0 B11R1.35 NC(CC1=CN=CS1)C(=O)O SY245713 [0,0,0,0,0,0|1,0,0]=1 1 B11R1.35 NC(CC1=CNC=N1)C(=O)O SY034142 [0,0,0,0,0,0|0,0,2]=2 2 B11R1.35 NC(CN1C=CC=N1)C(=O)O SY026507 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.35 N[C@@H](CC1=CC=CS1)C(=O)O SY035273 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.35 N[C@@H](CC1=CNC=N1)C(=O)O SY011122 [0,0,0,0,0,0|0,0,2]=2 5 B11R1.35 N[C@H](CC1=CC=CS1)C(=O)O SY035318 [0,0,0,0,0,0|2,0,0]=2 6 B11R1.35 N[C@H](CC1=CNC=N1)C(=O)O SY034122 [0,0,0,0,0,0|0,0,2]=2 7 B10R1.66 NC(=O)CCN1C=CN=C1 SY084458 [1,0,0,0,0,0|3,0,0]=4 8 B10R1.66 O=C(O)CCC1=CC=CS1 SY005413 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.66 O=C(O)CCC1=CSC=C1 SY122984 [1,0,0,0,0,0|2,0,0]=3 10 B10R1.66 O=C(O)CCC1=NC=CS1 SY019802 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.66 O=C(O)CCN1C=CC=C1 SY010374 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.66 O=C(O)CCN1C=CC=N1 SY014172 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.66 O=C(O)CCN1C=CN=C1 SY024292 [1,0,0,0,0,0|2,0,0]=3 14 B12R1.104 CC1=CC=C(CC(N)C(=O)O)S1 SY044901 [0,1,0,0,0,0|2,0,0]=3 15 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 SY041520 [0,1,0,0,0,0|0,0,2]=3 16 B12R1.108 COC(=O)[C@@H](N)CC1=CNC=N1 SY225440 [0,1,0,0,0,0|0,0,2]=3 17 B12R1.145 CC1=C(CC(N)C(=O)O)SC=C1 SY044897 [0,1,0,0,0,0|2,0,0]=3 18 B12R1.145 CC1=C(CC(N)C(=O)O)SC=N1 SY044875 [0,1,0,0,0,0|1,0,0]=2 19 B12R1.298 N#CC(CC1=CC=CS1)C(=O)O SY023779 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.23 CC(C(=O)O)C1=COC=C1 SY253516 [0,0,0,0,1,0|3,0,0]=4 21 B10R1.23 C[C@H](C(=O)O)N1C=CN=C1 SY024266 [0,0,0,0,1,0|3,0,0]=4 22 B10R1.23 NC(C(=O)O)C1=CC=CS1 SY014049 [0,0,0,0,1,0|2,0,0]=3 23 B10R1.23 NC(C(=O)O)C1=CSC=C1 SY015213 [0,0,0,0,1,0|2,0,0]=3 24 B10R1.23 NC(C(=O)O)C1=CSC=C1 SY025903 [0,0,0,0,1,0|2,0,0]=3 25 B10R1.23 O=C(O)C(=O)C1=CC=CN1 SY299895 [0,0,0,0,1,0|2,0,1]=4 26 B10R1.23 O=C(O)C(F)C1=CSC=C1 SY263434 [0,0,0,0,1,0|3,0,0]=4 27 B12R1.43 CC(CC1=CC=CC=C1)C(=O)O SY185587 [0,0,0,0,0,1|3,0,0]=4 28 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SY009482 [0,0,0,0,0,1|3,0,0]=4 29 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SY036427 [0,0,0,0,0,1|3,0,0]=4 30 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 SY034084 [0,0,0,0,0,1|3,0,0]=4 31 B12R1.43 N[C@@H](CC1=CC=CC=C1)C(=O)O SY001531 [0,0,0,0,0,1|2,0,0]=3 32 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O SY057601 [0,0,0,0,0,1|1,0,0]=2 33 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O SY057718 [0,0,0,0,0,1|1,0,1]=3 34 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SY005120 [0,0,0,0,0,1|2,0,0]=3 35 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O