0 B14R1.4474 N[C@@H](CC1=C(F)C=CC(F)=C1)C(=O)O A51811 [0,0,0,0,0,0|0,2,0]=2 1 B13R1.148 CC1=CC=CC(C[C@H](N)C(=O)O)=C1 A52953 [1,0,0,0,0,0|1,0,0]=2 2 B13R1.148 CC1=CC=CC(C[C@H](N)C(=O)O)=C1 M52937 [1,0,0,0,0,0|1,0,0]=2 3 B13R1.148 NC1=CC=CC(C[C@H](N)C(=O)O)=C1 A52254 [1,0,0,0,0,0|1,0,0]=2 4 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O A68969 [1,0,0,0,0,0|1,0,0]=2 5 B13R1.148 N[C@@H](CC1=CC(O)=CC=C1)C(=O)O T67429 [1,0,0,0,0,0|1,0,0]=2 6 B13R1.148 N[C@@H](CC1=CC=CC(Br)=C1)C(=O)O A37859 [1,0,0,0,0,0|0,1,0]=2 7 B13R1.148 N[C@@H](CC1=CC=CC(Br)=C1)C(=O)O B67992 [1,0,0,0,0,0|0,1,0]=2 8 B13R1.148 N[C@@H](CC1=CC=CC(Cl)=C1)C(=O)O A61471 [1,0,0,0,0,0|0,0,0]=1 9 B13R1.148 N[C@@H](CC1=CC=CC(F)=C1)C(=O)O F49826 [1,0,0,0,0,0|0,1,0]=2 10 B13R1.148 N[C@H](CC1=CC=CC(Br)=C1)C(=O)O A67546 [1,0,0,0,0,0|0,1,0]=2 11 B13R1.148 N[C@H](CC1=CC=CC(Cl)=C1)C(=O)O A68296 [1,0,0,0,0,0|0,0,0]=1 12 B13R1.148 N[C@H](CC1=CC=CC(F)=C1)C(=O)O A60702 [1,0,0,0,0,0|0,1,0]=2 13 B13R1.202 CC1=C(C[C@@H](N)C(=O)O)C=CC=C1 A52962 [1,0,0,0,0,0|1,0,0]=2 14 B13R1.202 CC1=C(C[C@H](N)C(=O)O)C=CC=C1 A52954 [1,0,0,0,0,0|1,0,0]=2 15 B13R1.202 N[C@@H](CC1=C(Br)C=CC=C1)C(=O)O A61938 [1,0,0,0,0,0|0,1,0]=2 16 B13R1.202 N[C@@H](CC1=C(Cl)C=CC=C1)C(=O)O A49818 [1,0,0,0,0,0|0,0,0]=1 17 B13R1.202 N[C@@H](CC1=C(O)C=CC=C1)C(=O)O A52126 [1,0,0,0,0,0|1,0,0]=2 18 B13R1.202 N[C@H](CC1=C(F)C=CC=C1)C(=O)O A49838 [1,0,0,0,0,0|0,1,0]=2 19 B13R1.893 O=C(O)CCC1=C(Cl)C=CC(Cl)=C1 D38926 [1,0,0,0,0,0|0,0,0]=1 20 B13R1.893 O=C(O)CCC1=C(F)C=CC(Br)=C1 B51585 [1,0,0,0,0,0|0,2,0]=3 21 B13R1.893 O=C(O)CCC1=C(F)C=CC(Cl)=C1 C51607 [1,0,0,0,0,0|0,1,0]=2 22 B15R1.8394 N[C@@H](CC1=CC(F)=C(F)C=C1F)C(=O)O A51479 [0,1,0,0,0,0|0,2,0]=3 23 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(O)=C2)CN1 H15604 [0,0,0,1,0,0|2,0,0]=3 24 B15R2.7174 O=C(O)[C@H]1CCC2=C(C=C(O)C=C2)C1 H61345 [0,0,0,1,0,0|3,0,0]=4 25 B13R1.897 N[C@@H](C(=O)O)C1=C(O)C=CC(F)=C1 A49616 [0,0,0,0,1,0|1,1,0]=3 26 B12R1.43 C=C(CC1=CC=CC=C1)C(=O)O B39587 [2,0,0,0,0,0|1,0,1]=4 27 B12R1.43 CC(=O)[C@@H](C)CC1=CC=CC=C1 M54757 [2,0,0,0,0,0|2,0,0]=4 28 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O P69450 [2,0,0,0,0,0|2,0,0]=4 29 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 A67883 [2,0,0,0,0,0|1,0,0]=3 30 