0 B12R1.43 CC(C)C(=O)CC1=CC=CN=C1 Q58395 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O P43046 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Q60576 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O P43045 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.43 CC(CC1=NC=CC=N1)C(=O)O Q60744 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.43 CC(CC1=NC=NC=C1)C(=O)O Q60710 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O K12054 [0,0,0,0,0,0|2,0,1]=3 7 B12R1.43 C\C(=C/C1=NC=CC=C1)C(=O)O P51664 [0,0,0,0,0,0|2,0,1]=3 8 B12R1.43 NC(CC1=CN=CN=C1)C(=O)O Q63780 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P36885 [0,0,0,0,0,0|2,0,1]=3 10 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P43169 [0,0,0,0,0,0|2,0,1]=3 11 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O P38459 [0,0,0,0,0,0|2,0,1]=3 12 B12R1.43 N[C@@H](CC1=CN=CN=C1)C(=O)O Q63782 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O P38458 [0,0,0,0,0,0|2,0,1]=3 14 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O P36517 [0,0,0,0,0,0|2,0,1]=3 15 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O O27942 [0,0,0,0,0,0|2,0,1]=3 16 B12R1.43 N[C@H](CC1=CN=CN=C1)C(=O)O Q63781 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O P38457 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.43 O=C(O)C(=O)CC1=CC=CC=N1 Q58255 [0,0,0,0,0,0|1,0,0]=1 19 B12R1.43 O=C(O)C(=O)NC1=CN=CC=C1 L18737 [0,0,0,0,0,0|2,0,0]=2 20 B12R1.43 O=C(O)\C(F)=C\C1=CC=CN=C1 Q58319 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.40 C=CC(=O)NC1=CC=CC=N1 Q58307 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.40 C=CC(=O)NC1=CC=CN=C1 Q58308 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.40 C=C[C@@H](N)CC1=CC=CC=C1 P51547 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.40 COC(=O)CC1=CC=CN=C1 P38302 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.40 NC(CO)CC1=CC=CC=C1 P36941 [1,0,0,0,0,0|1,0,2]=4 26 B11R1.40 NCC(=O)NC1=CC=CC=C1 P37442 [1,0,0,0,0,0|2,0,1]=4 27 B11R1.40 NNC(=O)CC1=CC=NC=C1 P36560 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.40 O=C(CBr)CC1=CC=CC=C1 O31255 [1,0,0,0,0,0|1,0,1]=3 29 B11R1.40 O=C(CBr)NC1=CC=CC=C1 P37595 [1,0,0,0,0,0|2,0,1]=4 30 B11R1.40 O=C(CC1=CC=CC=C1)NO P37592 [1,0,0,0,0,0|1,0,0]=2 31 B11R1.91 CC(=O)C#CC1=CC=CC=C1 P40366 [1,0,0,0,0,0|1,0,2]=4 32 B11R1.91 NC(=O)COC1=CC=CC=C1 P51047 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.91 O=C(O)CCC1=CC=CN=C1 P38473 [1,0,0,0,0,0|1,0,1]=3 34 B11R1.91 O=C(O)CCC1=CC=NC=C1 P36936 [1,0,0,0,0,0|1,0,1]=3 35 B11R1.91 O=C(O)CCC1=CC=NN=C1 O33206 [1,0,0,0,0,0|2,0,1]=4 36 B11R1.91 O=C(O)CCC1=NC=CC=C1 P41024 [1,0,0,0,0,0|1,0,1]=3 37 B11R1.91 O=C(O)CCC1=NC=CC=N1 Q60533 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.91 O=C(O)CCC1=NC=NC=C1 Q60531 [1,0,0,0,0,0|2,0,1]=4 39 B11R1.91 O=C(O)CCC1=NN=CC=C1 P45064 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.91 O=C(O)CNC1=NC=CC=C1 P37612 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.91 O=C(O)COC1=CC=CC=N1 P50811 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.91 O=C(O)COC1=CC=CC=N1 Q60650 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.91 O=C(O)COC1=CC=CN=C1 P35673 [1,0,0,0,0,0|2,0,1]=4 44 B11R1.91 O=C(O)\C=C\C1=CC=NC=N1 Q58672 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.91 O=C(O)\C=C\C1=CN=CN=C1 Q60664 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.91 O=C(O)\C=C\C1=NC=CC=N1 O32453 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.91 OB(O)\C=C\C1=CC=CC=C1 P50961 [1,0,0,0,0,0|1,0,2]=4 48 B13R1.133 CC(CC1=CC=C(Br)C=C1)C(=O)O O31634 [0,1,0,0,0,0|1,0,1]=3 49 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)O O28024 [0,1,0,0,0,0|2,0,1]=4 50 B13R1.133 CC(OC1=CC=C(Cl)C=C1)C(=O)O O28065 [0,1,0,0,0,0|2,0,1]=4 51 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)O O28022 [0,1,0,0,0,0|2,0,1]=4 52 B13R1.133 CC(SC1=CC=C(Cl)C=C1)C(=O)O P40295 [0,1,0,0,0,0|2,0,1]=4 53 B13R1.133 CC1=CC=C(OC(C)C(=O)O)C=C1 O27945 [0,1,0,0,0,0|2,0,1]=4 54 B13R1.133 CN(C)C(=O)CC1=CC=C(Br)C=C1 P40084 [0,1,0,0,0,0|3,0,0]=4 55 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O 10746 [0,1,0,0,0,0|1,0,1]=3 56 B13R1.133 O=C(O)C(=O)CC1=CC=C(Cl)C=C1 O28340 [0,1,0,0,0,0|0,0,0]=1 57 B13R1.133 O=C(O)C(=O)CC1=CC=C(F)C=C1 O28428 [0,1,0,0,0,0|0,0,0]=1 58 B13R1.133 O=C(O)C(=O)CC1=CC=C(O)C=C1 P40943 [0,1,0,0,0,0|0,0,0]=1 59 B13R1.133 O=C(O)C(=O)NC1=NC=C(Cl)C=C1 G-7820 [0,1,0,0,0,0|2,0,0]=3 60 B13R1.133 O=C(O)[C@H](O)CC1=CC=C(O)C=C1 O32356 [0,1,0,0,0,0|0,0,2]=3 61 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 P40579 [0,1,0,0,0,0|2,0,1]=4 62 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 P42628 [0,1,0,0,0,0|2,0,1]=4 63 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 P43149 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.135 CON(C)C(=O)CC1=CC=CN=C1 Q58483 [0,1,0,0,0,0|3,0,0]=4 65 B13R1.148 CC(OC1=CC=CC(F)=C1)C(=O)O M23298 [0,1,0,0,0,0|2,0,1]=4 66 B13R1.148 CC1=CC(C[C@@H](N)C(=O)O)=CC=C1 P42532 [0,1,0,0,0,0|1,0,1]=3 67 B13R1.148 CC1=CC(C[C@H](N)C(=O)O)=CC=C1 P42534 [0,1,0,0,0,0|1,0,1]=3 68 B13R1.148 NC(CC1=CC=CC(I)=C1)C(=O)O O28939 [0,1,0,0,0,0|1,0,1]=3 69 B13R1.148 N[C@@H](CC1=CC=CC(I)=C1)C(=O)O P39861 [0,1,0,0,0,0|1,0,1]=3 70 B13R1.148 N[C@@H](CC1=CC=CC(O)=C1)C(=O)O M15660 [0,1,0,0,0,0|1,0,1]=3 71 B13R1.148 N[C@H](CC1=CC=CC(I)=C1)C(=O)O P42108 [0,1,0,0,0,0|1,0,1]=3 72 B13R1.148 N[C@H](CC1=CC=CC(O)=C1)C(=O)O O28389 [0,1,0,0,0,0|1,0,1]=3 73 B13R1.148 O=C(O)C(=O)CC1=CC=CC(Cl)=C1 P34795 [0,1,0,0,0,0|0,0,0]=1 74 B13R1.148 O=C(O)C(=O)CC1=CC=CC(O)=C1 P37992 [0,1,0,0,0,0|0,0,0]=1 75 B13R1.152 CN(C)C(=O)C(N)C1=CC=CC=C1 O30261 [0,1,0,0,0,0|3,0,0]=4 76 B13R1.202 CC(OC1=CC=CC=C1F)C(=O)O O28105 [0,1,0,0,0,0|2,0,1]=4 77 B13R1.202 CC1=CC=CC=C1C[C@@H](N)C(=O)O O28101 [0,1,0,0,0,0|1,0,1]=3 78 B13R1.202 NC(CC1=CC=CC=C1I)C(=O)O O28928 [0,1,0,0,0,0|1,0,1]=3 79 B13R1.202 NC(CC1=CC=CC=C1O)C(=O)O P39476 [0,1,0,0,0,0|1,0,1]=3 80 B13R1.202 NC1=CC=CC=C1CC(N)C(=O)O P40491 [0,1,0,0,0,0|1,0,1]=3 81 B13R1.202 NC1=CC=CC=C1C[C@@H](N)C(=O)O P38558 [0,1,0,0,0,0|1,0,1]=3 82 B13R1.202 N[C@@H](CC1=CC=CC=C1I)C(=O)O P40681 [0,1,0,0,0,0|1,0,1]=3 83 B13R1.202 N[C@@H](CC1=CC=CC=C1O)C(=O)O P36335 [0,1,0,0,0,0|1,0,1]=3 84 B13R1.202 N[C@H](CC1=CC=CC=C1I)C(=O)O P36365 [0,1,0,0,0,0|1,0,1]=3 85 B13R1.202 N[C@H](CC1=CC=CC=C1O)C(=O)O P39452 [0,1,0,0,0,0|1,0,1]=3 86 B13R1.202 O=C(O)C(=O)CC1=CC=CC=C1Cl P38429 [0,1,0,0,0,0|0,0,0]=1 87 B13R1.418 CNC(CC1=CC=CC=C1)C(=O)O P39307 [0,1,0,0,0,0|1,0,1]=3 88 B13R1.418 CN[C@H](CC1=CC=CC=C1)C(=O)O P37373 [0,1,0,0,0,0|1,0,1]=3 89 B13R1.418 N#C\C(=C/C1=NC=CC=C1)C(=O)O K12220 [0,1,0,0,0,0|2,0,1]=4 90 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O O28350 [0,1,0,0,0,0|1,0,1]=3 91 B13R1.418 NCC(CC1=CC=CN=C1)C(=O)O Q58295 [0,1,0,0,0,0|2,0,1]=4 92 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O Q69028 [0,1,0,0,0,0|1,0,1]=3 93 B13R1.418 NC[C@@H](CC1=CC=CC=C1)C(=O)O Q69030 [0,1,0,0,0,0|1,0,1]=3 94 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O Q69024 [0,1,0,0,0,0|1,0,1]=3 95 B13R1.418 NC[C@H](CC1=CC=CC=C1)C(=O)O Q69027 [0,1,0,0,0,0|1,0,1]=3 96 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O O28334 [0,1,0,0,0,0|1,0,1]=3 97 B13R1.1073 CC(C)(CC1=CC=CC=N1)C(=O)O Q60843 [0,1,0,0,0,0|2,0,1]=4 98 B13R1.1073 CC(C)(CC1=CN=CC=C1)C(=O)O Q60820 [0,1,0,0,0,0|2,0,1]=4 99 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O O27989 [0,1,0,0,0,0|2,0,1]=4 100 B13R1.1073 CC(N)(CC1=CC=CC=C1)C(=O)O P42590 [0,1,0,0,0,0|1,0,1]=3 101 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O P39504 [0,1,0,0,0,0|1,0,1]=3 102 B13R2.369 CC1=CC2=CC=CC=C2NC1=O H-8558 [0,0,0,1,0,0|2,0,1]=4 103 B13R2.369 NC1=C(O)N=C2C=CC=CC2=N1 G-6217 [0,0,0,1,0,0|3,0,0]=4 104 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O O31934 [0,0,0,1,0,0|1,0,1]=3 105 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br N25822 [0,0,0,1,0,0|2,0,1]=4 106 B13R2.369 OC1=C(Cl)N=C2C=CC=CC2=N1 G-7209 [0,0,0,1,0,0|3,0,0]=4 107 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 Q56881 [0,0,0,1,0,0|1,0,1]=3 108 B13R2.423 O=C(O)C1CC1C2=CC=CC=N2 L19790 [0,0,0,1,0,0|2,0,1]=4 109 B13R2.423 O=C(O)C1CC1C2=CC=NC=C2 Q69973 [0,0,0,1,0,0|2,0,1]=4 110 B13R2.423 O=C(O)C1CC1C2=NC=CC=C2 O34337 [0,0,0,1,0,0|2,0,1]=4 111 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 L22498 [0,0,0,1,0,0|1,0,1]=3 112 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CC=C2 O33398 [0,0,0,1,0,0|1,0,1]=3 113 B13R2.423 O=C(O)[C@@H]1C[C@@H]1C2=CC=CN=C2 H-8208 [0,0,0,1,0,0|2,0,1]=4 114 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 O33360 [0,0,0,1,0,0|1,0,1]=3 115 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 O34527 [0,0,0,1,0,0|1,0,1]=3 116 B13R2.423 O=C(O)[C@H]1C[C@@H]1C2=CC=CC=C2 O32985 [0,0,0,1,0,0|1,0,1]=3 117 B13R2.423 O=C(O)[C@H]1C[C@H]1C2=CC=CC=C2 O33621 [0,0,0,1,0,0|1,0,1]=3 118 B13R2.435 CC(=O)C1=CC2=C(C=CC=C2)N1 P38123 [0,0,0,1,0,0|2,0,1]=4 119 B13R2.435 NC(=O)C1=CC2=CC=CC=C2O1 P37809 [0,0,0,1,0,0|1,0,2]=4 120 B13R2.435 NC(=O)C1=NC2=CC=CC=C2N1 O34406 [0,0,0,1,0,0|3,0,0]=4 121 B13R2.435 NC(=O)C1=NC2=CC=CC=C2S1 O32705 [0,0,0,1,0,0|2,1,0]=4 122 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)O1 L19588 [0,0,0,1,0,0|1,0,2]=4 123 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)O1 Q60621 [0,0,0,1,0,0|1,0,2]=4 124 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)S1 O30024 [0,0,0,1,0,0|1,1,1]=4 125 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 H-8587 [0,0,0,1,0,0|1,0,2]=4 126 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 O29920 [0,0,0,1,0,0|1,1,1]=4 127 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)N1 P44873 [0,0,0,1,0,0|2,0,1]=4 128 B13R2.435 O=C(O)C1=CC2=C(N=CC=C2)O1 Q60865 [0,0,0,1,0,0|1,0,2]=4 129 B13R2.435 O=C(O)C1=CC2=CC=CN=C2N1 C-2486 [0,0,0,1,0,0|2,0,1]=4 130 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 I-9857 [0,0,0,1,0,0|1,1,1]=4 131 B13R2.435 O=C(O)C1=CC2=CC=NC=C2N1 H-8552 [0,0,0,1,0,0|2,0,1]=4 132 B13R2.435 O=C(O)C1=CC2=CN=CC=C2N1 P44495 [0,0,0,1,0,0|2,0,1]=4 133 B13R2.435 O=C(O)C1=CC2=NC=CC=C2N1 O30350 [0,0,0,1,0,0|2,0,1]=4 134 B13R2.435 O=C(O)C1=CC2=NC=CC=C2S1 G-5384 [0,0,0,1,0,0|1,1,1]=4 135 B13R2.435 O=C(O)C1=CN2C=CC=CC2=N1 P36836 [0,0,0,1,0,0|2,0,1]=4 136 B13R2.435 O=C(O)C1=NC2=C(C=CN=C2)S1 P43167 [0,0,0,1,0,0|2,1,0]=4 137 B13R2.435 O=C(O)C1=NC2=CC=CC=C2N1 M15185 [0,0,0,1,0,0|2,0,0]=3 138 B13R2.435 O=C(O)C1=NC2=CC=CN=C2N1 Q63488 [0,0,0,1,0,0|3,0,0]=4 139 B13R2.435 O=C(O)C1=NC2=NC=CC=C2S1 P43191 [0,0,0,1,0,0|2,1,0]=4 140 B13R2.435 O=C(O)C1=NN2C=CC=CC2=C1 O34079 [0,0,0,1,0,0|2,0,1]=4 141 B13R2.435 O=C(O)C1=NN2C=CC=CC2=N1 Q62681 [0,0,0,1,0,0|3,0,0]=4 142 B13R2.435 O=C(O)C1CC2=C(N=CC=C2)N1 Q52870 [0,0,0,1,0,0|2,0,1]=4 143 B13R2.435 O=C(O)C1CC2=CC=CC=C2O1 H-8757 [0,0,0,1,0,0|0,0,2]=3 144 B13R2.435 O=C(O)C1CC2=CC=CN=C2C1 L18992 [0,0,0,1,0,0|2,0,1]=4 145 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 Q62630 [0,0,0,1,0,0|1,0,1]=3 146 B13R2.435 O=C(O)[C@H]1CC2=C(C=CC=C2)N1 P34766 [0,0,0,1,0,0|1,0,1]=3 147 B11R1.35 NC(CC1=CSC=C1)C(=O)O O27897 [0,0,0,0,1,0|2,0,1]=4 148 B11R1.35 N[C@@H](CC1=CC=CO1)C(=O)O O28616 [0,0,0,0,1,0|2,0,1]=4 149 B11R1.35 N[C@@H](CC1=CSC=C1)C(=O)O O28900 [0,0,0,0,1,0|2,0,1]=4 150 B11R1.35 N[C@H](CC1=CC=CO1)C(=O)O O28615 [0,0,0,0,1,0|2,0,1]=4 151 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O O28680 [0,0,0,0,1,0|2,0,1]=4 152 B11R1.35 N[C@H](CC1=CSC=C1)C(=O)O O28617 [0,0,0,0,1,0|2,0,1]=4 153 B11R1.35 O=C(O)[C@H](O)CC1=CC=CS1 P35098 [0,0,0,0,1,0|1,0,2]=4 154 B11R1.36 CC(C(=O)O)C1=CC=CN=C1 O29526 [0,0,0,0,1,0|2,0,1]=4 155 B11R1.36 