0 B4R0.2 CCOCC SOL-005 [0,0,0,0,0,0|2,0,0]=2 1 B4R0.2 COCCBr S-30131 [0,0,0,0,0,0|2,0,0]=2 2 B4R0.2 COCCBr S-30901 [0,0,0,0,0,0|2,0,0]=2 3 B4R0.2 COCCN HL12132 [0,0,0,0,0,0|2,0,0]=2 4 B4R0.2 COCCN HL12902 [0,0,0,0,0,0|2,0,0]=2 5 B4R0.2 COCCO S-30130 [0,0,0,0,0,0|1,0,0]=1 6 B4R0.2 COCCO S-30900 [0,0,0,0,0,0|1,0,0]=1 7 B4R0.2 COCCS HL12134 [0,0,0,0,0,0|1,1,0]=2 8 B4R0.2 COCCS HL12904 [0,0,0,0,0,0|1,1,0]=2 9 B3R0.1 C#CCN PEG2755 [1,0,0,0,0,0|1,0,2]=4 10 B3R0.1 C(CO)N HAL1020 [1,0,0,0,0,0|1,0,0]=2 11 B3R0.1 C(CS)N HAL1551 [1,0,0,0,0,0|1,1,0]=3 12 B3R0.1 C(CS)S RL-1097 [1,0,0,0,0,0|1,1,0]=3 13 B5R0.1 C(CN)C(=O)N HAA5550 [0,1,0,0,0,0|1,0,2]=4 14 B5R0.1 C(CN)C(=O)O HAA1003 [0,1,0,0,0,0|1,0,1]=3 15 B5R0.1 C(CS)C(=O)O RL-1000 [0,1,0,0,0,0|1,0,1]=3 16 B5R0.1 CNCC(=O)N HAA1581 [0,1,0,0,0,0|1,0,2]=4 17 B5R0.1 CNCC(=O)O HAA1192 [0,1,0,0,0,0|1,0,1]=3 18 B5R0.2 C(CCN)CN HNN1070 [0,1,0,0,0,0|1,0,0]=2 19 B5R0.2 C(CCN)CN HNN1080 [0,1,0,0,0,0|1,0,0]=2 20 B5R0.3 CNC(=O)CN HAA6580 [0,1,0,0,0,0|2,0,1]=4 21 B5R0.3 COC(=O)CN HAA5530 [0,1,0,0,0,0|2,0,1]=4 22 B2R0.1 C(Cl)Cl SOL-002 [2,0,0,0,0,0|2,0,0]=4 23 B2R0.1 CC#N SOL-013 [2,0,0,0,0,0|1,0,1]=4 24 B2R0.1 CSC RL-1098 [2,0,0,0,0,0|1,0,0]=3 25 B4R0.1 C[C@@H](CN)O FAL1033 [1,1,0,0,0,0|1,0,0]=3 26 B4R0.1 C[C@H](CO)N FAL1004 [1,1,0,0,0,0|0,0,0]=2 27 B6R0.1 CCOC(=O)CN HAA6590 [0,2,0,0,0,0|1,0,1]=4 28 B6R0.1 CNCC(=O)OC HAA7240 [0,2,0,0,0,0|1,0,1]=4 29 B6R0.1 COC(=O)CCN HAA5560 [0,2,0,0,0,0|1,0,1]=4 30 B6R0.2 *[C@@H](C)CC(=O)* EZK9050 [0,2,0,0,0,0|0,0,2]=4 31 B6R0.2 C[C@@H](CC(=O)O)N HAA8470 [0,2,0,0,0,0|0,0,1]=3 32 B6R0.2 C[C@H](CC(=O)O)N HAA8430 [0,2,0,0,0,0|0,0,1]=3 33 B6R0.3 C(C(C(=O)O)N)N HAA7960 [0,2,0,0,0,0|1,0,1]=4 34 B6R0.3 C([C@@H](C(=O)O)N)N HAA1081 [0,2,0,0,0,0|1,0,1]=4 35 B6R0.3 C([C@@H](C(=O)O)N)O HAA1129 [0,2,0,0,0,0|1,0,1]=4 36 B6R0.3 C([C@@H](C(=O)O)N)S HAA1080 [0,2,0,0,0,0|1,0,1]=4 37 B6R0.3 C([C@@H](C(=O)O)O)N HAA1900 [0,2,0,0,0,0|1,0,1]=4 38 B6R0.3 C([C@H](C(=O)O)N)N HAA1019 [0,2,0,0,0,0|1,0,1]=4 39 B6R0.3 C([C@H](C(=O)O)N)O HAA1051 [0,2,0,0,0,0|1,0,1]=4 40 B6R0.3 C([C@H](C(=O)O)N)S HAA1017 [0,2,0,0,0,0|1,0,1]=4 41 B6R0.3 CC(C)[C@@H](CO)N FAL1018 [0,2,0,0,0,0|0,0,0]=2 42 B6R0.3 CC[C@@H](C(=O)O)N HAA1247 [0,2,0,0,0,0|0,0,1]=3 43 B6R0.3 CC[C@H](C(=O)O)N HAA1006 [0,2,0,0,0,0|0,0,1]=3 44 B6R0.3 C[C@@H](C(=O)O)NC HAA1206 [0,2,0,0,0,0|1,0,1]=4 45 B6R0.3 C[C@H](C(=O)O)NC HAA1193 [0,2,0,0,0,0|1,0,1]=4 46 B6R0.3 C[C@H]([C@@H](CO)N)O FAL1016 [0,2,0,0,0,0|0,0,0]=2 47 B6R0.4 C(CC(=O)O)CN HAA1061 [0,2,0,0,0,0|0,0,1]=3 48 B6R0.6 C(CCN)CCO FAL1003 [0,2,0,0,0,0|0,0,0]=2 49 B6R0.6 C(COCCS)O PEG5450 [0,2,0,0,0,0|0,0,0]=2 50 B6R0.6 C(COCCS)O PEG5460 [0,2,0,0,0,0|0,0,0]=2 51 B6R0.6 C(COCCS)O PEG5470 [0,2,0,0,0,0|0,0,0]=2 52 B6R1.1 C1CCNCC1 SOL-010 [0,1,0,1,0,0|1,0,0]=3