,1,0,0,0|2,0,1]=4 803 B10R0.26 C\C(=C/CO)C[C@H](N)C(=O)O Amb27990183 [0,0,1,0,0,0|3,0,0]=4 804 B10R0.75 C=C\C=C\CCC(N)C(=O)O Amb33308773 [0,0,1,0,0,0|2,0,1]=4 805 B10R0.75 C=C\C=C\CC[C@@H](N)C(=O)O Amb33309012 [0,0,1,0,0,0|2,0,1]=4 806 B10R0.75 C=C\C=C\CC[C@H](N)C(=O)O Amb33066030 [0,0,1,0,0,0|2,0,1]=4 807 B10R0.75 CCC\C=C\CC(N)C(=O)O Amb33327187 [0,0,1,0,0,0|2,0,1]=4 808 B12R2.134 N[C@@H]1C(=O)N[C@H]1c2ccco2 Amb27803898 [0,0,0,1,0,0|3,0,0]=4 809 B12R2.134 O=C1N[C@@H](c2cncs2)[C@H]1O Amb27803114 [0,0,0,1,0,0|3,0,0]=4 810 B12R2.252 O=C(O)C1CC2N=CNC2C1 Amb18831028 [0,0,0,1,0,0|1,0,2]=4 811 B12R2.252 O=C(O)C1Cc2ccnn2C1 Amb18201417 [0,0,0,1,0,0|3,0,0]=4 812 B12R2.252 O=C(O)C1Cc2ccsc2C1 Amb10603806 [0,0,0,1,0,0|3,0,0]=4 813 B12R2.252 O=C(O)C1Cc2cncn2C1 Amb18201412 [0,0,0,1,0,0|1,0,0]=2 814 B12R2.252 O=C(O)C1Cc2cnoc2C1 Amb18201198 [0,0,0,1,0,0|3,0,0]=4 815 B12R2.252 O=C(O)C1Cc2cscc2C1 Amb24365365 [0,0,0,1,0,0|3,0,0]=4 816 B12R2.252 O=C(O)C1Cc2nccn2C1 Amb18201435 [0,0,0,1,0,0|3,0,0]=4 817 B12R2.252 O=C(O)C1Cc2nccn2C1 Amb31029005 [0,0,0,1,0,0|3,0,0]=4 818 B12R2.252 O=C(O)C1Cc2nncn2C1 Amb25825795 [0,0,0,1,0,0|2,0,0]=3 819 B12R2.252 O=C(O)C1Cc2nncn2C1 Amb35749962 [0,0,0,1,0,0|2,0,0]=3 820 B12R2.252 O=C(O)C1Cc2sccc2N1 Amb27174646 [0,0,0,1,0,0|2,0,0]=3 821 B12R2.252 O=C(O)c1cn2cncc2s1 Amb18199330 [0,0,0,1,0,0|2,0,1]=4 822 B12R2.1354 O=C(O)C1CC1c2ccco2 Amb9765540 [0,0,0,1,0,0|3,0,0]=4 823 B12R2.1354 O=C(O)C1CC1c2cccs2 Amb9765566 [0,0,0,1,0,0|3,0,0]=4 824 B12R2.1354 O=C(O)C1CC1c2ccns2 Amb30013859 [0,0,0,1,0,0|3,0,0]=4 825 B12R2.1354 O=C(O)C1CC1c2ccoc2 Amb25921432 [0,0,0,1,0,0|3,0,0]=4 826 B12R2.1354 O=C(O)C1CC1c2ccsc2 Amb9677089 [0,0,0,1,0,0|3,0,0]=4 827 B12R2.1354 O=C(O)C1CC1c2cnco2 Amb33415274 [0,0,0,1,0,0|2,0,0]=3 828 B12R2.1354 O=C(O)C1CC1c2cncs2 Amb24488090 [0,0,0,1,0,0|2,0,0]=3 829 B12R2.1354 O=C(O)C1CC1c2cocn2 Amb35750793 [0,0,0,1,0,0|2,0,1]=4 830 B12R2.1354 O=C(O)C1CC1c2cscn2 Amb27250152 [0,0,0,1,0,0|2,0,1]=4 831 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccco2 Amb26945410 [0,0,0,1,0,0|3,0,0]=4 832 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2cccs2 Amb26075145 [0,0,0,1,0,0|3,0,0]=4 833 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccoc2 Amb33361251 [0,0,0,1,0,0|3,0,0]=4 834 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2ccsc2 Amb28723392 [0,0,0,1,0,0|3,0,0]=4 835 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2cnco2 Amb33415265 [0,0,0,1,0,0|2,0,0]=3 836 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2cncs2 Amb33269824 [0,0,0,1,0,0|2,0,0]=3 837 B12R2.1354 O=C(O)[C@@H]1C[C@H]1c2cscn2 Amb33319110 [0,0,0,1,0,0|2,0,1]=4 838 B12R2.1354 O=C(O)[C@H]1C[C@@H]1c2ccco2 Amb27780939 [0,0,0,1,0,0|3,0,0]=4 839 B10R1.23 C=C(C(=O)O)c1cnco1 Amb33414803 [0,0,0,0,1,0|2,0,1]=4 840 B10R1.23 C=C(C(=O)O)c1cncs1 Amb33269090 [0,0,0,0,1,0|2,0,1]=4 841 B10R1.23 CC(=O)C(N)c1ccco1 Amb27170705 [0,0,0,0,1,0|3,0,0]=4 842 B10R1.23 CC(=O)C(N)c1cccs1 Amb25836886 [0,0,0,0,1,0|3,0,0]=4 843 B10R1.23 CC(C(=O)O)c1ccco1 Amb17087431 [0,0,0,0,1,0|3,0,0]=4 844 B10R1.23 CC(C(=O)O)c1cccs1 Amb10844027 [0,0,0,0,1,0|3,0,0]=4 845 B10R1.23 CC(C(=O)O)c1ccns1 Amb18830642 [0,0,0,0,1,0|3,0,0]=4 846 B10R1.23 CC(C(=O)O)c1ccoc1 Amb27954518 [0,0,0,0,1,0|3,0,0]=4 847 B10R1.23 CC(C(=O)O)c1ccsc1 Amb18284449 [0,0,0,0,1,0|3,0,0]=4 848 B10R1.23 CC(C(=O)O)c1cnco1 Amb33295052 [0,0,0,0,1,0|2,0,0]=3 849 B10R1.23 CC(C(=O)O)c1cncs1 Amb23580683 [0,0,0,0,1,0|2,0,0]=3 850 B10R1.23 CC(C(=O)O)c1cnsc1 Amb32713412 [0,0,0,0,1,0|3,0,0]=4 851 B10R1.23 CC(C(=O)O)c1cocn1 Amb18202773 [0,0,0,0,1,0|2,0,1]=4 852 B10R1.23 CC(C(=O)O)c1cscn1 Amb26398902 [0,0,0,0,1,0|2,0,1]=4 853 B10R1.23 CC(C(=O)O)n1ccnc1 Amb1133434 [0,0,0,0,1,0|3,0,0]=4 854 B10R1.23 CC(C(=O)O)n1ccnc1 Amb9154876 [0,0,0,0,1,0|3,0,0]=4 855 B10R1.23 CC(C(=O)O)n1cncn1 Amb21954261 [0,0,0,0,1,0|2,0,1]=4 856 B10R1.23 CC(C(=O)O)n1cncn1 Amb9708433 [0,0,0,0,1,0|2,0,1]=4 857 B10R1.23 C[C@@H](C(=O)O)c1cccs1 Amb10844019 [0,0,0,0,1,0|3,0,0]=4 858 B10R1.23 C[C@@H](C(=O)O)n1ccnc1 Amb18202909 [0,0,0,0,1,0|3,0,0]=4 859 B10R1.23 C[C@H](C(=O)O)c1ccco1 Amb27468877 [0,0,0,0,1,0|3,0,0]=4 860 B10R1.23 C[C@H](C(=O)O)n1ccnc1 Amb26430934 [0,0,0,0,1,0|3,0,0]=4 861 B10R1.23 NC(=O)C(N)c1ccco1 Amb17334171 [0,0,0,0,1,0|3,0,0]=4 862 B10R1.23 NC(=O)C(N)c1cccs1 Amb17334394 [0,0,0,0,1,0|3,0,0]=4 863 B10R1.23 NC(=O)C(N)c1ccns1 Amb27647262 [0,0,0,0,1,0|3,0,0]=4 864 B10R1.23 NC(C(=O)O)c1ccco1 Amb2696257 [0,0,0,0,1,0|2,0,0]=3 865 B10R1.23 NC(C(=O)O)c1cccs1 Amb1840251 [0,0,0,0,1,0|2,0,0]=3 866 B10R1.23 NC(C(=O)O)c1ccns1 Amb18199897 [0,0,0,0,1,0|2,0,0]=3 867 B10R1.23 NC(C(=O)O)c1ccon1 Amb18202657 [0,0,0,0,1,0|2,0,1]=4 868 B10R1.23 NC(C(=O)O)c1ccsc1 Amb33549251 [0,0,0,0,1,0|2,0,0]=3 869 B10R1.23 NC(C(=O)O)c1ccsc1 Amb9718858 [0,0,0,0,1,0|2,0,0]=3 870 B10R1.23 NC(C(=O)O)c1cnco1 Amb18202656 [0,0,0,0,1,0|1,0,0]=2 871 B10R1.23 NC(C(=O)O)c1cncs1 Amb18830497 [0,0,0,0,1,0|1,0,0]=2 872 B10R1.23 NC(C(=O)O)c1cnon1 Amb18202493 [0,0,0,0,1,0|1,0,1]=3 873 B10R1.23 NC(C(=O)O)c1cscn1 Amb18645003 [0,0,0,0,1,0|1,0,1]=3 874 B10R1.23 NC(C(=O)O)c1cscn1 Amb35788158 [0,0,0,0,1,0|1,0,1]=3 875 B10R1.23 NC(C(=O)O)c1csnn1 Amb24060289 [0,0,0,0,1,0|2,0,1]=4 876 B10R1.23 NC(C(=O)O)c1ncsn1 Amb18830399 [0,0,0,0,1,0|2,0,1]=4 877 B10R1.23 NC(c1ccoc1)[PH](=O)O Amb28250808 [0,0,0,0,1,0|3,0,0]=4 878 B10R1.23 N[C@@H](C(=O)O)c1cccs1 Amb22747193 [0,0,0,0,1,0|2,0,0]=3 879 B10R1.23 N[C@@H](C(=O)O)c1ccsc1 Amb22750704 [0,0,0,0,1,0|2,0,0]=3 880 B10R1.23 N[C@H](C(=O)O)[C@@H]1CC=NO1 Amb27222035 [0,0,0,0,1,0|2,0,1]=4 881 B10R1.23 N[C@H](C(=O)O)[C@H]1CC=NO1 Amb27968338 [0,0,0,0,1,0|2,0,1]=4 882 B10R1.23 N[C@H](C(=O)O)c1ccco1 Amb4296942 [0,0,0,0,1,0|2,0,0]=3 883 B10R1.23 N[C@H](C(=O)O)c1cccs1 Amb2694806 [0,0,0,0,1,0|2,0,0]=3 884 B10R1.23 N[C@H](C(=O)O)c1ccoc1 Amb27214171 [0,0,0,0,1,0|2,0,0]=3 885 B10R1.23 N[C@H](C(=O)O)c1ccsc1 Amb16232233 [0,0,0,0,1,0|2,0,0]=3 886 B10R1.23 N[C@H](C(=O)O)c1cncs1 Amb28136968 [0,0,0,0,1,0|1,0,0]=2 887 B10R1.23 O=C(O)C(=O)c1cnco1 Amb33415276 [0,0,0,0,1,0|2,0,1]=4 888 B10R1.23 O=C(O)C(=O)c1cncs1 Amb18830659 [0,0,0,0,1,0|2,0,1]=4 889 B10R1.23 O=C(O)C(Br)c1ccsc1 Amb27873590 [0,0,0,0,1,0|3,0,0]=4 890 B10R1.23 O=C(O)C(Cl)c1cccs1 Amb17233234 [0,0,0,0,1,0|3,0,0]=4 891 B10R1.23 O=C(O)C(Cl)c1ccsc1 Amb28138847 [0,0,0,0,1,0|3,0,0]=4 892 B10R1.23 O=C(O)C(F)c1ccco1 Amb25825778 [0,0,0,0,1,0|3,0,0]=4 893 B10R1.23 O=C(O)C(F)c1cccs1 Amb28193693 [0,0,0,0,1,0|3,0,0]=4 894 B10R1.23 O=C(O)C(F)c1ccns1 Amb28197326 [0,0,0,0,1,0|3,0,0]=4 895 B10R1.23 O=C(O)C(F)c1ccoc1 Amb26369748 [0,0,0,0,1,0|3,0,0]=4 896 B10R1.23 O=C(O)C(F)c1ccsc1 Amb27952222 [0,0,0,0,1,0|3,0,0]=4 897 B10R1.23 O=C(O)C(F)c1cncs1 Amb29878194 [0,0,0,0,1,0|2,0,0]=3 898 B10R1.23 O=C(O)C(F)c1cnsc1 Amb32713413 [0,0,0,0,1,0|3,0,0]=4 899 B10R1.23 O=C(O)C(F)c1cocn1 Amb27968038 [0,0,0,0,1,0|2,0,1]=4 900 B10R1.23 O=C(O)C(F)c1cscn1 Amb25767685 [0,0,0,0,1,0|2,0,1]=4 901 B10R1.23 O=C(O)C(F)n1ccnc1 Amb28050203 [0,0,0,0,1,0|3,0,0]=4 902 B10R1.23 O=C(O)C(O)c1ccco1 Amb597147 [0,0,0,0,1,0|3,0,0]=4 903 B10R1.23 O=C(O)C(O)c1cccs1 Amb17232241 [0,0,0,0,1,0|3,0,0]=4 904 B10R1.23 O=C(O)C(O)c1ccns1 Amb18830401 [0,0,0,0,1,0|3,0,0]=4 905 B10R1.23 O=C(O)C(O)c1ccoc1 Amb10810585 [0,0,0,0,1,0|3,0,0]=4 906 B10R1.23 O=C(O)C(O)c1ccsc1 Amb18952015 [0,0,0,0,1,0|3,0,0]=4 907 B10R1.23 O=C(O)C(O)c1cnco1 Amb18202499 [0,0,0,0,1,0|2,0,0]=3 908 B10R1.23 O=C(O)C(O)c1cnoc1 Amb18202500 [0,0,0,0,1,0|3,0,0]=4 909 B10R1.23 O=C(O)C(O)c1cnsc1 Amb35719527 [0,0,0,0,1,0|3,0,0]=4 910 B10R1.23 O=C(O)C(O)n1ccnc1 Amb21953001 [0,0,0,0,1,0|3,0,0]=4 911 B10R1.23 O=C(O)[C@H](O)c1cccs1 Amb27614848 [0,0,0,0,1,0|3,0,0]=4 912 B10R1.204 NC(CC1=CCC1)C(=O)O Amb28239360 [0,0,0,0,1,0|1,0,1]=3 913 B12R1.43 C=C(C)C(N)Cc1cccnc1 Amb27985470 [0,0,0,0,0,1|3,0,0]=4 914 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [0,0,0,0,0,1|2,0,1]=4 915 B12R1.43 C=C(Cc1ccncc1)C(=O)O Amb27389258 [0,0,0,0,0,1|2,0,1]=4 916 B12R1.43 CC(=O)C(Br)Cc1cncnc1 Amb28137449 [0,0,0,0,0,1|2,0,1]=4 917 B12R1.43 CC(=O)C(C)Cc1cccnc1 Amb27960854 [0,0,0,0,0,1|3,0,0]=4 918 B12R1.43 CC(=O)C(C)Cc1cnccn1 Amb35723160 [0,0,0,0,0,1|2,0,1]=4 919 B12R1.43 CC(=O)C(Cl)Cc1ccncc1 Amb17507769 [0,0,0,0,0,1|3,0,0]=4 920 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [0,0,0,0,0,1|3,0,0]=4 921 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [0,0,0,0,0,1|3,0,0]=4 922 B12R1.43 CC(=O)[C@@H](C)Cc1cccnc1 Amb27177781 [0,0,0,0,0,1|3,0,0]=4 923 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [0,0,0,0,0,1|3,0,0]=4 924 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [0,0,0,0,0,1|3,0,0]=4 925 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,0,0,0,0,1|3,0,0]=4 926 B12R1.43 CC(Cc1ccccn1)C(=O)O Amb5744008 [0,0,0,0,0,1|2,0,1]=4 927 B12R1.43 CC(Cc1cccnc1)C(=O)Cl Amb5744096 [0,0,0,0,0,1|3,0,0]=4 928 B12R1.43 CC(Cc1cccnc1)C(=O)O Amb5744009 [0,0,0,0,0,1|2,0,0]=3 929 B12R1.43 CC(Cc1cccnc1)C(N)=O Amb28072992 [0,0,0,0,0,1|3,0,0]=4 930 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb33743550 [0,0,0,0,0,1|2,0,0]=3 931 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb5744010 [0,0,0,0,0,1|2,0,0]=3 932 B12R1.43 CC(Cc1ccncn1)C(=O)O Amb7101497 [0,0,0,0,0,1|1,0,1]=3 933 B12R1.43 CC(Cc1cncnc1)C(=O)O Amb24375035 [0,0,0,0,0,1|1,0,1]=3 934 B12R1.43 CC(Cc1cncnn1)C(=O)O Amb27445911 [0,0,0,0,0,1|1,0,1]=3 935 B12R1.43 CC(Cc1ncccn1)C(=O)O Amb7101496 [0,0,0,0,0,1|2,0,1]=4 936 B12R1.43 CC(Nc1cccnc1)C(=O)O Amb18270393 [0,0,0,0,0,1|3,0,0]=4 937 B12R1.43 CC(Nc1ccnnc1)C(=O)O Amb25261344 [0,0,0,0,0,1|3,0,0]=4 938 B12R1.43 CC(Nc1ccnnc1)C(=O)O Amb32752692 [0,0,0,0,0,1|3,0,0]=4 939 B12R1.43 CC(Oc1cccnc1)C(=O)O Amb9783585 [0,0,0,0,0,1|3,0,0]=4 940 B12R1.43 CC(Sc1ccncc1)C(=O)O Amb6265772 [0,0,0,0,0,1|3,0,0]=4 941 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,0,0,0,0,1|3,0,0]=4 942 B12R1.43 C[C@@H](Cc1ccccn1)C(=O)O Amb10843999 [0,0,0,0,0,1|2,0,1]=4 943 B12R1.43 C[C@@H](Cc1cccnc1)C(=O)O Amb10844005 [0,0,0,0,0,1|2,0,0]=3 944 B12R1.43 C[C@@H](Cc1ccncc1)C(=O)O Amb10844007 [0,0,0,0,0,1|2,0,0]=3 945 B12R1.43 C[C@@H](Oc1cccnc1)C(=O)O Amb28288991 [0,0,0,0,0,1|3,0,0]=4 946 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,0,0,0,0,1|3,0,0]=4 947 B12R1.43 C[C@H](Cc1ccccn1)C(=O)O Amb10843998 [0,0,0,0,0,1|2,0,1]=4 948 B12R1.43 C[C@H](Cc1cccnc1)C(=O)O Amb10844004 [0,0,0,0,0,1|2,0,0]=3 949 B12R1.43 C[C@H](Cc1ccncc1)C(=O)O Amb10844006 [0,0,0,0,0,1|2,0,0]=3 950 B12R1.43 C[C@H](Nc1ccnnc1)C(=O)O Amb26542122 [0,0,0,0,0,1|3,0,0]=4 951 B12R1.43 C[C@H](Nc1ccnnc1)C(=O)O Amb32668107 [0,0,0,0,0,1|3,0,0]=4 952 B12R1.43 C[C@H](Oc1cccnc1)C(=O)O Amb28197526 [0,0,0,0,0,1|3,0,0]=4 953 B12R1.43 NC(=O)C(Cl)Cc1cccnc1 Amb27978950 [0,0,0,0,0,1|3,0,0]=4 954 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,0,0,0,0,1|3,0,0]=4 955 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb9727200 [0,0,0,0,0,1|3,0,0]=4 956 B12R1.43 NC(=O)C(N)Cc1ccccn1 Amb25873185 [0,0,0,0,0,1|2,0,1]=4 957 B12R1.43 NC(=O)C(N)Cc1cccnc1 Amb26475758 [0,0,0,0,0,1|2,0,0]=3 958 B12R1.43 NC(=O)C(N)Cc1cccnn1 Amb33065669 [0,0,0,0,0,1|2,0,1]=4 959 B12R1.43 NC(=O)C(N)Cc1ccncc1 Amb27153397 [0,0,0,0,0,1|2,0,0]=3 960 B12R1.43 NC(=O)C(N)Cc1ccncn1 Amb33065607 [0,0,0,0,0,1|1,0,1]=3 961 B12R1.43 NC(=O)C(N)Cc1ccnnc1 Amb33230890 [0,0,0,0,0,1|2,0,0]=3 962 B12R1.43 NC(=O)C(N)Cc1cnccn1 Amb33065713 [0,0,0,0,0,1|1,0,1]=3 963 B12R1.43 NC(=O)C(N)Cc1ncccn1 Amb26949419 [0,0,0,0,0,1|2,0,1]=4 964 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb6295777 [0,0,0,0,0,1|3,0,0]=4 965 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb9825510 [0,0,0,0,0,1|3,0,0]=4 966 B12R1.43 NC(=O)[C@@H](N)Cc1ccccn1 Amb30527600 [0,0,0,0,0,1|2,0,1]=4 967 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb16183950 [0,0,0,0,0,1|3,0,0]=4 968 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb33800758 [0,0,0,0,0,1|3,0,0]=4 969 B12R1.43 NC(=O)[C@H](N)Cc1ccncc1 Amb27840691 [0,0,0,0,0,1|2,0,0]=3 970 B12R1.43 NC(CC1=CCCCC1)C(=O)O Amb22233021 [0,0,0,0,0,1|2,0,1]=4 971 B12R1.43 NC(CC1=COCCC1)C(=O)O Amb33416022 [0,0,0,0,0,1|2,0,1]=4 972 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,0,0,0,0,1|2,0,0]=3 973 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,0,0,0,0,1|2,0,0]=3 974 B12R1.43 NC(Cc1ccccc1)[PH](=O)O Amb27254109 [0,0,0,0,0,1|3,0,0]=4 975 B12R1.43 NC(Cc1ccccn1)C(=O)O Amb22234042 [0,0,0,0,0,1|1,0,1]=3 976 B12R1.43 NC(Cc1ccccn1)C(=O)O Amb3788186 [0,0,0,0,0,1|1,0,1]=3 977 B12R1.43 NC(Cc1cccnc1)C(=O)O Amb22301544 [0,0,0,0,0,1|1,0,0]=2 978 B12R1.43 NC(Cc1cccnc1)C(=O)O Amb3788187 [0,0,0,0,0,1|1,0,0]=2 979 B12R1.43 NC(Cc1cccnn1)C(=O)O Amb18827268 [0,0,0,0,0,1|1,0,1]=3 980 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb22728340 [0,0,0,0,0,1|1,0,0]=2 981 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb32661063 [0,0,0,0,0,1|1,0,0]=2 982 B12R1.43 NC(Cc1ccncc1)C(=O)O Amb3788185 [0,0,0,0,0,1|1,0,0]=2 983 B12R1.43 NC(Cc1ccncn1)C(=O)O Amb19000856 [0,0,0,0,0,1|0,0,1]=2 984 B12R1.43 NC(Cc1ccncn1)C(=O)O Amb30584876 [0,0,0,0,0,1|0,0,1]=2 985 B12R1.43 NC(Cc1ccnnc1)C(=O)O Amb26517405 [0,0,0,0,0,1|1,0,0]=2 986 B12R1.43 NC(Cc1ccnnc1)C(=O)O Amb32682327 [0,0,0,0,0,1|1,0,0]=2 987 B12R1.43 NC(Cc1cnccn1)C(=O)O Amb19000859 [0,0,0,0,0,1|0,0,1]=2 988 B12R1.43 NC(Cc1cncnc1)C(=O)O Amb18302429 [0,0,0,0,0,1|0,0,1]=2 989 B12R1.43 NC(Cc1cncnc1)C(=O)O Amb35789114 [0,0,0,0,0,1|0,0,1]=2 990 B12R1.43 NC(Cc1cnncn1)C(=O)O Amb18826715 [0,0,0,0,0,1|0,0,1]=2 991 B12R1.43 NC(Cc1ncccn1)C(=O)O Amb18995251 [0,0,0,0,0,1|1,0,1]=3 992 B12R1.43 NC(Cc1ncccn1)C(=O)O Amb28555732 [0,0,0,0,0,1|1,0,1]=3 993 B12R1.43 N[C@@H](CC1=CCC=CC1)C(=O)O Amb24080592 [0,0,0,0,0,1|2,0,0]=3 994 B12R1.43 N[C@@H](CC1=CCCCC1)C(=O)O Amb26874843 [0,0,0,0,0,1|2,0,1]=4 995 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)Cl Amb27955901 [0,0,0,0,0,1|3,0,0]=4 996 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,0,0,0,0,1|2,0,0]=3 997 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,0,0,0,0,1|2,0,0]=3 998 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)S Amb27407796 [0,0,0,0,0,1|2,1,0]=4 999 B12R1.43 N[C@@H](Cc1ccccn1)C(=O)O Amb8629055 [0,0,0,0,0,1|1,0,1]=3 1000 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb16231985 [0,0,0,0,0,1|1,0,0]=2 1001 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb22008701 [0,0,0,0,0,1|1,0,0]=2 1002 B12R1.43 N[C@@H](Cc1cccnc1)C(=O)O Amb8395968 [0,0,0,0,0,1|1,0,0]=2 1003 B12R1.43 N[C@@H](Cc1cccnn1)C(=O)O Amb33066308 [0,0,0,0,0,1|1,0,1]=3 1004 B12R1.43 N[C@@H](Cc1ccncc1)C(=O)O Amb22745959 [0,0,0,0,0,1|1,0,0]=2 1005 B12R1.43 N[C@@H](Cc1ccncc1)C(=O)O Amb2699212 [0,0,0,0,0,1|1,0,0]=2 1006 B12R1.43 N[C@@H](Cc1ccncn1)C(=O)O Amb26025848 [0,0,0,0,0,1|0,0,1]=2 1007 B12R1.43 N[C@@H](Cc1cnccn1)C(=O)O Amb22801697 [0,0,0,0,0,1|0,0,1]=2 1008 B12R1.43 N[C@@H](Cc1cncnc1)C(=O)O Amb19149168 [0,0,0,0,0,1|0,0,1]=2 1009 B12R1.43 N[C@@H](Cc1ncccn1)C(=O)O Amb24524889 [0,0,0,0,0,1|1,0,1]=3 1010 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,0,0,0,0,1|2,0,0]=3 1011 B12R1.43 N[C@H](Cc1ccccn1)C(=O)O Amb8390365 [0,0,0,0,0,1|1,0,1]=3 1012 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb19930749 [0,0,0,0,0,1|1,0,0]=2 1013 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb22008700 [0,0,0,0,0,1|1,0,0]=2 1014 B12R1.43 N[C@H](Cc1cccnc1)C(=O)O Amb6295898 [0,0,0,0,0,1|1,0,0]=2 1015 B12R1.43 N[C@H](Cc1cccnn1)C(=O)O Amb33127536 [0,0,0,0,0,1|1,0,1]=3 1016 B12R1.43 N[C@H](Cc1ccncc1)C(=O)O Amb19944301 [0,0,0,0,0,1|1,0,0]=2 1017 B12R1.43 N[C@H](Cc1ccncc1)C(=O)O Amb6336423 [0,0,0,0,0,1|1,0,0]=2 1018 B12R1.43 N[C@H](Cc1ccncn1)C(=O)O Amb26876190 [0,0,0,0,0,1|0,0,1]=2 1019 B12R1.43 N[C@H](Cc1cnccn1)C(=O)O Amb24671229 [0,0,0,0,0,1|0,0,1]=2 1020 B12R1.43 N[C@H](Cc1ncccn1)C(=O)O Amb27593543 [0,0,0,0,0,1|1,0,1]=3 1021 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [0,0,0,0,0,1|0,0,3]=4 1022 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [0,0,0,0,0,1|0,0,3]=4 1023 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [0,0,0,0,0,1|2,0,1]=4 1024 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [0,0,0,0,0,1|2,0,1]=4 1025 B12R1.43 O=C(O)C(=O)Cc1ccncn1 Amb27870498 [0,0,0,0,0,1|1,0,2]=4 1026 B12R1.43 O=C(O)C(=O)Cc1cnccn1 Amb33360026 [0,0,0,0,0,1|1,0,2]=4 1027 B12R1.43 O=C(O)C(=O)Cc1cncnc1 Amb26564641 [0,0,0,0,0,1|1,0,2]=4 1028 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,0,0,0,0,1|3,0,0]=4 1029 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,0,0,0,0,1|3,0,0]=4 1030 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,0,0,0,0,1|3,0,0]=4 1031 B12R1.43 O=C(O)C(F)Cc1ccncc1 Amb27946336 [0,0,0,0,0,1|2,0,0]=3 1032 B12R1.43 O=C(O)C(F)Cc1cnccn1 Amb35600951 [0,0,0,0,0,1|1,0,1]=3 1033 B12R1.43 O=C(O)C(F)Cc1cncnc1 Amb27785706 [0,0,0,0,0,1|1,0,1]=3 1034 B12R1.43 O=C(O)C(F)Sc1ccncn1 Amb28370340 [0,0,0,0,0,1|2,0,1]=4 1035 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,0,0,0,0,1|3,0,0]=4 1036 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb17138619 [0,0,0,0,0,1|2,0,1]=4 1037 B12R1.43 O=C(O)C(O)Cc1ccccn1 Amb35750904 [0,0,0,0,0,1|2,0,1]=4 1038 B12R1.43 O=C(O)C(O)Cc1cccnc1 Amb2699798 [0,0,0,0,0,1|2,0,0]=3 1039 B12R1.43 O=C(O)C(O)Cc1ccncc1 