CC(C(=O)O)C1=NC=CC=C1 O29926 [0,0,0,0,1,0|2,0,1]=4 156 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 P37697 [0,0,0,0,1,0|2,0,1]=4 157 B11R1.36 NC(C(=O)O)C1=CC=NC=C1 Q63762 [0,0,0,0,1,0|2,0,1]=4 158 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 Q63763 [0,0,0,0,1,0|2,0,1]=4 159 B11R1.36 N[C@H](C(=O)O)C1=CC=NC=C1 Q63764 [0,0,0,0,1,0|2,0,1]=4 160 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58337 [0,0,0,0,1,0|1,0,2]=4 161 B11R1.36 O=C(O)C(O)C1=CC=CN=C1 Q58338 [0,0,0,0,1,0|1,0,2]=4 162 B13R1.348 CC(=O)CC(=O)CC1=CC=CC=C1 P38766 [0,0,0,0,0,1|1,0,0]=2 163 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 O28897 [0,0,0,0,0,1|1,0,1]=3 164 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 P41730 [0,0,0,0,0,1|1,0,1]=3 165 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 Q68980 [0,0,0,0,0,1|1,0,1]=3 166 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 P39247 [0,0,0,0,0,1|1,0,1]=3 167 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 Q68981 [0,0,0,0,0,1|1,0,1]=3 168 B13R1.348 O=C(O)CC(=O)NC1=CC=CC=C1 P40954 [0,0,0,0,0,1|1,0,0]=2 169 B13R1.351 CC(NCC1=CC=CC=N1)C(=O)O Q58247 [0,0,0,0,0,1|2,0,1]=4 170 B13R1.351 CC(NCC1=CC=CC=N1)C(=O)O Q58248 [0,0,0,0,0,1|2,0,1]=4 171 B13R1.351 CC(O)C(=O)OCC1=CC=CC=C1 Q65636 [0,0,0,0,0,1|1,0,1]=3 172 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 P36350 [0,0,0,0,0,1|1,0,1]=3 173 B13R1.351 C[C@H](O)C(=O)OCC1=CC=CC=C1 P37360 [0,0,0,0,0,1|1,0,1]=3 174 B10R1.17 C=COCC1=CC=CC=C1 I-9956 [2,0,0,0,0,0|2,0,0]=4 175 B10R1.17 O=CCCC1=CC=NC=C1 Q60378 [2,0,0,0,0,0|1,0,1]=4 176 B10R1.17 O=CCOC1=CC=CC=C1 K12296 [2,0,0,0,0,0|1,0,1]=4 177 B10R1.18 CC(=O)CC1=CC=CN=C1 P36950 [2,0,0,0,0,0|1,0,1]=4 178 B10R1.18 O=C(O)CC1=CC=NC=N1 Q51816 [2,0,0,0,0,0|2,0,0]=4 179 B10R1.18 O=C(O)CC1=CN=CN=C1 O33591 [2,0,0,0,0,0|2,0,0]=4 180 B10R1.18 O=C(O)CC1=CN=NC=C1 G-5165 [2,0,0,0,0,0|2,0,0]=4 181 B10R1.18 O=C(O)CC1=NC=CC=N1 G-5171 [2,0,0,0,0,0|2,0,0]=4 182 B12R1.32 N#CCC(=O)CC1=CC=CC=C1 P40169 [1,1,0,0,0,0|1,0,1]=4 183 B12R1.34 CNC(=O)C(N)C1=CC=CC=C1 O30231 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.34 COC(=O)[C@@H](N)C1=CC=CC=C1 P38441 [1,1,0,0,0,0|2,0,0]=4 185 B12R1.49 CCC(=O)CC1=CC=C(Br)C=C1 O31002 [1,1,0,0,0,0|1,0,1]=4 186 B12R1.49 CCC(=O)CC1=CC=C(F)C=C1 P37023 [1,1,0,0,0,0|1,0,1]=4 187 B12R1.49 COC(=O)CC1=CC=C(C)C=C1 P39469 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.49 NC1=CC=C(NC(=O)CO)C=C1 P40684 [1,1,0,0,0,0|1,0,1]=4 189 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 P37292 [1,1,0,0,0,0|2,0,0]=4 190 B12R1.49 O=C(CBr)CC1=CC=C(Cl)C=C1 O29303 [1,1,0,0,0,0|1,0,1]=4 191 B12R1.50 C=CC(=O)NC1=CC(O)=CC=C1 P48889 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.50 C=CC(=O)NC1=CC=CC(N)=C1 P47752 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.50 CCC(=O)CC1=CC=CC(C)=C1 P40770 [1,1,0,0,0,0|1,0,1]=4 194 B12R1.50 CCC(=O)CC1=CC=CC(F)=C1 P37115 [1,1,0,0,0,0|1,0,1]=4 195 B12R1.50 COC(=O)CC1=CC=CC(I)=C1 M22875 [1,1,0,0,0,0|2,0,0]=4 196 B12R1.50 COC(=O)CC1=CC=CC(O)=C1 P38153 [1,1,0,0,0,0|2,0,0]=4 197 B12R1.50 NNC(=O)CC1=CC=CC(Cl)=C1 P36762 [1,1,0,0,0,0|2,0,0]=4 198 B12R1.50 O=C(CBr)CC1=CC=CC(Br)=C1 O32163 [1,1,0,0,0,0|1,0,1]=4 199 B12R1.50 O=C(CBr)CC1=CC=CC(Cl)=C1 O29302 [1,1,0,0,0,0|1,0,1]=4 200 B12R1.371 CCC(=O)CC1=CC=CC=C1C P39216 [1,1,0,0,0,0|1,0,1]=4 201 B12R1.371 CCC(=O)CC1=CC=CC=C1F P41070 [1,1,0,0,0,0|1,0,1]=4 202 B12R1.371 COC(=O)CC1=CC=CC=C1C P38193 [1,1,0,0,0,0|2,0,0]=4 203 B12R1.371 COC(=O)CC1=CC=CC=C1I M23155 [1,1,0,0,0,0|2,0,0]=4 204 B12R1.371 COC(=O)CC1=CC=CC=C1O P39566 [1,1,0,0,0,0|2,0,0]=4 205 B12R1.371 C\C(C=O)=C/C1=CC=CC=C1F Q69219 [1,1,0,0,0,0|1,0,1]=4 206 B12R1.371 O=C(CBr)CC1=CC=CC=C1Cl O29301 [1,1,0,0,0,0|1,0,1]=4 207 B12R1.21 CC(=O)NCC1=CC=C(Br)C=C1 P35246 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 P39657 [1,1,0,0,0,0|1,0,1]=4 209 B12R1.21 CC1=NC=C(CCC(=O)O)C=C1 Q60510 [1,1,0,0,0,0|1,0,1]=4 210 B12R1.21 NC(=O)CCC1=CC=C(Br)C=C1 P37285 [1,1,0,0,0,0|1,0,1]=4 211 B12R1.21 NC(=O)CCC1=CC=C(N)C=C1 P38386 [1,1,0,0,0,0|1,0,1]=4 212 B12R1.21 O=C(Cl)CCC1=CC=C(Br)C=C1 N24618 [1,1,0,0,0,0|1,0,1]=4 213 B12R1.21 O=C(O)CCC1=CC=C(Cl)N=C1 Q53181 [1,1,0,0,0,0|1,0,1]=4 214 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 P38000 [1,1,0,0,0,0|0,0,1]=3 215 B12R1.21 O=C(O)CCC1=CC=C(F)N=C1 O29534 [1,1,0,0,0,0|1,0,1]=4 216 B12R1.21 O=C(O)CCC1=CC=C(I)C=C1 P40757 [1,1,0,0,0,0|0,0,1]=3 217 B12R1.21 O=C(O)CNC1=CC=C(Br)C=C1 P41622 [1,1,0,0,0,0|1,0,1]=4 218 B12R1.21 O=C(O)CNC1=CC=C(Cl)C=C1 P37505 [1,1,0,0,0,0|1,0,1]=4 219 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 P38616 [1,1,0,0,0,0|1,0,1]=4 220 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)N=C1 P51524 [1,1,0,0,0,0|1,0,1]=4 221 B12R1.21 O=C(O)\C=C\C1=NC=C(F)C=C1 Q69909 [1,1,0,0,0,0|1,0,1]=4 222 B12R1.27 COC(=O)CNC1=CC=CC=C1 P39503 [1,1,0,0,0,0|1,0,1]=4 223 B12R1.27 COC(=O)NCC1=CC=CC=C1 O34236 [1,1,0,0,0,0|1,0,0]=3 224 B12R1.27 NNC(=O)CCC1=CC=CC=C1 P38586 [1,1,0,0,0,0|1,0,1]=4 225 B12R1.107 CC(CC(=O)O)C1=CC=CC=N1 Q60567 [1,1,0,0,0,0|1,0,1]=4 226 B12R1.107 CC(CC(=O)O)C1=CC=NC=C1 Q60575 [1,1,0,0,0,0|1,0,1]=4 227 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 M23149 [1,1,0,0,0,0|1,0,1]=4 228 B12R1.107 NC(CC(=O)O)C1=CC=CN=C1 P37013 [1,1,0,0,0,0|1,0,1]=4 229 B12R1.107 NC(CC(=O)O)C1=CC=NC=C1 P38684 [1,1,0,0,0,0|1,0,1]=4 230 B12R1.107 NC(CC(=O)O)C1=NC=CC=C1 P41103 [1,1,0,0,0,0|1,0,1]=4 231 B12R1.125 CC(=O)NCC1=CC=CC=C1Br P36330 [1,1,0,0,0,0|2,0,0]=4 232 B12R1.125 CC1=C(CCC(=O)O)C=CC=N1 Q60514 [1,1,0,0,0,0|1,0,1]=4 233 B12R1.125 CC1=CC=CC=C1NCC(=O)O M22929 [1,1,0,0,0,0|1,0,1]=4 234 B12R1.125 CC1=CC=NC=C1CCC(=O)O Q60489 [1,1,0,0,0,0|1,0,1]=4 235 B12R1.125 CC1=CN=CC=C1CCC(=O)O Q60512 [1,1,0,0,0,0|1,0,1]=4 236 B12R1.125 NC(=O)CCC1=CC=CC=C1Br P37474 [1,1,0,0,0,0|1,0,1]=4 