0 B10R0.92 CP(=O)(O)CCC(N)C(=O)O 8174-1-00 [0,1,0,0,0,0|2,0,0]=3 1 B10R0.92 NC(CCC(F)(F)F)C(=O)O 4157-3-13 [0,1,0,0,0,0|3,0,0]=4 2 B10R0.93 NC(CC(F)C(=O)O)C(=O)O 4157-3-08 [0,1,0,0,0,0|3,0,0]=4 3 B10R1.13 CC1CCC(C(=O)O)CC1 2221-1-0A [0,0,0,1,0,0|2,0,0]=3 4 B10R1.13 CN1CCC(C(=O)O)CC1 4H21-5-Z0 [0,0,0,1,0,0|2,0,0]=3 5 B10R1.13 CN1CCC(C(=O)O)CC1 P311-A-68 [0,0,0,1,0,0|2,0,0]=3 6 B10R1.13 NC1CCC(C(=O)O)CC1 4257-1-03 [0,0,0,1,0,0|3,0,0]=4 7 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 4257-1-05 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 G311-A-62 [0,0,0,1,0,0|3,0,0]=4 9 B10R1.13 O=C1CCC(C(=O)O)CC1 2H29-1-01 [0,0,0,1,0,0|3,0,0]=4 10 B8R0.23 CC(C)C[C@H](O)C(=O)O 2129-1-SB [0,0,0,0,1,0|2,0,0]=3 11 B7R0.4 C#CCCCC(=O)O 2521-1-X0 [2,0,0,0,0,0|1,0,1]=4 12 B7R0.4 CCCCCC(=O)Cl 2116-5-11 [2,0,0,0,0,0|2,0,0]=4 13 B7R0.4 NCCCCC(=O)O 4157-1-37 [2,0,0,0,0,0|2,0,0]=4 14 B7R0.4 O=C(O)CCCCBr 2121-9-X2 [2,0,0,0,0,0|2,0,0]=4 15 B7R0.5 C=CC[C@H](N)C(=O)O 4357-1-X0 [2,0,0,0,0,0|0,0,2]=4 16 B7R0.5 CCC[C@H](N)C(=O)O 4157-1-SN [2,0,0,0,0,0|0,0,0]=2 17 B7R0.5 COCC(Cl)C(=O)O 2121-5-X1 [2,0,0,0,0,0|1,1,0]=4 18 B7R0.5 COC[C@H](N)C(=O)O 4157-5-S0 [2,0,0,0,0,0|0,1,0]=3 19 B7R0.5 N[C@@H](CCO)C(=O)O 4157-1-SQ [2,0,0,0,0,0|0,1,0]=3 20 B9R0.8 CCCCC(N)C(=O)OC 4157-5-03 [1,1,0,0,0,0|1,0,0]=3 21 B9R0.8 COC(=O)C(N)CCSC 8166-5-03 [1,1,0,0,0,0|0,0,1]=3 22 B9R0.42 COC(=O)C[C@H](N)C(=O)O 4157-5-S2 [1,1,0,0,0,0|0,1,1]=4 23 B9R0.47 NCCCC[C@H](N)C(=O)O 4157-1-S6 [1,1,0,0,0,0|1,0,0]=3 24 B9R0.47 NCCCC[C@H](N)C(=O)O 4157-1-X0 [1,1,0,0,0,0|1,0,0]=3 25 B9R0.51 CCCCC(C)(C)C(=O)O 2121-1-11 [1,1,0,0,0,0|2,0,0]=4 26 B9R0.51 CCCCC(F)(F)C(=O)O 2121-3-96 [1,1,0,0,0,0|2,0,0]=4 27 B9R0.1 COC(=O)CCCC(C)=O 2129-1-1R [1,1,0,0,0,0|2,0,0]=4 28 B11R0.120 COC(=O)CC[C@@H](N)C(=O)OC 4158-5-RE [0,2,0,0,0,0|2,0,0]=4 29 B9R1.6 O=C(O)C1CCCCN1 4H57-1-W5 [1,0,0,1,0,0|1,0,0]=3 30 B9R1.6 O=C(O)C1CCCCN1 4H58-5-BW [1,0,0,1,0,0|1,0,0]=3 31 B9R1.6 O=C(O)C1CCNCC1 4257-1-14 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.6 O=C(O)C1CCOCC1 P911-A-47 [1,0,0,1,0,0|1,1,0]=4 33 B9R1.6 O=C(O)C1CSCCN1 8H21-1-Y5 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.6 O=C(O)[C@@H]1CNCCN1 4H21-1-S2 [1,0,0,1,0,0|2,0,0]=4 35 B9R1.6 O=C(O)[C@@H]1CNCCN1 G311-A-13 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.6 O=C(O)[C@H]1CCCCN1 4H58-1-RE [1,0,0,1,0,0|1,0,0]=3 37 B9R1.6 O=C(O)[C@H]1CNCCN1 4H21-5-Z4 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.6 O=C(O)[C@H]1COCCN1 4H58-5-R9 [1,0,0,1,0,0|2,0,0]=4 39 B9R1.35 CN1CCC(C(=O)O)C1 4H58-1-E4 [1,0,0,1,0,0|2,0,0]=4 40 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 4H56-1-5D [1,0,0,1,0,0|2,0,0]=4 41 B9R1.35 O=C1CC[C@H](C(=O)O)N1 4H57-1-R1 [1,0,0,1,0,0|2,0,0]=4 42 B9R1.110 NC(C(=O)O)C1CCC1 4257-1-07 [1,0,0,1,0,0|1,0,0]=3 43 B9R1.164 CC1(C)CC(C(=O)O)C1 2221-1-27 [0,0,0,1,1,0|2,0,0]=4 44 B11R1.20 CN1CCC(CC(=O)O)CC1 4H58-1-D1 [0,0,0,1,0,1|2,0,0]=4 45 B11R1.20 CN1CCC(CC(=O)O)CC1 4H58-5-08 [0,0,0,1,0,1|2,0,0]=4 46 B11R1.3 NC[C@H]1CC[C@H](C(=O)O)CC1 4257-1-18 [0,1,0,1,0,0|2,0,0]=4 47 B7R0.16 CC(C)[C@H](O)C(=O)O 2129-1-S3 [0,0,0,0,2,0|2,0,0]=4 48 B7R0.16 CC(F)C(N)C(=O)O 4157-3-20 [0,0,0,0,2,0|2,0,0]=4 49 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O 4157-1-35 [0,0,0,0,2,0|2,0,0]=4 50 B9R0.55 CC(=O)CCCCC(=O)O 2121-1-X0 [1,0,0,0,0,1|2,0,0]=4 51 B9R0.55 CN(C)CCCCC(=O)O 4133-5-02 [1,0,0,0,0,1|1,0,0]=3