Amb17138620 [0,0,0,0,0,1|2,0,0]=3 1040 B12R1.43 O=C(O)C(O)Cc1ccncn1 Amb33353381 [0,0,0,0,0,1|1,0,1]=3 1041 B12R1.43 O=C(O)C(O)Cc1cnccn1 Amb33353471 [0,0,0,0,0,1|1,0,1]=3 1042 B12R1.43 O=C(O)C(O)Cc1cncnc1 Amb25722221 [0,0,0,0,0,1|1,0,1]=3 1043 B12R1.43 O=C(O)C(O)Cc1ncccn1 Amb26934951 [0,0,0,0,0,1|2,0,1]=4 1044 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,0,0,0,0,1|3,0,0]=4 1045 B12R1.43 O=C(O)C(S)Cc1cnccn1 Amb35602917 [0,0,0,0,0,1|1,0,1]=3 1046 B12R1.43 O=C(O)C(S)Cc1cncnc1 Amb27847788 [0,0,0,0,0,1|1,0,1]=3 1047 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,0,0,0,0,1|3,0,0]=4 1048 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,0,0,0,0,1|3,0,0]=4 1049 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,0,0,0,0,1|3,0,0]=4 1050 B12R1.43 O=C(O)[C@@H](O)Cc1cccnc1 Amb27878615 [0,0,0,0,0,1|2,0,0]=3 1051 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,0,0,0,0,1|3,0,0]=4 1052 B12R1.43 O=C(O)[C@H](O)Cc1ccccn1 Amb27165660 [0,0,0,0,0,1|2,0,1]=4 1053 B12R1.260 CC(CC(=O)O)Cc1ccco1 Amb17334712 [0,0,0,0,0,1|3,0,0]=4 1054 B12R1.260 CC(CC(=O)O)Cc1cccs1 Amb17335692 [0,0,0,0,0,1|3,0,0]=4 1055 B12R1.260 CN(CC(=O)O)Cc1cncs1 Amb21862100 [0,0,0,0,0,1|3,0,0]=4 1056 B12R1.260 NC(CC(=O)O)Cc1ccco1 Amb17470474 [0,0,0,0,0,1|2,0,0]=3 1057 B12R1.260 NC(CC(=O)O)Cc1cccs1 Amb17470677 [0,0,0,0,0,1|2,0,0]=3 1058 B12R1.260 NC(CC(=O)O)Cc1cccs1 Amb33512732 [0,0,0,0,0,1|2,0,0]=3 1059 B12R1.260 NC(CC(=O)O)Cc1cncs1 Amb18822048 [0,0,0,0,0,1|1,0,0]=2 1060 B12R1.260 N[C@@H](CC(=O)O)Cc1cccs1 Amb24106410 [0,0,0,0,0,1|2,0,0]=3 1061 B12R1.260 N[C@@H](CC(=O)O)Cc1ccsc1 Amb33726073 [0,0,0,0,0,1|2,0,0]=3 1062 B12R1.260 N[C@H](CC(=O)O)Cc1ccco1 Amb2699215 [0,0,0,0,0,1|2,0,0]=3 1063 B12R1.260 N[C@H](CC(=O)O)Cc1ccsc1 Amb24106405 [0,0,0,0,0,1|2,0,0]=3 1064 B12R1.260 O=C(O)CC(Br)Cc1cccs1 Amb18111161 [0,0,0,0,0,1|3,0,0]=4 1065 B12R1.260 O=C(O)CC(Cl)Cc1cccs1 Amb18111160 [0,0,0,0,0,1|3,0,0]=4 1066 B12R1.264 CC(CCc1ccco1)C(=O)O Amb17232664 [0,0,0,0,0,1|3,0,0]=4 1067 B12R1.264 CC(CCc1cccs1)C(=O)O Amb17234091 [0,0,0,0,0,1|3,0,0]=4 1068 B12R1.264 CC(CCc1ccoc1)C(=O)O Amb33360359 [0,0,0,0,0,1|3,0,0]=4 1069 B12R1.264 CC(CCc1ccsc1)C(=O)O Amb32953612 [0,0,0,0,0,1|3,0,0]=4 1070 B12R1.264 CC(CCc1cnco1)C(=O)O Amb33319931 [0,0,0,0,0,1|2,0,0]=3 1071 B12R1.264 CC(CCc1cncs1)C(=O)O Amb33172551 [0,0,0,0,0,1|2,0,0]=3 1072 B12R1.264 CC(CCc1cscn1)C(=O)O Amb33319257 [0,0,0,0,0,1|2,0,1]=4 1073 B12R1.264 CC(CCn1cncn1)C(=O)O Amb32726015 [0,0,0,0,0,1|2,0,1]=4 1074 B12R1.264 CC(CNc1nncs1)C(=O)O Amb18605201 [0,0,0,0,0,1|3,0,0]=4 1075 B12R1.264 CC(NCc1ccco1)C(=O)O Amb2592333 [0,0,0,0,0,1|3,0,0]=4 1076 B12R1.264 CC(NCc1cccs1)C(=O)O Amb9326923 [0,0,0,0,0,1|3,0,0]=4 1077 B12R1.264 CC(NCc1ccsc1)C(=O)O Amb9511210 [0,0,0,0,0,1|3,0,0]=4 1078 B12R1.264 CC(OCc1cncs1)C(=O)O Amb28963361 [0,0,0,0,0,1|2,0,0]=3 1079 B12R1.264 CC(OCc1cncs1)C(=O)O Amb32662923 [0,0,0,0,0,1|2,0,0]=3 1080 B12R1.264 CC(SCc1ccco1)C(=O)O Amb2721954 [0,0,0,0,0,1|3,0,0]=4 1081 B12R1.264 NC(=O)C(N)CCc1cccs1 Amb33036124 [0,0,0,0,0,1|3,0,0]=4 1082 B12R1.264 NC(=O)C(N)CCc1ccns1 Amb33065681 [0,0,0,0,0,1|3,0,0]=4 1083 B12R1.264 NC(=O)C(N)CCc1ccsc1 Amb33065792 [0,0,0,0,0,1|3,0,0]=4 1084 B12R1.264 NC(=O)C(N)CCn1ccnc1 Amb19036893 [0,0,0,0,0,1|3,0,0]=4 1085 B12R1.264 NC(=O)C(N)CCn1cncn1 Amb18316173 [0,0,0,0,0,1|2,0,1]=4 1086 B12R1.264 NC(=O)C(N)CNc1ccsc1 Amb27788980 [0,0,0,0,0,1|3,0,0]=4 1087 B12R1.264 NC(CCc1ccco1)C(=O)O Amb17470473 [0,0,0,0,0,1|2,0,0]=3 1088 B12R1.264 NC(CCc1cccs1)C(=O)O Amb17470676 [0,0,0,0,0,1|2,0,0]=3 1089 B12R1.264 NC(CCc1ccns1)C(=O)O Amb33308992 [0,0,0,0,0,1|2,0,0]=3 1090 B12R1.264 NC(CCc1ccsc1)C(=O)O Amb32788699 [0,0,0,0,0,1|2,0,0]=3 1091 B12R1.264 NC(CCn1cccn1)C(=O)O Amb19017346 [0,0,0,0,0,1|2,0,1]=4 1092 B12R1.264 NC(CCn1ccnc1)C(=O)O Amb19036892 [0,0,0,0,0,1|2,0,0]=3 1093 B12R1.264 NC(CCn1cncn1)C(=O)O Amb18316153 [0,0,0,0,0,1|1,0,1]=3 1094 B12R1.264 NC(CCn1cnnn1)C(=O)O Amb33065658 [0,0,0,0,0,1|2,0,1]=4 1095 B12R1.264 N[C@@H](CCc1cccs1)C(=O)O Amb33065951 [0,0,0,0,0,1|2,0,0]=3 1096 B12R1.264 N[C@@H](CCc1ccns1)C(=O)O Amb33037014 [0,0,0,0,0,1|2,0,0]=3 1097 B12R1.264 N[C@@H](CCc1ccsc1)C(=O)O Amb33065931 [0,0,0,0,0,1|2,0,0]=3 1098 B12R1.264 N[C@@H](CCn1cccn1)C(=O)O Amb33065821 [0,0,0,0,0,1|2,0,1]=4 1099 B12R1.264 N[C@@H](CCn1ccnc1)C(=O)O Amb33308983 [0,0,0,0,0,1|2,0,0]=3 1100 B12R1.264 N[C@@H](CCn1cncn1)C(=O)O Amb33066111 [0,0,0,0,0,1|1,0,1]=3 1101 B12R1.264 N[C@@H](CCn1cnnn1)C(=O)O Amb33065766 [0,0,0,0,0,1|2,0,1]=4 1102 B12R1.264 N[C@H](CCc1cccs1)C(=O)O Amb32864929 [0,0,0,0,0,1|2,0,0]=3 1103 B12R1.264 N[C@H](CCc1ccns1)C(=O)O Amb33309048 [0,0,0,0,0,1|2,0,0]=3 1104 B12R1.264 N[C@H](CCc1ccsc1)C(=O)O Amb33036520 [0,0,0,0,0,1|2,0,0]=3 1105 B12R1.264 N[C@H](CCn1cccn1)C(=O)O Amb33308959 [0,0,0,0,0,1|2,0,1]=4 1106 B12R1.264 N[C@H](CCn1ccnc1)C(=O)O Amb33065702 [0,0,0,0,0,1|2,0,0]=3 1107 B12R1.264 N[C@H](CCn1cncn1)C(=O)O Amb33065502 [0,0,0,0,0,1|1,0,1]=3 1108 B12R1.264 N[C@H](CCn1cnnn1)C(=O)O Amb33066107 [0,0,0,0,0,1|2,0,1]=4 1109 B12R1.264 O=C(O)C(=O)NCc1cnco1 Amb27480860 [0,0,0,0,0,1|2,0,1]=4 1110 B12R1.264 O=C(O)C(=O)NCc1cncs1 Amb25842941 [0,0,0,0,0,1|2,0,1]=4 1111 B12R1.264 O=C(O)C(O)CCc1ccsc1 Amb33172646 [0,0,0,0,0,1|3,0,0]=4 1112 B12R1.264 O=C(O)C(O)CCn1cncn1 Amb33743908 [0,0,0,0,0,1|2,0,1]=4 1113 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [1,0,1,0,0,0|1,0,1]=4 1114 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [1,0,1,0,0,0|1,0,1]=4 1115 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [1,0,1,0,0,0|1,0,1]=4 1116 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [1,0,1,0,0,0|1,0,1]=4 1117 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [1,0,1,0,0,0|1,0,1]=4 1118 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [1,0,1,0,0,0|1,0,1]=4 1119 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [1,0,1,0,0,0|1,0,1]=4 1120 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [1,0,1,0,0,0|1,0,1]=4 1121 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [1,0,1,0,0,0|1,0,1]=4 1122 B9R0.42 NC(CC(=O)NO)C(=O)O Amb22349932 [1,0,1,0,0,0|2,0,0]=4 1123 B9R0.42 NC(C\C(Cl)=C\Cl)C(=O)O Amb27232854 [1,0,1,0,0,0|2,0,0]=4 1124 B9R0.42 NNC(=O)C[C@H](N)C(=O)O Amb24680907 [1,0,1,0,0,0|1,0,1]=4 1125 B9R0.42 N[C@@H](CC(=O)NO)C(=O)O Amb28320876 [1,0,1,0,0,0|2,0,0]=4 1126 B9R0.42 N\C=C(/N)CC(N)C(=O)O Amb28250396 [1,0,1,0,0,0|0,0,1]=3 1127 B9R0.47 C#C\C=C\CC(N)C(=O)O Amb25147384 [1,0,1,0,0,0|1,0,1]=4 1128 B9R0.47 C=CCCCC(N)C(=O)O Amb22002149 [1,0,1,0,0,0|1,0,1]=4 1129 B9R0.47 C=CCCCC(N)C(=O)O Amb32752542 [1,0,1,0,0,0|1,0,1]=4 1130 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb22831130 [1,0,1,0,0,0|1,0,1]=4 1131 B9R0.47 C=CCCC[C@@H](N)C(=O)O Amb32687472 [1,0,1,0,0,0|1,0,1]=4 1132 B9R0.47 C=CCCC[C@H](N)C(=O)O Amb2699129 [1,0,1,0,0,0|1,0,1]=4 1133 B9R0.47 C=CCNCC(N)C(=O)O Amb27945606 [1,0,1,0,0,0|1,0,1]=4 1134 B9R0.47 C=CCOCC(N)C(=O)O Amb28048879 [1,0,1,0,0,0|2,0,0]=4 1135 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb31030961 [1,0,1,0,0,0|2,0,0]=4 1136 B9R0.47 C=CCOC[C@@H](N)C(=O)O Amb32941137 [1,0,1,0,0,0|2,0,0]=4 1137 B9R0.47 C=CCOC[C@H](N)C(=O)O Amb24713287 [1,0,1,0,0,0|2,0,0]=4 1138 B9R0.47 C=CCSCC(N)C(=O)O Amb6270069 [1,0,1,0,0,0|2,0,0]=4 1139 B9R0.47 C=CCSC[C@@H](N)C(=O)O Amb10843878 [1,0,1,0,0,0|2,0,0]=4 1140 B9R0.47 C=CCSC[C@H](N)C(=O)O Amb22231426 [1,0,1,0,0,0|2,0,0]=4 1141 B9R0.47 C=CSCCC(N)C(=O)O Amb26658187 [1,0,1,0,0,0|1,0,1]=4 1142 B9R0.47 C=C\C=C\CC(N)C(=O)O Amb18643715 [1,0,1,0,0,0|1,0,0]=3 1143 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [1,0,1,0,0,0|1,0,1]=4 1144 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [1,0,1,0,0,0|1,0,1]=4 1145 B9R0.47 C\C=C\CCC(N)C(=O)O Amb27770583 [1,0,1,0,0,0|1,0,1]=4 1146 B9R0.47 NC(CS\C=C\Cl)C(=O)O Amb28325993 [1,0,1,0,0,0|2,0,0]=4 1147 B9R0.47 NC(C\C=C/CO)C(=O)O Amb28046143 [1,0,1,0,0,0|1,0,1]=4 1148 B9R0.47 NC\C=C\CC(N)C(=O)O Amb22800680 [1,0,1,0,0,0|0,0,1]=3 1149 B9R0.48 C=C=C[C@H](N)CCC(=O)O Amb27391437 [1,0,1,0,0,0|1,0,1]=4 1150 B9R0.48 C=CNC(=O)CCC(=O)O Amb24505247 [1,0,1,0,0,0|2,0,0]=4 1151 B9R0.48 N#C\C=C(/N)CCC(=O)O Amb24053667 [1,0,1,0,0,0|2,0,0]=4 1152 B9R0.2 C=CC\C=C\CCC(=O)O Amb18643540 [1,0,1,0,0,0|2,0,0]=4 1153 B9R0.2 C\C=C\C=C\CCC(=O)O Amb18643576 [1,0,1,0,0,0|2,0,0]=4 1154 B9R1.12 O=CCCc1ccco1 Amb17081672 [2,0,0,0,0,0|2,0,0]=4 1155 B9R1.12 O=CCCc1cccs1 Amb17081673 [2,0,0,0,0,0|2,0,0]=4 1156 B9R1.12 O=CCCc1ccns1 Amb27235027 [2,0,0,0,0,0|2,0,0]=4 1157 B9R1.12 O=CCCc1ccoc1 Amb8394152 [2,0,0,0,0,0|2,0,0]=4 1158 B9R1.12 O=CCCc1ccsc1 Amb26961096 [2,0,0,0,0,0|2,0,0]=4 1159 B9R1.12 O=CCCc1cnco1 Amb26986955 [2,0,0,0,0,0|1,0,0]=3 1160 B9R1.12 O=CCCc1cncs1 Amb25705083 [2,0,0,0,0,0|1,0,0]=3 1161 B9R1.12 O=CCCc1cnoc1 Amb26535554 [2,0,0,0,0,0|2,0,0]=4 1162 B9R1.12 O=CCCc1cnsc1 Amb35716921 [2,0,0,0,0,0|2,0,0]=4 1163 B9R1.12 O=CCCn1ccnc1 Amb4303964 [2,0,0,0,0,0|2,0,0]=4 1164 B9R1.12 O=CCCn1cncn1 Amb27837420 [2,0,0,0,0,0|1,0,1]=4 1165 B9R1.12 O=CNCc1cncs1 Amb27628845 [2,0,0,0,0,0|2,0,0]=4 1166 B9R1.12 OCCCc1cnco1 Amb27833401 [2,0,0,0,0,0|1,0,1]=4 1167 B9R1.12 OCCCc1cncs1 Amb26017292 [2,0,0,0,0,0|1,0,1]=4 1168 B9R1.13 CC(O)Cc1cnco1 Amb33415202 [2,0,0,0,0,0|2,0,0]=4 1169 B9R1.13 CC(O)Cc1cncs1 Amb24659738 [2,0,0,0,0,0|2,0,0]=4 1170 B9R1.13 C[C@@H](N)Cc1cnco1 Amb33414816 [2,0,0,0,0,0|1,0,1]=4 1171 B9R1.13 C[C@@H](N)Cc1cncs1 Amb33269143 [2,0,0,0,0,0|1,0,1]=4 1172 B9R1.13 C[C@@H](O)Cc1cnco1 Amb33414812 [2,0,0,0,0,0|2,0,0]=4 1173 B9R1.13 C[C@@H](O)Cc1cncs1 Amb33225056 [2,0,0,0,0,0|2,0,0]=4 1174 B9R1.13 C[C@H](N)Cc1cnco1 Amb33414815 [2,0,0,0,0,0|1,0,1]=4 1175 B9R1.13 C[C@H](N)Cc1cncs1 Amb33269142 [2,0,0,0,0,0|1,0,1]=4 1176 B9R1.13 C[C@H](O)Cc1cnco1 Amb33414814 [2,0,0,0,0,0|2,0,0]=4 1177 B9R1.13 C[C@H](O)Cc1cncs1 Amb33269141 [2,0,0,0,0,0|2,0,0]=4 1178 B9R1.13 NC(=O)Cc1cncs1 Amb22372056 [2,0,0,0,0,0|1,0,1]=4 1179 B11R0.33 CC(=O)NC(=O)C[C@@H](N)C(=O)O Amb27477770 [0,1,1,0,0,0|2,0,0]=4 1180 B11R0.33 CC(=O)NC(=O)C[C@H](N)C(=O)O Amb27233425 [0,1,1,0,0,0|2,0,0]=4 1181 B11R0.33 NC(=O)NC(=O)CC(N)C(=O)O Amb27646444 [0,1,1,0,0,0|1,0,1]=4 1182 B11R0.29 NC(N)=NCCCC(N)C(=O)O Amb19866551 [0,1,1,0,0,0|0,0,2]=4 1183 B11R1.30 NC(CCO)Cc1cncs1 Amb32946709 [1,1,0,0,0,0|1,0,1]=4 1184 B11R1.39 Cc1ncc(CC(C)C=O)s1 Amb35616526 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.39 Cc1ncc(CC(N)CO)s1 Amb18198184 [1,1,0,0,0,0|1,0,1]=4 1186 B11R1.39 NC(CO)Cc1cnc(Br)s1 Amb27985358 [1,1,0,0,0,0|1,0,1]=4 1187 B11R1.39 NC(CO)Cc1cnc(Cl)s1 Amb25932206 [1,1,0,0,0,0|1,0,1]=4 1188 B11R1.136 CC(C)(C=O)Cc1cncs1 Amb25044915 [1,1,0,0,0,0|2,0,0]=4 1189 B11R1.136 CC(N)(CO)Cc1cnco1 Amb33424312 [1,1,0,0,0,0|1,0,1]=4 1190 B11R1.136 CC(N)(CO)Cc1cncs1 Amb33269130 [1,1,0,0,0,0|1,0,1]=4 1191 B11R1.136 CC(O)(C=O)Cc1cncs1 Amb27262320 [1,1,0,0,0,0|2,0,0]=4 1192 B11R1.228 CC(C=O)Cc1cncn1C Amb35743680 [1,1,0,0,0,0|1,0,0]=3 1193 B11R1.228 CC(C=O)Cc1cnnn1C Amb28070127 [1,1,0,0,0,0|2,0,0]=4 1194 B11R1.228 CC(C=O)Cc1nncn1C Amb28194782 [1,1,0,0,0,0|2,0,0]=4 1195 B11R1.228 CC(CO)Cc1cncn1C Amb35702097 [1,1,0,0,0,0|1,0,1]=4 1196 B11R1.228 Cc1ncsc1CC(C)C=O Amb35608814 [1,1,0,0,0,0|2,0,0]=4 1197 B11R1.228 Cc1ncsc1CC(N)CO Amb27976174 [1,1,0,0,0,0|1,0,1]=4 1198 B11R1.228 Cn1cccc1CC(N)CO Amb27429898 [1,1,0,0,0,0|1,0,1]=4 1199 B11R1.228 Cn1cncc1CC(Cl)CO Amb27617492 [1,1,0,0,0,0|1,0,1]=4 1200 B11R1.228 Cn1cncc1CC(N)CO Amb18125887 [1,1,0,0,0,0|0,0,1]=3 1201 B11R1.228 Cn1cncc1CC(O)C=O Amb35703100 [1,1,0,0,0,0|1,0,0]=3 1202 B11R1.228 Cn1cncc1C\C(N)=N\O Amb27638976 [1,1,0,0,0,0|1,0,1]=4 1203 B11R1.228 Cn1nncc1CC(N)CO Amb33145715 [1,1,0,0,0,0|1,0,1]=4 1204 B11R1.25 C=CC(=O)CCc1cnco1 Amb27673593 [1,1,0,0,0,0|2,0,0]=4 1205 B11R1.25 COC(=O)CCc1ccno1 Amb24762935 [1,1,0,0,0,0|2,0,0]=4 1206 B11R1.25 COC(=O)CCc1ccoc1 Amb27272302 [1,1,0,0,0,0|2,0,0]=4 1207 B11R1.25 COC(=O)CCc1ccsc1 Amb27491907 [1,1,0,0,0,0|2,0,0]=4 1208 B11R1.25 COC(=O)CCc1cncs1 Amb28387274 [1,1,0,0,0,0|1,0,0]=3 1209 B11R1.25 COC(=O)CCc1cnoc1 Amb25382987 [1,1,0,0,0,0|2,0,0]=4 1210 B11R1.25 COC(=O)CCn1ccnc1 Amb2794109 [1,1,0,0,0,0|2,0,0]=4 1211 B11R1.25 COC(=O)CCn1cncn1 Amb15740833 [1,1,0,0,0,0|1,0,1]=4 1212 B11R1.25 COC(=O)CCn1cncn1 Amb33529297 [1,1,0,0,0,0|1,0,1]=4 1213 B11R1.25 O=C(CCn1ccnc1)NO Amb28370554 [1,1,0,0,0,0|2,0,0]=4 1214 B11R1.25 O=C(CO)CCc1ccco1 Amb18065408 [1,1,0,0,0,0|2,0,0]=4 1215 B11R1.25 O=C(CO)CCc1cccs1 Amb18563930 [1,1,0,0,0,0|2,0,0]=4 1216 B11R1.25 O=C(CO)OCc1cncs1 Amb27988707 [1,1,0,0,0,0|2,0,0]=4 1217 B11R1.75 CC(=O)CCC1=CCC(=O)N1 Amb27849883 [1,1,0,0,0,0|2,0,0]=4 1218 B11R1.75 CC(=O)CCc1cnc(C)s1 Amb25084411 [1,1,0,0,0,0|2,0,0]=4 1219 B11R1.75 CC(=O)CCc1cnc(Cl)s1 Amb2436182 [1,1,0,0,0,0|2,0,0]=4 1220 B11R1.75 CC(=O)CCc1cnc(N)s1 Amb33307917 [1,1,0,0,0,0|2,0,0]=4 1221 B11R1.75 CC1=CC(CCC(=O)O)=CC1 Amb27632504 [1,1,0,0,0,0|2,0,0]=4 1222 B11R1.75 Cc1cc(CCC(=O)O)co1 Amb32713189 [1,1,0,0,0,0|2,0,0]=4 1223 B11R1.75 Cc1cc(CCC(=O)O)cs1 Amb27809533 [1,1,0,0,0,0|2,0,0]=4 1224 B11R1.75 Cc1cc(CCC(=O)O)on1 Amb18200535 [1,1,0,0,0,0|2,0,0]=4 1225 B11R1.75 Cc1cc(CCC(=O)O)sn1 Amb18198610 [1,1,0,0,0,0|2,0,0]=4 1226 B11R1.75 Cc1ccc(CCC(=O)O)o1 Amb6336472 [1,1,0,0,0,0|2,0,0]=4 1227 B11R1.75 Cc1ccc(CCC(=O)O)s1 Amb33528678 [1,1,0,0,0,0|2,0,0]=4 1228 B11R1.75 Cc1cn(CCC(=O)O)cn1 Amb18254950 [1,1,0,0,0,0|2,0,0]=4 1229 B11R1.75 Cc1csc(CCC(=O)O)c1 Amb22886570 [1,1,0,0,0,0|2,0,0]=4 1230 B11R1.75 Cc1nc(CCC(=O)O)co1 Amb17399989 [1,1,0,0,0,0|1,0,1]=4 1231 B11R1.75 Cc1nc(CCC(=O)O)cs1 Amb8010320 [1,1,0,0,0,0|1,0,1]=4 1232 B11R1.75 Cc1ncc(CCC(=O)O)o1 Amb18830921 [1,1,0,0,0,0|1,0,0]=3 1233 B11R1.75 Cc1ncc(CCC(=O)O)s1 Amb18302885 [1,1,0,0,0,0|1,0,0]=3 1234 B11R1.75 Cc1ncc(CCC(N)=O)s1 Amb23560128 [1,1,0,0,0,0|2,0,0]=4 1235 B11R1.75 Cc1ncc(OCC(=O)O)s1 Amb33148158 [1,1,0,0,0,0|2,0,0]=4 1236 B11R1.75 Cc1ncn(CCC(=O)O)n1 Amb18254980 [1,1,0,0,0,0|1,0,1]=4 1237 B11R1.75 Cc1nnc(CCC(=O)O)o1 Amb17101939 [1,1,0,0,0,0|2,0,0]=4 1238 B11R1.75 Cc1nnc(CCC(=O)O)s1 Amb8010338 [1,1,0,0,0,0|2,0,0]=4 1239 B11R1.75 Cc1noc(CCC(=O)O)n1 Amb525959 [1,1,0,0,0,0|1,0,1]=4 1240 B11R1.75 Cc1nsc(CCC(=O)O)n1 Amb18825366 [1,1,0,0,0,0|1,0,1]=4 1241 B11R1.75 Cn1cc(CCC(=O)O)cn1 Amb1946073 [1,1,0,0,0,0|2,0,0]=4 1242 B11R1.75 Cn1ccc(CCC(=O)O)c1 Amb18065395 [1,1,0,0,0,0|1,0,1]=4 1243 B11R1.75 Cn1cnc(CCC(=O)O)c1 Amb18064894 [1,1,0,0,0,0|0,0,2]=4 1244 B11R1.75 Cn1ncc(CCC(=O)O)n1 Amb26001419 [1,1,0,0,0,0|1,0,1]=4 1245 B11R1.75 NC(=O)CCc1cnc(Br)s1 Amb27193794 [1,1,0,0,0,0|2,0,0]=4 1246 B11R1.75 NC(=O)CCc1cnc(Cl)s1 Amb28051643 [1,1,0,0,0,0|2,0,0]=4 1247 B11R1.75 Nc1ccc(CCC(=O)O)s1 Amb18825427 [1,1,0,0,0,0|2,0,0]=4 1248 B11R1.75 Nc1cn(CCC(=O)O)cn1 Amb18200504 [1,1,0,0,0,0|2,0,0]=4 1249 B11R1.75 Nc1nc(CCC(=O)O)co1 Amb27762926 [1,1,0,0,0,0|1,0,1]=4 1250 B11R1.75 Nc1nc(CCC(=O)O)cs1 Amb13949099 [1,1,0,0,0,0|1,0,1]=4 1251 B11R1.75 Nc1nc(CCC(=O)O)cs1 Amb21955536 [1,1,0,0,0,0|1,0,1]=4 1252 B11R1.75 Nc1nc(CCC(=O)O)cs1 Amb2721898 [1,1,0,0,0,0|1,0,1]=4 1253 B11R1.75 Nc1ncc(CCC(=O)O)s1 Amb19373489 [1,1,0,0,0,0|1,0,0]=3 1254 B11R1.75 Nc1ncn(CCC(=O)O)n1 Amb22280454 [1,1,0,0,0,0|1,0,1]=4 1255 B11R1.75 Nc1ncn(CCC(=O)O)n1 Amb6891192 [1,1,0,0,0,0|1,0,1]=4 1256 B11R1.75 Nc1nnc(CCC(=O)O)o1 Amb18224389 [1,1,0,0,0,0|2,0,0]=4 1257 B11R1.75 Nc1nnc(CCC(=O)O)s1 Amb6353918 [1,1,0,0,0,0|2,0,0]=4 1258 B11R1.75 Nc1noc(CCC(=O)O)n1 Amb18200031 [1,1,0,0,0,0|1,0,1]=4 1259 B11R1.75 O=C(O)CCC1=CC(=O)NN1 Amb18200286 [1,1,0,0,0,0|2,0,0]=4 1260 B11R1.75 O=C(O)CCC1=CNC(=O)N1 Amb19550071 [1,1,0,0,0,0|0,0,1]=3 1261 B11R1.75 O=C(O)CCC1=CNC(=S)N1 Amb20243447 [1,1,0,0,0,0|0,0,1]=3 1262 B11R1.75 O=C(O)CCC1=CSC(=O)N1 Amb18544048 [1,1,0,0,0,0|1,0,0]=3 1263 B11R1.75 O=C(O)CCc1cc(Br)co1 Amb33332934 [1,1,0,0,0,0|2,0,0]=4 1264 B11R1.75 O=C(O)CCc1cc(Br)cs1 Amb8834285 [1,1,0,0,0,0|2,0,0]=4 1265 B11R1.75 O=C(O)CCc1cc(Br)no1 Amb16186748 [1,1,0,0,0,0|2,0,0]=4 1266 B11R1.75 O=C(O)CCc1cc(Cl)cs1 Amb19374564 [1,1,0,0,0,0|2,0,0]=4 1267 B11R1.75 O=C(O)CCc1cc(Cl)no1 Amb1063482 [1,1,0,0,0,0|2,0,0]=4 1268 B11R1.75 O=C(O)CCc1cc(O)no1 Amb535160 [1,1,0,0,0,0|2,0,0]=4 1269 B11R1.75 O=C(O)CCc1ccc(Br)o1 Amb9175389 [1,1,0,0,0,0|2,0,0]=4 1270 B11R1.75 O=C(O)CCc1ccc(Br)s1 Amb33528679 [1,1,0,0,0,0|2,0,0]=4 1271 B11R1.75 O=C(O)CCc1ccc(Cl)o1 Amb27235080 [1,1,0,0,0,0|2,0,0]=4 1272 B11R1.75 O=C(O)CCc1ccc(Cl)s1 Amb3934543 [1,1,0,0,0,0|2,0,0]=4 1273 B11R1.75 O=C(O)CCc1ccc(F)o1 Amb27428994 [1,1,0,0,0,0|2,0,0]=4 1274 B11R1.75 O=C(O)CCc1ccc(F)s1 Amb28132897 [1,1,0,0,0,0|2,0,0]=4 1275 B11R1.75 O=C(O)CCc1cnc(Br)s1 Amb9787016 [1,1,0,0,0,0|1,0,0]=3 1276 B11R1.75 O=C(O)CCc1cnc(Cl)s1 Amb27224214 [1,1,0,0,0,0|1,0,0]=3 1277 B11R1.75 O=C(O)CCc1coc(Br)c1 Amb26937632 [1,1,0,0,0,0|2,0,0]=4 1278 B11R1.75 O=C(O)CCc1csc(Br)c1 Amb26879641 [1,1,0,0,0,0|2,0,0]=4 1279 B11R1.75 O=C(O)CCc1csc(Br)n1 Amb17409134 [1,1,0,0,0,0|1,0,1]=4 1280 B11R1.75 O=C(O)CCc1csc(Cl)c1 Amb25116438 [1,1,0,0,0,0|2,0,0]=4 1281 B11R1.75 O=C(O)CCc1csc(I)c1 Amb33470232 [1,1,0,0,0,0|2,0,0]=4 1282 B11R1.75 O=C(O)CCc1csc(S)n1 Amb18129800 [1,1,0,0,0,0|1,0,1]=4 1283 B11R1.75 O=C(O)CCc1nc(Br)no1 Amb18162861 [1,1,0,0,0,0|1,0,1]=4 1284 B11R1.75 O=C(O)CCc1nnc(S)o1 Amb18862901 [1,1,0,0,0,0|2,0,0]=4 1285 B11R1.75 