0 B7R0.16 CC(C)[C@H](C(=O)N)N ACT03147 [0,0,0,0,0,0|2,0,0]=2 1 B7R0.16 CC(C)[C@H](C(=O)O)N ACT04818 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.2 C[C@@H](CC(=O)O)N ACT02393 [1,0,0,0,0,0|1,0,0]=2 3 B6R0.2 C[C@@H](CC(=O)O)N ACT09644 [1,0,0,0,0,0|1,0,0]=2 4 B6R0.2 C[C@H](CC(=O)O)N ACT05190 [1,0,0,0,0,0|1,0,0]=2 5 B6R0.3 C(C(=O)C(=O)O)Br ACT09279 [1,0,0,0,0,0|2,0,1]=4 6 B6R0.3 C(C(C(=O)O)N)O ACT07798 [1,0,0,0,0,0|0,0,0]=1 7 B6R0.3 C([C@@H](C(=O)N)N)O ACT05215 [1,0,0,0,0,0|1,0,0]=2 8 B6R0.3 C([C@@H](C(=O)O)N)O ACT08366 [1,0,0,0,0,0|0,0,0]=1 9 B6R0.3 CC(C)[C@@H](CO)N ACT04154 [1,0,0,0,0,0|1,0,1]=3 10 B6R0.3 CC(C)[C@H](CO)N ACT05171 [1,0,0,0,0,0|1,0,1]=3 11 B6R0.3 CC(CN)C(=O)O ACT09241 [1,0,0,0,0,0|2,0,0]=3 12 B6R0.3 CCC(C(=O)C)S ACT06317 [1,0,0,0,0,0|2,0,0]=3 13 B6R0.3 CCC(C(=O)O)Br ACT02003 [1,0,0,0,0,0|1,0,0]=2 14 B6R0.3 CC[C@@H](C(=O)O)N ACT03155 [1,0,0,0,0,0|0,0,0]=1 15 B6R0.3 C[C@@H]([C@H](CO)N)O ACT04169 [1,0,0,0,0,0|0,0,1]=2 16 B6R0.3 C[C@H]([C@@H](CO)N)O ACT04168 [1,0,0,0,0,0|0,0,1]=2 17 B6R0.3 C[C@H]([C@@H](CO)N)O ACT10787 [1,0,0,0,0,0|0,0,1]=2 18 B8R0.2 CC(C)C(C(=O)OC)Br ACT03009 [0,1,0,0,0,0|2,0,0]=3 19 B8R0.2 CC(C)[C@@H](C(=O)OC)N ACT08510 [0,1,0,0,0,0|1,0,0]=2 20 B8R0.2 CC(C)[C@H](C(=O)OC)N ACT07567 [0,1,0,0,0,0|1,0,0]=2 21 B8R0.2 C[C@H]([C@@H](C(=O)O)N)OC ACT05274 [0,1,0,0,0,0|0,0,0]=1 22 B8R0.27 CC(C)(C)C(C(=O)O)N ACT05266 [0,1,0,0,0,0|1,0,0]=2 23 B8R0.27 CC(C)(C)[C@@H](C(=O)O)N ACT00048 [0,1,0,0,0,0|1,0,0]=2 24 B8R0.27 CC(C)(C)[C@H](C(=O)O)N ACT09426 [0,1,0,0,0,0|1,0,0]=2 25 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N ACT11890 [0,0,0,0,0,1|1,0,2]=4 26 B8R0.23 C([C@H](C(=O)O)N)C(=O)O ACT03145 [0,0,0,0,0,1|1,0,1]=3 27 B8R0.23 CC(C(=O)O)NC(=O)C ACT11766 [0,0,0,0,0,1|1,0,2]=4 28 B8R0.23 CC(C)C[C@@H](C(=O)N)N ACT07151 [0,0,0,0,0,1|2,0,0]=3 29 B8R0.23 CC(C)[C@H](CC(=O)O)N ACT09686 [0,0,0,0,0,1|1,0,0]=2 30 B8R0.23 C[C@@H](C(=O)O)NC(=O)C ACT00056 [0,0,0,0,0,1|1,0,2]=4 31 B8R0.23 C[C@@H](CC(=O)O)C(=O)O ACT09257 [0,0,0,0,0,1|2,0,1]=4 32 B5R0.1 C(CN)C(=O)N ACT05141 [2,0,0,0,0,0|2,0,0]=4 33 B5R0.1 C(CN)C(=O)O ACT04890 [2,0,0,0,0,0|1,0,0]=3 34 B5R0.1 CC#CC(=O)O ACT02801 [2,0,0,0,0,0|0,0,2]=4 35 B5R0.1 CCSC(=O)C ACT06390 [2,0,0,0,0,0|2,0,0]=4 36 B5R0.1 CNCC(=O)O ACT04970 [2,0,0,0,0,0|1,0,0]=3 37 B5R0.3 C=C[C@@H](CO)N ACT09263 [2,0,0,0,0,0|1,0,0]=3 38 B5R0.3 CCC(C=C)O ACT06029 [2,0,0,0,0,0|2,0,0]=4 39 B5R0.5 CC(C(=O)Br)Br ACT03417 [2,0,0,0,0,0|2,0,0]=4 40 B5R0.5 CC(C(=O)C)O ACT06054 [2,0,0,0,0,0|1,0,1]=4 41 B5R0.5 CC(C(=O)C)S ACT06274 [2,0,0,0,0,0|2,0,0]=4 42 B5R0.5 CC(C(=O)O)Br ACT01974 [2,0,0,0,0,0|1,0,0]=3 43 B5R0.5 CC(C(=O)O)N ACT07794 [2,0,0,0,0,0|0,0,0]=2 44 B5R0.5 CC(C(C)S)O ACT06277 [2,0,0,0,0,0|1,0,1]=4 45 B5R0.5 CC(C)C(=O)Cl ACT05625 [2,0,0,0,0,0|2,0,0]=4 46 B5R0.5 C[C@@H](C(=O)N)N ACT03139 [2,0,0,0,0,0|1,0,0]=3 47 B5R0.5 C[C@H](C(=O)N)N ACT10902 [2,0,0,0,0,0|1,0,0]=3 48 B5R0.5 C[C@H](C(=O)O)N ACT07928 [2,0,0,0,0,0|0,0,0]=2 49 B7R0.2 C([C@H](CN)O)C(=O)O ACT10094 [1,1,0,0,0,0|0,0,0]=2 50 B7R0.2 CC[C@H](C)CC(=O)O ACT09115 [1,1,0,0,0,0|1,0,0]=3 51 B7R0.2 C[C@H](CC(=O)OC)O ACT06831 [1,1,0,0,0,0|0,0,0]=2 52 B7R0.9 CC(=O)CC(C)(C)S ACT05878 [1,1,0,0,0,0|1,1,0]=4 53 B7R0.9 CC(C)(C)CC(=O)Cl ACT06988 [1,1,0,0,0,0|2,0,0]=4 54 B7R0.9 CC(C)(C)CC(=O)O ACT06987 [1,1,0,0,0,0|1,0,0]=3 55 B7R0.9 C[Si](C)(C)CC(=O)O ACT09356 [1,1,0,0,0,0|1,1,0]=4 56 B7R0.5 C(CBr)C(C(=O)O)Br ACT09951 [1,1,0,0,0,0|1,0,0]=3 57 B7R0.5 C(CN)C(C(=O)O)O ACT11882 [1,1,0,0,0,0|1,0,0]=3 58 B7R0.5 C(CN)[C@@H](C(=O)O)O ACT02354 [1,1,0,0,0,0|1,0,0]=3 59 B7R0.5 C=CC[C@@H](C(=O)O)N ACT02836 [1,1,0,0,0,0|0,0,1]=3 60 B7R0.10 CCC(C(=O)OC)Br ACT02122 [1,1,0,0,0,0|1,0,0]=3 61 B7R0.10 CC[C@H](C(=O)OC)N ACT10443 [1,1,0,0,0,0|0,0,0]=2 62 B7R0.10 CC[C@H](C)[C@@H](CO)N ACT04158 [1,1,0,0,0,0|1,0,1]=4 63 B7R0.10 COC(=O)C(=C)CO ACT03973 [1,1,0,0,0,0|1,0,1]=4 64 B7R0.10 COC(=O)C(CO)N ACT08359 [1,1,0,0,0,0|0,0,0]=2 65 B7R0.10 COC(=O)[C@@H](CO)N ACT05963 [1,1,0,0,0,0|0,0,0]=2 66 B7R0.10 COC(=O)[C@H](CO)N