237 B12R1.125 NC1=CC=CC=C1CCC(=O)[O-] M22770 [1,1,0,0,0,0|0,0,2]=4 238 B12R1.125 O=C(O)CCC1=CC=NC=C1Cl Q60724 [1,1,0,0,0,0|1,0,1]=4 239 B12R1.125 O=C(O)CNC1=CC=CC=C1Br P38198 [1,1,0,0,0,0|1,0,1]=4 240 B12R1.125 O=C(O)CNC1=CC=CC=C1F P37600 [1,1,0,0,0,0|1,0,1]=4 241 B12R1.125 O=C(O)COC1=CC=CC=C1Cl M22951 [1,1,0,0,0,0|1,0,1]=4 242 B12R1.226 CC(=O)NCC1=CC=CC(Br)=C1 P38728 [1,1,0,0,0,0|2,0,0]=4 243 B12R1.226 CC1=CC(CCC(=O)O)=CC=C1 P38460 [1,1,0,0,0,0|0,0,1]=3 244 B12R1.226 CC1=CC(CCC(=O)O)=CC=N1 Q60479 [1,1,0,0,0,0|1,0,1]=4 245 B12R1.226 CC1=CC(CCC(=O)O)=CN=C1 Q60486 [1,1,0,0,0,0|1,0,1]=4 246 B12R1.226 CC1=CC(CCC(=O)O)=NC=C1 Q60480 [1,1,0,0,0,0|1,0,1]=4 247 B12R1.226 CC1=CC(OCC(=O)O)=CC=C1 P40758 [1,1,0,0,0,0|1,0,1]=4 248 B12R1.226 CC1=NC(CCC(=O)O)=CC=C1 Q60488 [1,1,0,0,0,0|1,0,1]=4 249 B12R1.226 CC1=NC(\C=C\C(=O)O)=CC=C1 Q60610 [1,1,0,0,0,0|1,0,1]=4 250 B12R1.226 NC(=O)CCC1=CC=CC(Br)=C1 P37053 [1,1,0,0,0,0|1,0,1]=4 251 B12R1.226 NC1=NC=CC(CCC(=O)O)=C1 O29533 [1,1,0,0,0,0|1,0,1]=4 252 B12R1.226 O=C(O)CCC1=CC(F)=CN=C1 Q60660 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 P38005 [1,1,0,0,0,0|0,0,1]=3 254 B12R1.226 O=C(O)CCC1=CC=CC(I)=C1 P36632 [1,1,0,0,0,0|0,0,1]=3 255 B12R1.226 O=C(O)CCC1=NC=CC(F)=C1 Q60481 [1,1,0,0,0,0|1,0,1]=4 256 B12R1.226 O=C(O)CNC1=CC=CC(Br)=C1 P38138 [1,1,0,0,0,0|1,0,1]=4 257 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 O28084 [1,1,0,0,0,0|1,0,1]=4 258 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 P38226 [1,1,0,0,0,0|1,0,1]=4 259 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 P50423 [1,1,0,0,0,0|0,0,1]=3 260 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 P34974 [0,1,0,0,1,0|1,0,1]=4 261 B12R1.20 CC(C(=O)O)C1=CC=C(F)C=C1 P36216 [0,1,0,0,1,0|1,0,1]=4 262 B12R1.20 CC(C(=O)O)C1=CC=C(N)C=C1 Q65925 [0,1,0,0,1,0|1,0,1]=4 263 B12R1.20 CC1=CC=C(C(=O)C(=O)O)C=C1 P36454 [0,1,0,0,1,0|0,0,0]=2 264 B12R1.20 CC1=CC=C([C@@H](C)C(=O)O)C=C1 P51478 [0,1,0,0,1,0|1,0,1]=4 265 B12R1.20 CC1=CC=C([C@@H](N)C(=O)O)C=C1 P36564 [0,1,0,0,1,0|1,0,1]=4 266 B12R1.20 CC1=CC=C([C@H](C)C(=O)O)C=C1 P51479 [0,1,0,0,1,0|1,0,1]=4 267 B12R1.20 CC1=CC=C([C@H](N)C(=O)O)C=C1 P42360 [0,1,0,0,1,0|1,0,1]=4 268 B12R1.20 NC(C(=O)O)C1=CC=C(Br)C=C1 P36483 [0,1,0,0,1,0|1,0,1]=4 269 B12R1.20 NC(C(=O)O)C1=CC=C(I)C=C1 P38972 [0,1,0,0,1,0|1,0,1]=4 270 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Br)C=C1 P42008 [0,1,0,0,1,0|1,0,1]=4 271 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(Cl)C=C1 O28109 [0,1,0,0,1,0|1,0,1]=4 272 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 O28686 [0,1,0,0,1,0|1,0,1]=4 273 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Br)C=C1 M22620 [0,1,0,0,1,0|1,0,1]=4 274 B12R1.20 O=C(O)C(=O)C1=CC=C(Br)C=C1 P36491 [0,1,0,0,1,0|0,0,0]=2 275 B12R1.20 O=C(O)C(=O)C1=CC=C(Cl)C=C1 P36490 [0,1,0,0,1,0|0,0,0]=2 276 B12R1.20 O=C(O)C(=O)C1=CC=C(F)C=C1 P39557 [0,1,0,0,1,0|0,0,0]=2 277 B12R1.20 O=C(O)C(=O)C1=CC=C(I)C=C1 P36018 [0,1,0,0,1,0|0,0,0]=2 278 B12R1.124 CC1=CC=CC=C1C(=O)C(=O)O P41054 [0,1,0,0,1,0|0,0,0]=2 279 B12R1.124 CC1=CC=CC=C1C(N)C(=O)O P41783 [0,1,0,0,1,0|1,0,1]=4 280 B12R1.124 NC(C(=O)O)C1=CC=CC=C1Br O28104 [0,1,0,0,1,0|1,0,1]=4 281 B12R1.124 NC(C(=O)O)C1=CC=CC=C1F P35865 [0,1,0,0,1,0|1,0,1]=4 282 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O M15540 [0,1,0,0,1,0|1,0,1]=4 283 B12R1.124 NC1=CC=CC=C1C(=O)C(=O)O M22832 [0,1,0,0,1,0|0,0,0]=2 284 B12R1.124 N[C@@H](C(=O)O)C1=CC=CC=C1O O28562 [0,1,0,0,1,0|1,0,1]=4 285 B12R1.124 N[C@H](C(=O)O)C1=CC=CC=C1O O28563 [0,1,0,0,1,0|1,0,1]=4 286 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Br P39207 [0,1,0,0,1,0|0,0,0]=2 287 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1Cl P39275 [0,1,0,0,1,0|0,0,0]=2 288 B12R1.124 O=C(O)C(=O)C1=CC=CC=C1F P36020 [0,1,0,0,1,0|0,0,0]=2 289 B12R1.124 O=C(O)C(O)C1=CC=CC=C1Br M22703 [0,1,0,0,1,0|0,0,2]=4 290 B12R1.225 CC1=CC(C(=O)C(=O)O)=CC=C1 P37051 [0,1,0,0,1,0|0,0,0]=2 291 B12R1.225 CC1=CC(C(=O)C(O)O)=CC=C1 P42391 [0,1,0,0,1,0|0,0,2]=4 292 B12R1.225 CC1=CC(C(N)C(=O)O)=CC=C1 P37582 [0,1,0,0,1,0|1,0,1]=4 293 B12R1.225 CC1=CC(C(O)C(=O)O)=CC=C1 P36822 [0,1,0,0,1,0|0,0,2]=4 294 B12R1.225 CC1=CC([C@@H](N)C(=O)O)=CC=C1 P40243 [0,1,0,0,1,0|1,0,1]=4 295 B12R1.225 CC1=CC([C@H](N)C(=O)O)=CC=C1 P42369 [0,1,0,0,1,0|1,0,1]=4 296 B12R1.225 NC(C(=O)O)C1=CC=CC(Br)=C1 O30706 [0,1,0,0,1,0|1,0,1]=4 297 B12R1.225 NC(C(=O)O)C1=CC=CC(F)=C1 P36389 [0,1,0,0,1,0|1,0,1]=4 298 B12R1.225 NC(C(=O)O)C1=CC=CC(O)=C1 O28864 [0,1,0,0,1,0|1,0,1]=4 299 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 O28938 [0,1,0,0,1,0|1,0,1]=4 300 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(F)=C1 P39302 [0,1,0,0,1,0|1,0,1]=4 301 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(O)=C1 O28464 [0,1,0,0,1,0|1,0,1]=4 302 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Br)=C1 P41079 [0,1,0,0,1,0|1,0,1]=4 303 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Cl)=C1 O28946 [0,1,0,0,1,0|1,0,1]=4 304 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(F)=C1 P40985 [0,1,0,0,1,0|1,0,1]=4 305 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(O)=C1 O28477 [0,1,0,0,1,0|1,0,1]=4 306 B12R1.225 O=C(O)C(=O)C1=CC=CC(Br)=C1 P36439 [0,1,0,0,1,0|0,0,0]=2 307 B12R1.225 O=C(O)C(=O)C1=CC=CC(Cl)=C1 P39209 [0,1,0,0,1,0|0,0,0]=2 308 B12R1.225 O=C(O)C(=O)C1=CC=CC(F)=C1 P36019 [0,1,0,0,1,0|0,0,0]=2 309 B12R1.225 O=C(O)C(=O)C1=CC=CC(I)=C1 P39211 [0,1,0,0,1,0|0,0,0]=2 310 B12R1.225 O=C(O)C(O)C1=CC=CC(Br)=C1 M23024 [0,1,0,0,1,0|0,0,2]=4 311 B12R1.225 O=C(O)C(O)C1=CC=CC(F)=C1 P38344 [0,1,0,0,1,0|0,0,2]=4 312 B12R1.253 CC(N)(C(=O)O)C1=CC=CC=C1 P37381 [0,1,0,0,1,0|1,0,1]=4 313 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 P36308 [0,1,0,0,1,0|1,0,1]=4 314 B12R1.478 CNC(C(=O)O)C1=CC=CC=C1 P39058 [0,1,0,0,1,0|1,0,1]=4 