O=C(O)CCn1cnc(Br)n1 Amb24269229 [1,1,0,0,0,0|1,0,1]=4 1286 B11R1.75 O=C(O)CCn1cnc(Cl)n1 Amb23481536 [1,1,0,0,0,0|1,0,1]=4 1287 B11R1.75 O=C(O)CCn1cnc(I)n1 Amb27617474 [1,1,0,0,0,0|1,0,1]=4 1288 B11R1.75 O=C(O)COc1cnc(Cl)s1 Amb33221827 [1,1,0,0,0,0|2,0,0]=4 1289 B11R1.77 CC(=O)CC(C)c1cncs1 Amb35612878 [1,1,0,0,0,0|2,0,0]=4 1290 B11R1.77 CC(CC(=O)O)c1ccco1 Amb33533316 [1,1,0,0,0,0|2,0,0]=4 1291 B11R1.77 CC(CC(=O)O)c1cccs1 Amb5738626 [1,1,0,0,0,0|2,0,0]=4 1292 B11R1.77 CC(CC(=O)O)c1ccoc1 Amb25890909 [1,1,0,0,0,0|2,0,0]=4 1293 B11R1.77 CC(CC(=O)O)c1ccsc1 Amb25274979 [1,1,0,0,0,0|2,0,0]=4 1294 B11R1.77 CC(CC(=O)O)c1cnco1 Amb33415284 [1,1,0,0,0,0|1,0,0]=3 1295 B11R1.77 CC(CC(=O)O)c1cncs1 Amb29878199 [1,1,0,0,0,0|1,0,0]=3 1296 B11R1.77 CC(CC(=O)O)c1cnsc1 Amb35720166 [1,1,0,0,0,0|2,0,0]=4 1297 B11R1.77 CC(CC(=O)O)c1cscn1 Amb28199109 [1,1,0,0,0,0|1,0,1]=4 1298 B11R1.77 CC(CC(=O)O)n1ccnc1 Amb20668070 [1,1,0,0,0,0|2,0,0]=4 1299 B11R1.77 CC(CC(=O)O)n1ccnc1 Amb33531763 [1,1,0,0,0,0|2,0,0]=4 1300 B11R1.77 CC(CC(=O)O)n1cncn1 Amb2572537 [1,1,0,0,0,0|1,0,1]=4 1301 B11R1.77 NC(=O)CC(N)c1cncs1 Amb25145791 [1,1,0,0,0,0|2,0,0]=4 1302 B11R1.77 NC(=O)C[C@@H](N)c1cncs1 Amb28066286 [1,1,0,0,0,0|2,0,0]=4 1303 B11R1.77 NC(=O)C[C@H](N)c1cncs1 Amb25100556 [1,1,0,0,0,0|2,0,0]=4 1304 B11R1.77 NC(CC(=O)O)c1ccco1 Amb2583027 [1,1,0,0,0,0|2,0,0]=4 1305 B11R1.77 NC(CC(=O)O)c1ccco1 Amb33295176 [1,1,0,0,0,0|2,0,0]=4 1306 B11R1.77 NC(CC(=O)O)c1cccs1 Amb9730102 [1,1,0,0,0,0|2,0,0]=4 1307 B11R1.77 NC(CC(=O)O)c1ccns1 Amb33255049 [1,1,0,0,0,0|2,0,0]=4 1308 B11R1.77 NC(CC(=O)O)c1ccoc1 Amb4053070 [1,1,0,0,0,0|2,0,0]=4 1309 B11R1.77 NC(CC(=O)O)c1ccsc1 Amb9730099 [1,1,0,0,0,0|2,0,0]=4 1310 B11R1.77 NC(CC(=O)O)c1cnco1 Amb33226498 [1,1,0,0,0,0|1,0,0]=3 1311 B11R1.77 NC(CC(=O)O)c1cncs1 Amb26399102 [1,1,0,0,0,0|1,0,0]=3 1312 B11R1.77 NC(CC(=O)O)c1cnsc1 Amb33255325 [1,1,0,0,0,0|2,0,0]=4 1313 B11R1.77 NC(CC(=O)O)c1cscn1 Amb25920675 [1,1,0,0,0,0|1,0,1]=4 1314 B11R1.77 N[C@@H](CC(=O)O)c1ccco1 Amb18179572 [1,1,0,0,0,0|2,0,0]=4 1315 B11R1.77 N[C@@H](CC(=O)O)c1cccs1 Amb18180320 [1,1,0,0,0,0|2,0,0]=4 1316 B11R1.77 N[C@@H](CC(=O)O)c1ccns1 Amb32787956 [1,1,0,0,0,0|2,0,0]=4 1317 B11R1.77 N[C@@H](CC(=O)O)c1ccoc1 Amb25058814 [1,1,0,0,0,0|2,0,0]=4 1318 B11R1.77 N[C@@H](CC(=O)O)c1ccsc1 Amb18180319 [1,1,0,0,0,0|2,0,0]=4 1319 B11R1.77 N[C@@H](CC(=O)O)c1cncs1 Amb27453232 [1,1,0,0,0,0|1,0,0]=3 1320 B11R1.77 N[C@@H](CC(=O)O)c1cnsc1 Amb33254126 [1,1,0,0,0,0|2,0,0]=4 1321 B11R1.77 N[C@@H](CC(=O)O)c1cscn1 Amb25861492 [1,1,0,0,0,0|1,0,1]=4 1322 B11R1.77 N[C@H](CC(=O)O)c1ccco1 Amb25319193 [1,1,0,0,0,0|2,0,0]=4 1323 B11R1.77 N[C@H](CC(=O)O)c1cccs1 Amb26888722 [1,1,0,0,0,0|2,0,0]=4 1324 B11R1.77 N[C@H](CC(=O)O)c1ccns1 Amb29856235 [1,1,0,0,0,0|2,0,0]=4 1325 B11R1.77 N[C@H](CC(=O)O)c1ccoc1 Amb27617385 [1,1,0,0,0,0|2,0,0]=4 1326 B11R1.77 N[C@H](CC(=O)O)c1ccsc1 Amb26483854 [1,1,0,0,0,0|2,0,0]=4 1327 B11R1.77 N[C@H](CC(=O)O)c1cncs1 Amb27257101 [1,1,0,0,0,0|1,0,0]=3 1328 B11R1.77 N[C@H](CC(=O)O)c1cnsc1 Amb33255225 [1,1,0,0,0,0|2,0,0]=4 1329 B11R1.77 N[C@H](CC(=O)O)c1cscn1 Amb27591355 [1,1,0,0,0,0|1,0,1]=4 1330 B11R1.77 O=C(O)CC(O)c1ccco1 Amb17232169 [1,1,0,0,0,0|2,0,0]=4 1331 B11R1.77 O=C(O)CC(O)c1cccs1 Amb17232866 [1,1,0,0,0,0|2,0,0]=4 1332 B11R1.77 O=C(O)CC(O)c1ccns1 Amb33036206 [1,1,0,0,0,0|2,0,0]=4 1333 B11R1.77 O=C(O)CC(O)c1ccoc1 Amb24485369 [1,1,0,0,0,0|2,0,0]=4 1334 B11R1.77 O=C(O)CC(O)c1ccsc1 Amb18298148 [1,1,0,0,0,0|2,0,0]=4 1335 B11R1.77 O=C(O)CC(O)c1cnco1 Amb18200045 [1,1,0,0,0,0|1,0,0]=3 1336 B11R1.77 O=C(O)CC(O)c1cncs1 Amb18198065 [1,1,0,0,0,0|1,0,0]=3 1337 B11R1.77 O=C(O)CC(O)c1cnsc1 Amb33036121 [1,1,0,0,0,0|2,0,0]=4 1338 B11R1.77 O=C(O)CC(O)c1cscn1 Amb18198066 [1,1,0,0,0,0|1,0,1]=4 1339 B11R1.77 O=C(O)C[C@@H](O)c1ccco1 Amb33360966 [1,1,0,0,0,0|2,0,0]=4 1340 B11R1.77 O=C(O)C[C@@H](O)c1cccs1 Amb33360892 [1,1,0,0,0,0|2,0,0]=4 1341 B11R1.77 O=C(O)C[C@@H](O)c1ccoc1 Amb33361227 [1,1,0,0,0,0|2,0,0]=4 1342 B11R1.77 O=C(O)C[C@@H](O)c1ccsc1 Amb33428932 [1,1,0,0,0,0|2,0,0]=4 1343 B11R1.77 O=C(O)C[C@@H](O)c1cnco1 Amb33414844 [1,1,0,0,0,0|1,0,0]=3 1344 B11R1.77 O=C(O)C[C@@H](O)c1cncs1 Amb33269156 [1,1,0,0,0,0|1,0,0]=3 1345 B11R1.77 O=C(O)C[C@@H](O)c1cscn1 Amb33418195 [1,1,0,0,0,0|1,0,1]=4 1346 B11R1.77 O=C(O)C[C@H](O)c1ccco1 Amb33360969 [1,1,0,0,0,0|2,0,0]=4 1347 B11R1.77 O=C(O)C[C@H](O)c1cccs1 Amb33360894 [1,1,0,0,0,0|2,0,0]=4 1348 B11R1.77 O=C(O)C[C@H](O)c1ccoc1 Amb33361337 [1,1,0,0,0,0|2,0,0]=4 1349 B11R1.77 O=C(O)C[C@H](O)c1ccsc1 Amb33428934 [1,1,0,0,0,0|2,0,0]=4 1350 B11R1.77 O=C(O)C[C@H](O)c1cnco1 Amb33414846 [1,1,0,0,0,0|1,0,0]=3 1351 B11R1.77 O=C(O)C[C@H](O)c1cncs1 Amb33225059 [1,1,0,0,0,0|1,0,0]=3 1352 B11R1.77 O=C(O)C[C@H](O)c1cscn1 Amb33418196 [1,1,0,0,0,0|1,0,1]=4 1353 B11R1.90 CC(=O)CCc1cccn1C Amb26038750 [1,1,0,0,0,0|2,0,0]=4 1354 B11R1.90 CC(=O)CCc1cncn1C Amb26048243 [1,1,0,0,0,0|1,0,0]=3 1355 B11R1.90 CC(=O)CCc1cnnn1C Amb24431181 [1,1,0,0,0,0|2,0,0]=4 1356 B11R1.90 CC(=O)CCc1scnc1C Amb26936638 [1,1,0,0,0,0|2,0,0]=4 1357 B11R1.90 CC(=O)OCc1cncn1C Amb27220497 [1,1,0,0,0,0|2,0,0]=4 1358 B11R1.90 CC(O)CCc1cncn1C Amb25149314 [1,1,0,0,0,0|1,0,1]=4 1359 B11R1.90 C[C@@H](O)CCc1cncn1C Amb32876986 [1,1,0,0,0,0|1,0,1]=4 1360 B11R1.90 C[C@H](O)CCc1cncn1C Amb32876989 [1,1,0,0,0,0|1,0,1]=4 1361 B11R1.90 Cc1ccoc1CCC(=O)O Amb18200842 [1,1,0,0,0,0|2,0,0]=4 1362 B11R1.90 Cc1ccsc1CCC(=O)O Amb2592463 [1,1,0,0,0,0|2,0,0]=4 1363 B11R1.90 Cc1cncn1CCC(=O)O Amb9901687 [1,1,0,0,0,0|2,0,0]=4 1364 B11R1.90 Cc1cnsc1CCC(=O)O Amb18198609 [1,1,0,0,0,0|2,0,0]=4 1365 B11R1.90 Cc1cocc1CCC(=O)O Amb24628818 [1,1,0,0,0,0|2,0,0]=4 1366 B11R1.90 Cc1cscc1CCC(=O)O Amb33469921 [1,1,0,0,0,0|2,0,0]=4 1367 B11R1.90 Cc1nccn1CCC(=O)O Amb1099401 [1,1,0,0,0,0|2,0,0]=4 1368 B11R1.90 Cc1nccn1CCC(=O)O Amb1292944 [1,1,0,0,0,0|2,0,0]=4 1369 B11R1.90 Cc1nccn1CCC(=O)O Amb8503293 [1,1,0,0,0,0|2,0,0]=4 1370 B11R1.90 Cc1ncnn1CCC(=O)O Amb18254989 [1,1,0,0,0,0|1,0,1]=4 1371 B11R1.90 Cc1ncoc1CCC(=O)O Amb18830918 [1,1,0,0,0,0|1,0,0]=3 1372 B11R1.90 Cc1ncsc1CCC(=O)O Amb3941253 [1,1,0,0,0,0|1,0,0]=3 1373 B11R1.90 Cc1ncsc1OCC(=O)O Amb33271215 [1,1,0,0,0,0|2,0,0]=4 1374 B11R1.90 Cc1nnsc1CCC(=O)O Amb28239590 [1,1,0,0,0,0|2,0,0]=4 1375 B11R1.90 Cc1nocc1CCC(=O)O Amb18200518 [1,1,0,0,0,0|2,0,0]=4 1376 B11R1.90 Cc1nonc1CCC(=O)O Amb18200254 [1,1,0,0,0,0|1,0,1]=4 1377 B11R1.90 Cc1nsnc1CCC(=O)O Amb18825365 [1,1,0,0,0,0|1,0,1]=4 1378 B11R1.90 Cc1ocnc1CCC(=O)O Amb18200534 [1,1,0,0,0,0|1,0,1]=4 1379 B11R1.90 Cc1oncc1CCC(=O)O Amb18200543 [1,1,0,0,0,0|2,0,0]=4 1380 B11R1.90 Cc1sccc1CCC(=O)O Amb18198905 [1,1,0,0,0,0|2,0,0]=4 1381 B11R1.90 Cc1sncc1CCC(=O)O Amb18825426 [1,1,0,0,0,0|2,0,0]=4 1382 B11R1.90 Cn1cccc1CCC(=O)O Amb33531730 [1,1,0,0,0,0|1,0,0]=3 1383 B11R1.90 Cn1cccc1NCC(=O)O Amb28320762 [1,1,0,0,0,0|2,0,0]=4 1384 B11R1.90 Cn1cccc1OCC(=O)O Amb33203951 [1,1,0,0,0,0|2,0,0]=4 1385 B11R1.90 Cn1ccnc1CCC(=O)O Amb2694658 [1,1,0,0,0,0|2,0,0]=4 1386 B11R1.90 Cn1ccnc1CCC(=O)O Amb32992708 [1,1,0,0,0,0|2,0,0]=4 1387 B11R1.90 Cn1cncc1C#CC(=O)O Amb25826828 [1,1,0,0,0,0|0,0,2]=4 1388 B11R1.90 Cn1cncc1CCC(=O)O Amb33551071 [1,1,0,0,0,0|0,0,0]=2 1389 B11R1.90 Cn1cncc1CCC(N)=O Amb27973525 [1,1,0,0,0,0|1,0,0]=3 1390 B11R1.90 Cn1cncc1CC[N+](=O)[O-] Amb32876973 [1,1,0,0,0,0|1,0,1]=4 1391 B11R1.90 Cn1cncc1CNC(N)=O Amb27443533 [1,1,0,0,0,0|2,0,0]=4 1392 B11R1.90 Cn1cncc1COC(=O)Cl Amb33297342 [1,1,0,0,0,0|2,0,0]=4 1393 B11R1.90 Cn1cncc1OCC(=O)O Amb32882625 [1,1,0,0,0,0|1,0,0]=3 1394 B11R1.90 Cn1cncc1\C=C\C(=O)O Amb32663974 [1,1,0,0,0,0|0,0,2]=4 1395 B11R1.90 Cn1cncc1\C=C\C(=O)O Amb33276186 [1,1,0,0,0,0|0,0,2]=4 1396 B11R1.90 Cn1cnnc1CCC(=O)O Amb10608042 [1,1,0,0,0,0|1,0,0]=3 1397 B11R1.90 Cn1cnnc1SCC(=O)O Amb6355979 [1,1,0,0,0,0|2,0,0]=4 1398 B11R1.90 Cn1nccc1CCC(=O)O Amb6888350 [1,1,0,0,0,0|2,0,0]=4 1399 B11R1.90 Cn1ncnc1CCC(=O)O Amb18995485 [1,1,0,0,0,0|1,0,1]=4 1400 B11R1.90 Cn1nncc1CCC(=O)O Amb25075001 [1,1,0,0,0,0|1,0,0]=3 1401 B11R1.90 Cn1nncc1OCC(=O)O Amb26350961 [1,1,0,0,0,0|2,0,0]=4 1402 B11R1.90 Cn1nnnc1CCC(=O)O Amb24670084 [1,1,0,0,0,0|2,0,0]=4 1403 B11R1.90 Nc1cncn1CCC(=O)O Amb27874034 [1,1,0,0,0,0|2,0,0]=4 1404 B11R1.90 Nc1nccn1CCC(=O)O Amb4296895 [1,1,0,0,0,0|2,0,0]=4 1405 B11R1.90 Nc1oncc1CCC(=O)O Amb27209688 [1,1,0,0,0,0|2,0,0]=4 1406 B11R1.90 Nn1cnnc1SCC(=O)O Amb640937 [1,1,0,0,0,0|2,0,0]=4 1407 B11R1.90 O=C(O)CCc1ccoc1Br Amb33470231 [1,1,0,0,0,0|2,0,0]=4 1408 B11R1.90 O=C(O)CCc1ccoc1Cl Amb33470229 [1,1,0,0,0,0|2,0,0]=4 1409 B11R1.90 O=C(O)CCc1ccsc1Br Amb27453855 [1,1,0,0,0,0|2,0,0]=4 1410 B11R1.90 O=C(O)CCc1cscc1Br Amb25826996 [1,1,0,0,0,0|2,0,0]=4 1411 B11R1.90 O=C(O)CCc1cscc1Cl Amb32713276 [1,1,0,0,0,0|2,0,0]=4 1412 B11R1.90 O=C(O)CCc1ncsc1Br Amb33470276 [1,1,0,0,0,0|1,0,1]=4 1413 B11R1.90 O=C(O)CCc1occc1F Amb27823334 [1,1,0,0,0,0|2,0,0]=4 1414 B11R1.90 O=C(O)CCc1sccc1Br Amb18293479 [1,1,0,0,0,0|2,0,0]=4 1415 B11R1.90 O=C(O)CCc1sccc1Cl Amb28061379 [1,1,0,0,0,0|2,0,0]=4 1416 B11R1.90 O=C(O)CCc1sccc1F Amb33470227 [1,1,0,0,0,0|2,0,0]=4 1417 B11R1.90 O=C(O)CCc1sccc1I Amb33470233 [1,1,0,0,0,0|2,0,0]=4 1418 B11R1.90 O=C(O)CCc1scnc1Br Amb18732847 [1,1,0,0,0,0|1,0,0]=3 1419 B11R1.90 O=C(O)CCn1ccnc1Cl Amb32670220 [1,1,0,0,0,0|2,0,0]=4 1420 B11R1.90 O=C(O)CCn1ccnc1O Amb18200269 [1,1,0,0,0,0|2,0,0]=4 1421 B11R1.90 O=C(O)CCn1ccnc1S Amb18825367 [1,1,0,0,0,0|2,0,0]=4 1422 B11R1.90 O=C(O)CCn1ncnc1Br Amb24269224 [1,1,0,0,0,0|1,0,1]=4 1423 B11R1.90 O=C(O)CCn1ncnc1Cl Amb24269227 [1,1,0,0,0,0|1,0,1]=4 1424 B11R1.89 C=C(C(=O)O)c1cncn1C Amb32876975 [0,1,0,0,1,0|1,0,1]=4 1425 B11R1.89 CC(C(=O)O)c1cccn1C Amb18644562 [0,1,0,0,1,0|2,0,0]=4 1426 B11R1.89 CC(C(=O)O)c1cncn1C Amb33347245 [0,1,0,0,1,0|1,0,0]=3 1427 B11R1.89 CC(C(=O)O)c1cnnn1C Amb24657851 [0,1,0,0,1,0|2,0,0]=4 1428 B11R1.89 CC(C(=O)O)c1nncn1C Amb18200482 [0,1,0,0,1,0|2,0,0]=4 1429 B11R1.89 Cc1ccoc1C(N)C(=O)O Amb18200530 [0,1,0,0,1,0|2,0,0]=4 1430 B11R1.89 Cc1ccsc1C(N)C(=O)O Amb3941903 [0,1,0,0,1,0|2,0,0]=4 1431 B11R1.89 Cc1cnoc1C(N)C(=O)O Amb27958718 [0,1,0,0,1,0|2,0,0]=4 1432 B11R1.89 Cc1cscc1C(N)C(=O)O Amb27167582 [0,1,0,0,1,0|2,0,0]=4 1433 B11R1.89 Cc1ncsc1C(C)C(=O)O Amb32713476 [0,1,0,0,1,0|2,0,0]=4 1434 B11R1.89 Cc1ncsc1C(F)C(=O)O Amb32713477 [0,1,0,0,1,0|2,0,0]=4 1435 B11R1.89 Cc1ncsc1C(N)C(=O)O Amb18198322 [0,1,0,0,1,0|1,0,0]=3 1436 B11R1.89 Cc1ncsc1C(O)C(=O)O Amb18825306 [0,1,0,0,1,0|2,0,0]=4 1437 B11R1.89 Cc1nnsc1C(N)C(=O)O Amb27781742 [0,1,0,0,1,0|2,0,0]=4 1438 B11R1.89 Cc1nonc1C(N)C(=O)O Amb18200036 [0,1,0,0,1,0|1,0,1]=4 1439 B11R1.89 Cc1occc1C(N)C(=O)O Amb28388760 [0,1,0,0,1,0|2,0,0]=4 1440 B11R1.89 Cc1oncc1C(N)C(=O)O Amb33361984 [0,1,0,0,1,0|2,0,0]=4 1441 B11R1.89 Cn1cccc1C(Cl)C(=O)O Amb27808563 [0,1,0,0,1,0|2,0,0]=4 1442 B11R1.89 Cn1cccc1C(N)C(=O)O Amb18200802 [0,1,0,0,1,0|1,0,0]=3 1443 B11R1.89 Cn1cccc1C(O)C(=O)O Amb18830923 [0,1,0,0,1,0|2,0,0]=4 1444 B11R1.89 Cn1ccnc1C(N)C(=O)O Amb16232075 [0,1,0,0,1,0|2,0,0]=4 1445 B11R1.89 Cn1cncc1C(=O)C(=O)O Amb18200865 [0,1,0,0,1,0|1,0,1]=4 1446 B11R1.89 Cn1cncc1C(F)C(=O)O Amb33347246 [0,1,0,0,1,0|1,0,0]=3 1447 B11R1.89 Cn1cncc1C(N)C(=O)O Amb26081320 [0,1,0,0,1,0|0,0,0]=2 1448 B11R1.89 Cn1cncc1C(O)C(=O)O Amb18200279 [0,1,0,0,1,0|1,0,0]=3 1449 B11R1.89 Cn1cncc1C(O)C(=O)O Amb28872327 [0,1,0,0,1,0|1,0,0]=3 1450 B11R1.89 Cn1cncc1[C@H](N)C(=O)O Amb27776950 [0,1,0,0,1,0|0,0,0]=2 1451 B11R1.89 Cn1cnnc1C(F)C(=O)O Amb24557286 [0,1,0,0,1,0|2,0,0]=4 1452 B11R1.89 Cn1nccc1C(N)C(=O)O Amb24691450 [0,1,0,0,1,0|2,0,0]=4 1453 B11R1.89 Cn1nccc1C(N)C(=O)O Amb28920698 [0,1,0,0,1,0|2,0,0]=4 1454 B11R1.89 Cn1nccc1C(N)C(=O)O Amb32663979 [0,1,0,0,1,0|2,0,0]=4 1455 B11R1.89 Cn1nncc1C(F)C(=O)O Amb24357733 [0,1,0,0,1,0|2,0,0]=4 1456 B11R1.89 Cn1nncc1C(O)C(=O)O Amb28423262 [0,1,0,0,1,0|2,0,0]=4 1457 B11R1.89 NC(C(=O)O)c1ccoc1F Amb27164231 [0,1,0,0,1,0|2,0,0]=4 1458 B11R1.89 NC(C(=O)O)c1ccsc1Cl Amb28250805 [0,1,0,0,1,0|2,0,0]=4 1459 B11R1.89 NC(C(=O)O)c1ccsc1F Amb27426943 [0,1,0,0,1,0|2,0,0]=4 1460 B11R1.89 NC(C(=O)O)c1cocc1F Amb27176306 [0,1,0,0,1,0|2,0,0]=4 1461 B11R1.89 NC(C(=O)O)c1cscc1F Amb28456449 [0,1,0,0,1,0|2,0,0]=4 1462 B11R1.89 NC(C(=O)O)c1cscc1O Amb27454616 [0,1,0,0,1,0|2,0,0]=4 1463 B11R1.89 NC(C(=O)O)c1occc1Br Amb27398546 [0,1,0,0,1,0|2,0,0]=4 1464 B11R1.89 NC(C(=O)O)c1sccc1Br Amb24375714 [0,1,0,0,1,0|2,0,0]=4 1465 B11R1.89 NC(C(=O)O)c1sccc1Cl Amb28346855 [0,1,0,0,1,0|2,0,0]=4 1466 B11R1.89 NC(C(=O)O)c1sccc1I Amb27465392 [0,1,0,0,1,0|2,0,0]=4 1467 B11R1.89 NC(C(=O)O)c1sccc1O Amb27950598 [0,1,0,0,1,0|2,0,0]=4 1468 B11R1.89 N[C@@H](C(=O)O)c1ccnn1O Amb27398468 [0,1,0,0,1,0|2,0,0]=4 1469 B11R1.89 N[C@@H](C(=O)O)c1sccc1Cl Amb27491807 [0,1,0,0,1,0|2,0,0]=4 1470 B11R1.89 N[C@H](C(=O)O)c1ccnn1O Amb28312952 [0,1,0,0,1,0|2,0,0]=4 1471 B11R1.89 N[C@H](C(=O)O)c1ccsc1Cl Amb27646196 [0,1,0,0,1,0|2,0,0]=4 1472 B11R1.89 N[C@H](C(=O)O)c1cscc1Br Amb28368316 [0,1,0,0,1,0|2,0,0]=4 1473 B11R1.89 N[C@H](C(=O)O)c1sccc1Br Amb27640902 [0,1,0,0,1,0|2,0,0]=4 1474 B11R1.89 N[C@H](C(=O)O)c1sccc1I Amb28241075 [0,1,0,0,1,0|2,0,0]=4 1475 B11R1.89 Nc1occc1C(N)C(=O)O Amb27163509 [0,1,0,0,1,0|2,0,0]=4 1476 B11R1.89 Nc1sccc1C(N)C(=O)O Amb27391150 [0,1,0,0,1,0|2,0,0]=4 1477 B11R1.173 CC(C)(C(=O)O)c1cnco1 Amb18200528 [0,1,0,0,1,0|2,0,0]=4 1478 B11R1.173 CC(C)(C(=O)O)c1cncs1 Amb29878196 [0,1,0,0,1,0|2,0,0]=4 1479 B11R1.173 CC(N)(C(=O)O)c1ccco1 Amb17621967 [0,1,0,0,1,0|2,0,0]=4 1480 B11R1.173 CC(N)(C(=O)O)c1cccs1 Amb9833690 [0,1,0,0,1,0|2,0,0]=4 1481 B11R1.173 CC(N)(C(=O)O)c1ccsc1 Amb27881732 [0,1,0,0,1,0|2,0,0]=4 1482 B11R1.173 C[C@](N)(C(=O)O)c1ccco1 Amb27617400 [0,1,0,0,1,0|2,0,0]=4 1483 B11R1.173 O=C(O)C(F)(F)c1cnco1 Amb33227026 [0,1,0,0,1,0|2,0,0]=4 1484 B11R1.173 O=C(O)C(F)(F)c1cncs1 Amb29878197 [0,1,0,0,1,0|2,0,0]=4 1485 B11R1.298 CCC(C(=O)O)c1cnco1 Amb33295051 [0,1,0,0,1,0|2,0,0]=4 1486 B11R1.298 CCC(C(=O)O)c1cncs1 Amb29878195 [0,1,0,0,1,0|2,0,0]=4 1487 B11R1.298 CNC(C(=O)O)c1ccco1 Amb27399701 [0,1,0,0,1,0|2,0,0]=4 1488 B11R1.298 CNC(C(=O)O)c1cccs1 Amb17622296 [0,1,0,0,1,0|2,0,0]=4 1489 B11R1.298 CNC(C(=O)O)c1ccns1 Amb35717133 [0,1,0,0,1,0|2,0,0]=4 1490 B11R1.298 CNC(C(=O)O)c1ccsc1 Amb9619775 [0,1,0,0,1,0|2,0,0]=4 1491 B11R1.298 COC(C(=O)O)c1cncs1 Amb27975087 [0,1,0,0,1,0|2,0,0]=4 1492 B11R1.298 NCC(C(=O)O)c1ccco1 Amb17399993 [0,1,0,0,1,0|2,0,0]=4 1493 B11R1.298 NCC(C(=O)O)c1cccs1 Amb17400352 [0,1,0,0,1,0|2,0,0]=4 1494 B11R1.298 NCC(C(=O)O)c1ccno1 Amb27234119 [0,1,0,0,1,0|2,0,0]=4 1495 B11R1.298 NCC(C(=O)O)c1ccoc1 Amb33361258 [0,1,0,0,1,0|2,0,0]=4 1496 B11R1.298 NCC(C(=O)O)c1ccsc1 Amb26327039 [0,1,0,0,1,0|2,0,0]=4 1497 B11R1.298 NCC(C(=O)O)c1cnco1 Amb33415246 [0,1,0,0,1,0|1,0,0]=3 1498 B11R1.298 NCC(C(=O)O)c1cncs1 Amb33269991 [0,1,0,0,1,0|1,0,0]=3 1499 B11R1.298 NCC(C(=O)O)c1cscn1 Amb33319117 [0,1,0,0,1,0|1,0,1]=4 1500 B11R1.298 NNC(C(=O)O)c1ccco1 Amb17399999 [0,1,0,0,1,0|2,0,0]=4 1501 B11R1.298 NNC(C(=O)O)c1cccs1 Amb17400366 [0,1,0,0,1,0|2,0,0]=4 1502 B11R1.314 CC(C(=O)O)c1cnc(Cl)s1 Amb33059191 [0,1,0,0,1,0|2,0,0]=4 1503 B11R1.314 Cc1cc(C(N)C(=O)O)on1 Amb18200262 [0,1,0,0,1,0|2,0,0]=4 1504 B11R1.314 Cc1cc([C@@H](N)C(=O)O)cs1 Amb27170528 [0,1,0,0,1,0|2,0,0]=4 1505 B11R1.314 Cc1ccc(C(N)C(=O)O)s1 Amb3941901 [0,1,0,0,1,0|2,0,0]=4 1506 B11R1.314 Cc1ccc([C@@H](N)C(=O)O)o1 Amb28291367 [0,1,0,0,1,0|2,0,0]=4 1507 B11R1.314 Cc1csc(C(N)C(=O)O)c1 Amb18198604 [0,1,0,0,1,0|2,0,0]=4 1508 B11R1.314 Cc1csc([C@@H](N)C(=O)O)c1 Amb28457716 [0,1,0,0,1,0|2,0,0]=4 1509 B11R1.314 Cc1ncc(C(C)C(=O)O)s1 Amb18198592 [0,1,0,0,1,0|2,0,0]=4 1510 B11R1.314 Cc1ncc(C(F)C(=O)O)s1 Amb32713454 [0,1,0,0,1,0|2,0,0]=4 1511 B11R1.314 Cc1ncc(C(N)C(=O)O)s1 Amb18198323 [0,1,0,0,1,0|1,0,0]=3 1512 B11R1.314 Cc1ncc(C(O)C(=O)O)s1 Amb18198073 [0,1,0,0,1,0|2,0,0]=4 1513 B11R1.314 Cn1cc(C(N)C(=O)O)cn1 Amb32652881 [0,1,0,0,1,0|2,0,0]=4 1514 B11R1.314 Cn1cc(C(N)C(=O)O)cn1 Amb9752541 [0,1,0,0,1,0|2,0,0]=4 1515 B11R1.314 Cn1ccc(C(N)C(=O)O)c1 Amb18224355 [0,1,0,0,1,0|1,0,1]=4 1516 B11R1.314 Cn1cnc(C(N)C(=O)O)c1 Amb27817715 [0,1,0,0,1,0|0,0,2]=4 1517 B11R1.314 NC(C(=O)O)c1cc(Br)co1 Amb27786414 [0,1,0,0,1,0|2,0,0]=4 1518 B11R1.314 NC(C(=O)O)c1cc(Br)cs1 Amb18953620 [0,1,0,0,1,0|2,0,0]=4 1519 B11R1.314 NC(C(=O)O)c1cc(Cl)co1 Amb26889133 [0,1,0,0,1,0|2,0,0]=4 1520 B11R1.314 NC(C(=O)O)c1cc(Cl)cs1 Amb28313663 [0,1,0,0,1,0|2,0,0]=4 1521 B11R1.314 NC(C(=O)O)c1cc(F)cs1 Amb28400210 [0,1,0,0,1,0|2,0,0]=4 1522 B11R1.314 NC(C(=O)O)c1ccc(Br)o1 Amb25823696 [0,1,0,0,1,0|2,0,0]=4 1523 B11R1.314 NC(C(=O)O)c1ccc(Br)s1 Amb3941902 [0,1,0,0,1,0|2,0,0]=4 1524 B11R1.314 NC(C(=O)O)c1ccc(Cl)o1 Amb24761476 [0,1,0,0,1,0|2,0,0]=4 1525 B11R1.314 NC(C(=O)O)c1ccc(Cl)s1 Amb4134817 [0,1,0,0,1,0|2,0,0]=4 1526 B11R1.314 NC(C(=O)O)c1ccc(O)o1 Amb27398515 [0,1,0,0,1,0|2,0,0]=4 1527 B11R1.314 NC(C(=O)O)c1cnc(Cl)s1 Amb33059184 [0,1,0,0,1,0|1,0,0]=3 1528 B11R1.314 NC(C(=O)O)c1coc(Br)c1 Amb27839865 [0,1,0,0,1,0|2,0,0]=4 1529 B11R1.314 NC(C(=O)O)c1coc(O)c1 Amb27644666 [0,1,0,0,1,0|2,0,0]=4 1530 B11R1.314 NC(C(=O)O)c1csc(Br)c1 Amb26889283 [0,1,0,0,1,0|2,0,0]=4 1531 B11R1.314 NC(C(=O)O)c1csc(Br)n1 Amb32680734 [0,1,0,0,1,0|1,0,1]=4 1532 B11R1.314 NC(C(=O)O)c1csc(Cl)c1 Amb26075704 [0,1,0,0,1,0|2,0,0]=4 1533 B11R1.314 N[C@@H](C(=O)O)c1ccc(Br)o1 Amb27259498 [0,1,0,0,1,0|2,0,0]=4 1534 B11R1.314 N[C@@H](C(=O)O)c1ccc(Cl)s1 Amb27974507 [0,1,0,0,1,0|2,0,0]=4 1535 B11R1.314 N[C@@H](C(=O)O)c1cnn(O)c1 Amb27645398 [0,1,0,0,1,0|2,0,0]=4 1536 B11R1.314 N[C@H](C(=O)O)c1cc(Br)cs1 Amb27224020 [0,1,0,0,1,0|2,0,0]=4 1537 B11R1.314 N[C@H](C(=O)O)c1cc(O)no1 Amb22800331 [0,1,0,0,1,0|2,0,0]=4 1538 B11R1.314 N[C@H](C(=O)O)c1ccc(Br)o1 Amb27649611 [0,1,0,0,1,0|2,0,0]=4 1539 B11R1.314 N[C@H](C(=O)O)c1ccc(Br)s1 Amb28187091 [0,1,0,0,1,0|2,0,0]=4 1540 B11R1.314 N[C@H](C(=O)O)c1cnn(O)c1 Amb28384084 [0,1,0,0,1,0|2,0,0]=4 1541 B11R1.314 Nc1ccc(C(N)C(=O)O)s1 Amb27263612 [0,1,0,0,1,0|2,0,0]=4 1542 B11R1.314 Nc1ncc(C(O)C(=O)O)s1 Amb18647806 [0,1,0,0,1,0|2,0,0]=4 1543 B11R1.314 Nc1ncc([C@@H](N)C(=O)O)s1 Amb27658585 [0,1,0,0,1,0|1,0,0]=3 1544 B11R1.314 O=C(O)C(O)c1cnc(Cl)s1 Amb33220946 [0,1,0,0,1,0|2,0,0]=4 1545 B13R1.133 CC(Cc1ccc(Br)nc1)C(=O)O Amb33387670 [0,1,0,0,0,1|2,0,0]=4 1546 B13R1.133 CC(Cc1ccc(Cl)nc1)C(=O)O Amb25685273 [0,1,0,0,0,1|2,0,0]=4 1547 B13R1.133 CC(Cc1ccc(F)nc1)C(=O)O Amb33426574 [0,1,0,0,0,1|2,0,0]=4 1548 B13R1.133 CC(Cc1cnc(Cl)cn1)C(=O)O Amb27625914 [0,1,0,0,0,1|1,0,1]=4 1549 B13R1.133 C[C@@H](Cc1ccc(F)nc1)C(=O)O Amb33743267 [0,1,0,0,0,1|2,0,0]=4 1550 B13R1.133 C[C@H](Cc1ccc(F)nc1)C(=O)O Amb33728205 [0,1,0,0,0,1|2,0,0]=4 1551 B13R1.133 Cc1ccc(CC(C)C(=O)O)cn1 Amb27608956 [0,1,0,0,0,1|2,0,0]=4 1552 B13R1.133 Cc1ccc(CC(N)C(=O)O)cc1 Amb33463040 [0,1,0,0,0,1|2,0,0]=4 1553 B13R1.133 Cc1ccc(CC(N)C(=O)O)cc1 Amb3788276 [0,1,0,0,0,1|2,0,0]=4 1554 B13R1.133 Cc1ccc(CC(N)C(=O)O)cn1 Amb18193897 [0,1,0,0,0,1|1,0,0]=3 1555 B13R1.133 Cc1ccc(CC(N)C(=O)O)nc1 Amb3788312 [0,1,0,0,0,1|1,0,1]=4 1556 B13R1.133 Cc1ccc(CC(N)C(=O)O)nn1 Amb18193226 [0,1,0,0,0,1|1,0,1]=4 1557 B13R1.133 Cc1ccc(CC(N)C(N)=O)cn1 Amb33066044 [0,1,0,0,0,1|2,0,0]=4 1558 B13R1.133 Cc1ccc(CC(O)C(=O)O)cn1 Amb32878624 [0,1,0,0,0,1|2,0,0]=4 1559 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)cc1 Amb8397010 [0,1,0,0,0,1|2,0,0]=4 1560 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)cn1 Amb25836372 [0,1,0,0,0,1|1,0,0]=3 1561 B13R1.133 Cc1ccc(C[C@@H](N)C(=O)O)nn1 Amb33066040 [0,1,0,0,0,1|1,0,1]=4 1562 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cc1 Amb8397007 [0,1,0,0,0,1|2,0,0]=4 1563 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb27609589 [0,1,0,0,0,1|1,0,0]=3 1564 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)cn1 Amb33872485 [0,1,0,0,0,1|1,0,0]=3 1565 B13R1.133 Cc1ccc(C[C@H](N)C(=O)O)nn1 Amb33066217 [0,1,0,0,0,1|1,0,1]=4 1566 B13R1.133 Cc1cnc(CC(C)C(=O)O)cn1 Amb33375593 [0,1,0,0,0,1|1,0,1]=4 1567 B13R1.133 Cc1cnc(CC(N)C(=O)O)cn1 Amb18193225 [0,1,0,0,0,1|0,0,1]=3 1568 B13R1.133 Cc1cnc(CC(N)C(=O)O)nc1 Amb33065812 [0,1,0,0,0,1|1,0,1]=4 1569 B13R1.133 Cc1cnc(CC(N)C(N)=O)cn1 Amb33066175 [0,1,0,0,0,1|1,0,1]=4 1570 B13R1.133 Cc1cnc(CC(O)C(=O)O)cn1 Amb33375084 [0,1,0,0,0,1|1,0,1]=4 1571 B13R1.133 Cc1cnc(C[C@@H](N)C(=O)O)cn1 Amb33309208 [0,1,0,0,0,1|0,0,1]=3 1572 B13R1.133 Cc1cnc(C[C@@H](N)C(=O)O)nc1 Amb33308982 [0,1,0,0,0,1|1,0,1]=4 1573 B13R1.133 Cc1cnc(C[C@H](N)C(=O)O)cn1 Amb33066209 [0,1,0,0,0,1|0,0,1]=3 1574 B13R1.133 Cc1cnc(C[C@H](N)C(=O)O)nc1 Amb33036958 [0,1,0,0,0,1|1,0,1]=4 1575 B13R1.133 Cc1ncc(CC(O)C(=O)O)cn1 Amb33353507 [0,1,0,0,0,1|1,0,1]=4 1576 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)nc1 Amb33066191 [0,1,0,0,0,1|2,0,0]=4 1577 B13R1.133 NC(=O)C(N)Cc1cnc(Cl)cn1 Amb32789394 [0,1,0,0,0,1|1,0,1]=4 1578 B13R1.133 NC(CC1=CNC(=O)C=C1)C(=O)O Amb24649985 [0,1,0,0,0,1|1,0,0]=3 1579 B13R1.133 NC(Cc1cc[n+]([O-])cc1)C(=O)O Amb17594678 [0,1,0,0,0,1|1,0,1]=4 1580 B13R1.133 NC(Cc1ccc(Br)cc1)C(=O)O Amb22490717 [0,1,0,0,0,1|2,0,0]=4 1581 B13R1.133 NC(Cc1ccc(Br)cc1)C(=O)O Amb2713315 [0,1,0,0,0,1|2,0,0]=4 1582 B13R1.133 NC(Cc1ccc(Br)cn1)C(=O)O Amb26594126 [0,1,0,0,0,1|1,0,1]=4 1583 B13R1.133 NC(Cc1ccc(Br)nc1)C(=O)O Amb26594363 [0,1,0,0,0,1|1,0,0]=3 1584 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb30867690 [0,1,0,0,0,1|2,0,0]=4 1585 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb8469810 [0,1,0,0,0,1|2,0,0]=4 1586 B13R1.133 NC(Cc1ccc(Cl)cc1)C(=O)O Amb9724294 [0,1,0,0,0,1|2,0,0]=4 1587 B13R1.133 NC(Cc1ccc(Cl)cn1)C(=O)O Amb27268269 [0,1,0,0,0,1|1,0,1]=4 1588 B13R1.133 NC(Cc1ccc(Cl)cn1)C(=O)O Amb35747081 [0,1,0,0,0,1|1,0,1]=4 1589 B13R1.133 NC(Cc1ccc(Cl)nc1)C(=O)O Amb25282233 [0,1,0,0,0,1|1,0,0]=3 1590 B13R1.133 NC(Cc1ccc(Cl)nn1)C(=O)O Amb33308646 [0,1,0,0,0,1|1,0,1]=4 1591 B13R1.133 NC(Cc1ccc(F)cc1)C(=O)O Amb20246818 [0,1,0,0,0,1|2,0,0]=4 1592 B13R1.133 NC(Cc1ccc(F)cc1)C(=O)O Amb6342375 [0,1,0,0,0,1|2,0,0]=4 1593 B13R1.133 NC(Cc1ccc(F)cn1)C(=O)O Amb25843769 [0,1,0,0,0,1|1,0,1]=4 1594 B13R1.133 NC(Cc1ccc(F)nc1)C(=O)O Amb24351607 [0,1,0,0,0,1|1,0,0]=3 1595 B13R1.133 NC(Cc1ccc(I)cc1)C(=O)O Amb3796904 [0,1,0,0,0,1|2,0,0]=4 1596 B13R1.133 NC(Cc1ccc(I)cn1)C(=O)O Amb28397971 [0,1,0,0,0,1|1,0,1]=4 1597 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)O Amb22730237 [0,1,0,0,0,1|2,0,0]=4 1598 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)O Amb9703113 [0,1,0,0,0,1|2,0,0]=4 1599 B13R1.133 NC(Cc1ccc(O)cn1)C(=O)O Amb28137820 [0,1,0,0,0,1|1,0,1]=4 1600 B13R1.133 NC(Cc1ccc(O)nc1)C(=O)O Amb35746579 [0,1,0,0,0,1|1,0,0]=3 1601 B13R1.133 NC(Cc1ccc(S)cc1)C(=O)O Amb27870593 [0,1,0,0,0,1|2,0,0]=4 1602 B13R1.133 NC(Cc1ccc(S)cc1)C(=O)O Amb33482800 [0,1,0,0,0,1|2,0,0]=4 1603 B13R1.133 NC(Cc1cnc(Cl)cn1)C(=O)O Amb33308607 [0,1,0,0,0,1|0,0,1]=3 1604 B13R1.133 NC(Cc1ncc(Br)cn1)C(=O)O Amb33334354 [0,1,0,0,0,1|1,0,1]=4 1605 B13R1.133 N[C@@H](CC1=CCC(=O)CC1)C(=O)O Amb27451296 [0,1,0,0,0,1|2,0,0]=4 1606 B13R1.133 N[C@@H](CC1=CNC(=O)C=C1)C(=O)O Amb25109157 [0,1,0,0,0,1|1,0,0]=3 1607 B13R1.133 N[C@@H](Cc1ccc(Br)cc1)C(=O)O Amb6295861 [0,1,0,0,0,1|2,0,0]=4 1608 B13R1.133 N[C@@H](Cc1ccc(Br)cn1)C(=O)O Amb25364955 [0,1,0,0,0,1|1,0,1]=4 1609 B13R1.133 N[C@@H](Cc1ccc(Br)cn1)C(=O)O Amb30869509 [0,1,0,0,0,1|1,0,1]=4 1610 B13R1.133 N[C@@H](Cc1ccc(Cl)cc1)C(=O)O Amb2719692 [0,1,0,0,0,1|2,0,0]=4 1611 B13R1.133 N[C@@H](Cc1ccc(Cl)cn1)C(=O)O Amb27585540 [0,1,0,0,0,1|1,0,1]=4 1612 B13R1.133 N[C@@H](Cc1ccc(Cl)nc1)C(=O)O Amb26472566 [0,1,0,0,0,1|1,0,0]=3 1613 B13R1.133 N[C@@H](Cc1ccc(Cl)nn1)C(=O)O Amb32862465 [0,1,0,0,0,1|1,0,1]=4 1614 B13R1.133 N[C@@H](Cc1ccc(F)cc1)C(=O)O Amb2688314 [0,1,0,0,0,1|2,0,0]=4 1615 B13R1.133 N[C@@H](Cc1ccc(F)cc1)C(=O)O Amb6295863 [0,1,0,0,0,1|2,0,0]=4 1616 B13R1.133 N[C@@H](Cc1ccc(F)nc1)C(=O)O Amb25858507 [0,1,0,0,0,1|1,0,0]=3 1617 B13R1.133 N[C@@H](Cc1ccc(I)cc1)C(=O)O Amb3941497 [0,1,0,0,0,1|2,0,0]=4 1618 B13R1.133 N[C@@H](Cc1ccc(I)nc1)C(=O)O Amb28282605 [0,1,0,0,0,1|1,0,0]=3 1619 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(=O)O Amb22351112 [0,1,0,0,0,1|2,0,0]=4 1620 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(=O)O Amb533651 [0,1,0,0,0,1|2,0,0]=4 1621 B13R1.133 N[C@@H](Cc1ccc(O)cn1)C(=O)O Amb27810763 [0,1,0,0,0,1|1,0,1]=4 1622 B13R1.133 N[C@@H](Cc1cnc(Cl)cn1)C(=O)O Amb33069943 [0,1,0,0,0,1|0,0,1]=3 1623 B13R1.133 N[C@H](CC1=CNC(=O)C=C1)C(=O)O Amb27229771 [0,1,0,0,0,1|1,0,0]=3 1624 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(=O)O Amb20241889 [0,1,0,0,0,1|2,0,0]=4 1625 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(=O)O Amb3938905 [0,1,0,0,0,1|2,0,0]=4 1626 B13R1.133 N[C@H](Cc1ccc(Br)cn1)C(=O)O Amb25278417 [0,1,0,0,0,1|1,0,1]=4 1627 B13R1.133 N[C@H](Cc1ccc(Br)nc1)C(=O)O Amb27402625 [0,1,0,0,0,1|1,0,0]=3 1628 B13R1.133 N[C@H](Cc1ccc(Cl)cc1)C(=O)O Amb6295862 [0,1,0,0,0,1|2,0,0]=4 1629 B13R1.133 N[C@H](Cc1ccc(Cl)cc1)C(=O)O Amb8390370 [0,1,0,0,0,1|2,0,0]=4 1630 B13R1.133 N[C@H](Cc1ccc(Cl)cn1)C(=O)O Amb26034050 [0,1,0,0,0,1|1,0,1]=4 1631 B13R1.133 N[C@H](Cc1ccc(Cl)nc1)C(=O)O Amb26484990 [0,1,0,0,0,1|1,0,0]=3 1632 B13R1.133 N[C@H](Cc1ccc(Cl)nn1)C(=O)O Amb33127510 [0,1,0,0,0,1|1,0,1]=4 1633 B13R1.133 N[C@H](Cc1ccc(F)cc1)C(=O)O Amb2720054 [0,1,0,0,0,1|2,0,0]=4 1634 B13R1.133 N[C@H](Cc1ccc(F)cc1)C(=O)O Amb4034642 [0,1,0,0,0,1|2,0,0]=4 1635 B13R1.133 N[C@H](Cc1ccc(F)cn1)C(=O)O Amb28346894 [0,1,0,0,0,1|1,0,1]=4 1636 B13R1.133 N[C@H](Cc1ccc(F)nc1)C(=O)O Amb24680870 [0,1,0,0,0,1|1,0,0]=3 1637 B13R1.133 N[C@H](Cc1ccc(I)cc1)C(=O)O Amb6298337 [0,1,0,0,0,1|2,0,0]=4 1638 B13R1.133 N[C@H](Cc1ccc(O)cc1)C(=O)O Amb2718757 [0,1,0,0,0,1|2,0,0]=4 1639 B13R1.133 N[C@H](Cc1ccc(O)cn1)C(=O)O Amb27250648 [0,1,0,0,0,1|1,0,1]=4 1640 B13R1.133 N[C@H](Cc1cnc(Cl)cn1)C(=O)O Amb33065853 [0,1,0,0,0,1|0,0,1]=3 1641 B13R1.133 Nc1ccc(CC(N)C(=O)O)cc1 Amb24079001 [0,1,0,0,0,1|2,0,0]=4 1642 B13R1.133 Nc1ccc(CC(N)C(=O)O)cc1 Amb6357138 [0,1,0,0,0,1|2,0,0]=4 1643 B13R1.133 Nc1ccc(CC(O)C(=O)O)cn1 Amb27946962 [0,1,0,0,0,1|2,0,0]=4 1644 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)cc1 Amb19130487 [0,1,0,0,0,1|2,0,0]=4 1645 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)cc1 Amb8397002 [0,1,0,0,0,1|2,0,0]=4 1646 B13R1.133 Nc1ccc(C[C@@H](N)C(=O)O)nc1 Amb27447182 [0,1,0,0,0,1|1,0,1]=4 1647 B13R1.133 Nc1ccc(C[C@H](N)C(=O)O)cc1 Amb6295864 [0,1,0,0,0,1|2,0,0]=4 1648 B13R1.133 Nc1ccc(C[C@H](N)C(=O)O)cc1 Amb6365459 [0,1,0,0,0,1|2,0,0]=4 1649 B13R1.133 Nc1ncc(CC(N)C(=O)O)cn1 Amb26519679 [0,1,0,0,0,1|0,0,1]=3 1650 B13R1.133 O=C(O)C(O)Cc1ccc(Br)nc1 Amb33387745 [0,1,0,0,0,1|2,0,0]=4 1651 B13R1.133 O=C(O)C(O)Cc1ccc(Cl)nc1 Amb33261189 [0,1,0,0,0,1|2,0,0]=4 1652 B13R1.133 O=C(O)C(O)Cc1ccc(F)nc1 Amb33426547 [0,1,0,0,0,1|2,0,0]=4 1653 B13R1.135 CNC(=O)C(N)Cc1cccnc1 Amb27220814 [0,1,0,0,0,1|2,0,0]=4 1654 B13R1.135 CNC(=O)C(N)Cc1ccncc1 Amb27252186 [0,1,0,0,0,1|2,0,0]=4 1655 B13R1.135 CNC(=O)C(N)Cc1ccnnc1 Amb33230892 [0,1,0,0,0,1|2,0,0]=4 1656 B13R1.135 CNC(=O)[C@@H](N)Cc1ccncc1 Amb28075255 [0,1,0,0,0,1|2,0,0]=4 1657 B13R1.135 CNC(=O)[C@H](N)Cc1cccnc1 Amb27804012 [0,1,0,0,0,1|2,0,0]=4 1658 B13R1.135 CNC(=O)[C@H](N)Cc1ccncc1 Amb28055852 [0,1,0,0,0,1|2,0,0]=4 1659 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb1779248 [0,1,0,0,0,1|2,0,0]=4 1660 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,1|2,0,0]=4 1661 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb6335185 [0,1,0,0,0,1|2,0,0]=4 1662 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb30867720 [0,1,0,0,0,1|1,0,1]=4 1663 B13R1.135 COC(=O)C(N)Cc1ccccn1 Amb32645721 [0,1,0,0,0,1|1,0,1]=4 1664 B13R1.135 COC(=O)C(N)Cc1cccnc1 Amb33042860 [0,1,0,0,0,1|1,0,0]=3 1665 B13R1.135 COC(=O)C(N)Cc1cccnn1 Amb32937012 [0,1,0,0,0,1|1,0,1]=4 1666 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb28555952 [0,1,0,0,0,1|1,0,0]=3 1667 B13R1.135 COC(=O)C(N)Cc1ccncc1 Amb33506229 [0,1,0,0,0,1|1,0,0]=3 1668 B13R1.135 COC(=O)C(N)Cc1ccncn1 Amb32661109 [0,1,0,0,0,1|0,0,1]=3 1669 B13R1.135 COC(=O)C(N)Cc1ccnnc1 Amb33230885 [0,1,0,0,0,1|1,0,0]=3 1670 B13R1.135 COC(=O)C(N)Cc1cnccn1 Amb33127563 [0,1,0,0,0,1|0,0,1]=3 1671 B13R1.135 COC(=O)C(N)Cc1cncnc1 Amb32413242 [0,1,0,0,0,1|0,0,1]=3 1672 B13R1.135 COC(=O)C(N)Cc1ncccn1 Amb32645693 [0,1,0,0,0,1|1,0,1]=4 1673 B13R1.135 COC(=O)C(O)Cc1cccnc1 Amb17138999 [0,1,0,0,0,1|2,0,0]=4 1674 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb17139000 [0,1,0,0,0,1|2,0,0]=4 1675 B13R1.135 COC(=O)C(O)Cc1ccncc1 Amb32663204 [0,1,0,0,0,1|2,0,0]=4 1676 B13R1.135 COC(=O)C(O)Cc1ccncn1 Amb33268573 [0,1,0,0,0,1|1,0,1]=4 1677 B13R1.135 COC(=O)C(O)Cc1cnccn1 Amb33429670 [0,1,0,0,0,1|1,0,1]=4 1678 B13R1.135 COC(=O)C(O)Cc1cncnc1 Amb32876396 [0,1,0,0,0,1|1,0,1]=4 1679 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb533665 [0,1,0,0,0,1|2,0,0]=4 1680 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb6364970 [0,1,0,0,0,1|2,0,0]=4 1681 B13R1.135 COC(=O)[C@@H](N)Cc1cccnc1 Amb22756662 [0,1,0,0,0,1|1,0,0]=3 1682 B13R1.135 COC(=O)[C@@H](N)Cc1ncccn1 Amb30527040 [0,1,0,0,0,1|1,0,1]=4 1683 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb3939007 [0,1,0,0,0,1|2,0,0]=4 1684 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb8396272 [0,1,0,0,0,1|2,0,0]=4 1685 B13R1.135 COC(=O)[C@H](N)Cc1ccccn1 Amb30527042 [0,1,0,0,0,1|1,0,1]=4 1686 B13R1.135 COC(=O)[C@H](N)Cc1cccnc1 Amb15691971 [0,1,0,0,0,1|1,0,0]=3 1687 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,0,1|2,0,0]=4 1688 B13R1.135 N[C@H](Cc1ccccc1)C(=O)NO Amb27587806 [0,1,0,0,0,1|2,0,0]=4 1689 B13R1.148 CC(Cc1ccnc(Cl)c1)C(=O)O Amb28396938 [0,1,0,0,0,1|2,0,0]=4 1690 B13R1.148 CC(Cc1cncc(Br)c1)C(=O)O Amb25821532 [0,1,0,0,0,1|2,0,0]=4 1691 B13R1.148 CC(Cc1cncc(F)c1)C(=O)O Amb25782318 [0,1,0,0,0,1|2,0,0]=4 1692 B13R1.148 C[C@@H](Cc1cncc(F)c1)C(=O)O Amb33728367 [0,1,0,0,0,1|2,0,0]=4 1693 B13R1.148 C[C@H](Cc1cncc(F)c1)C(=O)O Amb33728690 [0,1,0,0,0,1|2,0,0]=4 1694 B13R1.148 Cc1cc(CC(C)C(=O)O)ccn1 Amb33268546 [0,1,0,0,0,1|2,0,0]=4 1695 B13R1.148 Cc1cc(CC(N)C(=O)O)ccn1 Amb18824521 [0,1,0,0,0,1|1,0,0]=3 1696 B13R1.148 Cc1cc(CC(N)C(=O)O)ncn1 Amb18824236 [0,1,0,0,0,1|0,0,1]=3 1697 B13R1.148 Cc1cc(CC(N)C(N)=O)ccn1 Amb33036886 [0,1,0,0,0,1|2,0,0]=4 1698 B13R1.148 Cc1cc(CC(N)C(N)=O)ncn1 Amb33065842 [0,1,0,0,0,1|1,0,1]=4 1699 B13R1.148 Cc1cc(CC(O)C(=O)O)ccn1 Amb33268216 [0,1,0,0,0,1|2,0,0]=4 1700 B13R1.148 Cc1cc(C[C@@H](N)C(=O)O)ccn1 Amb24409497 [0,1,0,0,0,1|1,0,0]=3 1701 B13R1.148 Cc1cc(C[C@@H](N)C(=O)O)ncn1 Amb33036600 [0,1,0,0,0,1|0,0,1]=3 1702 B13R1.148 Cc1cc(C[C@H](N)C(=O)O)ccn1 Amb28316516 [0,1,0,0,0,1|1,0,0]=3 1703 B13R1.148 Cc1cc(C[C@H](N)C(=O)O)ncn1 Amb32987312 [0,1,0,0,0,1|0,0,1]=3 1704 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb33551326 [0,1,0,0,0,1|2,0,0]=4 1705 B13R1.148 Cc1cccc(CC(N)C(=O)O)c1 Amb3788275 [0,1,0,0,0,1|2,0,0]=4 1706 B13R1.148 Cc1cccc(CC(N)C(=O)O)n1 Amb3788309 [0,1,0,0,0,1|1,0,1]=4 1707 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)c1 Amb8397009 [0,1,0,0,0,1|2,0,0]=4 1708 B13R1.148 Cc1cccc(C[C@@H](N)C(=O)O)n1 Amb25117997 [0,1,0,0,0,1|1,0,1]=4 1709 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)c1 Amb8397006 [0,1,0,0,0,1|2,0,0]=4 1710 B13R1.148 Cc1cccc(C[C@H](N)C(=O)O)n1 Amb27190836 [0,1,0,0,0,1|1,0,1]=4 1711 B13R1.148 Cc1ccnc(CC(N)C(=O)O)c1 Amb18193874 [0,1,0,0,0,1|1,0,1]=4 1712 B13R1.148 Cc1ccnc(CC(N)C(=O)O)n1 Amb33065529 [0,1,0,0,0,1|1,0,1]=4 1713 B13R1.148 Cc1ccnc(C[C@@H](N)C(=O)O)c1 Amb28456557 [0,1,0,0,0,1|1,0,1]=4 1714 B13R1.148 Cc1ccnc(C[C@@H](N)C(=O)O)n1 Amb33036811 [0,1,0,0,0,1|1,0,1]=4 1715 B13R1.148 Cc1ccnc(C[C@H](N)C(=O)O)n1 Amb33065805 [0,1,0,0,0,1|1,0,1]=4 1716 B13R1.148 Cc1cncc(CC(C)C(=O)O)c1 Amb25898497 [0,1,0,0,0,1|2,0,0]=4 1717 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb18193896 [0,1,0,0,0,1|1,0,0]=3 1718 B13R1.148 Cc1cncc(CC(N)C(=O)O)c1 Amb33620537 [0,1,0,0,0,1|1,0,0]=3 1719 B13R1.148 Cc1cncc(CC(N)C(N)=O)c1 Amb27160949 [0,1,0,0,0,1|2,0,0]=4 1720 B13R1.148 Cc1cncc(CC(O)C(=O)O)c1 Amb33318319 [0,1,0,0,0,1|2,0,0]=4 1721 B13R1.148 Cc1cncc(C[C@@H](C)C(=O)O)c1 Amb33738122 [0,1,0,0,0,1|2,0,0]=4 1722 B13R1.148 Cc1cncc(C[C@@H](N)C(=O)O)c1 Amb26318555 [0,1,0,0,0,1|1,0,0]=3 1723 B13R1.148 Cc1cncc(C[C@H](C)C(=O)O)c1 Amb33744909 [0,1,0,0,0,1|2,0,0]=4 1724 B13R1.148 Cc1cncc(C[C@H](N)C(=O)O)c1 Amb25864934 [0,1,0,0,0,1|1,0,0]=3 1725 B13R1.148 Cc1nccc(CC(N)C(N)=O)n1 Amb33309226 [0,1,0,0,0,1|1,0,1]=4 1726 B13R1.148 Cc1nccc(CC(O)C(=O)O)n1 Amb33353344 [0,1,0,0,0,1|1,0,1]=4 1727 B13R1.148 Cc1nccc(C[C@@H](N)C(=O)O)n1 Amb33309118 [0,1,0,0,0,1|0,0,1]=3 1728 B13R1.148 Cc1nccc(C[C@H](N)C(=O)O)n1 Amb33036772 [0,1,0,0,0,1|0,0,1]=3 1729 B13R1.148 NC(=O)C(N)Cc1ccnc(Cl)c1 Amb33036744 [0,1,0,0,0,1|2,0,0]=4 1730 B13R1.148 NC(=O)C(N)Cc1ccnc(Cl)n1 Amb33308731 [0,1,0,0,0,1|1,0,1]=4 1731 B13R1.148 NC(=O)C(N)Cc1cncc(Br)c1 Amb25040763 [0,1,0,0,0,1|2,0,0]=4 1732 B13R1.148 NC(=O)C(N)Cc1cncc(Cl)c1 Amb33308613 [0,1,0,0,0,1|2,0,0]=4 1733 B13R1.148 NC(=O)C(N)Cc1cncc(F)c1 Amb27650841 [0,1,0,0,0,1|2,0,0]=4 1734 B13R1.148 NC(CC1=CC(=O)NC=C1)C(=O)O Amb25127065 [0,1,0,0,0,1|1,0,1]=4 1735 B13R1.148 NC(CC1=CC(=O)NC=N1)C(=O)O Amb25095191 [0,1,0,0,0,1|0,0,2]=4 1736 B13R1.148 NC(CC1=NC=CC(=O)N1)C(=O)O Amb25270760 [0,1,0,0,0,1|1,0,0]=3 1737 B13R1.148 NC(Cc1cc(Cl)ccn1)C(=O)O Amb25764479 [0,1,0,0,0,1|1,0,1]=4 1738 B13R1.148 NC(Cc1cc(F)ccn1)C(=O)O Amb33415313 [0,1,0,0,0,1|1,0,1]=4 1739 B13R1.148 NC(Cc1cc(O)ncn1)C(=O)O Amb35747953 [0,1,0,0,0,1|0,0,1]=3 1740 B13R1.148 NC(Cc1cccc(Br)c1)C(=O)O Amb33551434 [0,1,0,0,0,1|2,0,0]=4 1741 B13R1.148 NC(Cc1cccc(Br)c1)C(=O)O Amb3790941 [0,1,0,0,0,1|2,0,0]=4 1742 B13R1.148 NC(Cc1cccc(Br)n1)C(=O)O Amb28061133 [0,1,0,0,0,1|1,0,1]=4 1743 B13R1.148 NC(Cc1cccc(Cl)c1)C(=O)O Amb20622650 [0,1,0,0,0,1|2,0,0]=4 1744 B13R1.148 NC(Cc1cccc(Cl)c1)C(=O)O Amb3788687 [0,1,0,0,0,1|2,0,0]=4 1745 B13R1.148 NC(Cc1cccc(Cl)n1)C(=O)O Amb24342291 [0,1,0,0,0,1|1,0,1]=4 1746 B13R1.148 NC(Cc1cccc(F)c1)C(=O)O Amb2688313 [0,1,0,0,0,1|2,0,0]=4 1747 B13R1.148 NC(Cc1cccc(F)c1)C(=O)O Amb28468151 [0,1,0,0,0,1|2,0,0]=4 1748 B13R1.148 NC(Cc1cccc(I)c1)C(=O)O Amb3796903 [0,1,0,0,0,1|2,0,0]=4 1749 B13R1.148 NC(Cc1cccc(O)c1)C(=O)O Amb9727593 [0,1,0,0,0,1|2,0,0]=4 1750 B13R1.148 NC(Cc1cccc(S)c1)C(=O)O Amb28119335 [0,1,0,0,0,1|2,0,0]=4 1751 B13R1.148 NC(Cc1cccc(S)c1)C(=O)O Amb33330728 [0,1,0,0,0,1|2,0,0]=4 1752 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb25068866 [0,1,0,0,0,1|1,0,0]=3 1753 