0 B6R0.2 *[C@@H](C)CC(=O)* EZK9050 [0,0,0,0,0,0|2,0,0]=2 1 B6R0.2 C[C@@H](CC(=O)O)N HAA8470 [0,0,0,0,0,0|1,0,0]=1 2 B6R0.2 C[C@H](CC(=O)O)N HAA8430 [0,0,0,0,0,0|1,0,0]=1 3 B5R0.1 C(CN)C(=O)N HAA5550 [1,0,0,0,0,0|2,0,0]=3 4 B5R0.1 C(CN)C(=O)O HAA1003 [1,0,0,0,0,0|1,0,0]=2 5 B5R0.1 C(CS)C(=O)O RL-1000 [1,0,0,0,0,0|1,0,0]=2 6 B5R0.1 CNCC(=O)N HAA1581 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.1 CNCC(=O)O HAA1192 [1,0,0,0,0,0|1,0,0]=2 8 B7R0.2 C([C@@H](CO)N)C(=O)O HAA8460 [0,1,0,0,0,0|1,0,0]=2 9 B7R0.2 C([C@H](CO)N)C(=O)O HAA8570 [0,1,0,0,0,0|1,0,0]=2 10 B7R0.2 C=CC(CC(=O)O)N HAA2510 [0,1,0,0,0,0|1,0,1]=3 11 B7R0.2 C=CC(CC(=O)O)N HAA2700 [0,1,0,0,0,0|1,0,1]=3 12 B7R0.2 CC(C)C[C@@H](CO)N FAL1011 [0,1,0,0,0,0|1,0,1]=3 13 B7R0.2 CC(C)C[C@H](CO)N FAL1005 [0,1,0,0,0,0|1,0,1]=3 14 B7R0.16 CC(C)[C@@H](C(=O)N)N HAA7500 [0,1,0,0,0,0|1,0,0]=2 15 B7R0.16 CC(C)[C@@H](C(=O)O)N HAA1143 [0,1,0,0,0,0|0,0,0]=1 16 B7R0.16 CC(C)[C@H](C(=O)O)N HAA1060 [0,1,0,0,0,0|0,0,0]=1 17 B7R0.16 C[C@@H]([C@@H](C(=O)O)N)O HAA1188 [0,1,0,0,0,0|1,0,0]=2 18 B7R0.16 C[C@@H]([C@H](C(=O)O)N)O HAA1053 [0,1,0,0,0,0|1,0,0]=2 19 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O HAA1166 [0,1,0,0,0,0|2,0,0]=3 20 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O HAA1131 [0,1,0,0,0,0|1,0,0]=2 21 B7R0.16 C[C@H]([C@H](C(=O)O)N)O HAA1187 [0,1,0,0,0,0|1,0,0]=2 22 B5R0.5 *[C@H](N)C(=O)O EZK9040 [0,0,0,0,1,0|2,0,0]=3 23 B5R0.5 C[C@@H](C(=O)N)N HAA5610 [0,0,0,0,1,0|2,0,0]=3 24 B5R0.5 C[C@@H](C(=O)O)N HAA1066 [0,0,0,0,1,0|1,0,0]=2 25 B5R0.5 C[C@H](C(=O)N)N HAA5520 [0,0,0,0,1,0|2,0,0]=3 26 B5R0.5 C[C@H](C(=O)O)N HAA1007 [0,0,0,0,1,0|1,0,0]=2 27 B7R0.6 CC(=O)NCC(=O)O AAA1915 [0,0,0,0,0,1|1,0,1]=3 28 B4R0.1 C(C(=O)N)N HAA6570 [2,0,0,0,0,0|2,0,0]=4 29 B4R0.1 CN(C)C=O SOL-004 [2,0,0,0,0,0|1,0,0]=3 30 B4R0.1 C[C@@H](CN)O FAL1033 [2,0,0,0,0,0|2,0,0]=4 31 B4R0.1 C[C@H](CO)N FAL1004 [2,0,0,0,0,0|1,0,0]=3 32 B4R0.2 COCCO S-30130 [2,0,0,0,0,0|1,0,1]=4 33 B4R0.2 COCCO S-30900 [2,0,0,0,0,0|1,0,1]=4 34 B6R0.1 CCOC(=O)CN