0 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Br)C=C1 E65719 [0,0,0,0,0,0|3,0,1]=4 1 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Cl)C=C1 E65718 [0,0,0,0,0,0|3,0,1]=4 2 B15R1.48 CCOC(=O)[C@@H](N)CC1=CC=C(F)C=C1 E55479 [0,0,0,0,0,0|1,0,0]=1 3 B15R1.48 CCOC(=O)[C@H](C)OC1=CC=C(O)C=C1 E54807 [0,0,0,0,0,0|2,0,0]=2 4 B15R1.48 CCOC(=O)[C@H](N)CC1=CC=C(F)C=C1 E55478 [0,0,0,0,0,0|1,0,0]=1 5 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 E68535 [1,0,0,0,0,0|0,0,0]=1 6 B14R1.134 COC(=O)[C@@H](C)OC1=CC=C(O)C=C1 M52859 [1,0,0,0,0,0|2,0,0]=3 7 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 M67781 [1,0,0,0,0,0|1,0,0]=2 8 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(F)C=C1 M54134 [1,0,0,0,0,0|1,0,0]=2 9 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 M54169 [1,0,0,0,0,0|0,0,0]=1 10 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(O)C=C1 M67908 [1,0,0,0,0,0|0,0,0]=1 11 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(C)C=C1 M54181 [1,0,0,0,0,0|2,0,0]=3 12 B14R1.134 COC(=O)[C@@H](N)CC1=NC=C(Cl)C=C1 M49988 [1,0,0,0,0,0|2,0,0]=3 13 B14R1.502 CCOC(=O)C#CC1=CC=C(Cl)C=C1 E55405 [1,0,0,0,0,0|1,0,2]=4 14 B14R1.502 CCOC(=O)CCC1=CC=C(Br)C=C1 E38388 [1,0,0,0,0,0|1,0,0]=2 15 B14R1.502 CCOC(=O)CCC1=CC=C(Cl)C=C1 E66576 [1,0,0,0,0,0|1,0,0]=2 16 B14R1.502 CCOC(=O)CCC1=CC=C(F)C=C1 E54678 [1,0,0,0,0,0|1,0,0]=2 17 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 E54798 [1,0,0,0,0,0|0,0,0]=1 18 B14R1.502 CCOC(=O)COC1=CC=C(O)C=C1 E65342 [1,0,0,0,0,0|1,0,0]=2 19 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 E54450 [1,0,0,0,0,0|1,0,2]=4 20 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 E61841 [1,0,0,0,0,0|1,0,2]=4 21 B16R1.743 CCOC(=O)\C(C#N)=C\C1=CC=C(O)C=C1 E55682 [0,1,0,0,0,0|0,0,3]=4 22 B16R1.1065 CC(C)OC(=O)[C@@H](N)CC1=CC=C(O)C=C1 I37095 [0,1,0,0,0,0|0,0,0]=1 23 B16R1.15339 CCOC(=O)[C@@](C)(N)CC1=CC=C(O)C=C1 E56172 [0,1,0,0,0,0|0,0,0]=1 24 B16R2.755 CCOC(=O)C1=CC2=C(C=C(Br)C=C2)N1 E16203 [0,0,0,1,0,0|1,0,2]=4 25 B16R2.755 CCOC(=O)C1=CC2=C(C=C(Cl)C=C2)N1 E54326 [0,0,0,1,0,0|1,0,2]=4 26 B16R2.755 CCOC(=O)C1=CC2=C(C=C(F)C=C2)N1 E11123 [0,0,0,1,0,0|1,0,2]=4 27 B16R2.755 CCOC(=O)C1=CC2=C(C=CC(O)=C2)N1 E54432 [0,0,0,1,0,0|2,0,1]=4 28 B16R2.1131 O=C1N[C@@H](CC2=CC=C(O)C=C2)C(=O)O1 H53978 [0,0,0,1,0,0|1,0,1]=3 29 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Br)C=C1 E22198 [0,0,0,0,1,0|2,0,1]=4 30 B14R1.35 CCOC(=O)C(=O)C1=CC=C(C)C=C1 E54571 [0,0,0,0,1,0|2,0,1]=4 31 B14R1.35 CCOC(=O)C(=O)C1=CC=C(Cl)C=C1 E54025 [0,0,0,0,1,0|2,0,1]=4 32 B14R1.35 CCOC(=O)C(=O)C1=CC=C(O)C=C1 E52483 [0,0,0,0,1,0|1,0,1]=3 33 B14R1.35 CCOC(=O)[C@H](Br)C1=CC=C(Cl)C=C1 E52444 [0,0,0,0,1,0|2,0,0]=3 34 B14R1.35 CCOC(=O)[C@H](Br)C1=CC=C(F)C=C1 E38893 [0,0,0,0,1,0|2,0,0]=3 35 B13R1.19 CCOC(=O)CC1=CC=C(O)C=C1 E52825 [2,0,0,0,0,0|1,0,1]=4 36 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 P56074 [2,0,0,0,0,0|1,0,0]=3 37 B13R1.42 CCOC(=O)C#CC1=CC=CC=C1 E62302 [2,0,0,0,0,0|0,0,2]=4 38 