ACT09183 [1,1,0,0,0,0|0,0,0]=2 67 B7R0.10 COC(=O)[C@H](CS)N ACT07406 [1,1,0,0,0,0|0,1,0]=3 68 B7R0.13 CCC(C)(C)C(=O)Cl ACT06819 [1,1,0,0,0,0|2,0,0]=4 69 B7R0.13 CCC(C)(C)C(=O)O ACT06818 [1,1,0,0,0,0|1,0,0]=3 70 B7R0.13 CC[C@@](C)(C(=O)O)N ACT09522 [1,1,0,0,0,0|0,0,0]=2 71 B7R0.14 CC(C)(C)[C@@H](CO)N ACT07359 [1,1,0,0,0,0|1,0,1]=4 72 B7R0.14 CC(C)(C)[C@H](CO)N ACT07355 [1,1,0,0,0,0|1,0,1]=4 73 B7R0.15 CNC(CS)C(=O)O ACT09439 [1,1,0,0,0,0|0,1,0]=3 74 B9R0.23 CC(C)C[C@@H](C(=O)OC)N ACT08766 [0,1,0,0,0,1|1,0,0]=3 75 B9R0.23 CC(C)C[C@H](C(=O)OC)N ACT08412 [0,1,0,0,0,1|1,0,0]=3 76 B9R0.57 CC(C)(C)CC(C(=O)O)N ACT09147 [0,1,0,0,0,1|1,0,0]=3 77 B9R0.6 CCOC(=O)C(C(C)C)Br ACT02956 [0,2,0,0,0,0|2,0,0]=4 78 B9R0.6 CCOC(=O)[C@H](C(C)C)N ACT07377 [0,2,0,0,0,0|1,0,0]=3 79 B9R0.25 CC(C)(C)[C@@H](C(=O)OC)N ACT00049 [0,2,0,0,0,0|1,0,0]=3 80 B9R0.25 CC(C)(C)[C@@H](C(=O)OC)N ACT05262 [0,2,0,0,0,0|1,0,0]=3 81 B9R0.27 CC[C@H](C)[C@@H](C(=O)OC)N ACT07407 [0,2,0,0,0,0|1,0,0]=3 82 B9R0.72 CC(C)(C)[C@H](CN)C(=O)O ACT09621 [0,2,0,0,0,0|1,0,0]=3 83 B7R1.2 C1[C@@H](CNC1=O)O ACT01696 [1,0,0,1,0,0|1,0,0]=3 84 B7R1.4 C1C(C(=O)NO1)N ACT10891 [1,0,0,1,0,0|1,0,0]=3 85 B7R1.4 C1CNC(=O)C1N ACT09401 [1,0,0,1,0,0|1,0,0]=3 86 B7R1.4 C1[C@@H](C(=O)NO1)N ACT10801 [1,0,0,1,0,0|1,0,0]=3 87 B7R1.4 C1[C@H](C(=O)NO1)N ACT04767 [1,0,0,1,0,0|1,0,0]=3 88 B7R1.18 C1CN[C@@H]1C(=O)O ACT01799 [1,0,0,1,0,0|0,0,0]=2 89 B9R1.35 C1[C@@H](CN[C@H]1C(=O)O)O ACT02236 [0,0,0,1,0,1|0,0,0]=2 90 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)O ACT08225 [0,0,0,1,0,1|0,0,0]=2 91 B9R1.35 C1[C@H](CN[C@H]1C(=O)O)O ACT02252 [0,0,0,1,0,1|0,0,0]=2 92 B9R1.112 C1CC1C[C@H](C(=O)O)N ACT07808 [0,0,0,1,0,1|1,0,0]=3 93 B7R0.6 CC(=O)NCC(=O)O ACT08307 [1,0,0,0,0,1|0,0,2]=4 94 B7R0.6 CN(C)CCC(=O)O ACT09593 [1,0,0,0,0,1|2,0,0]=4 95 B9R0.7 C(CC(=O)O)[C@H](C(=O)O)N ACT08602 [0,0,0,0,0,2|1,0,1]=4 96 B9R0.53 CC(C)CC(CC(=O)O)N ACT09614 [0,0,0,0,0,2|1,0,0]=3 97 B9R0.53 CC(C)C[C@@H](CC(=O)O)N ACT04898 [0,0,0,0,0,2|1,0,0]=3