HAA6590 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.1 CNCC(=O)OC HAA7240 [1,1,0,0,0,0|1,0,0]=3 36 B6R0.1 COC(=O)CCN HAA5560 [1,1,0,0,0,0|1,0,0]=3 37 B6R0.3 C(C(C(=O)O)N)N HAA7960 [1,1,0,0,0,0|1,0,0]=3 38 B6R0.3 C([C@@H](C(=O)O)N)N HAA1081 [1,1,0,0,0,0|1,0,0]=3 39 B6R0.3 C([C@@H](C(=O)O)N)O HAA1129 [1,1,0,0,0,0|1,0,0]=3 40 B6R0.3 C([C@@H](C(=O)O)N)S HAA1080 [1,1,0,0,0,0|1,0,0]=3 41 B6R0.3 C([C@@H](C(=O)O)O)N HAA1900 [1,1,0,0,0,0|1,0,0]=3 42 B6R0.3 C([C@H](C(=O)O)N)N HAA1019 [1,1,0,0,0,0|1,0,0]=3 43 B6R0.3 C([C@H](C(=O)O)N)O HAA1051 [1,1,0,0,0,0|1,0,0]=3 44 B6R0.3 C([C@H](C(=O)O)N)S HAA1017 [1,1,0,0,0,0|1,0,0]=3 45 B6R0.3 CC(C)[C@@H](CO)N FAL1018 [1,1,0,0,0,0|0,0,1]=3 46 B6R0.3 CC[C@@H](C(=O)O)N HAA1247 [1,1,0,0,0,0|0,0,0]=2 47 B6R0.3 CC[C@H](C(=O)O)N HAA1006 [1,1,0,0,0,0|0,0,0]=2 48 B6R0.3 C[C@@H](C(=O)O)NC HAA1206 [1,1,0,0,0,0|1,0,0]=3 49 B6R0.3 C[C@H](C(=O)O)NC HAA1193 [1,1,0,0,0,0|1,0,0]=3 50 B6R0.3 C[C@H]([C@@H](CO)N)O FAL1016 [1,1,0,0,0,0|1,0,1]=4 51 B6R0.4 C(CC(=O)O)CN HAA1061 [1,1,0,0,0,0|0,0,0]=2 52 B6R0.7 C(=O)(C(F)(F)F)O SOL-011 [0,1,0,0,1,0|2,0,0]=4 53 B6R0.7 CC(C)(C(=O)O)N HAA1511 [0,1,0,0,1,0|0,0,0]=2 54 B8R0.23 CC(=O)N(C)CC(=O)O PSR1200 [0,1,0,0,0,1|1,0,1]=4 55 B8R0.23 CC(=O)N(C)CC(=O)O PSR1210 [0,1,0,0,0,1|1,0,1]=4 56 B8R0.23 CC(=O)N(C)CC(=O)O PSR1220 [0,1,0,0,0,1|1,0,1]=4 57 B8R0.23 CC(=O)N(C)CC(=O)O PSR1230 [0,1,0,0,0,1|1,0,1]=4 58 B8R0.23 CC(C)C(CC(=O)O)N HAA2470 [0,1,0,0,0,1|0,0,0]=2 59 B8R0.23 CC(C)C(CC(=O)O)N HAA2660 [0,1,0,0,0,1|0,0,0]=2 60 B8R0.23 CC(C)C[C@@H](C(=O)N)N HAA6780 [0,1,0,0,0,1|1,0,0]=3 61 B8R0.23 CC(C)C[C@@H](C(=O)O)N HAA1094 [0,1,0,0,0,1|0,0,0]=2 62 B8R0.23 CC(C)C[C@H](C(=O)N)N HAA6280 [0,1,0,0,0,1|1,0,0]=3 63 B8R0.23 CC(C)C[C@H](C(=O)O)N HAA1030 [0,1,0,0,0,1|0,0,0]=2 64 B8R0.23 CC(C)[C@@H](CC(=O)O)N HAA8610 [0,1,0,0,0,1|0,0,0]=2 65 B8R0.23 CC(C)[C@H](CC(=O)O)N HAA8680 [0,1,0,0,0,1|0,0,0]=2 66 B8R0.23 CN(C)C[C@@H](C(=O)O)N HAA1690 [0,1,0,0,0,1|1,0,0]=3 67 B8R0.23 CN(C)C[C@H](C(=O)O)N HAA1695 [0,1,0,0,0,1|1,0,0]=3 