SY033040 [0,0,0,0,0,1|1,0,0]=2 36 B12R1.43 O=C(O)C(Br)CC1=CC=CC=C1 SY103074 [0,0,0,0,0,1|3,0,0]=4 37 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 SY036063 [0,0,0,0,0,1|3,0,0]=4 38 B12R1.43 O=C(O)[C@@H](O)CC1=CC=CC=C1 SY020879 [0,0,0,0,0,1|3,0,0]=4 39 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 SY021341 [0,0,0,0,0,1|3,0,0]=4 40 B9R0.47 NC\C=C\CC(N)C(=O)O SY268261 [1,0,1,0,0,0|0,0,1]=3 41 B11R1.25 COC(=O)CCC1=CC=CN1 SY047286 [1,1,0,0,0,0|1,0,0]=3 42 B11R1.77 NC(CC(=O)O)C1=CC=CS1 SY013385 [1,1,0,0,0,0|2,0,0]=4 43 B11R1.77 NC(CC(=O)O)C1=CSC=C1 SY168025 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.89 CC1=C(C(N)C(=O)O)SC=C1 SY044855 [0,1,0,0,1,0|2,0,0]=4 45 B11R1.89 CC1=C(C(N)C(=O)O)SC=N1 SY044860 [0,1,0,0,1,0|1,0,0]=3 46 B11R1.173 CC(C)(C(=O)O)C1=CC=CN1 SY299893 [0,1,0,0,1,0|2,0,0]=4 47 B11R1.314 CC1=CC=C(C(N)C(=O)O)S1 SY044856 [0,1,0,0,1,0|2,0,0]=4 48 B13R1.133 CC1=CC=C(C[C@@H](N)C(=O)O)C=C1 SY035279 [0,1,0,0,0,1|2,0,0]=4 49 B13R1.133 CC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY035280 [0,1,0,0,0,1|2,0,0]=4 50 B13R1.133 NC(CC1=CC=C(Br)C=C1)C(=O)O SY049643 [0,1,0,0,0,1|2,0,0]=4 51 B13R1.133 NC(CC1=CC=C(F)C=C1)C(=O)O SY044822 [0,1,0,0,0,1|2,0,0]=4 52 B13R1.133 NC(CC1=CC=C(O)C=C1)C(=O)O SY013607 [0,1,0,0,0,1|2,0,0]=4 53 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY065205 [0,1,0,0,0,1|2,0,0]=4 54 B13R1.133 NC1=CC=C(C[C@H](N)C(=O)O)C=C1 SY110355 [0,1,0,0,0,1|2,0,0]=4 55 B13R1.133 N[C@@H](CC1=CC=C(Br)C=C1)C(=O)O SY023877 [0,1,0,0,0,1|2,0,0]=4 56 B13R1.133 N[C@@H](CC1=CC=C(Cl)C=C1)C(=O)O SY035278 [0,1,0,0,0,1|2,0,0]=4 57 B13R1.133 N[C@@H](CC1=CC=C(F)C=C1)C(=O)O SY030990 [0,1,0,0,0,1|2,0,0]=4 58 B13R1.133 N[C@H](CC1=CC=C(Br)C=C1)C(=O)O SY023876 [0,1,0,0,0,1|2,0,0]=4 59 B13R1.133 N[C@H](CC1=CC=C(Cl)C=C1)C(=O)O SY032852 [0,1,0,0,0,1|2,0,0]=4 60 B13R1.133 N[C@H](CC1=CC=C(F)C=C1)C(=O)O SY009526 [0,1,0,0,0,1|2,0,0]=4 61 B13R1.133 N[C@H](CC1=CC=C(O)C=C1)C(=O)O SY014304 [0,1,0,0,0,1|2,0,0]=4 62 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 SY106384 [0,1,0,0,0,1|2,0,0]=4 63 B13R1.135 COC(=O)[C@@H](N)CC1=CC=CC=C1 SY004788 [0,1,0,0,0,1|2,0,0]=4 64 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 SY034266 [0,1,0,0,0,1|2,0,0]=4 65 B13R1.148 NC(CC1=CC(O)=CC=C1)C(=O)O SY008841 [0,1,0,0,0,1|2,0,0]=4 66 B13R1.148 NC(CC1=CC=CC(Br)=C1)C(=O)O SY026457 [0,1,0,0,0,1|2,0,0]=4 67 B13R1.148 NC(CC1=CC=CC(F)=C1)C(=O)O SY046381 [0,1,0,0,0,1|2,0,0]=4 68 B13R1.148 N[C@@H](CC1=CC=CC(Br)=C1)C(=O)O SY023879 [0,1,0,0,0,1|2,0,0]=4 69 B13R1.148 N[C@@H](CC1=CC=CC(F)=C1)C(=O)O SY035269 [0,1,0,0,0,1|2,0,0]=4 70 B13R1.148 N[C@H](CC1=CC=CC(Br)=C1)C(=O)O SY023878 [0,1,0,0,0,1|2,0,0]=4 71 