0 B8R0.9 COC(=O)CCC(=O)O CUR-0027389 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.4 C#CCNCC(=O)O CUR-0123529 [1,0,0,0,0,0|1,0,2]=4 2 B7R0.4 C(CCBr)CC(=O)O CUR-0103088 [1,0,0,0,0,0|1,0,1]=3 3 B7R0.4 C(CCN)CC(=O)O CUR-0018281 [1,0,0,0,0,0|1,0,1]=3 4 B7R0.4 C(CN=[N+]=[N-])C(=O)O CUR-0027706 [1,0,0,0,0,0|3,0,0]=4 5 B7R0.4 C=CCOCC(=O)O CUR-0014777 [1,0,0,0,0,0|1,0,0]=2 6 B7R0.6 C(CC(=O)O)C(=O)O CUR-0014664 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.6 CC(=O)CCC(=O)O CUR-0012941 [1,0,0,0,0,0|1,0,2]=4 8 B9R0.7 C(CC(=O)N)[C@@H](C(=O)O)N CUR-0100985 [0,1,0,0,0,0|2,0,0]=3 9 B9R0.7 C(CC(=O)O)C(=O)C(=O)O CUR-0017496 [0,1,0,0,0,0|2,0,1]=4 10 B9R0.7 C(CC(=O)O)[C@@H](C(=O)O)N CUR-0013957 [0,1,0,0,0,0|1,0,0]=2 11 B9R1.35 C1C(CNC1C(=O)O)O CUR-0100797 [0,0,0,1,0,0|2,0,1]=4 12 B9R1.35 C1[C@@H](CN[C@@H]1C(=O)O)O CUR-0003674 [0,0,0,1,0,0|2,0,1]=4 13 B9R1.35 C1[C@H](CN[C@@H]1C(=O)O)O CUR-0013245 [0,0,0,1,0,0|2,0,1]=4 14 B7R0.2 CCC(C)CC(=O)O CUR-0101758 [0,0,0,0,1,0|1,0,2]=4 15 B6R0.4 C(CC(=O)Cl)CBr CUR-0103177 [2,0,0,0,0,0|2,0,0]=4 16 B6R0.4 C(CC(=O)Cl)CCl CUR-0020663 [2,0,0,0,0,0|2,0,0]=4 17 B6R0.4 C(CC(=O)O)CN CUR-0010241 [2,0,0,0,0,0|0,0,0]=2 18 B6R0.4 C(CNC(=O)N)N CUR-0013187 [2,0,0,0,0,0|2,0,0]=4 19 B6R0.4 C=CCCC(=O)O CUR-0101586 [2,0,0,0,0,0|0,0,0]=2 20 B6R0.4 CC(=O)CCCCl CUR-0004280 [2,0,0,0,0,0|2,0,0]=4 21 B6R0.4 CCCCC(=O)C CUR-0101595 [2,0,0,0,0,0|1,0,1]=4 22 B6R0.4 CCCCC(=O)Cl CUR-0101805 [2,0,0,0,0,0|1,0,1]=4 23 B6R0.4 CCCCC(=O)O CUR-0101620 [2,0,0,0,0,0|0,0,1]=3 24 B6R0.4 CCOCC(=O)O CUR-0101637 [2,0,0,0,0,0|1,0,1]=4 25 B6R0.4 COCCC(=O)O CUR-0012995 [2,0,0,0,0,0|1,0,1]=4 26 B6R0.6 C(CC=O)CC=O CUR-0101590 [2,0,0,0,0,0|1,0,0]=3 27 B6R0.6 C=CCNCC=C CUR-0101567 [2,0,0,0,0,0|2,0,0]=4 28 B8R0.7 C(CCC(=O)O)CCBr CUR-0101245 [1,1,0,0,0,0|0,0,2]=4 29 B8R0.7 C(CCC(=O)O)CCN CUR-0025350 [1,1,0,0,0,0|0,0,2]=4 30 B8R0.7 C(CCC(=O)O)CCN CUR-0101191 [1,1,0,0,0,0|0,0,2]=4 31 B8R0.7 C(CNCC(=O)O)C#N CUR-0008959 [1,1,0,0,0,0|1,0,1]=4 32 B8R0.7 CCCCCCC(=O)O CUR-0013258 [1,1,0,0,0,0|0,0,2]=4 33 B8R0.28 C(C(=O)O)NCC(=O)O CUR-0102003 [1,1,0,0,0,0|2,0,0]=4 34 B8R0.28 C(C(=O)O)SCC(=O)O