B13R1.42 CCOC(=O)CNC1=CC=CC=C1 P52940 [2,0,0,0,0,0|1,0,0]=3 39 B13R1.42 CCOC(=O)COC1=CN=CC=C1 E50088 [2,0,0,0,0,0|2,0,0]=4 40 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 E69409 [2,0,0,0,0,0|0,0,2]=4 41 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 A53040 [2,0,0,0,0,0|1,0,0]=3 42 B13R1.135 COC(=O)[C@@H](Br)CC1=CC=CC=C1 M52623 [2,0,0,0,0,0|1,0,0]=3 43 B13R1.135 COC(=O)[C@@H](Cl)CC1=CC=CC=C1 M22031 [2,0,0,0,0,0|1,0,0]=3 44 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 M69265 [2,0,0,0,0,0|0,0,0]=2 45 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 M37251 [2,0,0,0,0,0|1,0,0]=3 46 B13R1.135 COC(=O)[C@@H](O)CC1=CC=CC=C1 M52845 [2,0,0,0,0,0|1,0,0]=3 47 B13R1.135 COC(=O)[C@H](O)CC1=CC=CC=C1 M52844 [2,0,0,0,0,0|1,0,0]=3 48 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 M52626 [2,0,0,0,0,0|1,0,0]=3 49 B13R1.14 COC(=O)CCC1=CC=C(I)C=C1 M52652 [2,0,0,0,0,0|1,0,0]=3 50 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 M38944 [2,0,0,0,0,0|1,0,0]=3 51 B13R1.14 COC(=O)CCC1=CC=C(N)C=C1 M54163 [2,0,0,0,0,0|1,0,0]=3 52 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 M68976 [2,0,0,0,0,0|0,0,0]=2 53 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 M51987 [2,0,0,0,0,0|2,0,0]=4 54 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 A69608 [2,0,0,0,0,0|1,0,0]=3 55 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 A69604 [2,0,0,0,0,0|1,0,0]=3 56 B13R1.133 C[C@@H](OC1=CC=C(O)C=C1)C(=O)O H69720 [2,0,0,0,0,0|2,0,0]=4 57 B13R1.133 NC1=CC=C(C[C@@H](N)C(=O)O)C=C1 A50187 [2,0,0,0,0,0|1,0,0]=3 58 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 A68975 [2,0,0,0,0,0|1,0,0]=3 59 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O A68143 [2,0,0,0,0,0|1,0,0]=3 60 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O A68518 [2,0,0,0,0,0|1,0,0]=3 61 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O C61026 [2,0,0,0,0,0|1,0,0]=3 62 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O A52080 [2,0,0,0,0,0|1,0,0]=3 63 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O F67480 [2,0,0,0,0,0|1,0,0]=3 64 B13R1.133 N[C@@H](CC1=CC=C(I)C=C1)C(=O)O A67896 [2,0,0,0,0,0|1,0,0]=3 65 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O A52127 [2,0,0,0,0,0|0,0,0]=2 66 B13R1.133 N[C@@H](CC1=CC=C(O)C=C1)C(=O)O T60596 [2,0,0,0,0,0|0,0,0]=2 67 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O C37486 [2,0,0,0,0,0|1,0,0]=3 68 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O A49839 [2,0,0,0,0,0|1,0,0]=3 69 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O A52079 [2,0,0,0,0,0|1,0,0]=3 70 B13R1.133 N[C@H](CC1=CC=C(I)C=C1)C(=O)O A68483 [2,0,0,0,0,0|1,0,0]=3 71 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O T64926 [2,0,0,0,0,0|0,0,0]=2 72 B15R1.578 CCOC(=O)[C@@H](C)C(=O)C1=CC=CC=C1 E37287 [1,1,0,0,0,0|1,0,1]=4 73 B15R1.11652 COC(=O)[C@@](C)(N)CC1=CC=C(O)C=C1 M68673 [1,1,0,0,0,0|0,0,0]=2 74 B15R1.14339 COC(=O)[C@@H](N)CC1=C(C)C=C(C)C=C1 M56624 [1,1,0,0,0,0|1,0,0]=3 