B13R1.148 N[C@H](CC1=CC=CC(Cl)=C1)C(=O)O SY035277 [0,1,0,0,0,1|2,0,0]=4 72 B13R1.148 N[C@H](CC1=CC=CC(F)=C1)C(=O)O SY035324 [0,1,0,0,0,1|2,0,0]=4 73 B13R1.202 NC(CC1=CC=CC=C1Br)C(=O)O SY026385 [0,1,0,0,0,1|2,0,0]=4 74 B13R1.202 NC(CC1=CC=CC=C1Cl)C(=O)O SY030197 [0,1,0,0,0,1|2,0,0]=4 75 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O SY049820 [0,1,0,0,0,1|2,0,0]=4 76 B13R1.202 N[C@@H](CC1=C(Cl)C=CC=C1)C(=O)O SY035311 [0,1,0,0,0,1|2,0,0]=4 77 B13R1.202 N[C@@H](CC1=CC=CC=C1F)C(=O)O SY040068 [0,1,0,0,0,1|2,0,0]=4 78 B13R1.202 N[C@H](CC1=C(Br)C=CC=C1)C(=O)O SY035314 [0,1,0,0,0,1|2,0,0]=4 79 B13R1.202 N[C@H](CC1=C(Cl)C=CC=C1)C(=O)O SY035312 [0,1,0,0,0,1|2,0,0]=4 80 B13R1.418 N#CC(CC1=CC=CN=C1)C(=O)O SY047938 [0,1,0,0,0,1|1,0,1]=4 81 B13R1.418 NCC(CC1=CC=CC=C1)C(=O)O SY005517 [0,1,0,0,0,1|2,0,0]=4 82 B13R1.421 CC1=C(CC(C#N)C(=O)O)SC=N1 SY023784 [0,2,0,0,0,0|1,0,1]=4 83 B11R1.74 O=C1C[C@@H](C(=O)O)NC(=O)N1 SY042036 [0,0,1,1,0,0|2,0,0]=4 84 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY015083 [0,0,1,1,0,0|1,0,1]=4 85 B11R1.36 NC(C(=O)O)C1=CC=CN=C1 SY184594 [0,0,1,1,0,0|1,0,1]=4 86 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CN=C2 SY273782 [0,0,0,1,0,1|2,0,0]=4 87 B13R2.435 O=C(O)C1CC2=C(C=CC=C2)N1 SY004089 [0,0,0,1,0,1|2,0,0]=4 88 B13R2.435 O=C(O)[C@@H]1CC2=C(C=CC=C2)N1 SY003767 [0,0,0,1,0,1|2,0,0]=4 89 B13R2.435 O=C(O)[C@H]1CC2=C(C=CC=C2)N1 SY003766 [0,0,0,1,0,1|2,0,0]=4 90 B13R2.430 O=C(O)C1CCC2=C(C1)N=CN2 SY023404 [0,0,0,1,0,1|1,0,0]=3 91 B13R2.430 O=C(O)C1CCC2=C(C1)N=CN2 SY026670 [0,0,0,1,0,1|1,0,0]=3 92 B11R1.91 NC(=O)CCC1=CC=CN=C1 SY022419 [1,0,0,0,0,1|2,0,0]=4 93 B11R1.91 NC(=O)CCC1=CC=NC=C1 SY022418 [1,0,0,0,0,1|2,0,0]=4 94 B11R1.91 O=C(O)CCC1=CC=CC=C1 SY001654 [1,0,0,0,0,1|2,0,0]=4 95 B11R1.91 O=C(O)CCC1=CC=NC=C1 SY022403 [1,0,0,0,0,1|1,0,0]=3 96 B11R1.91 O=C(O)CCC1=CN=CC=C1 SY017981 [1,0,0,0,0,1|1,0,0]=3 97 B11R1.91 O=C(O)CCC1=NC=CC=C1 SY013900 [1,0,0,0,0,1|1,0,1]=4 98 B11R1.91 O=C(O)COC1=CC=CN=C1 SY110065 [1,0,0,0,0,1|2,0,0]=4 99 B11R1.172 O=C(O)CCCC1=CC=CS1 SY005888 [1,0,0,0,0,1|2,0,0]=4 100 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SY225087 [0,0,0,0,0,2|2,0,0]=4 101 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SY110088 [0,0,0,0,0,2|2,0,0]=4 102 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SY225455 [0,0,0,0,0,2|2,0,0]=4 103 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SY065308 [0,0,0,0,0,2|2,0,0]=4 104 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SY254222 [0,0,0,0,0,2|2,0,0]=4 105 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SY012060 [0,0,0,0,0,2|2,0,0]=4 106 B13R1.351 N[C@H](CCC1=CC=CC=C1)C(=O)O SY012187 [0,0,0,0,0,2|2,0,0]=4