B13R1.148 NC(Cc1ccnc(Br)c1)C(=O)O Amb33734846 [0,1,0,0,0,1|1,0,0]=3 1754 B13R1.148 NC(Cc1ccnc(Cl)c1)C(=O)O Amb25301408 [0,1,0,0,0,1|1,0,0]=3 1755 B13R1.148 NC(Cc1ccnc(Cl)n1)C(=O)O Amb33036794 [0,1,0,0,0,1|0,0,1]=3 1756 B13R1.148 NC(Cc1ccnc(O)c1)C(=O)O Amb33743902 [0,1,0,0,0,1|1,0,0]=3 1757 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33733905 [0,1,0,0,0,1|1,0,0]=3 1758 B13R1.148 NC(Cc1ccnc(S)c1)C(=O)O Amb33742683 [0,1,0,0,0,1|1,0,0]=3 1759 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb26850411 [0,1,0,0,0,1|1,0,0]=3 1760 B13R1.148 NC(Cc1cncc(Br)c1)C(=O)O Amb33527128 [0,1,0,0,0,1|1,0,0]=3 1761 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb26424973 [0,1,0,0,0,1|1,0,0]=3 1762 B13R1.148 NC(Cc1cncc(Cl)c1)C(=O)O Amb33299384 [0,1,0,0,0,1|1,0,0]=3 1763 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb26347287 [0,1,0,0,0,1|1,0,0]=3 1764 B13R1.148 NC(Cc1cncc(F)c1)C(=O)O Amb33620579 [0,1,0,0,0,1|1,0,0]=3 1765 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb24377085 [0,1,0,0,0,1|1,0,0]=3 1766 B13R1.148 NC(Cc1cncc(O)c1)C(=O)O Amb33620577 [0,1,0,0,0,1|1,0,0]=3 1767 B13R1.148 NC(Cc1cncc(S)c1)C(=O)O Amb35789190 [0,1,0,0,0,1|1,0,0]=3 1768 B13R1.148 NC(Cc1nccc(O)n1)C(=O)O Amb33484100 [0,1,0,0,0,1|1,0,1]=4 1769 B13R1.148 N[C@@H](Cc1cccc(Br)c1)C(=O)O Amb32409701 [0,1,0,0,0,1|2,0,0]=4 1770 B13R1.148 N[C@@H](Cc1cccc(Br)c1)C(=O)O Amb8396992 [0,1,0,0,0,1|2,0,0]=4 1771 B13R1.148 N[C@@H](Cc1cccc(Cl)c1)C(=O)O Amb8390369 [0,1,0,0,0,1|2,0,0]=4 1772 B13R1.148 N[C@@H](Cc1cccc(Cl)c1)C(=O)O Amb8396996 [0,1,0,0,0,1|2,0,0]=4 1773 B13R1.148 N[C@@H](Cc1cccc(Cl)n1)C(=O)O Amb27463062 [0,1,0,0,0,1|1,0,1]=4 1774 B13R1.148 N[C@@H](Cc1cccc(F)c1)C(=O)O Amb6295851 [0,1,0,0,0,1|2,0,0]=4 1775 B13R1.148 N[C@@H](Cc1cccc(F)n1)C(=O)O Amb28057714 [0,1,0,0,0,1|1,0,1]=4 1776 B13R1.148 N[C@@H](Cc1cccc(I)c1)C(=O)O Amb22229331 [0,1,0,0,0,1|2,0,0]=4 1777 B13R1.148 N[C@@H](Cc1cccc(O)c1)C(=O)O Amb6295781 [0,1,0,0,0,1|2,0,0]=4 1778 B13R1.148 N[C@@H](Cc1cccc(S)c1)C(=O)O Amb27404833 [0,1,0,0,0,1|2,0,0]=4 1779 B13R1.148 N[C@@H](Cc1ccnc(Cl)c1)C(=O)O Amb26988815 [0,1,0,0,0,1|1,0,0]=3 1780 B13R1.148 N[C@@H](Cc1ccnc(Cl)n1)C(=O)O Amb33308876 [0,1,0,0,0,1|0,0,1]=3 1781 B13R1.148 N[C@@H](Cc1ccnc(F)c1)C(=O)O Amb28076584 [0,1,0,0,0,1|1,0,0]=3 1782 B13R1.148 N[C@@H](Cc1ccnc(O)c1)C(=O)O Amb27270877 [0,1,0,0,0,1|1,0,0]=3 1783 B13R1.148 N[C@@H](Cc1cncc(Br)c1)C(=O)O Amb24418099 [0,1,0,0,0,1|1,0,0]=3 1784 B13R1.148 N[C@@H](Cc1cncc(Cl)c1)C(=O)O Amb26855853 [0,1,0,0,0,1|1,0,0]=3 1785 B13R1.148 N[C@@H](Cc1cncc(F)c1)C(=O)O Amb27609591 [0,1,0,0,0,1|1,0,0]=3 1786 B13R1.148 N[C@H](Cc1cccc(Br)c1)C(=O)O Amb8396991 [0,1,0,0,0,1|2,0,0]=4 1787 B13R1.148 N[C@H](Cc1cccc(Br)n1)C(=O)O Amb27180873 [0,1,0,0,0,1|1,0,1]=4 1788 B13R1.148 N[C@H](Cc1cccc(Cl)c1)C(=O)O Amb6295852 [0,1,0,0,0,1|2,0,0]=4 1789 B13R1.148 N[C@H](Cc1cccc(F)c1)C(=O)O Amb8389455 [0,1,0,0,0,1|2,0,0]=4 1790 B13R1.148 N[C@H](Cc1cccc(F)n1)C(=O)O Amb27175331 [0,1,0,0,0,1|1,0,1]=4 1791 B13R1.148 N[C@H](Cc1cccc(I)c1)C(=O)O Amb22229329 [0,1,0,0,0,1|2,0,0]=4 1792 B13R1.148 N[C@H](Cc1cccc(O)c1)C(=O)O Amb8396995 [0,1,0,0,0,1|2,0,0]=4 1793 B13R1.148 N[C@H](Cc1ccnc(Cl)c1)C(=O)O Amb27592823 [0,1,0,0,0,1|1,0,0]=3 1794 B13R1.148 N[C@H](Cc1ccnc(Cl)n1)C(=O)O Amb33066258 [0,1,0,0,0,1|0,0,1]=3 1795 B13R1.148 N[C@H](Cc1ccnc(F)c1)C(=O)O Amb27596543 [0,1,0,0,0,1|1,0,0]=3 1796 B13R1.148 N[C@H](Cc1ccnc(O)c1)C(=O)O Amb28317768 [0,1,0,0,0,1|1,0,0]=3 1797 B13R1.148 N[C@H](Cc1cncc(Br)c1)C(=O)O Amb26005016 [0,1,0,0,0,1|1,0,0]=3 1798 B13R1.148 N[C@H](Cc1cncc(Cl)c1)C(=O)O Amb26867986 [0,1,0,0,0,1|1,0,0]=3 1799 B13R1.148 N[C@H](Cc1cncc(F)c1)C(=O)O Amb25679683 [0,1,0,0,0,1|1,0,0]=3 1800 B13R1.148 N[C@H](Cc1cncc(O)c1)C(=O)O Amb28317767 [0,1,0,0,0,1|1,0,0]=3 1801 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb28316362 [0,1,0,0,0,1|1,0,0]=3 1802 B13R1.148 Nc1cc(CC(N)C(=O)O)ccn1 Amb33299370 [0,1,0,0,0,1|1,0,0]=3 1803 B13R1.148 Nc1cc(C[C@@H](N)C(=O)O)ccn1 Amb28365832 [0,1,0,0,0,1|1,0,0]=3 1804 B13R1.148 Nc1cccc(CC(N)C(=O)O)c1 Amb21864824 [0,1,0,0,0,1|2,0,0]=4 1805 B13R1.148 Nc1cccc(CC(N)C(=O)O)n1 Amb33804191 [0,1,0,0,0,1|1,0,1]=4 1806 B13R1.148 Nc1cccc(C[C@H](N)C(=O)O)c1 Amb33801893 [0,1,0,0,0,1|2,0,0]=4 1807 B13R1.148 Nc1cccc(C[C@H](N)C(=O)O)c1 Amb33872488 [0,1,0,0,0,1|2,0,0]=4 1808 B13R1.148 Nc1ccnc(CC(N)C(=O)O)c1 Amb28197756 [0,1,0,0,0,1|1,0,1]=4 1809 B13R1.148 Nc1ccnc(CC(N)C(=O)O)c1 Amb33620803 [0,1,0,0,0,1|1,0,1]=4 1810 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb28200132 [0,1,0,0,0,1|1,0,0]=3 1811 B13R1.148 Nc1cncc(CC(N)C(=O)O)c1 Amb33741539 [0,1,0,0,0,1|1,0,0]=3 1812 B13R1.148 Nc1cncc(C[C@H](N)C(=O)O)c1 Amb28456538 [0,1,0,0,0,1|1,0,0]=3 1813 B13R1.148 Nc1nccc(C[C@H](N)C(=O)O)n1 Amb25966577 [0,1,0,0,0,1|0,0,1]=3 1814 B13R1.148 O=C(O)C(O)Cc1cncc(Br)c1 Amb24535360 [0,1,0,0,0,1|2,0,0]=4 1815 B13R1.148 O=C(O)C(O)Cc1cncc(Cl)c1 Amb33353481 [0,1,0,0,0,1|2,0,0]=4 1816 B13R1.148 O=C(O)C(O)Cc1cncc(F)c1 Amb33196678 [0,1,0,0,0,1|2,0,0]=4 1817 B13R1.152 CC(C(=O)O)C(C)c1cccnc1 Amb27857029 [0,1,0,0,0,1|2,0,0]=4 1818 B13R1.152 CC(C(=O)O)C(C)c1ccncc1 Amb27415960 [0,1,0,0,0,1|2,0,0]=4 1819 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb10072242 [0,1,0,0,0,1|2,0,0]=4 1820 B13R1.152 CC(c1ccccc1)C(N)C(=O)O Amb2696733 [0,1,0,0,0,1|2,0,0]=4 1821 B13R1.152 CC(c1ccccc1)[C@H](N)C(=O)O Amb2694835 [0,1,0,0,0,1|2,0,0]=4 1822 B13R1.152 CC(c1ccccn1)C(N)C(=O)O Amb29892397 [0,1,0,0,0,1|1,0,1]=4 1823 B13R1.152 CC(c1cccnc1)C(N)C(=O)O Amb29892396 [0,1,0,0,0,1|1,0,0]=3 1824 B13R1.152 CC(c1cccnc1)[C@@H](C)C(=O)O Amb33749386 [0,1,0,0,0,1|2,0,0]=4 1825 B13R1.152 CC(c1cccnc1)[C@H](C)C(=O)O Amb33749516 [0,1,0,0,0,1|2,0,0]=4 1826 B13R1.152 CC(c1ccncc1)C(N)C(=O)O Amb29892398 [0,1,0,0,0,1|1,0,0]=3 1827 B13R1.152 CC(c1ccncn1)C(N)C(=O)O Amb30039898 [0,1,0,0,0,1|0,0,1]=3 1828 B13R1.152 CC(c1cnccn1)C(F)C(=O)O Amb27608863 [0,1,0,0,0,1|1,0,1]=4 1829 B13R1.152 CC(c1cnccn1)C(N)C(=O)O Amb29892399 [0,1,0,0,0,1|0,0,1]=3 1830 B13R1.152 C[C@@H](c1ccccc1)C(N)C(=O)O Amb27645474 [0,1,0,0,0,1|2,0,0]=4 1831 B13R1.152 C[C@@H](c1ccccc1)[C@H](N)C(=O)O Amb4021752 [0,1,0,0,0,1|2,0,0]=4 1832 B13R1.152 C[C@H](c1ccccc1)[C@@H](N)C(=O)O Amb22801136 [0,1,0,0,0,1|2,0,0]=4 1833 B13R1.152 C[C@H](c1ccccc1)[C@H](N)C(=O)O Amb28243568 [0,1,0,0,0,1|2,0,0]=4 1834 B13R1.152 NC(C(=O)O)C(Cl)c1ccccc1 Amb9809972 [0,1,0,0,0,1|2,0,0]=4 1835 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb2228459 [0,1,0,0,0,1|2,0,0]=4 1836 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb533731 [0,1,0,0,0,1|2,0,0]=4 1837 B13R1.152 NC(C(=O)O)C(O)c1cccnc1 Amb32992289 [0,1,0,0,0,1|1,0,0]=3 1838 B13R1.152 NC(C(=O)O)C(O)c1cccnc1 Amb4036110 [0,1,0,0,0,1|1,0,0]=3 1839 B13R1.152 NC(C(=O)O)C(O)c1ccncc1 Amb18192714 [0,1,0,0,0,1|1,0,0]=3 1840 B13R1.152 NC(C(=O)O)C(O)c1ccncc1 Amb32721630 [0,1,0,0,0,1|1,0,0]=3 1841 B13R1.152 NC(C(=O)O)C(O)c1ccncn1 Amb25359555 [0,1,0,0,0,1|0,0,1]=3 1842 B13R1.152 NC(C(=O)O)C(O)c1cnccn1 Amb33359997 [0,1,0,0,0,1|0,0,1]=3 1843 B13R1.152 NC(C(=O)O)C(O)c1cncnc1 Amb25362434 [0,1,0,0,0,1|0,0,1]=3 1844 B13R1.152 NC(C(=O)O)C(O)c1ncccn1 Amb33270414 [0,1,0,0,0,1|1,0,1]=4 1845 B13R1.152 NC(c1cccnc1)C(O)C(=O)O Amb2697385 [0,1,0,0,0,1|2,0,0]=4 1846 B13R1.152 N[C@@H](C(=O)O)[C@@H](F)c1ccccc1 Amb27400343 [0,1,0,0,0,1|2,0,0]=4 1847 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)c1ccccc1 Amb26968525 [0,1,0,0,0,1|2,0,0]=4 1848 B13R1.152 N[C@@H](C(=O)O)[C@H](F)c1ccccc1 Amb27179073 [0,1,0,0,0,1|2,0,0]=4 1849 B13R1.152 N[C@H](C(=O)O)C(O)c1ccccc1 Amb27180158 [0,1,0,0,0,1|2,0,0]=4 1850 B13R1.152 N[C@H](C(=O)O)[C@@H](F)c1ccccc1 Amb27983777 [0,1,0,0,0,1|2,0,0]=4 1851 B13R1.152 N[C@H](C(=O)O)[C@H](F)c1ccccc1 Amb27974203 [0,1,0,0,0,1|2,0,0]=4 1852 B13R1.152 N[C@H](C(=O)O)[C@H](O)c1ccccc1 Amb8516907 [0,1,0,0,0,1|2,0,0]=4 1853 B13R1.152 N[C@H](c1cccnc1)[C@@H](O)C(=O)O Amb28282699 [0,1,0,0,0,1|2,0,0]=4 1854 B13R1.202 CC(Cc1cccnc1Br)C(=O)O Amb33387424 [0,1,0,0,0,1|2,0,0]=4 1855 B13R1.202 CC(Cc1cccnc1Cl)C(=O)O Amb33256915 [0,1,0,0,0,1|2,0,0]=4 1856 B13R1.202 CC(Cc1cccnc1F)C(=O)O Amb33378336 [0,1,0,0,0,1|2,0,0]=4 1857 B13R1.202 CC(Cc1cccnc1N)C(=O)O Amb27954879 [0,1,0,0,0,1|2,0,0]=4 1858 B13R1.202 CC(Cc1ccncc1Br)C(=O)O Amb33242590 [0,1,0,0,0,1|2,0,0]=4 1859 B13R1.202 CC(Cc1ccncc1Cl)C(=O)O Amb26848472 [0,1,0,0,0,1|2,0,0]=4 1860 B13R1.202 CC(Cc1ccncc1F)C(=O)O Amb25039005 [0,1,0,0,0,1|2,0,0]=4 1861 B13R1.202 CC(Cc1cnccc1N)C(=O)O Amb28342767 [0,1,0,0,0,1|2,0,0]=4 1862 B13R1.202 Cc1ccccc1CC(N)C(=O)O Amb3788277 [0,1,0,0,0,1|2,0,0]=4 1863 B13R1.202 Cc1ccccc1CC(N)C(=O)O Amb5718718 [0,1,0,0,0,1|2,0,0]=4 1864 B13R1.202 Cc1ccccc1C[C@@H](N)C(=O)O Amb8397008 [0,1,0,0,0,1|2,0,0]=4 1865 B13R1.202 Cc1ccccc1C[C@H](N)C(=O)O Amb8397005 [0,1,0,0,0,1|2,0,0]=4 1866 B13R1.202 Cc1cccnc1CC(N)C(=O)O Amb3788310 [0,1,0,0,0,1|1,0,1]=4 1867 B13R1.202 Cc1cccnc1C[C@H](N)C(=O)O Amb24727924 [0,1,0,0,0,1|1,0,1]=4 1868 B13R1.202 Cc1ccncc1CC(C)C(=O)O Amb25696863 [0,1,0,0,0,1|2,0,0]=4 1869 B13R1.202 Cc1ccncc1CC(N)C(=O)O Amb27640249 [0,1,0,0,0,1|1,0,0]=3 1870 B13R1.202 Cc1ccncc1CC(O)C(=O)O Amb33377044 [0,1,0,0,0,1|2,0,0]=4 1871 B13R1.202 Cc1cnccc1CC(C)C(=O)O Amb27226786 [0,1,0,0,0,1|2,0,0]=4 1872 B13R1.202 Cc1cnccc1CC(N)C(=O)O Amb3788313 [0,1,0,0,0,1|1,0,0]=3 1873 B13R1.202 Cc1cnccc1CC(N)C(N)=O Amb33036921 [0,1,0,0,0,1|2,0,0]=4 1874 B13R1.202 Cc1cnccc1CC(O)C(=O)O Amb33414502 [0,1,0,0,0,1|2,0,0]=4 1875 B13R1.202 Cc1cnccc1C[C@@H](N)C(=O)O Amb25063835 [0,1,0,0,0,1|1,0,0]=3 1876 B13R1.202 Cc1cnccc1C[C@H](N)C(=O)O Amb24390165 [0,1,0,0,0,1|1,0,0]=3 1877 B13R1.202 Cc1ncccc1CC(C)C(=O)O Amb25773491 [0,1,0,0,0,1|2,0,0]=4 1878 B13R1.202 Cc1ncccc1CC(N)C(=O)O Amb26063815 [0,1,0,0,0,1|1,0,0]=3 1879 B13R1.202 Cc1ncccc1CC(N)C(N)=O Amb27251622 [0,1,0,0,0,1|2,0,0]=4 1880 B13R1.202 Cc1ncccc1CC(O)C(=O)O Amb32879600 [0,1,0,0,0,1|2,0,0]=4 1881 B13R1.202 Cc1ncccc1C[C@@H](N)C(=O)O Amb27187505 [0,1,0,0,0,1|1,0,0]=3 1882 B13R1.202 Cc1ncccc1C[C@H](N)C(=O)O Amb27609597 [0,1,0,0,0,1|1,0,0]=3 1883 B13R1.202 Cc1nccnc1CC(C)C(=O)O Amb33142868 [0,1,0,0,0,1|1,0,1]=4 1884 B13R1.202 Cc1nccnc1CC(F)C(=O)O Amb35600939 [0,1,0,0,0,1|1,0,1]=4 1885 B13R1.202 Cc1nccnc1CC(N)C(=O)O Amb18193215 [0,1,0,0,0,1|0,0,1]=3 1886 B13R1.202 Cc1nccnc1CC(N)C(N)=O Amb33065738 [0,1,0,0,0,1|1,0,1]=4 1887 B13R1.202 Cc1nccnc1CC(O)C(=O)O Amb33353469 [0,1,0,0,0,1|1,0,1]=4 1888 B13R1.202 Cc1nccnc1CC(S)C(=O)O Amb35602915 [0,1,0,0,0,1|1,0,1]=4 1889 B13R1.202 Cc1nccnc1C[C@@H](N)C(=O)O Amb33065870 [0,1,0,0,0,1|0,0,1]=3 1890 B13R1.202 Cc1nccnc1C[C@H](N)C(=O)O Amb33065930 [0,1,0,0,0,1|0,0,1]=3 1891 B13R1.202 Cc1ncncc1CC(C)C(=O)O Amb33472513 [0,1,0,0,0,1|1,0,1]=4 1892 B13R1.202 Cc1ncncc1CC(N)C(=O)O Amb18193227 [0,1,0,0,0,1|0,0,1]=3 1893 B13R1.202 Cc1ncncc1CC(O)C(=O)O Amb33472480 [0,1,0,0,0,1|1,0,1]=4 1894 B13R1.202 NC(=O)C(N)Cc1ccncc1Br Amb33309067 [0,1,0,0,0,1|2,0,0]=4 1895 B13R1.202 NC(=O)C(N)Cc1ccncc1Cl Amb25109764 [0,1,0,0,0,1|2,0,0]=4 1896 B13R1.202 NC(CC1=CN=CNC1=O)C(=O)O Amb24654941 [0,1,0,0,0,1|0,0,0]=2 1897 B13R1.202 NC(CC1=CN=CNC1=O)C(=O)O Amb35752476 [0,1,0,0,0,1|0,0,0]=2 1898 B13R1.202 NC(CN1C=NC=CC1=O)C(=O)O Amb27181213 [0,1,0,0,0,1|2,0,0]=4 1899 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb28963434 [0,1,0,0,0,1|2,0,0]=4 1900 B13R1.202 NC(Cc1ccccc1Br)C(=O)O Amb3790942 [0,1,0,0,0,1|2,0,0]=4 1901 B13R1.202 NC(Cc1ccccc1Cl)C(=O)O Amb22723318 [0,1,0,0,0,1|2,0,0]=4 1902 B13R1.202 NC(Cc1ccccc1Cl)C(=O)O Amb9720245 [0,1,0,0,0,1|2,0,0]=4 1903 B13R1.202 NC(Cc1ccccc1F)C(=O)O Amb9725850 [0,1,0,0,0,1|2,0,0]=4 1904 B13R1.202 NC(Cc1ccccc1I)C(=O)O Amb3796905 [0,1,0,0,0,1|2,0,0]=4 1905 B13R1.202 NC(Cc1ccccc1O)C(=O)O Amb4035732 [0,1,0,0,0,1|2,0,0]=4 1906 B13R1.202 NC(Cc1cccnc1Br)C(=O)O Amb28186491 [0,1,0,0,0,1|1,0,0]=3 1907 B13R1.202 NC(Cc1cccnc1Cl)C(=O)O Amb27622699 [0,1,0,0,0,1|1,0,0]=3 1908 B13R1.202 NC(Cc1cccnc1F)C(=O)O Amb26027275 [0,1,0,0,0,1|1,0,0]=3 1909 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb25965738 [0,1,0,0,0,1|1,0,0]=3 1910 B13R1.202 NC(Cc1cccnc1O)C(=O)O Amb35747686 [0,1,0,0,0,1|1,0,0]=3 1911 B13R1.202 NC(Cc1cccnc1S)C(=O)O Amb27234612 [0,1,0,0,0,1|1,0,0]=3 1912 B13R1.202 NC(Cc1ccncc1Br)C(=O)O Amb26595170 [0,1,0,0,0,1|1,0,0]=3 1913 B13R1.202 NC(Cc1ccncc1Cl)C(=O)O Amb28397123 [0,1,0,0,0,1|1,0,0]=3 1914 B13R1.202 NC(Cc1ccncc1F)C(=O)O Amb26519678 [0,1,0,0,0,1|1,0,0]=3 1915 B13R1.202 NC(Cc1ncccc1Br)C(=O)O Amb25732428 [0,1,0,0,0,1|1,0,1]=4 1916 B13R1.202 NC(Cc1ncccc1Cl)C(=O)O Amb25778279 [0,1,0,0,0,1|1,0,1]=4 1917 B13R1.202 NC(Cc1ncccc1F)C(=O)O Amb24700457 [0,1,0,0,0,1|1,0,1]=4 1918 B13R1.202 NC(Cc1ncccc1O)C(=O)O Amb27595613 [0,1,0,0,0,1|1,0,1]=4 1919 B13R1.202 N[C@@H](Cc1ccccc1Br)C(=O)O Amb6295856 [0,1,0,0,0,1|2,0,0]=4 1920 B13R1.202 N[C@@H](Cc1ccccc1Cl)C(=O)O Amb2720121 [0,1,0,0,0,1|2,0,0]=4 1921 B13R1.202 N[C@@H](Cc1ccccc1F)C(=O)O Amb6295853 [0,1,0,0,0,1|2,0,0]=4 1922 B13R1.202 N[C@@H](Cc1ccccc1I)C(=O)O Amb22228856 [0,1,0,0,0,1|2,0,0]=4 1923 B13R1.202 N[C@@H](Cc1ccccc1O)C(=O)O Amb23440357 [0,1,0,0,0,1|2,0,0]=4 1924 B13R1.202 N[C@@H](Cc1ccccc1O)C(=O)O Amb8396994 [0,1,0,0,0,1|2,0,0]=4 1925 B13R1.202 N[C@@H](Cc1cccnc1O)C(=O)O Amb27488704 [0,1,0,0,0,1|1,0,0]=3 1926 B13R1.202 N[C@@H](Cc1cccnc1S)C(=O)O Amb27461489 [0,1,0,0,0,1|1,0,0]=3 1927 B13R1.202 N[C@@H](Cc1ccncc1Br)C(=O)O Amb25995158 [0,1,0,0,0,1|1,0,0]=3 1928 B13R1.202 N[C@@H](Cc1ccncc1Cl)C(=O)O Amb24655759 [0,1,0,0,0,1|1,0,0]=3 1929 B13R1.202 N[C@@H](Cc1cnccc1Cl)C(=O)O Amb27398552 [0,1,0,0,0,1|1,0,0]=3 1930 B13R1.202 N[C@@H](Cc1ncccc1Br)C(=O)O Amb26656037 [0,1,0,0,0,1|1,0,1]=4 1931 B13R1.202 N[C@@H](Cc1ncccc1Cl)C(=O)O Amb26657363 [0,1,0,0,0,1|1,0,1]=4 1932 B13R1.202 N[C@@H](Cc1ncccc1O)C(=O)O Amb27602165 [0,1,0,0,0,1|1,0,1]=4 1933 B13R1.202 N[C@H](Cc1ccccc1Br)C(=O)O Amb8389456 [0,1,0,0,0,1|2,0,0]=4 1934 B13R1.202 N[C@H](Cc1ccccc1Cl)C(=O)O Amb8396997 [0,1,0,0,0,1|2,0,0]=4 1935 B13R1.202 N[C@H](Cc1ccccc1F)C(=O)O Amb33813069 [0,1,0,0,0,1|2,0,0]=4 1936 B13R1.202 N[C@H](Cc1ccccc1F)C(=O)O Amb8389454 [0,1,0,0,0,1|2,0,0]=4 1937 B13R1.202 N[C@H](Cc1ccccc1I)C(=O)O Amb22228855 [0,1,0,0,0,1|2,0,0]=4 1938 B13R1.202 N[C@H](Cc1ccccc1O)C(=O)O Amb8396993 [0,1,0,0,0,1|2,0,0]=4 1939 B13R1.202 N[C@H](Cc1ccccc1S)C(=O)O Amb27468501 [0,1,0,0,0,1|2,0,0]=4 1940 B13R1.202 N[C@H](Cc1cccnc1O)C(=O)O Amb27173186 [0,1,0,0,0,1|1,0,0]=3 1941 B13R1.202 N[C@H](Cc1ccncc1Br)C(=O)O Amb27390068 [0,1,0,0,0,1|1,0,0]=3 1942 B13R1.202 N[C@H](Cc1ccncc1Cl)C(=O)O Amb26935883 [0,1,0,0,0,1|1,0,0]=3 1943 B13R1.202 N[C@H](Cc1ccncc1O)C(=O)O Amb27187347 [0,1,0,0,0,1|1,0,0]=3 1944 B13R1.202 N[C@H](Cc1cnccc1Br)C(=O)O Amb28133340 [0,1,0,0,0,1|1,0,0]=3 1945 B13R1.202 N[C@H](Cc1ncccc1Br)C(=O)O Amb27397558 [0,1,0,0,0,1|1,0,1]=4 1946 B13R1.202 N[C@H](Cc1ncccc1Cl)C(=O)O Amb26881661 [0,1,0,0,0,1|1,0,1]=4 1947 B13R1.202 Nc1ccccc1CC(N)C(=O)O Amb22002697 [0,1,0,0,0,1|2,0,0]=4 1948 B13R1.202 Nc1ccccc1C[C@@H](N)C(=O)O Amb22228579 [0,1,0,0,0,1|2,0,0]=4 1949 B13R1.202 Nc1ccccc1C[C@H](N)C(=O)O Amb22228581 [0,1,0,0,0,1|2,0,0]=4 1950 B13R1.202 Nc1ccncc1CC(N)C(=O)O Amb24460737 [0,1,0,0,0,1|1,0,0]=3 1951 B13R1.202 Nc1cnccc1C[C@@H](N)C(=O)O Amb27759999 [0,1,0,0,0,1|1,0,0]=3 1952 B13R1.202 Nc1cnccc1C[C@H](N)C(=O)O Amb27817785 [0,1,0,0,0,1|1,0,0]=3 1953 B13R1.202 Nc1ncccc1CC(N)C(=O)O Amb26926489 [0,1,0,0,0,1|1,0,0]=3 1954 B13R1.202 Nc1ncccc1C[C@@H](N)C(=O)O Amb27173187 [0,1,0,0,0,1|1,0,0]=3 1955 B13R1.202 O=C(O)C(O)Cc1cccnc1Br Amb33387457 [0,1,0,0,0,1|2,0,0]=4 1956 B13R1.202 O=C(O)C(O)Cc1cccnc1Cl Amb33257315 [0,1,0,0,0,1|2,0,0]=4 1957 B13R1.202 O=C(O)C(O)Cc1cccnc1F Amb25266041 [0,1,0,0,0,1|2,0,0]=4 1958 B13R1.202 O=C(O)C(O)Cc1ccncc1Br Amb33330845 [0,1,0,0,0,1|2,0,0]=4 1959 B13R1.202 O=C(O)C(O)Cc1ccncc1Br Amb33353363 [0,1,0,0,0,1|2,0,0]=4 1960 B13R1.202 O=C(O)C(O)Cc1ccncc1Cl Amb25718576 [0,1,0,0,0,1|2,0,0]=4 1961 B13R1.202 O=C(O)C(O)Cc1ccncc1F Amb33317714 [0,1,0,0,0,1|2,0,0]=4 1962 B13R1.418 CC(=O)C(CN)Cc1cccnc1 Amb33447072 [0,1,0,0,0,1|2,0,0]=4 1963 B13R1.418 CC(=O)C(CN)Cc1ccncc1 Amb33447069 [0,1,0,0,0,1|2,0,0]=4 1964 B13R1.418 CCC(Cc1cccnc1)C(=O)O Amb5744034 [0,1,0,0,0,1|2,0,0]=4 1965 B13R1.418 CCC(Cc1ccncc1)C(=O)O Amb5744035 [0,1,0,0,0,1|2,0,0]=4 1966 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb33983942 [0,1,0,0,0,1|2,0,0]=4 1967 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb9619791 [0,1,0,0,0,1|2,0,0]=4 1968 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb10604038 [0,1,0,0,0,1|2,0,0]=4 1969 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb22744994 [0,1,0,0,0,1|2,0,0]=4 1970 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb16183857 [0,1,0,0,0,1|2,0,0]=4 1971 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb33801550 [0,1,0,0,0,1|2,0,0]=4 1972 B13R1.418 COC(Cc1cccnc1)C(=O)O Amb33360424 [0,1,0,0,0,1|2,0,0]=4 1973 B13R1.418 COC(Cc1ccncc1)C(=O)O Amb33380641 [0,1,0,0,0,1|2,0,0]=4 1974 B13R1.418 COC(Cc1ccncn1)C(=O)O Amb33225031 [0,1,0,0,0,1|1,0,1]=4 1975 B13R1.418 COC(Cc1cnccn1)C(=O)O Amb33429662 [0,1,0,0,0,1|1,0,1]=4 1976 B13R1.418 COC(Cc1cncnc1)C(=O)O Amb32876390 [0,1,0,0,0,1|1,0,1]=4 1977 B13R1.418 N#CC(Cc1cccnc1)C(=O)O Amb17090108 [0,1,0,0,0,1|1,0,1]=4 1978 