75 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Br)C=C1 E54462 [1,1,0,0,0,0|1,0,1]=4 76 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(C)C=C1 E55929 [1,1,0,0,0,0|1,0,1]=4 77 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(Cl)C=C1 E68007 [1,1,0,0,0,0|1,0,1]=4 78 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(F)C=C1 E65968 [1,1,0,0,0,0|1,0,1]=4 79 B15R1.23 CCOC(=O)CC(=O)C1=CC=C(I)C=C1 E54470 [1,1,0,0,0,0|1,0,1]=4 80 B15R1.791 CCOC(=O)CCC1=C(C)C=C(O)C=C1 E65404 [1,1,0,0,0,0|0,0,0]=2 81 B15R1.793 CCOC(=O)CCC1=CC=C(CO)C=C1 E56104 [1,1,0,0,0,0|0,0,0]=2 82 B15R1.619 CCOC(=O)C(C)(C)C1=CC=C(Br)C=C1 E56009 [0,1,0,0,1,0|2,0,0]=4 83 B15R1.619 CCOC(=O)C(F)(F)C1=CC=C(Cl)C=C1 E53999 [0,1,0,0,1,0|2,0,0]=4 84 B15R1.769 CCOC(=O)[C@H](CC)C1=CC=C(Br)C=C1 E56006 [0,1,0,0,1,0|2,0,0]=4 85 B17R1.1019 C=CC[C@@H](CC1=CC=C(Cl)C=C1)C(=O)OCC E66098 [0,2,0,0,0,0|2,0,0]=4 86 B17R1.1019 CCOC(=O)[C@H](CC1=CC=C(O)C=C1)OCC E36681 [0,2,0,0,0,0|1,0,0]=3 87 B17R1.5682 CCOC(=O)[C@@H](N)CC1=CC=C([N+](=O)[O-])C=C1 E61464 [0,2,0,0,0,0|0,0,1]=3 88 B17R1.5682 CCOC(=O)[C@@H](N)CC1=CC=C([N+](=O)[O-])C=C1 N65103 [0,2,0,0,0,0|0,0,1]=3 89 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 B53954 [1,0,0,1,0,0|1,0,1]=4 90 B15R2.325 O=C1N[C@@H](CC2=CC=CC=C2)C(=O)O1 P69617 [1,0,0,1,0,0|1,0,1]=4 91 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1C2=CC=CC=C2 E30019 [1,0,0,1,0,0|1,0,0]=3 92 B15R2.1356 CCOC(=O)C1=CC2=C(C=CC=C2)N1 E23375 [1,0,0,1,0,0|0,0,2]=4 93 B15R2.1356 CCOC(=O)C1=NC2=C(C=CC=C2)N1 E52314 [1,0,0,1,0,0|1,0,1]=4 94 B17R2.6194 CCOC(=O)[C@@H]1CC2=C(C=CC(O)=C2)CN1 E15605 [0,0,0,1,0,1|1,0,0]=3 95 B17R2.6194 CCOC(=O)[C@@H]1CC2=C(C=CC(O)=C2)CN1 I18415 [0,0,0,1,0,1|1,0,0]=3 96 B17R2.311425 CCOC(=O)[C@@H]1C[C@H]1C2=CC(F)=C(F)C=C2 E55765 [0,1,0,1,0,0|2,0,0]=4 97 B13R1.47 CCOC(=O)[C@@H](N)C1=CC=CC=C1 E63316 [1,0,0,0,1,0|0,0,0]=2 98 B13R1.47 CCOC(=O)[C@H](N)C1=CC=CC=C1 E8869 [1,0,0,0,1,0|0,0,0]=2 99 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 E15413 [1,0,0,0,1,0|1,0,0]=3 100 B13R1.47 CCOC(=O)[C@H](N)C1=NC=CC=C1 E61729 [1,0,0,0,1,0|1,0,0]=3 101 B13R1.21 COC(=O)C(=O)C1=CC=C(O)C=C1 M51644 [1,0,0,0,1,0|1,0,1]=4 102 B13R1.21 COC(=O)[C@@H](N)C1=CC=C(O)C=C1 M52128 [1,0,0,0,1,0|0,0,0]=2 103 B13R1.21 COC(=O)[C@H](Br)C1=CC=C(F)C=C1 M51587 [1,0,0,0,1,0|2,0,0]=4 104 B13R1.21 COC(=O)[C@H](C)C1=CC=C(N)C=C1 M62862 [1,0,0,0,1,0|2,0,0]=4 105 B13R1.21 COC(=O)[C@H](N)C1=CC=C(Cl)C=C1 M49825 [1,0,0,0,1,0|1,0,0]=3 106 B13R1.21 COC(=O)[C@H](N)C1=CC=C(O)C=C1 M39583 [1,0,0,0,1,0|0,0,0]=2 107 B13R1.21 COC(=O)[C@H](N)C1=CC=C(O)C=C1 M69456 [1,0,0,0,1,0|0,0,0]=2 108 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 E55926 [1,0,0,0,0,1|1,0,1]=4 109 B15R1.826 CCOC(=O)[C@@H](N)CCC1=CC=CC=C1 E67497 [1,0,0,0,0,1|0,0,0]=2 110 B15R1.826 CCOC(=O)[C@H](N)CCC1=CC=CC=C1 H56622 [1,0,0,0,0,1|0,0,0]=2 111 B15R1.826 CCOC(=O)[C@H](O)CCC1=CC=CC=C1 E68769 [1,0,0,0,0,1|1,0,0]=3 112 B15R1.11 CCOC(=O)CCCC1=CC=C(Br)C=C1 E37053 [1,0,0,0,0,1|1,0,0]=3