315 B12R1.478 CN[C@@H](C(=O)O)C1=CC=CC=C1 P38907 [0,1,0,0,1,0|1,0,1]=4 316 B12R1.478 CN[C@H](C(=O)O)C1=CC=CC=C1 P39274 [0,1,0,0,1,0|1,0,1]=4 317 B12R1.478 NCC(C(=O)O)C1=CC=CC=C1 O28753 [0,1,0,0,1,0|1,0,1]=4 318 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 Q69047 [0,1,0,0,1,0|1,0,1]=4 319 B12R1.478 NC[C@@H](C(=O)O)C1=CC=CC=C1 Q69050 [0,1,0,0,1,0|1,0,1]=4 320 B12R1.478 NC[C@H](C(=O)O)C1=CC=CC=C1 Q69051 [0,1,0,0,1,0|1,0,1]=4 321 B12R1.478 NC[C@H](C(=O)O)C1=CC=CC=C1 Q69055 [0,1,0,0,1,0|1,0,1]=4 322 B14R1.337 CC(=O)CC(=O)NC1=CC=CC=C1F P37624 [0,1,0,0,0,1|2,0,0]=4 323 B14R1.337 CC1=CC=CC=C1C[C@@H](N)CC(=O)O P39183 [0,1,0,0,0,1|1,0,1]=4 324 B14R1.337 CC1=CC=CC=C1C[C@H](N)CC(=O)O P39173 [0,1,0,0,0,1|1,0,1]=4 325 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1Br P36351 [0,1,0,0,0,1|1,0,1]=4 326 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1Cl P39198 [0,1,0,0,0,1|1,0,1]=4 327 B14R1.337 N[C@@H](CC(=O)O)CC1=CC=CC=C1F P36370 [0,1,0,0,0,1|1,0,1]=4 328 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1Br P36161 [0,1,0,0,0,1|1,0,1]=4 329 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1Cl P39156 [0,1,0,0,0,1|1,0,1]=4 330 B14R1.337 N[C@H](CC(=O)O)CC1=CC=CC=C1F P39396 [0,1,0,0,0,1|1,0,1]=4 331 B14R1.698 CC(=O)CC(=O)NC1=CC=C(Br)C=C1 P38398 [0,1,0,0,0,1|2,0,0]=4 332 B14R1.698 CC1=CC=C(C[C@@H](N)CC(=O)O)C=C1 P40459 [0,1,0,0,0,1|1,0,1]=4 333 B14R1.698 CC1=CC=C(C[C@H](N)CC(=O)O)C=C1 P39172 [0,1,0,0,0,1|1,0,1]=4 334 B14R1.698 NC(CC(=O)O)CC1=CC=C(Br)C=C1 P41889 [0,1,0,0,0,1|1,0,1]=4 335 B14R1.698 NC(CC(=O)O)CC1=CC=C(Cl)C=C1 P36643 [0,1,0,0,0,1|1,0,1]=4 336 B14R1.698 NC(CC(=O)O)CC1=CC=C(F)C=C1 P36608 [0,1,0,0,0,1|1,0,1]=4 337 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(Br)C=C1 P36130 [0,1,0,0,0,1|1,0,1]=4 338 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(Cl)C=C1 P36642 [0,1,0,0,0,1|1,0,1]=4 339 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(Cl)C=C1 Q69091 [0,1,0,0,0,1|1,0,1]=4 340 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(F)C=C1 P36200 [0,1,0,0,0,1|1,0,1]=4 341 B14R1.698 N[C@@H](CC(=O)O)CC1=CC=C(I)C=C1 P39187 [0,1,0,0,0,1|1,0,1]=4 342 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Br)C=C1 P39175 [0,1,0,0,0,1|1,0,1]=4 343 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Br)C=C1 Q69093 [0,1,0,0,0,1|1,0,1]=4 344 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Cl)C=C1 P39154 [0,1,0,0,0,1|1,0,1]=4 345 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(Cl)C=C1 Q69089 [0,1,0,0,0,1|1,0,1]=4 346 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(F)C=C1 P39150 [0,1,0,0,0,1|1,0,1]=4 347 B14R1.698 N[C@H](CC(=O)O)CC1=CC=C(I)C=C1 P39167 [0,1,0,0,0,1|1,0,1]=4 348 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 P38439 [0,1,0,0,0,1|0,0,0]=2 349 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 P43132 [0,1,0,0,0,1|1,0,1]=4 350 B14R1.5978 CC(=O)CC(=O)NC1=CC=CC(O)=C1 P39641 [0,1,0,0,0,1|2,0,0]=4 351 B14R1.161 CC1=CC=CC=C1CCC(N)C(=O)O P39555 [0,1,0,0,0,1|1,0,1]=4 352 B14R1.161 CC1=CC=CC=C1CC[C@@H](N)C(=O)O P41946 [0,1,0,0,0,1|1,0,1]=4 353 B14R1.161 CC1=CC=CC=C1CC[C@H](N)C(=O)O P41954 [0,1,0,0,0,1|1,0,1]=4 354 B14R1.161 NC(CCC1=CC=CC=C1Cl)C(=O)O P42056 [0,1,0,0,0,1|1,0,1]=4 355 B14R1.161 NC(CCC1=CC=CC=C1F)C(=O)O P39552 [0,1,0,0,0,1|1,0,1]=4 356 B14R1.161 NC(CCC1=CC=CC=C1O)C(=O)O P40288 [0,1,0,0,0,1|1,0,1]=4 357 B14R1.161 N[C@@H](CCC1=CC=CC=C1Cl)C(=O)O P41952 [0,1,0,0,0,1|1,0,1]=4 358 B14R1.161 N[C@@H](CCC1=CC=CC=C1F)C(=O)O P42005 [0,1,0,0,0,1|1,0,1]=4 359 B14R1.161 N[C@H](CCC1=CC=CC=C1F)C(=O)O P41967 [0,1,0,0,0,1|1,0,1]=4 360 B14R1.679 CC1=CC=C(CC[C@@H](N)C(=O)O)C=C1 M23072 [0,1,0,0,0,1|1,0,1]=4 361 B14R1.679 CC1=CC=C(CC[C@H](N)C(=O)O)C=C1 P36495 [0,1,0,0,0,1|1,0,1]=4 362 B14R1.679 NC(CCC1=CC=C(Br)C=C1)C(=O)O O28211 [0,1,0,0,0,1|1,0,1]=4 363 B14R1.679 NC(CCC1=CC=C(Cl)C=C1)C(=O)O O28396 [0,1,0,0,0,1|1,0,1]=4 364 B14R1.679 NC(CCC1=CC=C(F)C=C1)C(=O)O O28379 [0,1,0,0,0,1|1,0,1]=4 365 B14R1.679 N[C@@H](CCC1=CC=C(Br)C=C1)C(=O)O P42006 [0,1,0,0,0,1|1,0,1]=4 366 B14R1.679 N[C@@H](CCC1=CC=C(Cl)C=C1)C(=O)O P40918 [0,1,0,0,0,1|1,0,1]=4 367 B14R1.679 N[C@@H](CCC1=CC=C(F)C=C1)C(=O)O P42004 [0,1,0,0,0,1|1,0,1]=4 368 B14R1.679 N[C@@H](CCC1=CC=C(O)C=C1)C(=O)O M22766 [0,1,0,0,0,1|1,0,1]=4 369 B14R1.679 N[C@@H](CCC1=CC=C(O)C=C1)C(=O)O M23132 [0,1,0,0,0,1|1,0,1]=4 370 B14R1.679 N[C@H](CCC1=CC=C(Br)C=C1)C(=O)O P42001 [0,1,0,0,0,1|1,0,1]=4 371 B14R1.679 N[C@H](CCC1=CC=C(Cl)C=C1)C(=O)O P40919 [0,1,0,0,0,1|1,0,1]=4 372 B14R1.679 N[C@H](CCC1=CC=C(F)C=C1)C(=O)O P41999 [0,1,0,0,0,1|1,0,1]=4 373 B14R1.679 N[C@H](CCC1=CC=C(O)C=C1)C(=O)O M22787 [0,1,0,0,0,1|1,0,1]=4 374 B14R1.679 N[C@H](CCC1=CC=C(O)C=C1)C(=O)O M23230 [0,1,0,0,0,1|1,0,1]=4 375 B14R1.756 COC(=O)[C@@H](C)NCC1=CC=CC=C1 P34864 [0,1,0,0,0,1|1,0,1]=4 376 B14R1.4194 O=C(O)C(CO)NCC1=CC=CC=C1 P42767 [0,1,0,0,0,1|0,0,2]=4 377 B14R1.4194 O=C(O)[C@@H](CO)NCC1=CC=CC=C1 P42766 [0,1,0,0,0,1|0,0,2]=4 378 B14R1.5956 CC1=CC(CC[C@@H](N)C(=O)O)=CC=C1 P41996 [0,1,0,0,0,1|1,0,1]=4 379 B14R1.5956 CC1=CC(CC[C@H](N)C(=O)O)=CC=C1 P41995 [0,1,0,0,0,1|1,0,1]=4 380 B14R1.5956 N[C@@H](CCC1=CC=CC(Cl)=C1)C(=O)O P41989 [0,1,0,0,0,1|1,0,1]=4 381 B14R1.5956 N[C@@H](CCC1=CC=CC(F)=C1)C(=O)O P42000 [0,1,0,0,0,1|1,0,1]=4 382 B14R1.5956 N[C@H](CCC1=CC=CC(Br)=C1)C(=O)O P41978 [0,1,0,0,0,1|1,0,1]=4 383 B14R1.5956 N[C@H](CCC1=CC=CC(Cl)=C1)C(=O)O P41948 [0,1,0,0,0,1|1,0,1]=4 384 B14R1.5956 N[C@H](CCC1=CC=CC(F)=C1)C(=O)O M23097 [0,1,0,0,0,1|1,0,1]=4 385 B14R1.6395 CC(C)(OCC1=CC=CC=C1)C(=O)O O32639 [0,1,0,0,0,1|1,0,1]=4 386 B14R1.6395 CC(N)(CCC1=CC=CC=C1)C(=O)O P37500 [0,1,0,0,0,1|1,0,1]=4 387 B14R1.3 C#CC1=CC=C(C[C@H](N)C(=O)O)C=C1 O28248 [0,2,0,0,0,0|1,0,1]=4 388 B14R1.3 CCC1=CC=C(CC(N)C(=O)O)C=C1 O28924 [0,2,0,0,0,0|1,0,1]=4 389 B14R1.3 CCC1=CC=C(C[C@@H](N)C(=O)O)C=C1 