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O A52116 [2,0,0,0,0,0|0,0,0]=2 31 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O P69134 [2,0,0,0,0,0|0,0,0]=2 32 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O A49500 [2,0,0,0,0,0|1,0,0]=3 33 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O A49660 [2,0,0,0,0,0|1,0,0]=3 34 B12R1.43 N[C@@H](CC1=CN=CC=C1)C(=O)O A49659 [2,0,0,0,0,0|1,0,0]=3 35 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O A46684 [2,0,0,0,0,0|1,0,0]=3 36 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O A61463 [2,0,0,0,0,0|1,0,0]=3 37 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O A60776 [2,0,0,0,0,0|1,0,0]=3 38 B12R1.43 O=C(Cl)[C@@H](Br)CC1=CC=CC=C1 B6285 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.43 O=C(O)[C@@H](Br)CC1=CC=CC=C1 B8639 [2,0,0,0,0,0|1,0,0]=3 40 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 H49929 [2,0,0,0,0,0|1,0,0]=3 41 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 H49928 [2,0,0,0,0,0|1,0,0]=3 42 B12R1.50 N[C@H](CO)CC1=CC=CC(Cl)=C1 A50259 [2,0,0,0,0,0|0,0,1]=3 43 B12R1.226 CC1=CC=CC(CCC(=O)O)=C1 M52805 [2,0,0,0,0,0|1,0,0]=3 44 B12R1.226 CC1=CC=CC(OCC(=O)O)=C1 T69043 [2,0,0,0,0,0|2,0,0]=4 45 B12R1.226 O=C(O)C=CC1=CC=CC(Cl)=C1 C39567 [2,0,0,0,0,0|0,0,2]=4 46 B12R1.226 O=C(O)CCC1=CC(O)=CC=C1 H67695 [2,0,0,0,0,0|1,0,0]=3 47 B12R1.226 O=C(O)CCC1=CC=CC(Br)=C1 B51889 [2,0,0,0,0,0|0,1,0]=3 48 B12R1.226 O=C(O)CCC1=CC=CC(Cl)=C1 C51921 [2,0,0,0,0,0|0,0,0]=2 49 B12R1.226 O=C(O)CCC1=CC=CC(F)=C1 F51935 [2,0,0,0,0,0|0,1,0]=3 50 B12R1.226 O=C(O)COC1=CC=CC(Br)=C1 B63813 [2,0,0,0,0,0|1,1,0]=4 51 B12R1.226 O=C(O)COC1=CC=CC(F)=C1 F48670 [2,0,0,0,0,0|1,1,0]=4 52 B12R1.125 CC1=C(CCC(=O)O)C=CC=C1 M52804 [2,0,0,0,0,0|1,0,0]=3 53 B12R1.125 CC1=C(OCC(=O)O)C=CC=C1 M62392 [2,0,0,0,0,0|2,0,0]=4 54 B12R1.125 O=C(O)CCC1=C(Br)C=CC=C1 B51888 [2,0,0,0,0,0|0,1,0]=3 55 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 C51920 [2,0,0,0,0,0|0,0,0]=2 56 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 F51934 [2,0,0,0,0,0|0,1,0]=3 57 B12R1.125 O=C(O)CCC1=C(I)C=CC=C1 K51957 [2,0,0,0,0,0|0,1,0]=3 58 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 F48669 [2,0,0,0,0,0|1,1,0]=4 59 B12R1.125 O=C(O)CSC1=C(Cl)C=CC=C1 C64672 [2,0,0,0,0,0|1,0,0]=3 60 B12R1.125 