B13R1.418 N#CC(Cc1ccncc1)C(=O)O Amb17090109 [0,1,0,0,0,1|1,0,1]=4 1979 B13R1.418 N#CC(Cc1cnccn1)C(=O)O Amb35621326 [0,1,0,0,0,1|0,0,2]=4 1980 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb2697356 [0,1,0,0,0,1|2,0,0]=4 1981 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb33547962 [0,1,0,0,0,1|2,0,0]=4 1982 B13R1.418 NCC(Cc1ccccn1)C(=O)O Amb19343541 [0,1,0,0,0,1|1,0,1]=4 1983 B13R1.418 NCC(Cc1ccccn1)C(=O)O Amb5744248 [0,1,0,0,0,1|1,0,1]=4 1984 B13R1.418 NCC(Cc1cccnc1)C(=O)O Amb19373762 [0,1,0,0,0,1|1,0,0]=3 1985 B13R1.418 NCC(Cc1cccnc1)C(=O)O Amb33532050 [0,1,0,0,0,1|1,0,0]=3 1986 B13R1.418 NCC(Cc1ccncc1)C(=O)O Amb32664801 [0,1,0,0,0,1|1,0,0]=3 1987 B13R1.418 NCC(Cc1ccncc1)C(=O)O Amb5744250 [0,1,0,0,0,1|1,0,0]=3 1988 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745974 [0,1,0,0,0,1|2,0,0]=4 1989 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745975 [0,1,0,0,0,1|2,0,0]=4 1990 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33329263 [0,1,0,0,0,1|2,0,0]=4 1991 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33457755 [0,1,0,0,0,1|2,0,0]=4 1992 B13R1.418 NOC(Cc1ccccc1)C(=O)O Amb32663372 [0,1,0,0,0,1|2,0,0]=4 1993 B13R1.418 NOC(Cc1ccccc1)C(=O)O Amb33339164 [0,1,0,0,0,1|2,0,0]=4 1994 B13R1.418 O=C(O)C(Cc1ccccc1)NO Amb33482855 [0,1,0,0,0,1|2,0,0]=4 1995 B13R1.1073 CC(=O)C(C)(N)Cc1ccncc1 Amb28136931 [0,1,0,0,0,1|2,0,0]=4 1996 B13R1.1073 CC(C)(Cc1cccnc1)C(=O)O Amb18065825 [0,1,0,0,0,1|2,0,0]=4 1997 B13R1.1073 CC(C)(Cc1ccncc1)C(=O)O Amb18065826 [0,1,0,0,0,1|2,0,0]=4 1998 B13R1.1073 CC(C)(Cc1ccncn1)C(=O)O Amb33269481 [0,1,0,0,0,1|1,0,1]=4 1999 B13R1.1073 CC(C)(Cc1cnccn1)C(=O)O Amb33360421 [0,1,0,0,0,1|1,0,1]=4 2000 B13R1.1073 CC(C)(Cc1cncnc1)C(=O)O Amb33149191 [0,1,0,0,0,1|1,0,1]=4 2001 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb28555907 [0,1,0,0,0,1|2,0,0]=4 2002 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb3941655 [0,1,0,0,0,1|2,0,0]=4 2003 B13R1.1073 CC(N)(Cc1ccccn1)C(=O)O Amb17400758 [0,1,0,0,0,1|1,0,1]=4 2004 B13R1.1073 CC(N)(Cc1cccnc1)C(=O)O Amb17233667 [0,1,0,0,0,1|1,0,0]=3 2005 B13R1.1073 CC(N)(Cc1ccncc1)C(=O)O Amb17400763 [0,1,0,0,0,1|1,0,0]=3 2006 B13R1.1073 CC(O)(Cc1cccnc1)C(=O)O Amb33360048 [0,1,0,0,0,1|2,0,0]=4 2007 B13R1.1073 CC(O)(Cc1ccncc1)C(=O)O Amb33380638 [0,1,0,0,0,1|2,0,0]=4 2008 B13R1.1073 CC(O)(Cc1ccncn1)C(=O)O Amb33267969 [0,1,0,0,0,1|1,0,1]=4 2009 B13R1.1073 CC(O)(Cc1cnccn1)C(=O)O Amb33429654 [0,1,0,0,0,1|1,0,1]=4 2010 B13R1.1073 CC(O)(Cc1cncnc1)C(=O)O Amb32876383 [0,1,0,0,0,1|1,0,1]=4 2011 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb33482937 [0,1,0,0,0,1|2,0,0]=4 2012 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb8629107 [0,1,0,0,0,1|2,0,0]=4 2013 B13R1.1073 C[C@@](N)(Cc1cccnc1)C(=O)O Amb27433908 [0,1,0,0,0,1|1,0,0]=3 2014 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb2720582 [0,1,0,0,0,1|2,0,0]=4 2015 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb33482933 [0,1,0,0,0,1|2,0,0]=4 2016 B13R1.1073 O=C(O)C(F)(F)Cc1cccnc1 Amb27878125 [0,1,0,0,0,1|2,0,0]=4 2017 B13R1.1073 O=C(O)C(F)(F)Cc1ccncc1 Amb24586446 [0,1,0,0,0,1|2,0,0]=4 2018 B13R1.1073 O=C(O)C(F)(F)Cc1ccncn1 Amb33409893 [0,1,0,0,0,1|1,0,1]=4 2019 B13R1.1073 O=C(O)C(F)(F)Cc1cnccn1 Amb33170643 [0,1,0,0,0,1|1,0,1]=4 2020 B13R1.1073 O=C(O)C(F)(F)Cc1cncnc1 Amb33170644 [0,1,0,0,0,1|1,0,1]=4 2021 B13R1.340 NC(CC(=O)O)C(O)c1cncs1 Amb18177007 [0,1,0,0,0,1|1,0,0]=3 2022 B13R1.2007 CC(N)(CC(=O)O)Cc1cccs1 Amb33254375 [0,1,0,0,0,1|2,0,0]=4 2023 B13R1.2007 CC(N)(CC(=O)O)Cc1ccsc1 Amb33308236 [0,1,0,0,0,1|2,0,0]=4 2024 B13R1.3424 Cc1ccc(CC(N)CC(=O)O)o1 Amb18192132 [0,1,0,0,0,1|2,0,0]=4 2025 B13R1.3424 Cc1ncc(CC(N)CC(=O)O)s1 Amb18187442 [0,1,0,0,0,1|1,0,0]=3 2026 B13R1.3424 Cn1ccc(CC(N)CC(=O)O)c1 Amb18863015 [0,1,0,0,0,1|1,0,1]=4 2027 B13R1.3424 NC(CC(=O)O)Cc1cc(Br)cs1 Amb18229962 [0,1,0,0,0,1|2,0,0]=4 2028 B13R1.3424 NC(CC(=O)O)Cc1ccc(Br)s1 Amb18883672 [0,1,0,0,0,1|2,0,0]=4 2029 B13R1.3424 NC(CC(=O)O)Cc1ccc(Cl)s1 Amb18226020 [0,1,0,0,0,1|2,0,0]=4 2030 B13R1.169 CC(CCc1cccn1C)C(=O)O Amb33203974 [0,1,0,0,0,1|2,0,0]=4 2031 B13R1.169 CC(CCc1cncn1C)C(=O)O Amb32878159 [0,1,0,0,0,1|1,0,0]=3 2032 B13R1.169 CC(CCc1cnnn1C)C(=O)O Amb33144856 [0,1,0,0,0,1|2,0,0]=4 2033 B13R1.169 Cc1nccn1CCC(N)C(=O)O Amb18307527 [0,1,0,0,0,1|2,0,0]=4 2034 B13R1.169 Cc1nccn1CC[C@@H](N)C(=O)O Amb33065786 [0,1,0,0,0,1|2,0,0]=4 2035 B13R1.169 Cc1nccn1CC[C@H](N)C(=O)O Amb33036948 [0,1,0,0,0,1|2,0,0]=4 2036 B13R1.169 Cc1ncsc1CCC(C)C(=O)O Amb18332326 [0,1,0,0,0,1|2,0,0]=4 2037 B13R1.169 Cc1ncsc1CCC(N)C(=O)O Amb33036731 [0,1,0,0,0,1|1,0,0]=3 2038 B13R1.169 Cc1ncsc1CCC(N)C(N)=O Amb33065817 [0,1,0,0,0,1|2,0,0]=4 2039 B13R1.169 Cc1ncsc1CC[C@@H](N)C(=O)O Amb33065631 [0,1,0,0,0,1|1,0,0]=3 2040 B13R1.169 Cc1ncsc1CC[C@H](N)C(=O)O Amb32862467 [0,1,0,0,0,1|1,0,0]=3 2041 B13R1.169 Cn1ccnc1CCC(N)C(=O)O Amb33308950 [0,1,0,0,0,1|2,0,0]=4 2042 B13R1.169 Cn1ccnc1CC[C@@H](N)C(=O)O Amb33066219 [0,1,0,0,0,1|2,0,0]=4 2043 B13R1.169 Cn1ccnc1CC[C@H](N)C(=O)O Amb33309045 [0,1,0,0,0,1|2,0,0]=4 2044 B13R1.169 Cn1nccc1CCC(N)C(=O)O Amb33036141 [0,1,0,0,0,1|2,0,0]=4 2045 B13R1.169 Cn1nccc1CC[C@@H](N)C(=O)O Amb33066088 [0,1,0,0,0,1|2,0,0]=4 2046 B13R1.169 Cn1nccc1CC[C@H](N)C(=O)O Amb33065710 [0,1,0,0,0,1|2,0,0]=4 2047 B13R1.339 NC(CC(=O)c1ccco1)C(=O)O Amb33308714 [0,1,0,0,0,1|2,0,0]=4 2048 B13R1.339 NC(CC(=O)c1cccs1)C(=O)O Amb28600351 [0,1,0,0,0,1|2,0,0]=4 2049 B13R1.339 NC(CC(=O)c1cccs1)C(=O)O Amb3633650 [0,1,0,0,0,1|2,0,0]=4 2050 B13R1.339 N[C@@H](CC(=O)c1ccco1)C(=O)O Amb33037101 [0,1,0,0,0,1|2,0,0]=4 2051 B13R1.339 N[C@@H](CC(=O)c1cccs1)C(=O)O Amb33308923 [0,1,0,0,0,1|2,0,0]=4 2052 B13R1.339 N[C@H](CC(=O)c1ccco1)C(=O)O Amb33036525 [0,1,0,0,0,1|2,0,0]=4 2053 B13R1.339 N[C@H](CC(=O)c1cccs1)C(=O)O Amb32937013 [0,1,0,0,0,1|2,0,0]=4 2054 B13R1.554 COC(=O)C(N)CCc1cccs1 Amb32940430 [0,1,0,0,0,1|2,0,0]=4 2055 B13R1.554 COC(=O)C(N)CCc1ccns1 Amb33036521 [0,1,0,0,0,1|2,0,0]=4 2056 B13R1.554 COC(=O)C(N)CCc1ccsc1 Amb33036925 [0,1,0,0,0,1|2,0,0]=4 2057 B13R1.554 COC(=O)C(N)CCn1ccnc1 Amb18318590 [0,1,0,0,0,1|2,0,0]=4 2058 B13R1.554 COC(=O)C(N)CCn1cncn1 Amb18318781 [0,1,0,0,0,1|1,0,1]=4 2059 B13R1.1074 CC(N)(CCn1ccnc1)C(=O)O Amb19045181 [0,1,0,0,0,1|2,0,0]=4 2060 B13R1.1074 CC(N)(CCn1cncn1)C(=O)O Amb19045378 [0,1,0,0,0,1|1,0,1]=4 2061 B13R1.3383 CNC(CCn1ccnc1)C(=O)O Amb18318589 [0,1,0,0,0,1|2,0,0]=4 2062 B13R1.3383 CNC(CCn1cncn1)C(=O)O Amb18318780 [0,1,0,0,0,1|1,0,1]=4 2063 B13R1.3383 NCC(CCc1ccsc1)C(=O)O Amb33322405 [0,1,0,0,0,1|2,0,0]=4 2064 B13R1.3383 NCC(CCn1cncn1)C(=O)O Amb32726018 [0,1,0,0,0,1|1,0,1]=4 2065 B13R1.3425 CC(CCc1cnc(Cl)s1)C(=O)O Amb33221359 [0,1,0,0,0,1|2,0,0]=4 2066 B13R1.3425 Cc1ncc(CCC(C)C(=O)O)s1 Amb33149361 [0,1,0,0,0,1|2,0,0]=4 2067 B13R1.3425 Cn1cc(CCC(N)C(=O)O)cn1 Amb33036896 [0,1,0,0,0,1|2,0,0]=4 2068 B13R1.3425 Cn1cc(CC[C@@H](N)C(=O)O)cn1 Amb33036651 [0,1,0,0,0,1|2,0,0]=4 2069 B13R1.3425 Cn1cc(CC[C@H](N)C(=O)O)cn1 Amb33037017 [0,1,0,0,0,1|2,0,0]=4 2070 B13R1.3425 NC(CCc1ccc(Br)s1)C(=O)O Amb17473913 [0,1,0,0,0,1|2,0,0]=4 2071 B13R1.3425 NC(CCc1ccc(Cl)s1)C(=O)O Amb17471723 [0,1,0,0,0,1|2,0,0]=4 2072 B13R1.59 C=Cn1cc(CC(N)C(=O)O)cn1 Amb32727888 [0,2,0,0,0,0|2,0,0]=4 2073 B13R1.59 CCc1ccc(CC(N)C(=O)O)s1 Amb3788683 [0,2,0,0,0,0|2,0,0]=4 2074 B13R1.59 CCc1ccc(C[C@@H](N)C(=O)O)s1 Amb19084966 [0,2,0,0,0,0|2,0,0]=4 2075 B13R1.59 CCc1ccc(C[C@H](N)C(=O)O)s1 Amb33036456 [0,2,0,0,0,0|2,0,0]=4 2076 B13R1.59 CCc1nnc(CC(N)C(=O)O)s1 Amb33065389 [0,2,0,0,0,0|2,0,0]=4 2077 B13R1.59 CCc1nnc(C[C@@H](N)C(=O)O)s1 Amb33309117 [0,2,0,0,0,0|2,0,0]=4 2078 B13R1.59 CCc1nnc(C[C@H](N)C(=O)O)s1 Amb33065582 [0,2,0,0,0,0|2,0,0]=4 2079 B13R1.59 CCn1cc(CC(N)C(=O)O)cn1 Amb19057087 [0,2,0,0,0,0|2,0,0]=4 2080 B13R1.59 CCn1cc(C[C@@H](N)C(=O)O)cn1 Amb33308725 [0,2,0,0,0,0|2,0,0]=4 2081 B13R1.59 CCn1cc(C[C@H](N)C(=O)O)cn1 Amb33036455 [0,2,0,0,0,0|2,0,0]=4 2082 B13R1.59 CCn1cnc(CC(N)C(=O)O)c1 Amb18129232 [0,2,0,0,0,0|0,0,2]=4 2083 B13R1.59 CCn1cnc(C[C@@H](N)C(=O)O)c1 Amb33191702 [0,2,0,0,0,0|0,0,2]=4 2084 B13R1.59 CCn1cnc(C[C@H](N)C(=O)O)c1 Amb33191691 [0,2,0,0,0,0|0,0,2]=4 2085 B13R1.59 COc1cc(CC(N)C(=O)O)sn1 Amb33308569 [0,2,0,0,0,0|2,0,0]=4 2086 B13R1.59 COc1cc(C[C@@H](N)C(=O)O)sn1 Amb33036471 [0,2,0,0,0,0|2,0,0]=4 2087 B13R1.59 COc1cc(C[C@H](N)C(=O)O)sn1 Amb33036151 [0,2,0,0,0,0|2,0,0]=4 2088 B13R1.59 COc1ncc(CC(C)C(=O)O)s1 Amb33226229 [0,2,0,0,0,0|2,0,0]=4 2089 B13R1.59 COc1ncc(CC(N)C(=O)O)s1 Amb18177003 [0,2,0,0,0,0|1,0,0]=3 2090 B13R1.59 COc1ncc(CC(O)C(=O)O)s1 Amb33353389 [0,2,0,0,0,0|2,0,0]=4 2091 B13R1.59 N#Cc1cc(CC(N)C(=O)O)cs1 Amb27144114 [0,2,0,0,0,0|2,0,0]=4 2092 B13R1.59 N#Cc1cc(CC(N)C(=O)O)cs1 Amb35750410 [0,2,0,0,0,0|2,0,0]=4 2093 B13R1.59 N#Cc1ccc(CC(N)C(=O)O)s1 Amb25191963 [0,2,0,0,0,0|2,0,0]=4 2094 B13R1.59 N#Cc1csc(CC(N)C(=O)O)c1 Amb33472365 [0,2,0,0,0,0|2,0,0]=4 2095 B13R1.130 CC(c1cc(Br)cs1)C(N)C(=O)O Amb30040047 [0,2,0,0,0,0|2,0,0]=4 2096 B13R1.130 CC(c1ccc(Br)o1)C(N)C(=O)O Amb35660780 [0,2,0,0,0,0|2,0,0]=4 2097 B13R1.130 CC(c1ccc(Br)s1)C(N)C(=O)O Amb35660776 [0,2,0,0,0,0|2,0,0]=4 2098 B13R1.130 CC(c1ccc(Cl)s1)C(N)C(=O)O Amb35660766 [0,2,0,0,0,0|2,0,0]=4 2099 B13R1.130 CC(c1cnn(C)c1)C(N)C(=O)O Amb30040143 [0,2,0,0,0,0|2,0,0]=4 2100 B13R1.130 CC(c1csc(Cl)c1)C(N)C(=O)O Amb30040138 [0,2,0,0,0,0|2,0,0]=4 2101 B13R1.130 Cc1cc(C(C)C(N)C(=O)O)cs1 Amb30040150 [0,2,0,0,0,0|2,0,0]=4 2102 B13R1.130 Cc1cc(C(O)C(N)C(=O)O)on1 Amb33326777 [0,2,0,0,0,0|2,0,0]=4 2103 B13R1.130 Cc1cc(C(O)C(N)C(=O)O)sn1 Amb35730836 [0,2,0,0,0,0|2,0,0]=4 2104 B13R1.130 Cc1ccc(C(C)C(N)C(=O)O)o1 Amb29892400 [0,2,0,0,0,0|2,0,0]=4 2105 B13R1.130 Cc1ccc(C(C)C(N)C(=O)O)s1 Amb30040034 [0,2,0,0,0,0|2,0,0]=4 2106 B13R1.130 Cc1ccc(C(O)C(N)C(=O)O)o1 Amb18822586 [0,2,0,0,0,0|2,0,0]=4 2107 B13R1.130 Cc1ccc(C(O)C(N)C(=O)O)s1 Amb26947320 [0,2,0,0,0,0|2,0,0]=4 2108 B13R1.130 Cc1csc(C(O)C(N)C(=O)O)c1 Amb33427608 [0,2,0,0,0,0|2,0,0]=4 2109 B13R1.130 Cc1nc(C(O)C(N)C(=O)O)cs1 Amb25273576 [0,2,0,0,0,0|1,0,1]=4 2110 B13R1.130 Cc1ncc(C(C)C(C)C(=O)O)s1 Amb18187686 [0,2,0,0,0,0|2,0,0]=4 2111 B13R1.130 Cc1ncc(C(O)C(N)C(=O)O)s1 Amb24685407 [0,2,0,0,0,0|1,0,0]=3 2112 B13R1.130 Cn1cc(C(O)C(N)C(=O)O)cn1 Amb27881405 [0,2,0,0,0,0|2,0,0]=4 2113 B13R1.130 Cn1cnc(C(O)C(N)C(=O)O)c1 Amb25743803 [0,2,0,0,0,0|0,0,2]=4 2114 B13R1.130 NC(C(=O)O)C(O)c1cc(Br)co1 Amb33431572 [0,2,0,0,0,0|2,0,0]=4 2115 B13R1.130 NC(C(=O)O)C(O)c1cc(Br)cs1 Amb26073813 [0,2,0,0,0,0|2,0,0]=4 2116 B13R1.130 NC(C(=O)O)C(O)c1cc(Cl)cs1 Amb25035559 [0,2,0,0,0,0|2,0,0]=4 2117 B13R1.130 NC(C(=O)O)C(O)c1ccc(Br)o1 Amb25060044 [0,2,0,0,0,0|2,0,0]=4 2118 B13R1.130 NC(C(=O)O)C(O)c1ccc(Br)s1 Amb27433295 [0,2,0,0,0,0|2,0,0]=4 2119 B13R1.130 NC(C(=O)O)C(O)c1ccc(Cl)o1 Amb33258316 [0,2,0,0,0,0|2,0,0]=4 2120 B13R1.130 NC(C(=O)O)C(O)c1ccc(Cl)s1 Amb26463660 [0,2,0,0,0,0|2,0,0]=4 2121 B13R1.130 NC(C(=O)O)C(O)c1cnc(Cl)s1 Amb33221027 [0,2,0,0,0,0|1,0,0]=3 2122 B13R1.130 NC(C(=O)O)C(O)c1csc(Br)c1 Amb25827914 [0,2,0,0,0,0|2,0,0]=4 2123 B13R1.130 NC(C(=O)O)C(O)c1csc(Br)n1 Amb33335421 [0,2,0,0,0,0|1,0,1]=4 2124 B13R1.134 COC(=O)C(N)Cc1cc(Br)cs1 Amb33066037 [0,2,0,0,0,0|2,0,0]=4 2125 B13R1.134 COC(=O)C(N)Cc1ccc(Br)o1 Amb33066007 [0,2,0,0,0,0|2,0,0]=4 2126 B13R1.134 COC(=O)C(N)Cc1ccc(Br)s1 Amb33034707 [0,2,0,0,0,0|2,0,0]=4 2127 B13R1.134 COC(=O)C(N)Cc1ccc(C)o1 Amb33065901 [0,2,0,0,0,0|2,0,0]=4 2128 B13R1.134 COC(=O)C(N)Cc1ccc(Cl)s1 Amb33036664 [0,2,0,0,0,0|2,0,0]=4 2129 B13R1.134 COC(=O)C(N)Cc1cnc(C)s1 Amb32865919 [0,2,0,0,0,0|1,0,0]=3 2130 B13R1.134 COC(=O)C(N)Cc1cnn(C)c1 Amb32663197 [0,2,0,0,0,0|2,0,0]=4 2131 B13R1.134 COC(=O)C(N)Cc1cnn(C)c1 Amb33607456 [0,2,0,0,0,0|2,0,0]=4 2132 B13R1.134 COC(=O)C(N)Cc1cnn(C)n1 Amb33036978 [0,2,0,0,0,0|1,0,1]=4 2133 B13R1.134 COC(=O)C(N)Cc1coc(Br)c1 Amb33127574 [0,2,0,0,0,0|2,0,0]=4 2134 B13R1.134 COC(=O)C(N)Cc1csc(C)c1 Amb33127514 [0,2,0,0,0,0|2,0,0]=4 2135 B13R1.134 COC(=O)C(N)Cc1csc(C)n1 Amb33065592 [0,2,0,0,0,0|1,0,1]=4 2136 B13R1.134 COC(=O)C(N)Cc1csc(Cl)c1 Amb33308585 [0,2,0,0,0,0|2,0,0]=4 2137 B13R1.134 COC(=O)C(N)Cc1csc(Cl)n1 Amb33037067 [0,2,0,0,0,0|1,0,1]=4 2138 B13R1.134 COC(=O)C(N)Cc1nnc(C)s1 Amb33036646 [0,2,0,0,0,0|2,0,0]=4 2139 B13R1.134 COC(=O)C(O)Cc1cnc(C)s1 Amb33149367 [0,2,0,0,0,0|2,0,0]=4 2140 B13R1.134 COC(=O)C(O)Cc1cnc(Cl)s1 Amb33221356 [0,2,0,0,0,0|2,0,0]=4 2141 B13R1.134 COC(=O)[C@@H](N)Cc1cn(C)cn1 Amb16233903 [0,2,0,0,0,0|0,0,2]=4 2142 B13R1.134 COC(=O)[C@@H](N)Cc1cn(C)cn1 Amb19930730 [0,2,0,0,0,0|0,0,2]=4 2143 B13R1.134 COC(=O)[C@H](N)Cc1cn(C)cn1 Amb33727448 [0,2,0,0,0,0|0,0,2]=4 2144 B13R1.410 COC(Cc1cnc(C)s1)C(=O)O Amb33148473 [0,2,0,0,0,0|2,0,0]=4 2145 B13R1.410 COC(Cc1cnc(Cl)s1)C(=O)O Amb33221395 [0,2,0,0,0,0|2,0,0]=4 2146 B13R1.410 Cc1ncc(CC(C#N)C(=O)O)s1 Amb35621462 [0,2,0,0,0,0|1,0,1]=4 2147 B13R1.410 Cn1cc(CC(CN)C(=O)O)cn1 Amb33291375 [0,2,0,0,0,0|2,0,0]=4 2148 B13R1.410 Cn1cc(CC(CN)C(=O)O)cn1 Amb7800945 [0,2,0,0,0,0|2,0,0]=4 2149 B13R1.3429 CC(C)(Cc1cnc(Cl)s1)C(=O)O Amb33221026 [0,2,0,0,0,0|2,0,0]=4 2150 B13R1.3429 CC(N)(Cc1ccc(Br)s1)C(=O)O Amb27411259 [0,2,0,0,0,0|2,0,0]=4 2151 B13R1.3429 CC(N)(Cc1ccc(Cl)s1)C(=O)O Amb28060577 [0,2,0,0,0,0|2,0,0]=4 2152 B13R1.3429 CC(O)(Cc1cnc(Cl)s1)C(=O)O Amb33221328 [0,2,0,0,0,0|2,0,0]=4 2153 B13R1.3429 Cc1ccc(CC(C)(N)C(=O)O)s1 Amb27166573 [0,2,0,0,0,0|2,0,0]=4 2154 B13R1.3429 Cc1ncc(CC(C)(C)C(=O)O)s1 Amb18302887 [0,2,0,0,0,0|2,0,0]=4 2155 B13R1.3429 Cc1ncc(CC(C)(O)C(=O)O)s1 Amb33148471 [0,2,0,0,0,0|2,0,0]=4 2156 B13R1.3429 Cc1ncc(CC(F)(F)C(=O)O)s1 Amb33171200 [0,2,0,0,0,0|2,0,0]=4 2157 B13R1.3429 O=C(O)C(F)(F)Cc1cnc(Cl)s1 Amb32810875 [0,2,0,0,0,0|2,0,0]=4 2158 B13R1.3449 Cc1cc(CC(N)C(=O)O)oc1C Amb27831910 [0,2,0,0,0,0|2,0,0]=4 2159 B13R1.3449 Cc1cc(CC(N)C(=O)O)sc1C Amb18187683 [0,2,0,0,0,0|2,0,0]=4 2160 B13R1.3449 Cc1cc(C[C@H](N)C(=O)O)oc1C Amb27210734 [0,2,0,0,0,0|2,0,0]=4 2161 B13R1.3449 Cc1sc(CC(N)C(=O)O)cc1Br Amb25846676 [0,2,0,0,0,0|2,0,0]=4 2162 B13R1.3449 Cc1sc(C[C@@H](N)C(=O)O)cc1Br Amb27835633 [0,2,0,0,0,0|2,0,0]=4 2163 B13R1.3449 NC(Cc1cc(Br)c(Cl)s1)C(=O)O Amb24675155 [0,2,0,0,0,0|2,0,0]=4 2164 B13R1.3449 N[C@@H](Cc1cc(Br)c(Br)o1)C(=O)O Amb28365918 [0,2,0,0,0,0|2,0,0]=4 2165 B13R1.3449 N[C@H](Cc1cc(Br)c(Cl)s1)C(=O)O Amb27956331 [0,2,0,0,0,0|2,0,0]=4 2166 B13R1.3481 CC1=C(CC(N)C(=O)O)NC(=S)N1 Amb27587078 [0,2,0,0,0,0|0,0,1]=3 2167 B13R1.3481 Cc1cc(Br)c(CC(N)C(=O)O)s1 Amb33431043 [0,2,0,0,0,0|2,0,0]=4 2168 B13R1.3481 Cc1cc(Br)oc1CC(N)C(=O)O Amb33451872 [0,2,0,0,0,0|2,0,0]=4 2169 B13R1.3481 Cc1cc(CC(N)C(=O)O)c(C)o1 Amb26958505 [0,2,0,0,0,0|2,0,0]=4 2170 B13R1.3481 Cc1cc(CC(N)C(=O)O)c(C)s1 Amb18995881 [0,2,0,0,0,0|2,0,0]=4 2171 B13R1.3481 Cc1cc(CC(N)C(=O)O)n(C)n1 Amb9777888 [0,2,0,0,0,0|2,0,0]=4 2172 B13R1.3481 Cc1cc(C[C@@H](N)C(=O)O)c(C)s1 Amb19084965 [0,2,0,0,0,0|2,0,0]=4 2173 B13R1.3481 Cc1cc(C[C@@H](N)C(=O)O)n(C)n1 Amb25180043 [0,2,0,0,0,0|2,0,0]=4 2174 B13R1.3481 Cc1cc(C[C@H](N)C(=O)O)c(C)s1 Amb28239338 [0,2,0,0,0,0|2,0,0]=4 2175 B13R1.3481 Cc1cc(C[C@H](N)C(=O)O)n(C)n1 Amb27595431 [0,2,0,0,0,0|2,0,0]=4 2176 B13R1.3481 Cc1cn(CC(N)C(=O)O)c(C)n1 Amb33128906 [0,2,0,0,0,0|2,0,0]=4 2177 B13R1.3481 Cc1cn(CC(N)C(=O)O)c(O)n1 Amb35597108 [0,2,0,0,0,0|2,0,0]=4 2178 B13R1.3481 Cc1nc(C)c(CC(C)C(=O)O)s1 Amb28060694 [0,2,0,0,0,0|2,0,0]=4 2179 B13R1.3481 Cc1nc(C)c(CC(F)C(=O)O)s1 Amb28074380 [0,2,0,0,0,0|2,0,0]=4 2180 B13R1.3481 Cc1nc(C)c(CC(N)C(N)=O)s1 Amb33036850 [0,2,0,0,0,0|2,0,0]=4 2181 B13R1.3481 Cc1nc(C)c(CC(O)C(=O)O)s1 Amb33353499 [0,2,0,0,0,0|2,0,0]=4 2182 B13R1.3481 Cc1nc(C)c(C[C@@H](N)C(=O)O)s1 Amb26405568 [0,2,0,0,0,0|1,0,0]=3 2183 B13R1.3481 Cc1nc(C)c(C[C@H](N)C(=O)O)s1 Amb25321156 [0,2,0,0,0,0|1,0,0]=3 2184 B13R1.3481 Cc1nc(C)n(CC(N)C(=O)O)n1 Amb18294538 [0,2,0,0,0,0|1,0,1]=4 2185 B13R1.3481 Cc1nc(CC(N)C(=O)O)c(C)s1 Amb18187443 [0,2,0,0,0,0|1,0,1]=4 2186 B13R1.3481 Cc1nc(CC(N)C(=O)O)n(C)n1 Amb18822956 [0,2,0,0,0,0|1,0,1]=4 2187 B13R1.3481 Cc1nc(C[C@@H](N)C(=O)O)c(C)s1 Amb33065788 [0,2,0,0,0,0|1,0,1]=4 2188 B13R1.3481 Cc1nc(C[C@@H](N)C(=O)O)n(C)n1 Amb32937022 [0,2,0,0,0,0|1,0,1]=4 2189 B13R1.3481 Cc1nc(C[C@H](N)C(=O)O)c(C)s1 Amb33066072 [0,2,0,0,0,0|1,0,1]=4 2190 B13R1.3481 Cc1nc(C[C@H](N)C(=O)O)n(C)n1 Amb33308998 [0,2,0,0,0,0|1,0,1]=4 2191 B13R1.3481 Cc1nn(C)cc1CC(N)C(=O)O Amb18192055 [0,2,0,0,0,0|2,0,0]=4 2192 B13R1.3481 Cc1nn(C)cc1CC(N)C(=O)O Amb33338908 [0,2,0,0,0,0|2,0,0]=4 2193 B13R1.3481 Cc1nn(C)cc1C[C@@H](N)C(=O)O Amb26314140 [0,2,0,0,0,0|2,0,0]=4 2194 B13R1.3481 Cc1nn(C)cc1C[C@H](N)C(=O)O Amb24668721 [0,2,0,0,0,0|2,0,0]=4 2195 B13R1.3481 Cc1sc(Cl)cc1CC(N)C(=O)O Amb33734284 [0,2,0,0,0,0|2,0,0]=4 2196 B13R1.3481 Cc1sc(Cl)cc1CC(N)C(=O)O Amb33734662 [0,2,0,0,0,0|2,0,0]=4 2197 B13R1.3481 Cn1cc(C[C@@H](N)C(=O)O)c(Br)n1 Amb33127529 [0,2,0,0,0,0|2,0,0]=4 2198 B13R1.3481 Cn1cc(C[C@H](N)C(=O)O)c(Br)n1 Amb33065547 [0,2,0,0,0,0|2,0,0]=4 2199 B13R1.3481 Cn1nc(Br)cc1CC(N)C(=O)O Amb33435717 [0,2,0,0,0,0|2,0,0]=4 2200 B13R1.3481 Cn1nc(Br)cc1C[C@@H](N)C(=O)O Amb35723630 [0,2,0,0,0,0|2,0,0]=4 2201 B13R1.3481 Cn1nc(Br)cc1C[C@H](N)C(=O)O Amb35723631 [0,2,0,0,0,0|2,0,0]=4 2202 B13R1.3481 NC(CC1=CC(=O)NC1=O)C(=O)O Amb28422355 [0,2,0,0,0,0|1,0,1]=4 