M22655 [0,2,0,0,0,0|1,0,1]=4 390 B14R1.3 CCC1=CC=C(C[C@H](N)C(=O)O)C=C1 O28819 [0,2,0,0,0,0|1,0,1]=4 391 B14R1.3 COC1=CC=C(CC(=O)C(=O)O)C=C1 O28768 [0,2,0,0,0,0|0,0,0]=2 392 B14R1.3 COC1=CC=C(C[C@H](N)C(=O)O)C=C1 P37010 [0,2,0,0,0,0|1,0,1]=4 393 B14R1.3 N#CC1=CC=C(CC(=O)C(=O)O)C=C1 P38102 [0,2,0,0,0,0|0,0,0]=2 394 B14R1.3 N#CC1=CC=C(CC(N)C(=O)O)C=C1 P39528 [0,2,0,0,0,0|1,0,1]=4 395 B14R1.3 N#CC1=CC=C(C[C@H](N)C(=O)O)C=C1 P40688 [0,2,0,0,0,0|1,0,1]=4 396 B14R1.3 NCC1=CC=C(C[C@H](N)C(=O)O)C=C1 P41066 [0,2,0,0,0,0|1,0,1]=4 397 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 P34742 [0,2,0,0,0,0|1,0,1]=4 398 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Cl)C=C1 P37123 [0,2,0,0,0,0|1,0,1]=4 399 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Cl)C=C1 P38715 [0,2,0,0,0,0|1,0,1]=4 400 B14R1.134 CON(C)C(=O)CC1=CC=C(Br)C=C1 O31806 [0,2,0,0,0,0|2,0,0]=4 401 B14R1.536 CC1=CC=C(CC(CN)C(=O)O)C=C1 P36612 [0,2,0,0,0,0|1,0,1]=4 402 B14R1.536 CN[C@@H](CC1=CC=C(O)C=C1)C(=O)O P37573 [0,2,0,0,0,0|1,0,1]=4 403 B14R1.536 CN[C@H](CC1=CC=C(O)C=C1)C(=O)O M22994 [0,2,0,0,0,0|1,0,1]=4 404 B14R1.536 NCC(CC1=CC=C(Br)C=C1)C(=O)O P35191 [0,2,0,0,0,0|1,0,1]=4 405 B14R1.536 NCC(CC1=CC=C(F)C=C1)C(=O)O P35193 [0,2,0,0,0,0|1,0,1]=4 406 B14R1.686 CC1=CC=C(C[C@H](N)C(=O)O)C=C1C O28772 [0,2,0,0,0,0|1,0,1]=4 407 B14R1.686 NC(CC1=CC(F)=C(O)C=C1)C(=O)O P38234 [0,2,0,0,0,0|1,0,1]=4 408 B14R1.686 NC(CC1=CC=C(Br)C(Br)=C1)C(=O)O O28526 [0,2,0,0,0,0|1,0,1]=4 409 B14R1.686 NC(CC1=CC=C(Cl)C(Cl)=C1)C(=O)O P37502 [0,2,0,0,0,0|1,0,1]=4 410 B14R1.686 NC(CC1=CC=C(Cl)C(F)=C1)C(=O)O O28771 [0,2,0,0,0,0|1,0,1]=4 411 B14R1.686 NC(CC1=CC=C(F)C(Br)=C1)C(=O)O P36097 [0,2,0,0,0,0|1,0,1]=4 412 B14R1.686 NC(CC1=CC=C(F)C(Cl)=C1)C(=O)O O28761 [0,2,0,0,0,0|1,0,1]=4 413 B14R1.686 NC(CC1=CC=C(F)C(F)=C1)C(=O)O P38841 [0,2,0,0,0,0|1,0,1]=4 414 B14R1.686 N[C@@H](CC1=CC(F)=C(O)C=C1)C(=O)O P36334 [0,2,0,0,0,0|1,0,1]=4 415 B14R1.686 N[C@@H](CC1=CC=C(F)C(Br)=C1)C(=O)O P35516 [0,2,0,0,0,0|1,0,1]=4 416 B14R1.686 N[C@@H](CC1=CC=C(F)C(Cl)=C1)C(=O)O P36073 [0,2,0,0,0,0|1,0,1]=4 417 B14R1.686 N[C@H](CC1=CC(Cl)=C(O)C=C1)C(=O)O P40792 [0,2,0,0,0,0|1,0,1]=4 418 B14R1.686 N[C@H](CC1=CC(F)=C(O)C=C1)C(=O)O P36892 [0,2,0,0,0,0|1,0,1]=4 419 B14R1.686 N[C@H](CC1=CC=C(F)C(Br)=C1)C(=O)O P42262 [0,2,0,0,0,0|1,0,1]=4 420 B14R1.686 N[C@H](CC1=CC=C(F)C(Cl)=C1)C(=O)O P36160 [0,2,0,0,0,0|1,0,1]=4 421 B14R1.686 N[C@H](CC1=CC=C(F)C(F)=C1)C(=O)O P39373 [0,2,0,0,0,0|1,0,1]=4 422 B14R1.686 O=C(O)C(=O)CC1=CC=C(O)C(O)=C1 M15562 [0,2,0,0,0,0|0,0,0]=2 423 B14R1.6049 CC1=CC(Cl)=CC=C1C[C@@H](N)C(=O)O P34885 [0,2,0,0,0,0|1,0,1]=4 424 B14R1.6049 CC1=CC(Cl)=CC=C1C[C@H](N)C(=O)O P42103 [0,2,0,0,0,0|1,0,1]=4 425 B14R1.6049 CC1=CC=C(CC(N)C(=O)O)C(C)=C1 O28029 [0,2,0,0,0,0|1,0,1]=4 426 B14R1.6049 CC1=CC=C(CC(N)C(=O)O)C(F)=C1 M22677 [0,2,0,0,0,0|1,0,1]=4 427 B14R1.6049 CC1=CC=C(C[C@@H](N)C(=O)O)C(C)=C1 O28884 [0,2,0,0,0,0|1,0,1]=4 428 B14R1.6049 CC1=CC=C(C[C@H](N)C(=O)O)C(C)=C1 O28855 [0,2,0,0,0,0|1,0,1]=4 429 B14R1.6049 NC(CC1=C(F)C=C(O)C=C1)C(=O)O P36185 [0,2,0,0,0,0|1,0,1]=4 430 B14R1.6049 NC(CC1=CC=C(Br)C=C1Cl)C(=O)O P38053 [0,2,0,0,0,0|1,0,1]=4 431 B14R1.6049 NC(CC1=CC=C(Br)C=C1F)C(=O)O O28493 [0,2,0,0,0,0|1,0,1]=4 432 B14R1.6049 NC(CC1=CC=C(Cl)C=C1Cl)C(=O)O P37501 [0,2,0,0,0,0|1,0,1]=4 433 B14R1.6049 NC(CC1=CC=C(Cl)C=C1F)C(=O)O O28494 [0,2,0,0,0,0|1,0,1]=4 434 B14R1.6049 NC(CC1=CC=C(F)C=C1F)C(=O)O O28984 [0,2,0,0,0,0|1,0,1]=4 435 B14R1.6049 N[C@@H](CC1=C(Cl)C=C(O)C=C1)C(=O)O P36518 [0,2,0,0,0,0|1,0,1]=4 436 B14R1.6049 N[C@@H](CC1=C(F)C=C(O)C=C1)C(=O)O P36055 [0,2,0,0,0,0|1,0,1]=4 437 B14R1.6049 N[C@@H](CC1=CC=C(Br)C=C1Cl)C(=O)O P42269 [0,2,0,0,0,0|1,0,1]=4 438 B14R1.6049 N[C@@H](CC1=CC=C(F)C=C1F)C(=O)O M22623 [0,2,0,0,0,0|1,0,1]=4 439 B14R1.6049 N[C@H](CC1=CC=C(Br)C=C1Cl)C(=O)O P42257 [0,2,0,0,0,0|1,0,1]=4 440 B14R1.6049 N[C@H](CC1=CC=C(F)C=C1F)C(=O)O M22624 [0,2,0,0,0,0|1,0,1]=4 441 B14R1.7626 CC(C)(CC1=CC=C(F)C=C1)C(=O)O P36667 [0,2,0,0,0,0|1,0,1]=4 442 B14R1.7626 CC(N)(CC1=CC=C(Br)C=C1)C(=O)O Q65850 [0,2,0,0,0,0|1,0,1]=4 443 B14R1.7626 CC(N)(CC1=CC=C(Cl)C=C1)C(=O)O Q65847 [0,2,0,0,0,0|1,0,1]=4 444 B14R1.7626 CC(N)(CC1=CC=C(F)C=C1)C(=O)O Q65844 [0,2,0,0,0,0|1,0,1]=4 445 B14R1.7626 C[C@@](N)(CC1=CC=C(Br)C=C1)C(=O)O P51604 [0,2,0,0,0,0|1,0,1]=4 446 B14R1.7626 C[C@@](N)(CC1=CC=C(Br)C=C1)C(=O)O Q65851 [0,2,0,0,0,0|1,0,1]=4 447 B14R1.7626 C[C@@](N)(CC1=CC=C(Cl)C=C1)C(=O)O Q65849 [0,2,0,0,0,0|1,0,1]=4 448 B14R1.7626 C[C@@](N)(CC1=CC=C(F)C=C1)C(=O)O Q65845 [0,2,0,0,0,0|1,0,1]=4 449 B14R1.7626 C[C@](N)(CC1=CC=C(Br)C=C1)C(=O)O Q65852 [0,2,0,0,0,0|1,0,1]=4 450 B14R1.7626 C[C@](N)(CC1=CC=C(Cl)C=C1)C(=O)O Q65848 [0,2,0,0,0,0|1,0,1]=4 451 B14R1.7626 C[C@](N)(CC1=CC=C(F)C=C1)C(=O)O Q65846 [0,2,0,0,0,0|1,0,1]=4 452 B14R1.7626 C[C@](N)(CC1=CC=C(O)C=C1)C(=O)O L21628 [0,2,0,0,0,0|1,0,1]=4 453 B14R1.85 COC(=O)[C@@H](O)[C@H](N)C1=CC=CC=C1 G-7455 [0,2,0,0,0,0|0,0,2]=4 454 B14R1.85 COC(=O)[C@H](O)[C@H](N)C1=CC=CC=C1 G-7454 [0,2,0,0,0,0|0,0,2]=4 455 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Cl)=C1 Q65904 [0,2,0,0,0,0|1,0,1]=4 456 B14R1.135 COC(=O)[C@H](N)CC1=CC=CC(Cl)=C1 Q65903 [0,2,0,0,0,0|1,0,1]=4 457 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1C M22963 [0,2,0,0,0,0|1,0,1]=4 458 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1Cl P38006 [0,2,0,0,0,0|1,0,1]=4 459 B14R1.1031 CN[C@@H](CC1=CC=CC=C1)C(=O)OC P40118 [0,2,0,0,0,0|1,0,1]=4 460 B14R1.1031 COC(=O)[C@H](CN)CC1=CC=CC=C1 Q69025 [0,2,0,0,0,0|1,0,1]=4 461 B14R1.75 COC1=CC(C[C@@H](N)C(=O)O)=CC=C1 P41206 [0,2,0,0,0,0|1,0,1]=4 462 B14R1.75 COC1=CC(C[C@H](N)C(=O)O)=CC=C1 P38724 [0,2,0,0,0,0|1,0,1]=4 463 B14R1.75 N#CC1=CC(CC(N)C(=O)O)=CC=C1 P36893 [0,2,0,0,0,0|1,0,1]=4 464 B14R1.75 N#CC1=CC(C[C@@H](N)C(=O)O)=CC=C1 P39235 [0,2,0,0,0,0|1,0,1]=4 465 B14R1.75 N#CC1=CC(C[C@H](N)C(=O)O)=CC=C1 P37340 [0,2,0,0,0,0|1,0,1]=4 466 B14R1.153 CC1=C(C)C(CC(N)C(=O)O)=CC=C1 O28709 [0,2,0,0,0,0|1,0,1]=4 467 B14R1.153 CC1=C(C)C(C[C@@H](N)C(=O)O)=CC=C1 P42101 [0,2,0,0,0,0|1,0,1]=4 468 B14R1.153 CC1=C(C)C(C[C@H](N)C(=O)O)=CC=C1 P39286 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.153 NC(CC1=CC=CC(Br)=C1F)C(=O)O P41845 [0,2,0,0,0,0|1,0,1]=4 470 B14R1.153 NC(CC1=CC=CC(Cl)=C1Cl)C(=O)O O28985 [0,2,0,0,0,0|1,0,1]=4 471 B14R1.153 NC(CC1=CC=CC(F)=C1F)C(=O)O O28647 [0,2,0,0,0,0|1,0,1]=4 472 B14R1.153 NC(CC1=CC=CC(O)=C1O)C(=O)O P39081 [0,2,0,0,0,0|1,0,1]=4 473 B14R1.153 N[C@@H](CC1=CC=CC(Br)=C1Cl)C(=O)O P41425 [0,2,0,0,0,0|1,0,1]=4 474 B14R1.153 N[C@@H](CC1=CC=CC(Br)=C1F)C(=O)O P41852 [0,2,0,0,0,0|1,0,1]=4 475 B14R1.153 N[C@@H](CC1=CC=CC(Cl)=C1Cl)C(=O)O O28818 [0,2,0,0,0,0|1,0,1]=4 476 B14R1.153 N[C@@H](CC1=CC=CC(F)=C1F)C(=O)O O28786 [0,2,0,0,0,0|1,0,1]=4 477 B14R1.153 N[C@H](CC1=CC=CC(Br)=C1F)C(=O)O P41624 [0,2,0,0,0,0|1,0,1]=4 478 B14R1.153 N[C@H](CC1=CC=CC(Cl)=C1Cl)C(=O)O O28831 [0,2,0,0,0,0|1,0,1]=4 479 B14R1.153 N[C@H](CC1=CC=CC(F)=C1F)C(=O)O O28292 [0,2,0,0,0,0|1,0,1]=4 480 B14R1.542 CC1=CC(CC(CN)C(=O)O)=CC=C1 P35195 [0,2,0,0,0,0|1,0,1]=4 481 B14R1.542 NCC(CC1=CC=CC(Br)=C1)C(=O)O P35192 [0,2,0,0,0,0|1,0,1]=4 482 B14R1.4257 CC1=CC(Br)=CC(CC(N)C(=O)O)=C1 O28488 [0,2,0,0,0,0|1,0,1]=4 483 B14R1.4257 CC1=CC(C)=CC(CC(N)C(=O)O)=C1 O28824 [0,2,0,0,0,0|1,0,1]=4 484 B14R1.4257 CC1=CC(F)=CC(CC(N)C(=O)O)=C1 O28490 [0,2,0,0,0,0|1,0,1]=4 485 B14R1.4257 NC(CC1=CC(Br)=CC(Br)=C1)C(=O)O M22728 [0,2,0,0,0,0|1,0,1]=4 486 B14R1.4257 NC(CC1=CC(Cl)=CC(Cl)=C1)C(=O)O P34971 [0,2,0,0,0,0|1,0,1]=4 487 B14R1.4257 NC(CC1=CC(F)=CC(Br)=C1)C(=O)O P42014 [0,2,0,0,0,0|1,0,1]=4 488 B14R1.4257 NC(CC1=CC(F)=CC(F)=C1)C(=O)O P38840 [0,2,0,0,0,0|1,0,1]=4 489 B14R1.4257 N[C@@H](CC1=CC(Br)=CC(Br)=C1)C(=O)O M23106 [0,2,0,0,0,0|1,0,1]=4 490 B14R1.4257 N[C@@H](CC1=CC(Cl)=CC(Cl)=C1)C(=O)O O28833 [0,2,0,0,0,0|1,0,1]=4 491 B14R1.4257 N[C@@H](CC1=CC(F)=CC(Br)=C1)C(=O)O P41879 [0,2,0,0,0,0|1,0,1]=4 492 B14R1.4257 N[C@@H](CC1=CC(F)=CC(F)=C1)C(=O)O P38900 [0,2,0,0,0,0|1,0,1]=4 493 B14R1.4257 N[C@H](CC1=CC(Br)=CC(Br)=C1)C(=O)O M23105 [0,2,0,0,0,0|1,0,1]=4 494 B14R1.4257 N[C@H](CC1=CC(Cl)=CC(Cl)=C1)C(=O)O P42102 [0,2,0,0,0,0|1,0,1]=4 495 B14R1.4257 N[C@H](CC1=CC(F)=CC(Br)=C1)C(=O)O P41867 [0,2,0,0,0,0|1,0,1]=4 496 B14R1.4257 N[C@H](CC1=CC(F)=CC(F)=C1)C(=O)O P39220 [0,2,0,0,0,0|1,0,1]=4 497 B14R1.4474 CC1=CC=C(Br)C=C1C[C@H](N)C(=O)O P41872 [0,2,0,0,0,0|1,0,1]=4 498 B14R1.4474 CC1=CC=C(C)C(CC(N)C(=O)O)=C1 O28711 [0,2,0,0,0,0|1,0,1]=4 499 B14R1.4474 CC1=CC=C(Cl)C=C1C[C@@H](N)C(=O)O P41877 [0,2,0,0,0,0|1,0,1]=4 500 B14R1.4474 CC1=CC=C(Cl)C=C1C[C@H](N)C(=O)O P41875 [0,2,0,0,0,0|1,0,1]=4 501 B14R1.4474 CC1=CC=C(I)C=C1C[C@H](N)C(=O)O P41424 [0,2,0,0,0,0|1,0,1]=4 502 B14R1.4474 NC(CC1=CC(Br)=CC=C1Br)C(=O)O O28518 [0,2,0,0,0,0|1,0,1]=4 503 B14R1.4474 NC(CC1=CC(Br)=CC=C1Cl)C(=O)O M22731 [0,2,0,0,0,0|1,0,1]=4 504 B14R1.4474 NC(CC1=CC(Br)=CC=C1F)C(=O)O P38074 [0,2,0,0,0,0|1,0,1]=4 505 B14R1.4474 NC(CC1=CC(Cl)=CC=C1Cl)C(=O)O O28710 [0,2,0,0,0,0|1,0,1]=4 506 B14R1.4474 NC(CC1=CC(F)=CC=C1F)C(=O)O O28520 [0,2,0,0,0,0|1,0,1]=4 507 B14R1.4474 N[C@@H](CC1=CC(Br)=CC=C1Cl)C(=O)O M22824 [0,2,0,0,0,0|1,0,1]=4 508 B14R1.4474 N[C@@H](CC1=CC(Br)=CC=C1F)C(=O)O P41863 [0,2,0,0,0,0|1,0,1]=4 509 B14R1.4474 N[C@@H](CC1=CC(Cl)=CC=C1Cl)C(=O)O O28698 [0,2,0,0,0,0|1,0,1]=4 510 B14R1.4474 N[C@@H](CC1=CC(F)=CC=C1F)C(=O)O O28862 [0,2,0,0,0,0|1,0,1]=4 511 B14R1.4474 N[C@@H](CC1=CC(I)=CC=C1Br)C(=O)O P41628 [0,2,0,0,0,0|1,0,1]=4 512 B14R1.4474 N[C@H](CC1=CC(Br)=CC=C1Cl)C(=O)O M22823 [0,2,0,0,0,0|1,0,1]=4 513 B14R1.4474 N[C@H](CC1=CC(Br)=CC=C1F)C(=O)O P41876 [0,2,0,0,0,0|1,0,1]=4 514 B14R1.4474 N[C@H](CC1=CC(Cl)=CC=C1Cl)C(=O)O O28519 [0,2,0,0,0,0|1,0,1]=4 515 B14R1.4474 N[C@H](CC1=CC(F)=CC=C1F)C(=O)O O28427 [0,2,0,0,0,0|1,0,1]=4 516 B14R1.550 NCC(CC1=CC=CC=C1F)C(=O)O P35194 [0,2,0,0,0,0|1,0,1]=4 517 B14R1.3135 COC1=CC=CC=C1CC(=O)C(=O)O P35924 [0,2,0,0,0,0|0,0,0]=2 518 B14R1.3135 COC1=CC=CC=C1C[C@@H](N)C(=O)O P40608 [0,2,0,0,0,0|1,0,1]=4 519 B14R1.3135 COC1=CC=CC=C1C[C@H](N)C(=O)O O27906 [0,2,0,0,0,0|1,0,1]=4 520 B14R1.3135 N#CC1=CC=CC=C1CC(N)C(=O)O P39237 [0,2,0,0,0,0|1,0,1]=4 521 B14R1.3135 N#CC1=CC=CC=C1C[C@@H](N)C(=O)O O28703 [0,2,0,0,0,0|1,0,1]=4 522 B14R1.3135 N#CC1=CC=CC=C1C[C@H](N)C(=O)O P39236 [0,2,0,0,0,0|1,0,1]=4 523 B14R1.5882 CC(C)(CC1=CC=CC=C1F)C(=O)O Q66009 [0,2,0,0,0,0|1,0,1]=4 524 B14R1.5882 CC(N)(CC1=CC=CC=C1Cl)C(=O)O P39795 [0,2,0,0,0,0|1,0,1]=4 525 B14R1.5971 CC1=CC=CC(C)=C1CC(N)C(=O)O O28982 [0,2,0,0,0,0|1,0,1]=4 526 B14R1.5971 NC(CC1=C(Cl)C=CC=C1Cl)C(=O)O O28937 [0,2,0,0,0,0|1,0,1]=4 527 B14R1.5971 NC(CC1=C(F)C=CC=C1Cl)C(=O)O P37151 [0,2,0,0,0,0|1,0,1]=4 528 B14R1.5971 NC(CC1=C(F)C=CC=C1F)C(=O)O O28966 [0,2,0,0,0,0|1,0,1]=4 529 B14R1.5971 N[C@@H](CC1=C(Cl)C=CC=C1Cl)C(=O)O O28522 [0,2,0,0,0,0|1,0,1]=4 530 B14R1.5971 N[C@@H](CC1=C(F)C=CC=C1F)C(=O)O O28708 [0,2,0,0,0,0|1,0,1]=4 531 B14R1.5971 N[C@H](CC1=C(Cl)C=CC=C1Cl)C(=O)O O28521 [0,2,0,0,0,0|1,0,1]=4 532 B14R1.5971 N[C@H](CC1=C(F)C=CC=C1F)C(=O)O O28433 [0,2,0,0,0,0|1,0,1]=4 533 B14R1.4513 CN(C)[C@H](CC1=CC=CC=C1)C(=O)O Q65832 [0,2,0,0,0,0|1,0,1]=4 534 B14R1.4513 O=C(O)C(CC1=CC=CC=C1)C(=O)O P37047 [0,2,0,0,0,0|0,0,1]=3 535 B12R2.18 O=C1NC2=C(C=CC=N2)C1=O P45467 [1,0,0,1,0,0|2,0,0]=4 536 B12R2.18 O=C1NC2=C(N=CC=C2)C1=O Q52820 [1,0,0,1,0,0|2,0,0]=4 537 B12R2.23 O=C1CCC1C2=CC=CC=C2 F-4430 [1,0,0,1,0,0|1,0,1]=4 538 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 P39429 [1,0,0,1,0,0|2,0,0]=4 539 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 P51461 [1,0,0,1,0,0|0,1,1]=4 540 B12R2.27 O=CC1CC1C2=CC=CC=C2 L20873 [1,0,0,1,0,0|1,0,1]=4 541 