CUR-0008007 [1,1,0,0,0,0|2,0,0]=4 35 B8R0.28 C(CC(=O)O)CC(=O)O CUR-0012316 [1,1,0,0,0,0|1,0,0]=3 36 B8R0.23 C([C@@H](C(=O)O)N)C(=O)N CUR-0101987 [1,1,0,0,0,0|1,0,1]=4 37 B8R0.23 CC(C)CC(C(=O)O)N CUR-0101977 [1,1,0,0,0,0|1,0,1]=4 38 B8R0.23 CC(C)C[C@H](C(=O)O)N CUR-0101976 [1,1,0,0,0,0|1,0,1]=4 39 B8R0.29 C(CC(F)(F)F)C(=O)O CUR-0102178 [1,1,0,0,0,0|2,0,0]=4 40 B8R1.1 C1CC(=O)NC1CN CUR-0094491 [1,0,0,1,0,0|1,0,1]=4 41 B8R1.1 C1CC(=O)NC1CO CUR-0028114 [1,0,0,1,0,0|1,0,1]=4 42 B8R1.3 C1CC(=O)NCC1N CUR-0023298 [1,0,0,1,0,0|1,0,1]=4 43 B8R1.3 C1CC(=O)NCC1N CUR-0094615 [1,0,0,1,0,0|1,0,1]=4 44 B8R1.4 C1CC(=O)CC(=O)C1 CUR-0019886 [1,0,0,1,0,0|2,0,0]=4 45 B8R1.4 C1CC(=O)OC(=O)C1 CUR-0009916 [1,0,0,1,0,0|1,0,0]=3 46 B8R1.7 C1C=CCC1C(=O)O CUR-0017055 [1,0,0,1,0,0|0,0,2]=4 47 B8R1.7 C1CC(NC1)C(=O)O CUR-0028986 [1,0,0,1,0,0|1,0,1]=4 48 B8R1.7 C1CC(OC1)C(=O)O CUR-0016168 [1,0,0,1,0,0|1,0,1]=4 49 B8R1.7 C1CCC(C1)C(=O)O CUR-0019739 [1,0,0,1,0,0|0,0,2]=4 50 B8R1.7 C1COCC1C(=O)O CUR-0024198 [1,0,0,1,0,0|1,0,1]=4 51 B8R1.7 C1C[C@@H](NC1)C(=O)O CUR-0100756 [1,0,0,1,0,0|1,0,1]=4 52 B8R1.7 C1C[C@H](NC1)C(=O)O CUR-0101268 [1,0,0,1,0,0|1,0,1]=4 53 B10R1.25 CNC1CCC(=O)NC1=O CUR-0122167 [0,1,0,1,0,0|2,0,0]=4 54 B10R1.25 CNC1CCC(=O)NC1=O CUR-0153412 [0,1,0,1,0,0|2,0,0]=4 55 B10R1.66 c1c(ncs1)CCC(=O)O CUR-0002570 [0,1,0,1,0,0|0,0,2]=4 56 B10R1.66 c1cc(oc1)CCC(=O)O CUR-0011478 [0,1,0,1,0,0|1,0,1]=4 57 B10R1.66 c1cn(cn1)CCC(=O)O CUR-0096432 [0,1,0,1,0,0|1,0,1]=4 58 B10R1.66 c1cnn(c1)CCC(=O)O CUR-0079520 [0,1,0,1,0,0|1,0,1]=4 59 B10R1.66 c1cscc1CCC(=O)O CUR-0000666 [0,1,0,1,0,0|1,0,1]=4 60 B10R1.66 c1ncn(n1)CCC(=O)O CUR-0099680 [0,1,0,1,0,0|1,0,1]=4 61 B6R0.2 CC(C)CC(=O)O CUR-0017645 [1,0,0,0,1,0|1,0,1]=4 62 B6R0.3 C(C(C(=O)O)N)O CUR-0101646 [0,0,0,0,2,0|1,0,1]=4 63 B6R0.3 C(C(C(=O)O)N)S CUR-0101261 [0,0,0,0,2,0|1,0,1]=4 64 B6R0.3 C([C@@H](C(=O)O)N)O CUR-0101109 [0,0,0,0,2,0|1,0,1]=4 65 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0004971 [0,0,0,0,2,0|1,0,1]=4 66 B6R0.3 C([C@@H](C(=O)O)N)S CUR-0101810 [0,0,0,0,2,0|1,0,1]=4 67 B6R0.3 CCC(C(=O)O)N CUR-0010659 [0,0,0,0,2,0|0,0,2]=4