2203 B13R1.3481 NC(CN1NC(=O)NC1=O)C(=O)O Amb27233013 [0,2,0,0,0,0|1,0,1]=4 2204 B13R1.3481 NC(Cc1cc(Br)sc1Br)C(=O)O Amb33802997 [0,2,0,0,0,0|2,0,0]=4 2205 B13R1.3481 NC(Cc1cc(Br)sc1Br)C(=O)O Amb33804754 [0,2,0,0,0,0|2,0,0]=4 2206 B13R1.3481 NC(Cc1cc(Cl)sc1Cl)C(=O)O Amb27866298 [0,2,0,0,0,0|2,0,0]=4 2207 B13R1.3481 NC(Cc1cc(Cl)sc1Cl)C(=O)O Amb33299258 [0,2,0,0,0,0|2,0,0]=4 2208 B13R1.3481 NC(Cc1nc(Cl)sc1Cl)C(=O)O Amb35788539 [0,2,0,0,0,0|1,0,1]=4 2209 B13R1.3481 NC(Cc1nc(Cl)sc1Cl)C(=O)O Amb35789655 [0,2,0,0,0,0|1,0,1]=4 2210 B13R1.3481 NC(Cc1sc(Cl)nc1Cl)C(=O)O Amb27585398 [0,2,0,0,0,0|1,0,0]=3 2211 B13R1.3481 N[C@@H](Cc1cc(Cl)sc1Cl)C(=O)O Amb27814728 [0,2,0,0,0,0|2,0,0]=4 2212 B13R1.3481 N[C@H](Cc1cc(Cl)sc1Cl)C(=O)O Amb27472374 [0,2,0,0,0,0|2,0,0]=4 2213 B13R1.3481 O=C(O)C(F)Cc1sc(Cl)nc1Cl Amb27856403 [0,2,0,0,0,0|2,0,0]=4 2214 B13R1.5896 Cc1c(Br)csc1CC(N)C(=O)O Amb27871354 [0,2,0,0,0,0|2,0,0]=4 2215 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb28555943 [0,2,0,0,0,0|2,0,0]=4 2216 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb35751801 [0,2,0,0,0,0|2,0,0]=4 2217 B13R1.5896 Cc1c(CC(N)C(=O)O)cnn1C Amb6888415 [0,2,0,0,0,0|2,0,0]=4 2218 B13R1.5896 Cc1c(C[C@@H](N)C(=O)O)cnn1C Amb26963466 [0,2,0,0,0,0|2,0,0]=4 2219 B13R1.5896 Cc1c(C[C@H](N)C(=O)O)cnn1C Amb25044003 [0,2,0,0,0,0|2,0,0]=4 2220 B13R1.5896 Cc1c(O)noc1CC(N)C(=O)O Amb2699203 [0,2,0,0,0,0|2,0,0]=4 2221 B13R1.5896 Cc1c(O)noc1C[C@@H](N)C(=O)O Amb2699216 [0,2,0,0,0,0|2,0,0]=4 2222 B13R1.5896 Cc1c(O)noc1C[C@H](N)C(=O)O Amb2699217 [0,2,0,0,0,0|2,0,0]=4 2223 B13R1.5896 Cc1csc(CC(N)C(=O)O)c1Br Amb33433480 [0,2,0,0,0,0|2,0,0]=4 2224 B13R1.5896 Cc1csc(CC(N)C(=O)O)c1Cl Amb25844088 [0,2,0,0,0,0|2,0,0]=4 2225 B13R1.5896 Cc1csc(C[C@@H](N)C(=O)O)c1Cl Amb27771484 [0,2,0,0,0,0|2,0,0]=4 2226 B13R1.5896 Cc1ncc(CC(=O)C(=O)O)n1C Amb35656418 [0,2,0,0,0,0|1,0,1]=4 2227 B13R1.5896 Cc1ncc(CC(F)C(=O)O)n1C Amb35656425 [0,2,0,0,0,0|1,0,0]=3 2228 B13R1.5896 Cc1ncc(CC(N)C(=O)O)n1C Amb18823347 [0,2,0,0,0,0|0,0,0]=2 2229 B13R1.5896 Cc1ncc(CC(O)C(=O)O)n1C Amb33353307 [0,2,0,0,0,0|1,0,0]=3 2230 B13R1.5896 Cc1ncc(CC(S)C(=O)O)n1C Amb35652783 [0,2,0,0,0,0|1,0,0]=3 2231 B13R1.5896 Cc1ncc(C[C@@H](N)C(=O)O)n1C Amb35656362 [0,2,0,0,0,0|0,0,0]=2 2232 B13R1.5896 Cc1ncc(C[C@H](N)C(=O)O)n1C Amb35656363 [0,2,0,0,0,0|0,0,0]=2 2233 B13R1.5896 Cc1ncn(CC(N)C(=O)O)c1C Amb18296533 [0,2,0,0,0,0|2,0,0]=4 2234 B13R1.5896 Cc1nnc(CC(N)C(=O)O)n1C Amb18822959 [0,2,0,0,0,0|1,0,0]=3 2235 B13R1.5896 Cc1nnc(CC(N)C(N)=O)n1C Amb32789407 [0,2,0,0,0,0|2,0,0]=4 2236 B13R1.5896 Cc1nnc(C[C@@H](N)C(=O)O)n1C Amb33308682 [0,2,0,0,0,0|1,0,0]=3 2237 B13R1.5896 Cc1nnc(C[C@H](N)C(=O)O)n1C Amb32865921 [0,2,0,0,0,0|1,0,0]=3 2238 B13R1.5896 Cn1c(Cl)cnc1C[C@@H](N)C(=O)O Amb28366461 [0,2,0,0,0,0|2,0,0]=4 2239 B13R1.5896 Cn1c(Cl)cnc1C[C@H](N)C(=O)O Amb26882002 [0,2,0,0,0,0|2,0,0]=4 2240 B13R1.5896 Cn1cnc(C[C@H](N)C(=O)O)c1S Amb27949652 [0,2,0,0,0,0|0,0,2]=4 2241 B13R1.5896 NC(Cn1cnc(I)c1I)C(=O)O Amb27465514 [0,2,0,0,0,0|2,0,0]=4 2242 B13R1.5896 N[C@@H](Cc1onc(O)c1Br)C(=O)O Amb22799616 [0,2,0,0,0,0|2,0,0]=4 2243 B13R1.5896 N[C@H](Cc1onc(O)c1Br)C(=O)O Amb24370073 [0,2,0,0,0,0|2,0,0]=4 2244 B13R1.5898 NC(CC1(F)C=NC(F)=N1)C(=O)O Amb27657523 [0,2,0,0,0,0|0,0,2]=4 2245 B13R1.66 CCOC(=O)C(N)Cc1ccco1 Amb19045175 [0,2,0,0,0,0|2,0,0]=4 2246 B13R1.66 CCOC(=O)C(N)Cc1cccs1 Amb3788685 [0,2,0,0,0,0|2,0,0]=4 2247 B13R1.66 CCOC(=O)C(N)Cc1ccno1 Amb33745587 [0,2,0,0,0,0|2,0,0]=4 2248 B13R1.66 CCOC(=O)C(N)Cc1ccns1 Amb32937035 [0,2,0,0,0,0|2,0,0]=4 2249 B13R1.66 CCOC(=O)C(N)Cc1ccoc1 Amb33036775 [0,2,0,0,0,0|2,0,0]=4 2250 B13R1.66 CCOC(=O)C(N)Cc1ccsc1 Amb19038381 [0,2,0,0,0,0|2,0,0]=4 2251 B13R1.66 CCOC(=O)C(N)Cc1cncs1 Amb18316916 [0,2,0,0,0,0|1,0,0]=3 2252 B13R1.66 CCOC(=O)C(N)Cc1cnns1 Amb33065580 [0,2,0,0,0,0|2,0,0]=4 2253 B13R1.66 CCOC(=O)C(N)Cc1cnsn1 Amb33065600 [0,2,0,0,0,0|1,0,1]=4 2254 B13R1.66 CCOC(=O)C(N)Cc1cscn1 Amb18316917 [0,2,0,0,0,0|1,0,1]=4 2255 B13R1.66 CCOC(=O)C(N)Cn1ccnc1 Amb18318566 [0,2,0,0,0,0|2,0,0]=4 2256 B13R1.66 CCOC(=O)C(N)Cn1cncn1 Amb18318773 [0,2,0,0,0,0|1,0,1]=4 2257 B13R1.66 CCOC(=O)[C@@H](N)Cc1cccs1 Amb33801537 [0,2,0,0,0,0|2,0,0]=4 2258 B13R1.83 COC(=O)C(N)C(C)n1ccnc1 Amb22642987 [0,2,0,0,0,0|2,0,0]=4 2259 B13R1.83 COC(=O)C(N)C(C)n1cncn1 Amb22643015 [0,2,0,0,0,0|1,0,1]=4 2260 B13R1.704 COC(=O)C(N)Cc1ccsc1Br Amb33036553 [0,2,0,0,0,0|2,0,0]=4 2261 B13R1.704 COC(=O)C(N)Cc1ccsc1Cl Amb33308954 [0,2,0,0,0,0|2,0,0]=4 2262 B13R1.704 COC(=O)C(N)Cc1cncn1C Amb33069588 [0,2,0,0,0,0|0,0,0]=2 2263 B13R1.704 COC(=O)C(N)Cc1cscc1C Amb33065616 [0,2,0,0,0,0|2,0,0]=4 2264 B13R1.704 COC(=O)C(N)Cc1nccn1C Amb31156521 [0,2,0,0,0,0|2,0,0]=4 2265 B13R1.704 COC(=O)C(N)Cc1nccn1C Amb33036826 [0,2,0,0,0,0|2,0,0]=4 2266 B13R1.704 COC(=O)C(N)Cc1ncnn1C Amb33037041 [0,2,0,0,0,0|1,0,1]=4 2267 B13R1.704 COC(=O)C(N)Cc1ncsc1Cl Amb33309105 [0,2,0,0,0,0|1,0,1]=4 2268 B13R1.704 COC(=O)C(N)Cc1nncn1C Amb33066011 [0,2,0,0,0,0|1,0,0]=3 2269 B13R1.704 COC(=O)C(N)Cc1nnnn1C Amb33308588 [0,2,0,0,0,0|2,0,0]=4 2270 B13R1.704 COC(=O)C(N)Cc1nonc1C Amb33746359 [0,2,0,0,0,0|1,0,1]=4 2271 B13R1.704 COC(=O)C(N)Cc1sccc1Br Amb32664642 [0,2,0,0,0,0|2,0,0]=4 2272 B13R1.704 COC(=O)C(N)Cc1sccc1Br Amb32752664 [0,2,0,0,0,0|2,0,0]=4 2273 B13R1.704 COC(=O)C(N)Cc1sccc1C Amb32665944 [0,2,0,0,0,0|2,0,0]=4 2274 B13R1.704 COC(=O)C(N)Cc1sccc1Cl Amb33036837 [0,2,0,0,0,0|2,0,0]=4 2275 B13R1.704 COC(=O)C(N)Cc1scnc1Cl Amb33036477 [0,2,0,0,0,0|1,0,0]=3 2276 B13R1.704 COC(=O)C(N)Cc1sncc1Br Amb33036994 [0,2,0,0,0,0|2,0,0]=4 2277 B13R1.704 COC(=O)C(N)Cc1snnc1C Amb33036569 [0,2,0,0,0,0|2,0,0]=4 2278 B13R1.704 COC(=O)C(N)Cn1ccnc1C Amb18318569 [0,2,0,0,0,0|2,0,0]=4 2279 B13R1.704 COC(=O)C(O)Cc1cccn1C Amb33204010 [0,2,0,0,0,0|2,0,0]=4 2280 B13R1.704 COC(=O)C(O)Cc1cncn1C Amb32878166 [0,2,0,0,0,0|1,0,0]=3 2281 B13R1.704 COC(=O)C(O)Cc1cnnn1C Amb33145365 [0,2,0,0,0,0|2,0,0]=4 2282 B13R1.704 COC(=O)C(O)Cc1scnc1C Amb32876823 [0,2,0,0,0,0|2,0,0]=4 2283 B13R1.704 COC(=O)[C@@H](N)Cc1sccc1Br Amb32667308 [0,2,0,0,0,0|2,0,0]=4 2284 B13R1.704 COC(=O)[C@@H](N)Cc1sccc1Br Amb32667334 [0,2,0,0,0,0|2,0,0]=4 2285 B13R1.704 COC(=O)[C@H](N)Cc1sccc1C Amb19375484 [0,2,0,0,0,0|2,0,0]=4 2286 B13R1.721 CNC(Cn1ccnc1)C(=O)OC Amb18318567 [0,2,0,0,0,0|2,0,0]=4 2287 B13R1.721 CNC(Cn1cncn1)C(=O)OC Amb18318774 [0,2,0,0,0,0|1,0,1]=4 2288 B13R1.721 COC(=O)C(CN)Cc1cccs1 Amb33726833 [0,2,0,0,0,0|2,0,0]=4 2289 B13R1.1773 COC(=O)C(C)(N)Cc1ccco1 Amb17400980 [0,2,0,0,0,0|2,0,0]=4 2290 B13R1.1773 COC(=O)C(C)(N)Cc1cccs1 Amb17402302 [0,2,0,0,0,0|2,0,0]=4 2291 B13R1.1773 COC(=O)C(C)(N)Cn1ccnc1 Amb19045182 [0,2,0,0,0,0|2,0,0]=4 2292 B13R1.1773 COC(=O)C(C)(N)Cn1cncn1 Amb18318776 [0,2,0,0,0,0|1,0,1]=4 2293 B13R1.196 CC(C(=O)O)C(C)c1cncn1C Amb35601942 [0,2,0,0,0,0|1,0,0]=3 2294 B13R1.196 CC(C(=O)O)C(C)c1nncn1C Amb28141169 [0,2,0,0,0,0|2,0,0]=4 2295 B13R1.196 CC(C(=O)O)C(O)c1cnnn1C Amb27981483 [0,2,0,0,0,0|2,0,0]=4 2296 B13R1.196 CC(c1ccnn1C)C(N)C(=O)O Amb30040148 [0,2,0,0,0,0|2,0,0]=4 2297 B13R1.196 CC(c1nccn1C)C(N)C(=O)O Amb30040147 [0,2,0,0,0,0|2,0,0]=4 2298 B13R1.196 Cc1ccoc1C(O)C(N)C(=O)O Amb24389197 [0,2,0,0,0,0|2,0,0]=4 2299 B13R1.196 Cc1ccsc1C(C)C(N)C(=O)O Amb30040039 [0,2,0,0,0,0|2,0,0]=4 2300 B13R1.196 Cc1ccsc1C(O)C(N)C(=O)O Amb24432417 [0,2,0,0,0,0|2,0,0]=4 2301 B13R1.196 Cc1cscc1C(O)C(N)C(=O)O Amb33146300 [0,2,0,0,0,0|2,0,0]=4 2302 B13R1.196 Cc1nccn1C(C)C(N)C(=O)O Amb33129059 [0,2,0,0,0,0|2,0,0]=4 2303 B13R1.196 Cc1ncsc1C(C)C(C)C(=O)O Amb18187685 [0,2,0,0,0,0|2,0,0]=4 2304 B13R1.196 Cc1ncsc1C(O)C(N)C(=O)O Amb32876036 [0,2,0,0,0,0|1,0,0]=3 2305 B13R1.196 Cc1nnsc1C(O)C(N)C(=O)O Amb27965120 [0,2,0,0,0,0|2,0,0]=4 2306 B13R1.196 Cc1occc1C(O)C(N)C(=O)O Amb26951797 [0,2,0,0,0,0|2,0,0]=4 2307 B13R1.196 Cc1oncc1C(O)C(N)C(=O)O Amb33361663 [0,2,0,0,0,0|2,0,0]=4 2308 B13R1.196 Cc1sccc1C(O)C(N)C(=O)O Amb27876003 [0,2,0,0,0,0|2,0,0]=4 2309 B13R1.196 Cn1cccc1C(O)C(N)C(=O)O Amb33315129 [0,2,0,0,0,0|1,0,0]=3 2310 B13R1.196 Cn1ccnc1C(O)C(N)C(=O)O Amb25348369 [0,2,0,0,0,0|2,0,0]=4 2311 B13R1.196 Cn1cncc1C(O)C(N)C(=O)O Amb26948472 [0,2,0,0,0,0|0,0,0]=2 2312 B13R1.196 Cn1nccc1C(O)C(N)C(=O)O Amb24367504 [0,2,0,0,0,0|2,0,0]=4 2313 B13R1.196 Cn1nncc1C(O)C(N)C(=O)O Amb24624791 [0,2,0,0,0,0|1,0,0]=3 2314 B13R1.196 NC(C(=O)O)C(O)c1sccc1Br Amb28063226 [0,2,0,0,0,0|2,0,0]=4 2315 B13R1.196 NC(C(=O)O)C(O)c1sccc1Cl Amb24532379 [0,2,0,0,0,0|2,0,0]=4 2316 B13R1.709 CNC(C(=O)O)C(C)n1ccnc1 Amb33129018 [0,2,0,0,0,0|2,0,0]=4 2317 B13R1.709 CNC(C(=O)O)C(C)n1cncn1 Amb33129020 [0,2,0,0,0,0|1,0,1]=4 2318 B13R1.1007 CC(C)(c1ccco1)C(N)C(=O)O Amb33360977 [0,2,0,0,0,0|2,0,0]=4 2319 B13R1.1007 CC(C)(c1cccs1)C(N)C(=O)O Amb33360901 [0,2,0,0,0,0|2,0,0]=4 2320 B13R1.1007 CC(C)(c1ccoc1)C(N)C(=O)O Amb33361242 [0,2,0,0,0,0|2,0,0]=4 2321 B13R1.1007 CC(C)(c1ccsc1)C(N)C(=O)O Amb33428944 [0,2,0,0,0,0|2,0,0]=4 2322 B13R1.1007 CC(C)(c1cnco1)C(N)C(=O)O Amb33415250 [0,2,0,0,0,0|1,0,0]=3 2323 B13R1.1007 CC(C)(c1cnco1)C(O)C(=O)O Amb33415247 [0,2,0,0,0,0|2,0,0]=4 2324 B13R1.1007 CC(C)(c1cncs1)C(N)C(=O)O Amb33269815 [0,2,0,0,0,0|1,0,0]=3 2325 B13R1.1007 CC(C)(c1cncs1)C(O)C(=O)O Amb33269810 [0,2,0,0,0,0|2,0,0]=4 2326 B13R1.1007 CC(C)(c1cscn1)C(N)C(=O)O Amb33418182 [0,2,0,0,0,0|1,0,1]=4 2327 B13R1.1071 O=C(O)C(F)(F)C(O)c1cncs1 Amb33328304 [0,2,0,0,0,0|2,0,0]=4 2328 B13R1.421 CNC(Cn1ccnc1C)C(=O)O Amb19045183 [0,2,0,0,0,0|2,0,0]=4 2329 B13R1.421 COC(Cc1cccn1C)C(=O)O Amb33204004 [0,2,0,0,0,0|2,0,0]=4 2330 B13R1.421 COC(Cc1cncn1C)C(=O)O Amb32876941 [0,2,0,0,0,0|1,0,0]=3 2331 B13R1.421 COC(Cc1cnnn1C)C(=O)O Amb33145359 [0,2,0,0,0,0|2,0,0]=4 2332 B13R1.421 COC(Cc1scnc1C)C(=O)O Amb32875917 [0,2,0,0,0,0|2,0,0]=4 2333 B13R1.421 Cn1cncc1CC(C#N)C(=O)O Amb29875740 [0,2,0,0,0,0|0,0,1]=3 2334 B13R1.772 Cc1nccn1CC(C)(N)C(=O)O Amb18984341 [0,2,0,0,0,0|2,0,0]=4 2335 B13R1.772 Cc1ncsc1CC(C)(C)C(=O)O Amb32877624 [0,2,0,0,0,0|2,0,0]=4 2336 B13R1.772 Cc1ncsc1CC(C)(O)C(=O)O Amb33271590 [0,2,0,0,0,0|2,0,0]=4 2337 B13R1.772 Cc1ncsc1CC(F)(F)C(=O)O Amb33171197 [0,2,0,0,0,0|2,0,0]=4 2338 B13R1.772 Cn1cccc1CC(C)(C)C(=O)O Amb33314738 [0,2,0,0,0,0|2,0,0]=4 2339 B13R1.772 Cn1cccc1CC(C)(O)C(=O)O Amb33203995 [0,2,0,0,0,0|2,0,0]=4 2340 B13R1.772 Cn1cccc1CC(F)(F)C(=O)O Amb32811212 [0,2,0,0,0,0|2,0,0]=4 2341 B13R1.772 Cn1cncc1CC(C)(C)C(=O)O Amb32878185 [0,2,0,0,0,0|1,0,0]=3 2342 B13R1.772 Cn1cncc1CC(C)(O)C(=O)O Amb32876935 [0,2,0,0,0,0|1,0,0]=3 2343 B13R1.772 Cn1cncc1CC(F)(F)C(=O)O Amb33171201 [0,2,0,0,0,0|1,0,0]=3 2344 B13R1.772 Cn1cnnc1CC(F)(F)C(=O)O Amb33170970 [0,2,0,0,0,0|2,0,0]=4 2345 B13R1.772 Cn1nncc1CC(C)(C)C(=O)O Amb33145399 [0,2,0,0,0,0|2,0,0]=4 2346 B13R1.772 Cn1nncc1CC(C)(O)C(=O)O Amb33145008 [0,2,0,0,0,0|2,0,0]=4 2347 B13R1.772 Cn1nncc1CC(F)(F)C(=O)O Amb33170769 [0,2,0,0,0,0|2,0,0]=4 2348 B13R1.2801 CCc1ccsc1CC(N)C(=O)O Amb32729513 [0,2,0,0,0,0|2,0,0]=4 2349 B13R1.2801 CCc1nccn1CC(N)C(=O)O Amb18318576 [0,2,0,0,0,0|2,0,0]=4 2350 B13R1.2801 CCc1nonc1CC(N)C(=O)O Amb18191408 [0,2,0,0,0,0|1,0,1]=4 2351 B13R1.2801 CCn1ccnc1CC(N)C(=O)O Amb18315782 [0,2,0,0,0,0|2,0,0]=4 2352 B13R1.2801 CCn1ccnc1C[C@@H](N)C(=O)O Amb32788586 [0,2,0,0,0,0|2,0,0]=4 2353 B13R1.2801 CCn1ccnc1C[C@H](N)C(=O)O Amb33308560 [0,2,0,0,0,0|2,0,0]=4 2354 B13R1.2801 CCn1cncc1CC(=O)C(=O)O Amb33361933 [0,2,0,0,0,0|1,0,1]=4 2355 B13R1.2801 CCn1cncc1CC(C)C(=O)O Amb33474392 [0,2,0,0,0,0|1,0,0]=3 2356 B13R1.2801 CCn1cncc1CC(N)C(=O)O Amb32953896 [0,2,0,0,0,0|0,0,0]=2 2357 B13R1.2801 CCn1cncc1CC(O)C(=O)O Amb32668568 [0,2,0,0,0,0|1,0,0]=3 2358 B13R1.2801 CCn1cncc1C[C@H](N)C(=O)O Amb33952430 [0,2,0,0,0,0|0,0,0]=2 2359 B13R1.2801 CCn1nccc1CC(N)C(=O)O Amb9777887 [0,2,0,0,0,0|2,0,0]=4 2360 B13R1.2801 CCn1ncnc1CC(N)C(=O)O Amb33127556 [0,2,0,0,0,0|1,0,1]=4 2361 B13R1.2801 CCn1ncnc1C[C@@H](N)C(=O)O Amb33308893 [0,2,0,0,0,0|1,0,1]=4 2362 B13R1.2801 CCn1ncnc1C[C@H](N)C(=O)O Amb33036546 [0,2,0,0,0,0|1,0,1]=4 2363 B13R1.2801 CCn1nnnc1CC(N)C(=O)O Amb33065491 [0,2,0,0,0,0|2,0,0]=4 2364 B13R1.2801 CCn1nnnc1C[C@@H](N)C(=O)O Amb33036735 [0,2,0,0,0,0|2,0,0]=4 2365 B13R1.2801 CCn1nnnc1C[C@H](N)C(=O)O Amb33127566 [0,2,0,0,0,0|2,0,0]=4 2366 B13R1.2801 COc1nonc1CC(N)C(=O)O Amb18191179 [0,2,0,0,0,0|1,0,1]=4 2367 B13R1.2801 COc1nscc1CC(N)C(=O)O Amb32867915 [0,2,0,0,0,0|2,0,0]=4 2368 B13R1.2801 COc1nscc1C[C@@H](N)C(=O)O Amb33036488 [0,2,0,0,0,0|2,0,0]=4 2369 B13R1.2801 COc1nscc1C[C@H](N)C(=O)O Amb33309053 [0,2,0,0,0,0|2,0,0]=4 2370 B13R1.7553 CC(Cc1c(Br)nnn1C)C(=O)O Amb27668209 [0,2,0,0,0,0|2,0,0]=4 2371 B13R1.7553 CC(Cc1c(Cl)ncn1C)C(=O)O Amb33481841 [0,2,0,0,0,0|1,0,0]=3 2372 B13R1.7553 Cc1cnn(C)c1CC(N)C(=O)O Amb18192070 [0,2,0,0,0,0|2,0,0]=4 2373 B13R1.7553 Cc1cnn(C)c1C[C@@H](N)C(=O)O Amb35580810 [0,2,0,0,0,0|2,0,0]=4 2374 B13R1.7553 Cc1cnn(C)c1C[C@H](N)C(=O)O Amb35580811 [0,2,0,0,0,0|2,0,0]=4 2375 B13R1.7553 Cc1ncn(O)c1CC(N)C(=O)O Amb27760359 [0,2,0,0,0,0|0,0,0]=2 2376 B13R1.7553 Cc1noc(C)c1CC(N)C(=O)O Amb18560927 [0,2,0,0,0,0|2,0,0]=4 2377 B13R1.7553 Cc1onc(Cl)c1CC(N)C(=O)O Amb27220152 [0,2,0,0,0,0|2,0,0]=4 2378 B13R1.7553 Cc1onc(O)c1CC(N)C(=O)O Amb10068487 [0,2,0,0,0,0|2,0,0]=4 2379 B13R1.7553 Cc1onc(O)c1C[C@@H](N)C(=O)O Amb19930306 [0,2,0,0,0,0|2,0,0]=4 2380 B13R1.7553 Cn1cnc(Br)c1CC(N)C(=O)O Amb27608538 [0,2,0,0,0,0|0,0,0]=2 2381 B13R1.7553 Cn1cnc(Cl)c1CC(=O)C(=O)O Amb33057146 [0,2,0,0,0,0|1,0,1]=4 2382 B13R1.7553 Cn1cnc(Cl)c1CC(N)C(=O)O Amb33056790 [0,2,0,0,0,0|0,0,0]=2 2383 B13R1.7553 Cn1cnc(Cl)c1CC(O)C(=O)O Amb33057142 [0,2,0,0,0,0|1,0,0]=3 2384 B13R1.7553 Cn1cnc(S)c1C[C@H](N)C(=O)O Amb26413977 [0,2,0,0,0,0|0,0,0]=2 2385 B13R1.7553 Cn1ncc(Br)c1C[C@@H](N)C(=O)O Amb33308745 [0,2,0,0,0,0|2,0,0]=4 2386 B13R1.7553 Cn1ncc(Br)c1C[C@H](N)C(=O)O Amb33065608 [0,2,0,0,0,0|2,0,0]=4 2387 B13R1.7553 Cn1ncc(Cl)c1CC(N)C(=O)O Amb9777890 [0,2,0,0,0,0|2,0,0]=4 2388 B13R1.7553 Cn1ncc(Cl)c1C[C@@H](N)C(=O)O Amb35580800 [0,2,0,0,0,0|2,0,0]=4 2389 B13R1.7553 Cn1ncc(Cl)c1C[C@H](N)C(=O)O Amb35580801 [0,2,0,0,0,0|2,0,0]=4 2390 B13R1.7553 Cn1nnc(Br)c1CC(N)C(N)=O Amb32941148 [0,2,0,0,0,0|2,0,0]=4 2391 B13R1.7553 Cn1nnc(Br)c1CC(O)C(=O)O Amb33353480 [0,2,0,0,0,0|2,0,0]=4 2392 B13R1.7553 Cn1nnc(Br)c1C[C@@H](N)C(=O)O Amb32789431 [0,2,0,0,0,0|1,0,0]=3 2393 B13R1.7553 Cn1nnc(Br)c1C[C@H](N)C(=O)O Amb33308556 [0,2,0,0,0,0|1,0,0]=3 2394 B13R1.695 CCNC(Cn1ccnc1)C(=O)O Amb18318565 [0,2,0,0,0,0|2,0,0]=4 2395 B13R1.695 CCNC(Cn1cncn1)C(=O)O Amb19045379 [0,2,0,0,0,0|1,0,1]=4 2396 B13R1.695 O=CNC(Cc1ccco1)C(=O)O Amb33066071 [0,2,0,0,0,0|2,0,0]=4 2397 B13R1.695 O=CNC(Cc1cccs1)C(=O)O Amb33036868 [0,2,0,0,0,0|2,0,0]=4 2398 B13R1.695 O=CNC(Cc1ccns1)C(=O)O Amb33308765 [0,2,0,0,0,0|2,0,0]=4 2399 B13R1.695 O=CNC(Cc1ccoc1)C(=O)O Amb32796092 [0,2,0,0,0,0|2,0,0]=4 2400 B13R1.695 O=CNC(Cc1ccsc1)C(=O)O Amb33309126 [0,2,0,0,0,0|2,0,0]=4 2401 B13R1.695 O=CNC(Cc1cncs1)C(=O)O Amb33042723 [0,2,0,0,0,0|1,0,0]=3 2402 B13R1.695 O=CNC(Cc1cnns1)C(=O)O Amb33036767 [0,2,0,0,0,0|2,0,0]=4 2403 B13R1.695 O=CNC(Cc1cnsn1)C(=O)O Amb32789413 [0,2,0,0,0,0|1,0,1]=4 2404 B13R1.695 O=CNC(Cc1cscn1)C(=O)O Amb33065652 [0,2,0,0,0,0|1,0,1]=4 2405 B13R1.3571 CN(C)C(Cc1ccco1)C(=O)O Amb17233981 [0,2,0,0,0,0|2,0,0]=4 2406 B13R1.3571 CN(C)C(Cc1cccs1)C(=O)O Amb17236955 [0,2,0,0,0,0|2,0,0]=4 2407 B13R1.5639 CC(CN)(Cc1ccco1)C(=O)O Amb26304164 [0,2,0,0,0,0|2,0,0]=4 2408 B13R1.5639 CC(CN)(Cc1ccco1)C(=O)O Amb5744273 [0,2,0,0,0,0|2,0,0]=4 2409 B13R1.5639 CC(CN)(Cc1cccs1)C(=O)O Amb26304165 [0,2,0,0,0,0|2,0,0]=4 2410 B13R1.5639 CC(CN)(Cc1cccs1)C(=O)O Amb5744274 [0,2,0,0,0,0|2,0,0]=4 2411 B13R1.5639 CC(Cc1ccco1)(NN)C(=O)O Amb17401004 [0,2,0,0,0,0|2,0,0]=4 2412 B13R1.5639 CC(Cc1cccs1)(NN)C(=O)O Amb17402354 [0,2,0,0,0,0|2,0,0]=4 2413 B13R1.5639 CNC(C)(Cn1ccnc1)C(=O)O Amb18318568 [0,2,0,0,0,0|2,0,0]=4 2414 B13R1.5639 CNC(C)(Cn1cncn1)C(=O)O Amb18318775 [0,2,0,0,0,0|1,0,1]=4 2415 B11R1.74 N=C1NC(=O)CC(C(=O)O)S1 Amb1042569 [0,0,1,1,0,0|2,0,0]=4 2416 B11R1.74 O=C1CC(C(=O)O)NC(=O)N1 Amb4006223 [0,0,1,1,0,0|2,0,0]=4 2417 B11R1.74 O=C1CC(C(=O)O)NC(=S)N1 Amb27759133 [0,0,1,1,0,0|2,0,0]=4 2418 B11R1.74 O=C1C[C@@H](C(=O)O)NC(=O)N1 Amb6296191 [0,0,1,1,0,0|2,0,0]=4 2419 B11R1.74 O=C1C[C@H](C(=O)O)NC(=O)N1 Amb3997218 [0,0,1,1,0,0|2,0,0]=4 2420 B11R1.36 NC(C(=O)O)c1cccnc1 Amb10632723 [0,0,1,1,0,0|1,0,1]=4 2421 B11R1.36 NC(C(=O)O)c1cccnc1 Amb2696725 [0,0,1,1,0,0|1,0,1]=4 2422 B11R1.36 NC(C(=O)O)c1ccncc1 Amb2696724 [0,0,1,1,0,0|1,0,1]=4 2423 B11R1.36 NC(C(=O)O)c1ccncc1 Amb2699210 [0,0,1,1,0,0|1,0,1]=4 2424 B11R1.36 NC(C(=O)O)c1ccncn1 Amb18201161 [0,0,1,1,0,0|0,0,2]=4 2425 B11R1.36 NC(C(=O)O)c1cncnc1 Amb24485788 [0,0,1,1,0,0|0,0,2]=4 2426 B11R1.36 N[C@@H](C(=O)O)c1ccncc1 Amb27621348 [0,0,1,1,0,0|1,0,1]=4 2427 B11R1.36 N[C@H](C(=O)O)c1ccncc1 Amb2694813 [0,0,1,1,0,0|1,0,1]=4 2428 B11R2.8 NC1Cc2sccc2C1=O Amb18831125 [1,0,0,1,0,0|2,0,0]=4 2429 B11R2.8 NC1Cn2cncc2C1=O Amb27851705 [1,0,0,1,0,0|2,0,0]=4 2430 B11R2.36 NC1CCn2cncc2C1 Amb18832346 [1,0,0,1,0,0|1,0,1]=4 2431 B11R2.36 NC1CCn2cncc2C1 Amb22035335 [1,0,0,1,0,0|1,0,1]=4 2432 B11R2.11 O=C1CC(c2cncs2)N1 Amb27204951 [1,0,0,1,0,0|2,0,0]=4 2433 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,0,0,1,0,1|2,0,0]=4 2434 B13R2.369 