O=C(O)\C=C\C1=C(Cl)C=CC=C1 C6638 [2,0,0,0,0,0|0,0,2]=4 61 B12R1.371 N[C@H](CO)CC1=C(Cl)C=CC=C1 A50258 [2,0,0,0,0,0|0,0,1]=3 62 B12R1.127 O=C(O)CC1=C(Cl)C=CC(Cl)=C1 D48161 [2,0,0,0,0,0|1,0,1]=4 63 B14R1.75 COC1=CC=CC(C[C@@H](N)C(=O)O)=C1 M52977 [1,1,0,0,0,0|1,0,0]=3 64 B14R1.75 COC1=CC=CC(C[C@H](N)C(=O)O)=C1 A52986 [1,1,0,0,0,0|1,0,0]=3 65 B14R1.75 N#CC1=CC=CC(C[C@@H](N)C(=O)O)=C1 A63671 [1,1,0,0,0,0|1,0,0]=3 66 B14R1.135 COC(=O)[C@@H](N)CC1=CC(O)=CC=C1 M32208 [1,1,0,0,0,0|1,0,0]=3 67 B14R1.135 COC(=O)[C@@H](O)CC1=CC(O)=CC=C1 M52860 [1,1,0,0,0,0|2,0,0]=4 68 B14R1.153 N[C@@H](CC1=CC=CC(Cl)=C1Cl)C(=O)O A51801 [1,1,0,0,0,0|0,0,0]=2 69 B14R1.686 NC(=O)[C@@H](N)CC1=CC(O)=C(O)C=C1 A52140 [1,1,0,0,0,0|2,0,0]=4 70 B14R1.686 N[C@@H](CC1=CC(Br)=C(O)C=C1)C(=O)O A69186 [1,1,0,0,0,0|0,1,0]=3 71 B14R1.686 N[C@@H](CC1=CC(F)=C(F)C=C1)C(=O)O A51812 [1,1,0,0,0,0|0,1,0]=3 72 B14R1.686 N[C@@H](CC1=CC(F)=C(F)C=C1)C(=O)O D60689 [1,1,0,0,0,0|0,1,0]=3 73 B14R1.4257 N[C@@H](CC1=CC(Cl)=CC(Cl)=C1)C(=O)O A51802 [1,1,0,0,0,0|0,0,0]=2 74 B14R1.4257 N[C@@H](CC1=CC(F)=CC(F)=C1)C(=O)O D51804 [1,1,0,0,0,0|0,1,0]=3 75 B14R1.3135 COC1=C(C[C@H](N)C(=O)O)C=CC=C1 A52981 [1,1,0,0,0,0|1,0,0]=3 76 B14R1.6049 N[C@@H](CC1=C(Cl)C=C(Cl)C=C1)C(=O)O A60896 [1,1,0,0,0,0|0,0,0]=2 77 B14R1.6049 N[C@@H](CC1=C(F)C=C(F)C=C1)C(=O)O A51810 [1,1,0,0,0,0|0,1,0]=3 78 B14R1.6049 N[C@H](CC1=C(Cl)C=C(Cl)C=C1)C(=O)O D51795 [1,1,0,0,0,0|0,0,0]=2 79 B14R1.6049 N[C@H](CC1=C(F)C=C(F)C=C1)C(=O)O A51809 [1,1,0,0,0,0|0,1,0]=3 80 B14R1.2335 CSC1=CC(CCC(=O)O)=C(O)C=C1 H67028 [1,1,0,0,0,0|2,0,0]=4 81 B16R1.11361 N[C@@H](CC(=O)O)CC1=CC(F)=C(F)C=C1F A37506 [0,1,0,0,0,1|0,2,0]=4 82 B16R1.11361 N[C@@H](CC(=O)O)CC1=CC(F)=C(F)C=C1F A52376 [0,1,0,0,0,1|0,2,0]=4 83 B14R2.4476 O=C(O)C1CC1C2=CC=CC(Cl)=C2 C53996 [1,0,0,1,0,0|1,0,0]=3 84 B14R2.4476 O=C(O)[C@@H]1C[C@H]1C2=CC=CC(F)=C2 F61658 [1,0,0,1,0,0|1,1,0]=4 85 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Cl)=C2)N1 C9530 [1,0,0,1,0,0|0,0,2]=4 86 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 C50879 [1,0,0,1,0,0|0,0,2]=4 87 B14R2.7969 O=C(O)[C@H]1CC2=C(C1)C(O)=CC=C2 H52463 [1,0,0,1,0,0|2,0,0]=4 88 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 P64908 [1,0,0,1,0,0|1,0,0]=3 89 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 