0 B5R0.3 CNC(=O)CN HAA6580 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 COC(=O)CN HAA5530 [0,0,0,0,0,0|2,0,1]=3 2 B4R0.1 C(C(=O)N)N HAA6570 [1,0,0,0,0,0|2,0,1]=4 3 B4R0.1 CN(C)C=O SOL-004 [1,0,0,0,0,0|2,0,1]=4 4 B4R0.1 C[C@@H](CN)O FAL1033 [1,0,0,0,0,0|1,0,0]=2 5 B4R0.1 C[C@H](CO)N FAL1004 [1,0,0,0,0,0|1,0,0]=2 6 B4R0.2 CCOCC SOL-005 [1,0,0,0,0,0|2,0,0]=3 7 B4R0.2 COCCBr S-30131 [1,0,0,0,0,0|2,0,0]=3 8 B4R0.2 COCCBr S-30901 [1,0,0,0,0,0|2,0,0]=3 9 B4R0.2 COCCN HL12132 [1,0,0,0,0,0|1,0,0]=2 10 B4R0.2 COCCN HL12902 [1,0,0,0,0,0|1,0,0]=2 11 B4R0.2 COCCO S-30130 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.2 COCCO S-30900 [1,0,0,0,0,0|2,0,0]=3 13 B4R0.2 COCCS HL12134 [1,0,0,0,0,0|2,0,0]=3 14 B4R0.2 COCCS HL12904 [1,0,0,0,0,0|2,0,0]=3 15 B6R0.1 CCOC(=O)CN HAA6590 [0,1,0,0,0,0|1,0,1]=3 16 B6R0.1 CNCC(=O)OC HAA7240 [0,1,0,0,0,0|2,0,1]=4 17 B6R0.1 COC(=O)CCN HAA5560 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.3 C(C(C(=O)O)N)N HAA7960 [0,1,0,0,0,0|2,0,1]=4 19 B6R0.3 C([C@@H](C(=O)O)N)N HAA1081 [0,1,0,0,0,0|2,0,1]=4 20 B6R0.3 C([C@@H](C(=O)O)O)N HAA1900 [0,1,0,0,0,0|2,0,1]=4 21 B6R0.3 C([C@H](C(=O)O)N)N HAA1019 [0,1,0,0,0,0|2,0,1]=4 22 B6R0.3 CC(C)[C@@H](CO)N FAL1018 [0,1,0,0,0,0|2,0,0]=3 23 B6R0.3 CC[C@@H](C(=O)O)N HAA1247 [0,1,0,0,0,0|2,0,1]=4 24 B6R0.3 CC[C@H](C(=O)O)N HAA1006 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.3 C[C@@H](C(=O)O)NC HAA1206 [0,1,0,0,0,0|2,0,1]=4 26 B6R0.3 C[C@@H](C(=O)OC)N HAA1067 [0,1,0,0,0,0|2,0,1]=4 27 B6R0.3 C[C@H](C(=O)O)NC HAA1193 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.3 C[C@H](C(=O)OC)N HAA5580 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.3 C[C@H]([C@@H](CO)N)O FAL1016 [0,1,0,0,0,0|2,0,0]=3 30 B3R0.1 C#CCN PEG2755 [2,0,0,0,0,0|0,0,2]=4 31 B3R0.1 C(CO)N HAL1020 [2,0,0,0,0,0|1,0,0]=3 32 B3R0.1 C(CS)N HAL1551 [2,0,0,0,0,0|1,0,0]=3 33 B3R0.1 C(CS)S RL-1097 [2,0,0,0,0,0|2,0,0]=4 34 B5R0.1 C(CN)C(=O)N HAA5550 [1,1,0,0,0,0|1,0,1]=4 35 B5R0.1 CNCC(=O)N HAA1581 [1,1,0,0,0,0|1,0,1]=4 36 B5R0.5 C[C@@H](C(=O)N)N HAA5610 [1,1,0,0,0,0|1,0,1]=4 37 B5R0.5 C[C@@H](C(=O)O)N HAA1066 [1,1,0,0,0,0|1,0,1]=4 38 B5R0.5 C[C@H](C(=O)N)N HAA5520 [1,1,0,0,0,0|1,0,1]=4 39 B5R0.5 C[C@H](C(=O)O)N HAA1007 [1,1,0,0,0,0|1,0,1]=4 40 B5R0.2 C(CCN)CN HNN1070 [1,1,0,0,0,0|0,0,0]=2 41 B5R0.2 C(CCN)CN HNN1080 [1,1,0,0,0,0|0,0,0]=2 42 B7R0.2 CC(C)C[C@@H](CO)N FAL1011 [0,2,0,0,0,0|2,0,0]=4 43 B7R0.2 CC(C)C[C@H](CO)N FAL1005 [0,2,0,0,0,0|2,0,0]=4 44 B7R0.3 CSCC[C@H](CO)N FAL1006 [0,2,0,0,0,0|2,0,0]=4 45 B7R0.5 CCOC(=O)[C@H](C)N HAA5630 [0,2,0,0,0,0|1,0,1]=4 46 B7R0.10 C([C@@H]([C@H](CS)O)O)S RL-1103 [0,2,0,0,0,0|2,0,0]=4 47 B7R0.10 C([C@H]([C@@H](CS)O)O)S RL-1020 [0,2,0,0,0,0|2,0,0]=4 48 B7R0.10 C([C@H]([C@@H](CS)O)O)S RL-1167 [0,2,0,0,0,0|2,0,0]=4 49 B7R0.10 C([C@H]([C@H](CS)O)O)S RL-1019 [0,2,0,0,0,0|2,0,0]=4 50 B7R0.10 CC[C@H](C)[C@@H](CO)N FAL1026 [0,2,0,0,0,0|0,0,0]=2 51 B7R0.13 CC[C@@](C)(C(=O)O)N HAA5270 [0,2,0,0,0,0|1,0,1]=4 52 B7R0.13 CC[C@](C)(C(=O)O)N HAA5260 [0,2,0,0,0,0|1,0,1]=4 53 B7R0.16 CC(C)[C@@H](C(=O)N)N HAA7500 [0,2,0,0,0,0|1,0,1]=4 54 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O HAA1166 [0,2,0,0,0,0|1,0,1]=4 55 B7R1.1 C1C[C@@H](NC1)CO HAL1025 [0,1,0,1,0,0|1,0,0]=3 56 B7R1.1 C1C[C@H](NC1)CO FAL1015 [0,1,0,1,0,0|1,0,0]=3 57 B7R1.3 CC1CCNCC1 RL-2003 [0,1,0,1,0,0|0,0,0]=2 58 B7R1.4 C1COC(=O)[C@@H]1N HAA1538 [0,1,0,1,0,0|1,0,1]=4 59 B7R1.4 C1COC(=O)[C@H]1N HAA1543 [0,1,0,1,0,0|1,0,1]=4