NC1Cc2cccnc2NC1=O Amb23571829 [0,0,0,1,0,1|2,0,0]=4 2435 B13R2.369 NC1Cc2cccnc2NC1=O Amb30291382 [0,0,0,1,0,1|2,0,0]=4 2436 B13R2.369 NC1Cc2cnccc2NC1=O Amb20241350 [0,0,0,1,0,1|2,0,0]=4 2437 B13R2.369 NC1Cc2cnccc2NC1=O Amb30046355 [0,0,0,1,0,1|2,0,0]=4 2438 B13R2.423 O=C(O)C1CC1c2cccnc2 Amb9677138 [0,0,0,1,0,1|2,0,0]=4 2439 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb19514911 [0,0,0,1,0,1|2,0,0]=4 2440 B13R2.423 O=C(O)C1CC1c2ccncc2 Amb9677129 [0,0,0,1,0,1|2,0,0]=4 2441 B13R2.423 O=C(O)C1CC1c2ccncn2 Amb24662852 [0,0,0,1,0,1|1,0,1]=4 2442 B13R2.423 O=C(O)C1CC1c2cnccn2 Amb26336135 [0,0,0,1,0,1|1,0,1]=4 2443 B13R2.423 O=C(O)C1CC1c2cncnc2 Amb23571328 [0,0,0,1,0,1|1,0,1]=4 2444 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2cccnc2 Amb27234646 [0,0,0,1,0,1|2,0,0]=4 2445 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cccnc2 Amb26636966 [0,0,0,1,0,1|2,0,0]=4 2446 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb25299768 [0,0,0,1,0,1|2,0,0]=4 2447 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncc2 Amb28594202 [0,0,0,1,0,1|2,0,0]=4 2448 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb33269039 [0,0,0,1,0,1|1,0,1]=4 2449 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccncn2 Amb35753095 [0,0,0,1,0,1|1,0,1]=4 2450 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cnccn2 Amb33360019 [0,0,0,1,0,1|1,0,1]=4 2451 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2cncnc2 Amb33472947 [0,0,0,1,0,1|1,0,1]=4 2452 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2cccnc2 Amb26928613 [0,0,0,1,0,1|2,0,0]=4 2453 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccncc2 Amb27974957 [0,0,0,1,0,1|2,0,0]=4 2454 B13R2.435 O=C(O)C1Cc2ccccc2N1 Amb1914079 [0,0,0,1,0,1|2,0,0]=4 2455 B13R2.435 O=C(O)C1Cc2cccnc2C1 Amb18829466 [0,0,0,1,0,1|2,0,0]=4 2456 B13R2.435 O=C(O)C1Cc2cccnc2C1 Amb29083219 [0,0,0,1,0,1|2,0,0]=4 2457 B13R2.435 O=C(O)C1Cc2cccnc2N1 Amb27794813 [0,0,0,1,0,1|1,0,0]=3 2458 B13R2.435 O=C(O)C1Cc2ccncc2C1 Amb24563347 [0,0,0,1,0,1|2,0,0]=4 2459 B13R2.435 O=C(O)C1Cc2ccncc2C1 Amb33552604 [0,0,0,1,0,1|2,0,0]=4 2460 B13R2.435 O=C(O)C1Cc2cncnc2C1 Amb18829042 [0,0,0,1,0,1|1,0,1]=4 2461 B13R2.435 O=C(O)C1Cc2nccnc2C1 Amb18829015 [0,0,0,1,0,1|1,0,1]=4 2462 B13R2.435 O=C(O)[C@@H]1Cc2ccccc2N1 Amb2698470 [0,0,0,1,0,1|2,0,0]=4 2463 B13R2.435 O=C(O)[C@H]1Cc2ccccc2N1 Amb2699613 [0,0,0,1,0,1|2,0,0]=4 2464 B13R2.5517 NC1(C(=O)O)Cc2ccccc21 Amb28120231 [0,0,0,1,0,1|2,0,0]=4 2465 B13R2.543 O=C(O)CC1Cc2cncn2C1 Amb18827834 [0,0,0,1,0,1|1,0,0]=3 2466 B13R2.149 NC1CC(c2cccs2)OC1=O Amb17470658 [0,0,0,1,0,1|2,0,0]=4 2467 B13R2.430 O=C(O)C1CCc2cncn2C1 Amb18827836 [0,0,0,1,0,1|1,0,0]=3 2468 B13R2.430 O=C(O)C1CCc2cncn2C1 Amb28555791 [0,0,0,1,0,1|1,0,0]=3 2469 B13R2.430 O=C(O)C1CCc2cnnn2C1 Amb26007157 [0,0,0,1,0,1|2,0,0]=4 2470 B13R2.430 O=C(O)C1CCc2nncn2C1 Amb9785101 [0,0,0,1,0,1|2,0,0]=4 2471 B13R2.430 O=C(O)C1CSc2cnnn2C1 Amb20622775 [0,0,0,1,0,1|2,0,0]=4 2472 B13R2.430 O=C(O)C1Cn2cccc2CN1 Amb27441286 [0,0,0,1,0,1|2,0,0]=4 2473 B13R2.430 O=C(O)C1Cn2cnnc2CN1 Amb32667867 [0,0,0,1,0,1|2,0,0]=4 2474 B13R2.430 O=C(O)C1Cn2cnnc2CN1 Amb32682059 [0,0,0,1,0,1|2,0,0]=4 2475 B13R2.400 O=C(O)C1Cc2nc(Br)sc2N1 Amb24392277 [0,1,0,1,0,0|1,0,1]=4 2476 B13R2.2978 Cc1ncc(C2CC2C(=O)O)s1 Amb27659584 [0,1,0,1,0,0|2,0,0]=4 2477 B13R2.2978 Cc1ncc([C@@H]2C[C@H]2C(=O)O)s1 Amb33142954 [0,1,0,1,0,0|2,0,0]=4 2478 B13R2.2978 O=C(O)C1CC1c2cnc(Cl)s2 Amb33220955 [0,1,0,1,0,0|2,0,0]=4 2479 B13R2.2978 O=C(O)[C@@H]1C[C@H]1c2cnc(Cl)s2 Amb33220958 [0,1,0,1,0,0|2,0,0]=4 2480 B13R2.3678 Cc1nnc2n1CC(C(=O)O)C2 Amb24426350 [0,1,0,1,0,0|2,0,0]=4 2481 B13R2.3678 Cc1nnc2n1CC(C(=O)O)C2 Amb33735051 [0,1,0,1,0,0|2,0,0]=4 2482 B13R2.3678 Cn1cnc2c1CC(C(=O)O)C2 Amb18827821 [0,1,0,1,0,0|1,0,0]=3 2483 B13R2.11634 CC1Cc2c(ncn2C)NC1=O Amb27816318 [0,1,0,1,0,0|2,0,0]=4 2484 B13R2.29 O=C1COCC1Cc2cncs2 Amb35736969 [0,1,0,1,0,0|2,0,0]=4 2485 B13R2.432 O=C(O)C1CCC1c2cncs2 Amb29878204 [0,1,0,1,0,0|2,0,0]=4 2486 B13R2.3437 Cc1ncsc1C2CC2C(=O)O Amb25127151 [0,1,0,1,0,0|2,0,0]=4 2487 B13R2.3437 Cc1ncsc1[C@@H]2C[C@H]2C(=O)O Amb32876316 [0,1,0,1,0,0|2,0,0]=4 2488 B13R2.3437 Cc1ncsc1[C@H]2C[C@@H]2C(=O)O Amb27858721 [0,1,0,1,0,0|2,0,0]=4 2489 B13R2.3437 Cn1cccc1C2CC2C(=O)O Amb23538765 [0,1,0,1,0,0|2,0,0]=4 2490 B13R2.3437 Cn1cccc1[C@@H]2C[C@H]2C(=O)O Amb33315154 [0,1,0,1,0,0|2,0,0]=4 2491 B13R2.3437 Cn1cncc1C2CC2C(=O)O Amb25722288 [0,1,0,1,0,0|1,0,0]=3 2492 B13R2.3437 Cn1cncc1C2CC2C(=O)O Amb32662588 [0,1,0,1,0,0|1,0,0]=3 2493 B13R2.3437 Cn1cncc1[C@@H]2C[C@H]2C(=O)O Amb24752425 [0,1,0,1,0,0|1,0,0]=3 2494 B13R2.3437 Cn1cncc1[C@@H]2C[C@H]2C(=O)O Amb28594165 [0,1,0,1,0,0|1,0,0]=3 2495 B13R2.3437 Cn1nncc1C2CC2C(=O)O Amb24709428 [0,1,0,1,0,0|2,0,0]=4 2496 B13R2.3437 Cn1nncc1[C@@H]2C[C@H]2C(=O)O Amb33145958 [0,1,0,1,0,0|2,0,0]=4 2497 B13R2.5597 O=C(O)C1(Cc2cnco2)CC1 Amb33414830 [0,1,0,1,0,0|2,0,0]=4 2498 B13R2.5597 O=C(O)C1(Cc2cncs2)CC1 Amb27172910 [0,1,0,1,0,0|2,0,0]=4 2499 B9R1.11 CC(C=O)c1cnco1 Amb33295068 [1,0,0,0,1,0|2,0,0]=4 2500 B9R1.11 CC(C=O)c1cncs1 Amb33269136 [1,0,0,0,1,0|2,0,0]=4 2501 B9R1.11 NC(CO)c1cnco1 Amb22713444 [1,0,0,0,1,0|1,0,1]=4 2502 B9R1.11 NC(CO)c1cncs1 Amb18831492 [1,0,0,0,1,0|1,0,1]=4 2503 B9R1.11 N[C@@H](CO)c1cnco1 Amb33415548 [1,0,0,0,1,0|1,0,1]=4 2504 B9R1.11 N[C@@H](CO)c1cncs1 Amb33269152 [1,0,0,0,1,0|1,0,1]=4 2505 B9R1.11 N[C@H](CO)c1cnco1 Amb33414847 [1,0,0,0,1,0|1,0,1]=4 2506 B9R1.11 N[C@H](CO)c1cncs1 Amb33269158 [1,0,0,0,1,0|1,0,1]=4 2507 B9R1.11 O=CC(O)c1cncs1 Amb30026644 [1,0,0,0,1,0|2,0,0]=4 2508 B9R1.110 NC(C(=O)O)C1=CCC1 Amb27792901 [0,0,0,0,2,0|1,0,1]=4 2509 B11R1.40 C=CC(N)Cc1cccnc1 Amb27196336 [1,0,0,0,0,1|2,0,0]=4 2510 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [1,0,0,0,0,1|2,0,0]=4 2511 B11R1.40 NC(CO)Cc1cccnc1 Amb17062683 [1,0,0,0,0,1|1,0,1]=4 2512 B11R1.40 NC(CO)Cc1cccnc1 Amb28872296 [1,0,0,0,0,1|1,0,1]=4 2513 B11R1.40 NC(CO)Cc1cccnc1 Amb32729349 [1,0,0,0,0,1|1,0,1]=4 2514 B11R1.40 NC(CO)Cc1ccncc1 Amb17062684 [1,0,0,0,0,1|1,0,1]=4 2515 B11R1.40 NC(CO)Cc1ccncc1 Amb28872297 [1,0,0,0,0,1|1,0,1]=4 2516 B11R1.40 NC(CO)Cc1ccncc1 Amb32729350 [1,0,0,0,0,1|1,0,1]=4 2517 B11R1.40 NC(CO)Cc1ccncn1 Amb24099661 [1,0,0,0,0,1|0,0,2]=4 2518 B11R1.40 NC(CO)Cc1ccnnc1 Amb33230897 [1,0,0,0,0,1|1,0,1]=4 2519 B11R1.40 NC(CO)Cc1cnccn1 Amb25972735 [1,0,0,0,0,1|0,0,2]=4 2520 B11R1.40 NC(CO)Cc1cncnc1 Amb25963732 [1,0,0,0,0,1|0,0,2]=4 2521 B11R1.40 N[C@@H](CO)Cc1cccnc1 Amb27590328 [1,0,0,0,0,1|1,0,1]=4 2522 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [1,0,0,0,0,1|2,0,0]=4 2523 B11R1.40 N[C@H](CO)Cc1ccncc1 Amb28368142 [1,0,0,0,0,1|1,0,1]=4 2524 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [1,0,0,0,0,1|2,0,0]=4 2525 B11R1.40 O=CC(Cl)Cc1cncnc1 Amb27239364 [1,0,0,0,0,1|1,0,1]=4 2526 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,1|2,0,0]=4 2527 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,1|2,0,0]=4 2528 B11R1.91 CC(=O)CCc1ccncc1 Amb33329478 [1,0,0,0,0,1|2,0,0]=4 2529 B11R1.91 CC(=O)CCc1ccncn1 Amb27399166 [1,0,0,0,0,1|1,0,1]=4 2530 B11R1.91 CC(=O)CCc1cnccn1 Amb25307907 [1,0,0,0,0,1|1,0,1]=4 2531 B11R1.91 CC(=O)CCc1cncnc1 Amb28285350 [1,0,0,0,0,1|1,0,1]=4 2532 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,0,1|2,0,0]=4 2533 B11R1.91 NC(=O)CCc1ccncn1 Amb27231725 [1,0,0,0,0,1|1,0,1]=4 2534 B11R1.91 O=C(Cl)CCc1cccnc1 Amb24077445 [1,0,0,0,0,1|2,0,0]=4 2535 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,0,0,0,0,1|2,0,0]=4 2536 B11R1.91 O=C(O)CCc1ccccn1 Amb2696647 [1,0,0,0,0,1|1,0,1]=4 2537 B11R1.91 O=C(O)CCc1ccccn1 Amb33532884 [1,0,0,0,0,1|1,0,1]=4 2538 B11R1.91 O=C(O)CCc1ccccn1 Amb8428105 [1,0,0,0,0,1|1,0,1]=4 2539 B11R1.91 O=C(O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,1|1,0,0]=3 2540 B11R1.91 O=C(O)CCc1cccnn1 Amb23592184 [1,0,0,0,0,1|1,0,1]=4 2541 B11R1.91 O=C(O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,1|1,0,0]=3 2542 B11R1.91 O=C(O)CCc1ccncn1 Amb33545203 [1,0,0,0,0,1|0,0,1]=3 2543 B11R1.91 O=C(O)CCc1ccnnc1 Amb22499259 [1,0,0,0,0,1|1,0,0]=3 2544 B11R1.91 O=C(O)CCc1cnccn1 Amb5846608 [1,0,0,0,0,1|0,0,1]=3 2545 B11R1.91 O=C(O)CCc1cncnc1 Amb18201449 [1,0,0,0,0,1|0,0,1]=3 2546 B11R1.91 O=C(O)CCc1cncnn1 Amb27956128 [1,0,0,0,0,1|0,0,1]=3 2547 B11R1.91 O=C(O)CCc1cnncn1 Amb18201165 [1,0,0,0,0,1|0,0,1]=3 2548 B11R1.91 O=C(O)CCc1ncccn1 Amb3997808 [1,0,0,0,0,1|1,0,1]=4 2549 B11R1.91 O=C(O)CCc1nccnn1 Amb18201164 [1,0,0,0,0,1|1,0,1]=4 2550 B11R1.91 O=C(O)CCc1ncncn1 Amb18862491 [1,0,0,0,0,1|0,0,1]=3 2551 B11R1.91 O=C(O)CNc1cccnc1 Amb17593781 [1,0,0,0,0,1|2,0,0]=4 2552 B11R1.91 O=C(O)CNc1cccnc1 Amb22035240 [1,0,0,0,0,1|2,0,0]=4 2553 B11R1.91 O=C(O)CNc1ccncc1 Amb33549238 [1,0,0,0,0,1|2,0,0]=4 2554 B11R1.91 O=C(O)CNc1ccncc1 Amb6271127 [1,0,0,0,0,1|2,0,0]=4 2555 B11R1.91 O=C(O)CNc1ccncn1 Amb18973871 [1,0,0,0,0,1|1,0,1]=4 2556 B11R1.91 O=C(O)CNc1cnccn1 Amb6256346 [1,0,0,0,0,1|1,0,1]=4 2557 B11R1.91 O=C(O)CNc1cncnc1 Amb18933571 [1,0,0,0,0,1|1,0,1]=4 2558 B11R1.91 O=C(O)COc1cccnc1 Amb22738612 [1,0,0,0,0,1|2,0,0]=4 2559 B11R1.91 O=C(O)COc1cccnc1 Amb33552775 [1,0,0,0,0,1|2,0,0]=4 2560 B11R1.91 O=C(O)COc1cccnc1 Amb836933 [1,0,0,0,0,1|2,0,0]=4 2561 B11R1.91 O=C(O)COc1ccncc1 Amb18125520 [1,0,0,0,0,1|2,0,0]=4 2562 B11R1.91 O=C(O)COc1ccncn1 Amb26495531 [1,0,0,0,0,1|1,0,1]=4 2563 B11R1.91 O=C(O)COc1cnccn1 Amb26976070 [1,0,0,0,0,1|1,0,1]=4 2564 B11R1.91 O=C(O)COc1cncnc1 Amb8009333 [1,0,0,0,0,1|1,0,1]=4 2565 B11R1.91 O=C(O)CSc1ccncc1 Amb24053001 [1,0,0,0,0,1|2,0,0]=4 2566 B11R1.91 O=C(O)CSc1ccncc1 Amb3940121 [1,0,0,0,0,1|2,0,0]=4 2567 B11R1.91 O=C(O)CSc1ccncn1 Amb8089703 [1,0,0,0,0,1|1,0,1]=4 2568 B11R1.91 O=C(O)CSc1ccnnc1 Amb24670204 [1,0,0,0,0,1|2,0,0]=4 2569 B11R1.91 O=C(O)CSc1cnccn1 Amb6278353 [1,0,0,0,0,1|1,0,1]=4 2570 B11R1.172 O=C(O)CCCc1ccco1 Amb18125675 [1,0,0,0,0,1|2,0,0]=4 2571 B11R1.172 O=C(O)CCCc1cccs1 Amb1152340 [1,0,0,0,0,1|2,0,0]=4 2572 B11R1.172 O=C(O)CCCc1ccno1 Amb18200545 [1,0,0,0,0,1|2,0,0]=4 2573 B11R1.172 O=C(O)CCCc1ccoc1 Amb25385034 [1,0,0,0,0,1|2,0,0]=4 2574 B11R1.172 O=C(O)CCCc1ccsc1 Amb22000608 [1,0,0,0,0,1|2,0,0]=4 2575 B11R1.172 O=C(O)CCCc1cnco1 Amb18200538 [1,0,0,0,0,1|1,0,0]=3 2576 B11R1.172 O=C(O)CCCc1cncs1 Amb18198607 [1,0,0,0,0,1|1,0,0]=3 2577 B11R1.172 O=C(O)CCCc1cocn1 Amb18200521 [1,0,0,0,0,1|1,0,1]=4 2578 B11R1.172 O=C(O)CCCc1cscn1 Amb18062607 [1,0,0,0,0,1|1,0,1]=4 2579 B11R1.172 O=C(O)CCCc1ncns1 Amb18198313 [1,0,0,0,0,1|1,0,1]=4 2580 B11R1.172 O=C(O)CCCc1nnco1 Amb17138462 [1,0,0,0,0,1|2,0,0]=4 2581 B11R1.172 O=C(O)CCCn1ccnc1 Amb13949166 [1,0,0,0,0,1|2,0,0]=4 2582 B11R1.172 O=C(O)CCCn1ccnc1 Amb2721839 [1,0,0,0,0,1|2,0,0]=4 2583 B11R1.172 O=C(O)CCCn1cncn1 Amb1102653 [1,0,0,0,0,1|1,0,1]=4 2584 B11R1.172 O=C(O)CCCn1cncn1 Amb22586679 [1,0,0,0,0,1|1,0,1]=4 2585 B11R1.172 O=C(O)CCNc1ncns1 Amb28203201 [1,0,0,0,0,1|1,0,1]=4 2586 B11R1.172 O=C(O)CCNc1nncs1 Amb18092003 [1,0,0,0,0,1|2,0,0]=4 2587 B11R1.172 O=C(O)CCSc1cccs1 Amb6717244 [1,0,0,0,0,1|2,0,0]=4 2588 B11R1.172 O=C(O)CCSc1ccoc1 Amb27988487 [1,0,0,0,0,1|2,0,0]=4 2589 B11R1.172 O=C(O)CCSc1ncns1 Amb27672014 [1,0,0,0,0,1|1,0,1]=4 2590 B11R1.172 O=C(O)CCSc1nnco1 Amb17138715 [1,0,0,0,0,1|2,0,0]=4 2591 B11R1.172 O=C(O)CNCc1ccco1 Amb2592332 [1,0,0,0,0,1|2,0,0]=4 2592 B11R1.172 O=C(O)CNCc1cccs1 Amb8827556 [1,0,0,0,0,1|2,0,0]=4 2593 B11R1.172 O=C(O)CNCc1ccno1 Amb9325921 [1,0,0,0,0,1|2,0,0]=4 2594 B11R1.172 O=C(O)CNCc1ccsc1 Amb8827740 [1,0,0,0,0,1|2,0,0]=4 2595 B11R1.172 O=C(O)CNCc1cscn1 Amb9325650 [1,0,0,0,0,1|1,0,1]=4 2596 B11R1.172 O=C(O)COCc1cccs1 Amb19015456 [1,0,0,0,0,1|2,0,0]=4 2597 B11R1.172 O=C(O)COCc1ccsc1 Amb27271137 [1,0,0,0,0,1|2,0,0]=4 2598 B11R1.172 O=C(O)COCc1cncs1 Amb27986318 [1,0,0,0,0,1|1,0,0]=3 2599 B11R1.172 O=C(O)COCc1ncno1 Amb18306338 [1,0,0,0,0,1|1,0,1]=4 2600 B11R1.172 O=C(O)CSCc1ccco1 Amb2721897 [1,0,0,0,0,1|2,0,0]=4 2601 B11R1.172 O=C(O)CSCc1cccs1 Amb423757 [1,0,0,0,0,1|2,0,0]=4 2602 B11R1.172 O=C(O)CSCc1ccsc1 Amb446162 [1,0,0,0,0,1|2,0,0]=4 2603 B11R1.172 O=C(O)CSCc1cscn1 Amb33528427 [1,0,0,0,0,1|1,0,1]=4 2604 B11R1.172 O=C(O)CSCc1cscn1 Amb33550256 [1,0,0,0,0,1|1,0,1]=4 2605 B13R1.348 CC(CC(=O)O)Cc1cccnc1 Amb17335287 [0,0,0,0,0,2|2,0,0]=4 2606 B13R1.348 CC(CC(=O)O)Cc1ccncc1 Amb17335288 [0,0,0,0,0,2|2,0,0]=4 2607 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb20623358 [0,0,0,0,0,2|2,0,0]=4 2608 B13R1.348 NC(CC(=O)O)Cc1ccccc1 Amb8631754 [0,0,0,0,0,2|2,0,0]=4 2609 B13R1.348 NC(CC(=O)O)Cc1ccccn1 Amb17470627 [0,0,0,0,0,2|1,0,1]=4 2610 B13R1.348 NC(CC(=O)O)Cc1cccnc1 Amb17470630 [0,0,0,0,0,2|1,0,0]=3 2611 B13R1.348 NC(CC(=O)O)Cc1ccncc1 Amb17470634 [0,0,0,0,0,2|1,0,0]=3 2612 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb16184010 [0,0,0,0,0,2|2,0,0]=4 2613 B13R1.348 N[C@@H](CC(=O)O)Cc1ccccc1 Amb2697591 [0,0,0,0,0,2|2,0,0]=4 2614 B13R1.348 N[C@@H](CC(=O)O)Cc1cccnc1 Amb33933974 [0,0,0,0,0,2|1,0,0]=3 2615 B13R1.348 N[C@@H](CC(=O)O)Cc1ccncc1 Amb33726055 [0,0,0,0,0,2|1,0,0]=3 2616 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb2699235 [0,0,0,0,0,2|2,0,0]=4 2617 B13R1.348 N[C@H](CC(=O)O)Cc1ccccc1 Amb8629294 [0,0,0,0,0,2|2,0,0]=4 2618 B13R1.348 N[C@H](CC(=O)O)Cc1cccnc1 Amb22746342 [0,0,0,0,0,2|1,0,0]=3 2619 B13R1.348 N[C@H](CC(=O)O)Cc1ccncc1 Amb22746344 [0,0,0,0,0,2|1,0,0]=3 2620 B13R1.351 CC(CCc1cccnc1)C(=O)O Amb17233532 [0,0,0,0,0,2|2,0,0]=4 2621 B13R1.351 CC(CCc1ccncc1)C(=O)O Amb17335289 [0,0,0,0,0,2|2,0,0]=4 2622 B13R1.351 CC(CCc1ccncn1)C(=O)O Amb33267952 [0,0,0,0,0,2|1,0,1]=4 2623 B13R1.351 CC(CCc1cnccn1)C(=O)O Amb33429871 [0,0,0,0,0,2|1,0,1]=4 2624 B13R1.351 CC(CCc1cncnc1)C(=O)O Amb32876140 [0,0,0,0,0,2|1,0,1]=4 2625 B13R1.351 CC(CNc1ccncc1)C(=O)O Amb19027731 [0,0,0,0,0,2|2,0,0]=4 2626 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb10199875 [0,0,0,0,0,2|2,0,0]=4 2627 B13R1.351 CC(NCc1cccnc1)C(=O)O Amb1110808 [0,0,0,0,0,2|2,0,0]=4 2628 B13R1.351 CC(NCc1ccncc1)C(=O)O Amb9326995 [0,0,0,0,0,2|2,0,0]=4 2629 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662717 [0,0,0,0,0,2|2,0,0]=4 2630 B13R1.351 CC(OCc1cccnc1)C(=O)O Amb32662837 [0,0,0,0,0,2|2,0,0]=4 2631 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb28556093 [0,0,0,0,0,2|2,0,0]=4 2632 B13R1.351 CC(OCc1ccncc1)C(=O)O Amb32662726 [0,0,0,0,0,2|2,0,0]=4 2633 B13R1.351 NC(=O)C(N)CCc1cccnc1 Amb32796900 [0,0,0,0,0,2|2,0,0]=4 2634 B13R1.351 NC(=O)C(N)CCc1ccncc1 Amb33309222 [0,0,0,0,0,2|2,0,0]=4 2635 B13R1.351 NC(=O)C(N)CCc1cnccn1 Amb33309095 [0,0,0,0,0,2|1,0,1]=4 2636 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb33309501 [0,0,0,0,0,2|2,0,0]=4 2637 B13R1.351 NC(CCc1ccccc1)C(=O)O Amb4134816 [0,0,0,0,0,2|2,0,0]=4 2638 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb1101108 [0,0,0,0,0,2|1,0,1]=4 2639 B13R1.351 NC(CCc1ccccn1)C(=O)O Amb24117831 [0,0,0,0,0,2|1,0,1]=4 2640 B13R1.351 NC(CCc1cccnc1)C(=O)O Amb8385705 [0,0,0,0,0,2|1,0,0]=3 2641 B13R1.351 NC(CCc1cccnn1)C(=O)O Amb33036496 [0,0,0,0,0,2|1,0,1]=4 2642 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb17470633 [0,0,0,0,0,2|1,0,0]=3 2643 B13R1.351 NC(CCc1ccncc1)C(=O)O Amb32795038 [0,0,0,0,0,2|1,0,0]=3 2644 B13R1.351 NC(CCc1cnccn1)C(=O)O Amb33065886 [0,0,0,0,0,2|0,0,1]=3 2645 B13R1.351 NC(CSc1ccccc1)C(=O)O Amb18325246 [0,0,0,0,0,2|2,0,0]=4 2646 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb6295860 [0,0,0,0,0,2|2,0,0]=4 2647 B13R1.351 N[C@@H](CCc1ccccc1)C(=O)O Amb8393714 [0,0,0,0,0,2|2,0,0]=4 2648 B13R1.351 N[C@@H](CCc1ccccn1)C(=O)O Amb33065409 [0,0,0,0,0,2|1,0,1]=4 2649 B13R1.351 N[C@@H](CCc1cccnc1)C(=O)O Amb33066201 [0,0,0,0,0,2|1,0,0]=3 2650 B13R1.351 N[C@@H](CCc1cccnn1)C(=O)O Amb33033603 [0,0,0,0,0,2|1,0,1]=4 2651 B13R1.351 N[C@@H](CCc1ccncc1)C(=O)O Amb33036545 [0,0,0,0,0,2|1,0,0]=3 2652 B13R1.351 N[C@@H](CCc1cnccn1)C(=O)O Amb33066161 [0,0,0,0,0,2|0,0,1]=3 2653 B13R1.351 N[C@@H](CNc1ccccc1)C(=O)O Amb26880836 [0,0,0,0,0,2|2,0,0]=4 2654 B13R1.351 N[C@@H](CSc1ccccc1)C(=O)O Amb6357272 [0,0,0,0,0,2|2,0,0]=4 2655 B13R1.351 N[C@H](CCc1ccccc1)C(=O)O Amb6357139 [0,0,0,0,0,2|2,0,0]=4 2656 B13R1.351 N[C@H](CCc1ccccn1)C(=O)O Amb33036457 [0,0,0,0,0,2|1,0,1]=4 2657 B13R1.351 N[C@H](CCc1cccnc1)C(=O)O Amb33308822 [0,0,0,0,0,2|1,0,0]=3 2658 B13R1.351 N[C@H](CCc1cccnn1)C(=O)O Amb33066114 [0,0,0,0,0,2|1,0,1]=4 2659 B13R1.351 N[C@H](CCc1ccncc1)C(=O)O Amb32941145 [0,0,0,0,0,2|1,0,0]=3 2660 B13R1.351 N[C@H](CCc1cnccn1)C(=O)O Amb33308904 [0,0,0,0,0,2|0,0,1]=3 2661 B13R1.351 N\C(=C\Cc1cccnc1)C(=O)O Amb28370348 [0,0,0,0,0,2|1,0,1]=4 2662 B13R1.593 NC(CCc1ccsc1)CC(=O)O Amb33322408 [0,0,0,0,0,2|2,0,0]=4 2663 B13R1.593 NC(CCn1cncn1)CC(=O)O Amb32726021 [0,0,0,0,0,2|1,0,1]=4 2664 B13R1.1110 NC(CCCc1ccsc1)C(=O)O Amb33359860 [0,0,0,0,0,2|2,0,0]=4 2665 B13R1.1110 NC(CCCn1ccnc1)C(=O)O Amb18322508 [0,0,0,0,0,2|2,0,0]=4 2666 B13R1.1110 NC(CCCn1cncn1)C(=O)O Amb33308790 [0,0,0,0,0,2|1,0,1]=4 2667 B13R1.1110 N[C@@H](CCCn1ccnc1)C(=O)O Amb33036907 [0,0,0,0,0,2|2,0,0]=4 2668 B13R1.1110 N[C@@H](CCCn1cncn1)C(=O)O Amb32796911 [0,0,0,0,0,2|1,0,1]=4 2669 B13R1.1110 N[C@H](CCCn1ccnc1)C(=O)O Amb33309130 [0,0,0,0,0,2|2,0,0]=4 2670 B13R1.1110 N[C@H](CCCn1cncn1)C(=O)O Amb32937046 [0,0,0,0,0,2|1,0,1]=4