T54113 [1,0,0,1,0,0|1,0,0]=3 90 B14R2.781 O=C(O)[C@@H]1CC2=C(C=CC=C2)CN1 T67672 [1,0,0,1,0,0|1,0,0]=3 91 B14R2.781 O=C(O)[C@@H]1CNC2=C(C=CC=C2)C1 T64049 [1,0,0,1,0,0|2,0,0]=4 92 B14R2.781 O=C(O)[C@H]1CC2=C(C=CC=C2)CN1 T52580 [1,0,0,1,0,0|1,0,0]=3 93 B14R2.781 O=C(O)[C@H]1CCC2=C(C=CC=C2)C1 T54558 [1,0,0,1,0,0|2,0,0]=4 94 B14R2.5443 O=C(O)C1CC1C2=C(Br)C=CC=C2 B53989 [1,0,0,1,0,0|1,1,0]=4 95 B14R2.5443 O=C(O)C1CC1C2=C(Cl)C=CC=C2 C17014 [1,0,0,1,0,0|1,0,0]=3 96 B14R2.5443 O=C(O)[C@@H]1C[C@H]1C2=C(Br)C=CC=C2 B61659 [1,0,0,1,0,0|1,1,0]=4 97 B14R2.5443 O=C(O)[C@@H]1C[C@H]1C2=C(F)C=CC=C2 F61868 [1,0,0,1,0,0|1,1,0]=4 98 B12R1.104 N[C@@H](CC1=CC=C(Br)S1)C(=O)O A46138 [1,0,0,0,1,0|1,1,0]=4 99 B12R1.104 N[C@H](CC1=CC=C(Br)S1)C(=O)O A46137 [1,0,0,0,1,0|1,1,0]=4 100 B12R1.225 C[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 C51919 [1,0,0,0,1,0|1,0,0]=3 101 B12R1.225 NC1=CC=CC([C@@H](N)C(=O)O)=C1 A46679 [1,0,0,0,1,0|1,0,0]=3 102 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Br)=C1 A48925 [1,0,0,0,1,0|0,1,0]=3 103 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 A48954 [1,0,0,0,1,0|0,0,0]=2 104 B12R1.225 N[C@@H](C(=O)O)C1=CC=CC(Cl)=C1 A48962 [1,0,0,0,1,0|0,0,0]=2 105 B12R1.225 N[C@H](C(=O)O)C1=CC=CC(Cl)=C1 A48960 [1,0,0,0,1,0|0,0,0]=2 106 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Cl)=C1 C64552 [1,0,0,0,1,0|1,0,0]=3 107 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(Cl)=C1 C64588 [1,0,0,0,1,0|1,0,0]=3 108 B12R1.225 O=C(O)[C@H](O)C1=CC=CC(F)=C1 F48687 [1,0,0,0,1,0|1,1,0]=4 109 B12R1.124 C[C@@H](C(=O)O)C1=C(Cl)C=CC=C1 C51918 [1,0,0,0,1,0|1,0,0]=3 110 B12R1.124 N[C@@H](C(=O)O)C1=C(O)C=CC=C1 A49337 [1,0,0,0,1,0|1,0,0]=3 111 B12R1.124 N[C@H](C(=O)O)C1=C(Cl)C=CC=C1 A39505 [1,0,0,0,1,0|0,0,0]=2 112 B12R1.124 O=C(O)[C@@H](O)C1=C(Cl)C=CC=C1 C48667 [1,0,0,0,1,0|1,0,0]=3 113 B12R1.124 O=C(O)[C@H](Br)C1=C(Cl)C=CC=C1 B39471 [1,0,0,0,1,0|1,0,0]=3 114 B12R1.124 O=C(O)[C@H](O)C1=C(Cl)C=CC=C1 C67488 [1,0,0,0,1,0|1,0,0]=3 115 B12R1.124 O=C(O)[C@H](O)C1=C(F)C=CC=C1 F61964 [1,0,0,0,1,0|1,1,0]=4 116 B14R1.5978 N[C@H](CC(=O)O)CC1=CC=CC(Cl)=C1 A52761 [1,0,0,0,0,1|0,0,0]=2 117 B14R1.5978 N[C@H](CC(=O)O)CC1=CC=CC(Cl)=C1 A52762 [1,0,0,0,0,1|0,0,0]=2 118 B14R1.337 CC1=C(C[C@@H](N)CC(=O)O)C=CC=C1 A54871 [1,0,0,0,0,1|1,0,0]=3