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 O30293 [1,0,0,1,0,0|1,0,1]=4 542 B12R2.22 O=C1CC(C2=CC=CC=C2)N1 D-2509 [1,0,0,1,0,0|1,0,1]=4 543 B14R2.19 O=C1CC(CC2=CC=CC=C2)CO1 P51671 [0,0,0,1,0,1|1,0,1]=4 544 B14R2.598 O=C1CC(=O)N(C2=CC=CC=C2)N1 P50989 [0,0,0,1,0,1|2,0,0]=4 545 B14R2.642 O=C(O)C1=C(Cl)NC2=CC=CC=C21 Q60503 [0,0,0,1,0,1|2,0,0]=4 546 B14R2.768 O=C(O)CC1=CC2=CC=CC=C2O1 P37021 [0,0,0,1,0,1|0,0,2]=4 547 B14R2.768 O=C(O)CC1=NC2=CC=CC=C2S1 O31718 [0,0,0,1,0,1|1,1,0]=4 548 B14R2.768 O=C(O)CC1CC2=C(C=CC=C2)C1 P38431 [0,0,0,1,0,1|1,0,1]=4 549 B14R2.779 O=C(O)C1CC(C2=CC=CC=C2)C1 L18004 [0,0,0,1,0,1|1,0,1]=4 550 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)OC1 10629 [0,0,0,1,0,1|1,0,0]=3 551 B14R2.781 O=C(O)C1=NC=C2C=CC=CC2=C1 L13540 [0,0,0,1,0,1|1,0,1]=4 552 B14R2.781 O=C(O)C1CCC2=CC=CC=C2O1 P37675 [0,0,0,1,0,1|0,0,2]=4 553 B14R2.781 O=C(O)C1CNC2=C(C=CC=C2)C1 O30492 [0,0,0,1,0,1|1,0,1]=4 554 B14R2.781 O=C(O)C1CNC2=CC=CC=C2O1 P35244 [0,0,0,1,0,1|0,0,2]=4 555 B14R2.781 O=C(O)C1COC2=C(C=CC=C2)C1 O34441 [0,0,0,1,0,1|1,0,1]=4 556 B14R2.781 [C@H]1(C(=O)O)COC2=CC=CC=C2O1 10049 [0,0,0,1,0,1|0,0,2]=4 557 B14R2.9535 NC1(C(=O)O)CCC2=C1C=CC=C2 O28879 [0,0,0,1,0,1|1,0,1]=4 558 B14R2.4402 NC1=CC=C(C2CC2C(=O)O)C=C1 Q69987 [0,1,0,1,0,0|1,0,1]=4 559 B14R2.4402 O=C(O)C1CC1C2=CC=C(Br)C=C2 O34336 [0,1,0,1,0,0|1,0,1]=4 560 B14R2.4402 O=C(O)C1CC1C2=CC=C(Cl)C=C2 O34419 [0,1,0,1,0,0|1,0,1]=4 561 B14R2.4402 O=C(O)C1CC1C2=CC=C(F)C=C2 O34420 [0,1,0,1,0,0|1,0,1]=4 562 B14R2.4402 O=C(O)[C@H]1C[C@@H]1C2=CC=C(O)C=C2 L14739 [0,1,0,1,0,0|1,0,1]=4 563 B14R2.4529 CC1=CC2=C(C=C1)NC(C(=O)O)=C2 M15083 [0,1,0,1,0,0|1,0,1]=4 564 B14R2.4529 CC1=CC=C2C=C(C(=O)O)OC2=C1 M22856 [0,1,0,1,0,0|0,0,2]=4 565 B14R2.4529 CC1=CC=C2C=C(C(=O)O)SC2=C1 O31918 [0,1,0,1,0,0|0,1,1]=4 566 B14R2.4529 NC1=CC2=C(C=C1)NC(C(=O)O)=N2 F-4573 [0,1,0,1,0,0|2,0,0]=4 567 B14R2.4529 NC1=CC=C2OC(C(=O)O)=CC2=C1 10004 [0,1,0,1,0,0|0,0,2]=4 568 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)N1 P40692 [0,1,0,1,0,0|1,0,1]=4 569 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)N1 I-9560 [0,1,0,1,0,0|1,0,1]=4 570 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 O32317 [0,1,0,1,0,0|1,0,1]=4 571 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 P39711 [0,1,0,1,0,0|1,0,1]=4 572 B14R2.4529 O=C(O)C1=CC2=CC(Br)=CC=C2S1 G-5524 [0,1,0,1,0,0|0,1,1]=4 573 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2O1 M22855 [0,1,0,1,0,0|0,0,2]=4 574 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2S1 I-9869 [0,1,0,1,0,0|0,1,1]=4 575 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Br)=C2)N1 10715 [0,1,0,1,0,0|2,0,0]=4 576 B14R2.4529 O=C(O)C1=NC2=C(C=CC(Cl)=C2)S1 P45718 [0,1,0,1,0,0|1,1,0]=4 577 B14R2.4529 O=C(O)C1CC2=CC(Br)=CC=C2O1 H-8758 [0,1,0,1,0,0|0,0,2]=4 578 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 M15624 [0,1,0,1,0,0|2,0,0]=4 579 B14R2.972 COC(=O)C1=NC2=CC=CC=C2N1 O34482 [0,1,0,1,0,0|2,0,0]=4 580 B14R2.972 COC(=O)C1CC2=C(C=CC=C2)N1 P37208 [0,1,0,1,0,0|1,0,1]=4 581 B14R2.4476 CC1=CC(C2CC2C(=O)O)=CC=C1 Q69990 [0,1,0,1,0,0|1,0,1]=4 582 B14R2.4476 O=C(O)C1CC1C2=CC=CC(Br)=C2 O34382 [0,1,0,1,0,0|1,0,1]=4 583 B14R2.4476 O=C(O)C1CC1C2=CC=CC(Cl)=C2 O34295 [0,1,0,1,0,0|1,0,1]=4 584 B14R2.4476 O=C(O)C1CC1C2=CC=CC(F)=C2 O34383 [0,1,0,1,0,0|1,0,1]=4 585 B14R2.4476 O=C(O)[C@H]1C[C@@H]1C2=CC(F)=CC=C2 P43784 [0,1,0,1,0,0|1,0,1]=4 586 B14R2.7969 O=C(O)C1=CC2=C(Br)C=CC=C2N1 10613 [0,1,0,1,0,0|1,0,1]=4 587 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2F)N1 O32240 [0,1,0,1,0,0|1,0,1]=4 588 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2O)N1 Q60732 [0,1,0,1,0,0|1,0,1]=4 589 B14R2.7969 O=C(O)C1=CC2=C(S1)C(Cl)=CC=C2 L14875 [0,1,0,1,0,0|0,1,1]=4 590 B14R2.7969 O=C(O)C1=CC2=CC=CC(Br)=C2O1 P37481 [0,1,0,1,0,0|0,0,2]=4 591 B14R2.7969 O=C(O)C1=NC2=C(F)C=CC=C2S1 P51678 [0,1,0,1,0,0|1,1,0]=4 592 B14R2.28472 O=C1NC2=C(NC1=O)C(O)=CC=C2 O29383 [0,1,0,1,0,0|2,0,0]=4 593 B14R2.450 CN1C(C(=O)O)=CC2=C1C=CC=C2 Q52556 [0,1,0,1,0,0|1,0,1]=4 594 B14R2.789 CC1(C(=O)O)CC2=C(C=CC=C2)O1 S72797 [0,1,0,1,0,0|0,0,2]=4 595 B14R2.789 NC1(C(=O)O)CC2=C(C=CC=C2)C1 P39127 [0,1,0,1,0,0|1,0,1]=4 596 B14R2.5443 O=C(O)C1CC1C2=CC=CC=C2Br O34381 [0,1,0,1,0,0|1,0,1]=4 597 B14R2.5443 O=C(O)C1CC1C2=CC=CC=C2Cl I-9942 [0,1,0,1,0,0|1,0,1]=4 598 B14R2.5443 O=C(O)C1CC1C2=CC=CC=C2F P51416 [0,1,0,1,0,0|1,0,1]=4 599 B14R2.788 O=C(O)C1(CC2=CC=CC=C2)CC1 L22287 [0,1,0,1,0,0|1,0,1]=4 600 B10R1.15 C#CC(=O)C1=CC=CC=C1 P38531 [1,0,0,0,1,0|1,0,1]=4 601 B10R1.15 C=CC(=O)C1=CC=CC=N1 Q52779 [1,0,0,0,1,0|2,0,0]=4 602 B10R1.15 C=CC(=O)C1=CC=CN=C1 Q52778 [1,0,0,0,1,0|2,0,0]=4 603 B10R1.15 C=CC(=O)C1=CC=NC=C1 Q52777 [1,0,0,0,1,0|2,0,0]=4 604 B10R1.66 O=C(O)CCC1=CSC=C1 P40765 [1,0,0,0,1,0|1,0,1]=4 605 B10R1.66 O=C(O)CCN1C=CC=C1 P35344 [1,0,0,0,1,0|1,0,1]=4 606 B10R1.66 O=C(O)\C=C\C1=CC=CO1 P45498 [1,0,0,0,1,0|1,0,1]=4 607 B12R1.252 O=C(O)CCCC1=CN=CC=C1 Q60813 [1,0,0,0,0,1|1,0,1]=4 608 B12R1.252 O=C(O)CCOC1=CC=CC=C1 P36446 [1,0,0,0,0,1|0,0,1]=3 609 B14R1.423 N[C@@H](CCC(=O)O)CC1=CC=CC=C1 P35128 [0,0,0,0,0,2|1,0,1]=4 610 B14R1.423 O=C(O)CCC(=O)NC1=CC=CN=C1 P39317 [0,0,0,0,0,2|2,0,0]=4 611 B14R1.818 NC(CCC1=CC=CC=C1)CC(=O)O P35180 [0,0,0,0,0,2|1,0,1]=4 612 B14R1.818 N[C@@H](CCC1=CC=CC=C1)CC(=O)O M22764 [0,0,0,0,0,2|1,0,1]=4 613 B14R1.818 N[C@H](CCC1=CC=CC=C1)CC(=O)O M22743 [0,0,0,0,0,2|1,0,1]=4 614 B14R1.6449 NC(CCCC1=CC=CC=C1)C(=O)O P38634 [0,0,0,0,0,2|1,0,1]=4 615 B14R1.6449 N[C@@H](CCCC1=CC=CC=C1)C(=O)O P36970 [0,0,0,0,0,2|1,0,1]=4 616 B14R1.6449 N[C@@H](C\C=C\C1=CC=CC=C1)C(=O)O O28886 [0,0,0,0,0,2|1,0,1]=4 617 B14R1.6449 N[C@H](CCCC1=CC=CC=C1)C(=O)O P38551 [0,0,0,0,0,2|1,0,1]=4 618 B14R1.6449 N[C@H](CSCC1=CC=CC=C1)C(=O)O O27904 [0,0,0,0,0,2|1,0,1]=4 619 B14R1.6449 N[C@H](C\C=C\C1=CC=CC=C1)C(=O)O O28856 [0,0,0,0,0,2|1,0,1]=4