68 B8R0.23 C[C@@H](C(=O)O)NC(=O)C AAA1911 [0,1,0,0,0,1|1,0,1]=4 69 B8R0.23 C[C@@H]([C@H](CC(=O)O)N)O HAA8580 [0,1,0,0,0,1|1,0,0]=3 70 B8R0.23 C[C@H](C(=O)O)NC(=O)C AAA1909 [0,1,0,0,0,1|1,0,1]=4 71 B8R0.2 CC(C)[C@@H](C(=O)OC)N HAA1144 [0,2,0,0,0,0|0,0,0]=2 72 B8R0.2 CC(C)[C@H](C(=O)OC)N HAA1559 [0,2,0,0,0,0|0,0,0]=2 73 B8R0.2 CC[C@@H](C)[C@@H](C(=O)O)N HAA1515 [0,2,0,0,0,0|0,0,0]=2 74 B8R0.2 CC[C@@H](C)[C@H](C(=O)O)N HAA1029 [0,2,0,0,0,0|0,0,0]=2 75 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N HAA1093 [0,2,0,0,0,0|0,0,0]=2 76 B8R0.2 CC[C@H](C)[C@H](C(=O)O)N HAA1186 [0,2,0,0,0,0|0,0,0]=2 77 B8R0.2 C[C@@H]([C@@H](C(=O)O)N)OC HAA1660 [0,2,0,0,0,0|0,0,0]=2 78 B8R0.2 C[C@H]([C@@H](C(=O)OC)N)O HAA1576 [0,2,0,0,0,0|1,0,0]=3 79 B8R0.2 C[C@H]([C@H](C(=O)O)N)OC HAA1665 [0,2,0,0,0,0|0,0,0]=2 80 B8R0.5 C=CCC(CC(=O)O)N HAA2515 [0,2,0,0,0,0|1,0,0]=3 81 B8R0.5 C=CCC(CC(=O)O)N HAA2705 [0,2,0,0,0,0|1,0,0]=3 82 B8R0.5 C=CC[C@@H](CC(=O)O)N HAA8700 [0,2,0,0,0,0|1,0,0]=3 83 B8R0.5 C=CC[C@H](CC(=O)O)N HAA8690 [0,2,0,0,0,0|1,0,0]=3 84 B8R0.5 CCCC(CC(=O)O)N HAA2445 [0,2,0,0,0,0|1,0,0]=3 85 B8R0.5 CCCC(CC(=O)O)N HAA2635 [0,2,0,0,0,0|1,0,0]=3 86 B8R0.24 CC(C)(C)OC(=O)CN HAA6610 [0,2,0,0,0,0|2,0,0]=4 87 B8R0.24 CC(C)(C)OC(=O)NO BAL1014 [0,2,0,0,0,0|1,0,0]=3 88 B8R0.34 CC(CC(=O)O)(C=C)N HAA2520 [0,2,0,0,0,0|0,0,1]=3 89 B8R0.34 CC(CC(=O)O)(C=C)N HAA2710 [0,2,0,0,0,0|0,0,1]=3 90 B8R0.34 CC(CC(=O)O)(CCl)N HAA2475 [0,2,0,0,0,0|0,0,0]=2 91 B8R0.34 CC(CC(=O)O)(CCl)N HAA2665 [0,2,0,0,0,0|0,0,0]=2 92 B8R0.27 CC(C)(C)[C@@H](C(=O)O)N HAA1134 [0,2,0,0,0,0|0,0,0]=2 93 B8R0.27 CC(C)(C)[C@H](C(=O)O)N HAA1514 [0,2,0,0,0,0|0,0,0]=2 94 B8R0.27 CC(C)([C@@H](C(=O)O)N)O HAA1640 [0,2,0,0,0,0|0,0,0]=2 95 B8R0.27 CC(C)([C@H](C(=O)O)N)O HAA1645 [0,2,0,0,0,0|0,0,0]=2 96 B8R0.18 CC(C)[C@@H](C(=O)O)NC HAA1222 [0,2,0,0,0,0|0,0,0]=2 97 B8R0.37 CC(C)[C@@](C)(C(=O)O)N HAA1549 [0,2,0,0,0,0|0,0,0]=2 98 B8R0.37 CC(C)[C@](C)(C(=O)O)N HAA5380 [0,2,0,0,0,0|0,0,0]=2 99 B8R0.28 CC(=O)NCCC(=O)O AAA1907 [0,0,0,0,0,2|1,0,1]=4