0 B11R0.29 CC(=N)NCCC[C@H](N)C(=O)O Molport-003-983-778 [0,0,0,0,0,0|0,0,0]=0 1 B11R0.29 CC(=O)NCSC[C@H](N)C(=O)O Molport-003-925-051 [0,0,0,0,0,0|2,0,0]=2 2 B11R0.29 N=C(N)NOCC[C@H](N)C(=O)O Molport-003-939-378 [0,0,0,0,0,0|2,0,0]=2 3 B11R0.29 NC(=[NH2+])NCCCC(N)C(=O)O Molport-051-608-281 [0,0,0,0,0,0|1,0,1]=2 4 B11R0.29 N[C@@H](CSCCC(=O)O)C(=O)O Molport-006-115-870 [0,0,0,0,0,0|4,0,0]=4 5 B10R0.97 CN(C)CCCCCC(=O)O Molport-021-073-625 [1,0,0,0,0,0|3,0,0]=4 6 B10R0.97 CN(C)CCCCCC(=O)O Molport-046-163-493 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.97 N=C(N)NCCCCC(=O)O Molport-023-292-388 [1,0,0,0,0,0|1,0,0]=2 8 B10R0.97 N=C(N)SCCCCC(=O)O Molport-003-054-798 [1,0,0,0,0,0|2,0,0]=3 9 B10R0.97 NC(=O)NCCCCC(=O)O Molport-001-729-022 [1,0,0,0,0,0|1,0,1]=3 10 B10R0.97 NC(=[NH2+])SCCCCC(=O)O Molport-000-642-823 [1,0,0,0,0,0|2,0,1]=4 11 B12R0.186 C/N=C(\N)/NCCCC(N)C(=O)O Molport-044-724-215 [0,1,0,0,0,0|0,0,1]=2 12 B12R0.186 C/N=C(\N)/NCCC[C@H](N)C(=O)O Molport-019-996-261 [0,1,0,0,0,0|0,0,1]=2 13 B12R0.186 CNC(=N)NCCC[C@@H](N)C(=O)O Molport-003-958-819 [0,1,0,0,0,0|0,0,0]=1 14 B12R0.186 CNC(=N)NCCC[C@H](N)C(=O)O Molport-044-183-538 [0,1,0,0,0,0|0,0,0]=1 15 B12R0.186 CSC(=N)NCCC[C@H](N)C(=O)O Molport-004-963-433 [0,1,0,0,0,0|0,0,0]=1 16 B12R0.186 N=C(NN)NCCC[C@H](N)C(=O)O Molport-039-139-148 [0,1,0,0,0,0|1,0,0]=2 17 B12R1.258 CC(=O)N1CCCC(C1)C(=O)O Molport-002-469-883 [0,0,0,1,0,0|2,0,0]=3 18 B12R1.258 CC(C)N1CCCC(C1)C(=O)O Molport-003-991-470 [0,0,0,1,0,0|2,0,1]=4 19 B12R1.258 NC(=O)N1CCCC(C1)C(=O)O Molport-001-769-010 [0,0,0,1,0,0|2,0,1]=4 20 B10R0.98 CC(=O)OCC[C@H](N)C(=O)O Molport-003-844-403 [0,0,0,0,1,0|2,0,0]=3 21 B10R0.98 CC(C)CCC[C@H](N)C(=O)O Molport-023-332-999 [0,0,0,0,1,0|1,0,1]=3 22 B10R0.98 NC(CCCC(=O)O)C(=O)O Molport-035-944-984 [0,0,0,0,1,0|2,0,0]=3 23 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-006-013-457 [0,0,0,0,1,0|3,0,0]=4 24 B10R0.98 NC(CSCC(=O)O)C(=O)O Molport-019-997-772 [0,0,0,0,1,0|3,0,0]=4 25 B10R0.98 O=C(O)CCCC(O)C(=O)O Molport-023-333-797 [0,0,0,0,1,0|3,0,0]=4 26 B12R0.42 CC(=N)NCCCC[C@H](N)C(=O)O Molport-003-983-777 [0,0,0,0,0,1|0,0,0]=1 27 B12R0.42 CC(=O)NCCCCC(N)C(=O)O Molport-002-893-879 [0,0,0,0,0,1|1,0,0]=2 28 B12R0.42 CC(=O)NCCCC[C@H](N)C(=O)O Molport-035-785-371 [0,0,0,0,0,1|1,0,0]=2 29 B12R0.42 N[C@@H](CSCCCC(=O)O)C(=O)O Molport-046-689-011 [0,0,0,0,0,1|3,0,0]=4 30 B9R0.2 CNCCCCCC(=O)O Molport-044-559-563 [2,0,0,0,0,0|2,0,0]=4 31 B9R0.47 C=CCSC[C@@H](N)C(=O)O Molport-003-666-562 [2,0,0,0,0,0|1,0,1]=4 32 B9R0.47 CCNCCC(N)C(=O)O Molport-008-322-976 [2,0,0,0,0,0|0,0,1]=3 33 B9R0.47 CCSCCC(N)C(=O)O Molport-001-788-344 [2,0,0,0,0,0|1,0,1]=4 34 B9R0.47 CCSCCC(N)C(=O)O Molport-035-946-619 [2,0,0,0,0,0|1,0,1]=4 35 B9R0.47 NC(CCCC[NH3+])C(=O)O Molport-051-608-280 [2,0,0,0,0,0|0,0,2]=4 36 B9R0.47 NCCCCC(N)C(=O)O Molport-004-963-510 [2,0,0,0,0,0|0,0,2]=4 37 B9R0.47 NCCCC[C@@H](N)C(=O)O Molport-003-937-842 [2,0,0,0,0,0|0,0,2]=4 38 B9R0.47 N[C@@H](CCCNO)C(=O)O Molport-042-668-512 [2,0,0,0,0,0|1,0,0]=3 39 B11R0.42 CCCCCCCC(N)C(=O)O Molport-002-510-603 [1,1,0,0,0,0|1,0,1]=4 40 B11R0.6 CC(=CCCC(C)CC(=O)O)C Molport-001-792-025 [1,1,0,0,0,0|2,0,0]=4 41 B13R0.204 CCC(=O)NCCCC[C@H](N)C(=O)O Molport-039-140-941 [0,1,0,0,0,1|1,0,0]=3 42 B13R0.353 CN(C)C(=N)NCCC[C@H](N)C(=O)O Molport-006-823-010 [0,1,0,0,0,1|2,0,0]=4 43 B13R0.91 C=CCC(=N)NCCC[C@H](N)C(=O)O Molport-009-018-783 [0,2,0,0,0,0|0,0,0]=2 44 B11R1.35 NC(CC1=CNC=N1)C(=O)O Molport-001-779-923 [1,0,0,1,0,0|0,0,2]=4 45 B11R1.35 NC(CC1=CNC=N1)C(=O)O Molport-003-983-035 [1,0,0,1,0,0|0,0,2]=4 46 B11R1.36 CC(C(=O)O)C1CCNCC1 Molport-016-583-186 [1,0,0,1,0,0|1,0,1]=4 47 B11R1.36 NC(C(=O)O)C1CCCCC1 Molport-002-903-974 [1,0,0,1,0,0|1,0,1]=4 48 B11R1.36 N[C@@H](C(=O)O)C1CCOCC1 Molport-002-499-454 [1,0,0,1,0,0|1,0,1]=4 49 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 Molport-000-000-500 [1,0,0,1,0,0|1,0,1]=4 50 B11R1.497 O=C1CCCCC(N1)C(=O)O Molport-020-167-138 [1,0,0,1,0,0|2,0,0]=4 51 B11R1.737 NC1(CCCCCC1)C(=O)O Molport-000-000-293 [1,0,0,1,0,0|1,0,1]=4 52 B11R1.157 O=C(O)CN1CCNC(=O)C1 Molport-000-148-445 [1,0,0,1,0,0|2,0,0]=4 53 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-000-144-437 [1,0,0,1,0,0|1,0,0]=3 54 B11R1.178 CC(=O)N1CCCC1C(=O)O Molport-003-700-719 [1,0,0,1,0,0|1,0,0]=3 55 B11R1.178 CC(=O)N1CSC[C@H]1C(=O)O Molport-006-130-393 [1,0,0,1,0,0|2,0,0]=4 56 B11R1.178 NC(=O)N1CCCC1C(=O)O Molport-002-464-038 [1,0,0,1,0,0|1,0,1]=4 57 B13R1.543 CCC(=O)N1CCCC(C1)C(=O)O Molport-003-739-807 [0,1,0,1,0,0|2,0,0]=4 58 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Molport-046-925-996 [0,0,0,0,2,0|2,0,0]=4 59 B9R0.7 NC(=O)CC[C@H]([15NH2])C(=O)O Molport-003-934-621 [0,0,0,0,2,0|1,0,1]=4 60 B9R0.7 NC(CCC(=O)O)C(=O)O Molport-002-130-089 [0,0,0,0,2,0|2,0,0]=4 61 B9R0.7 N[C@@H](CCC(=O)[15NH2])C(=O)O Molport-003-934-620 [0,0,0,0,2,0|1,0,1]=4 62 B9R0.7 N[C@@H](CCC(=O)[O-])C(=O)O Molport-001-795-061 [0,0,0,0,2,0|2,0,0]=4 63 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(=O)O Molport-042-682-386 [0,0,0,0,2,0|1,0,1]=4 64 B11R0.30 CC(=O)NCCCCNC(=O)C Molport-019-107-672 [1,0,0,0,0,1|2,0,0]=4 65 B13R0.180 CC(=N)NCCSCC[C@H](N)C(=O)O Molport-046-418-010 [0,0,0,0,0,2|0,0,0]=2 66 B13R0.180 CC(=N)NCCSCC[C@H](N)C(=O)O Molport-047-156-049 [0,0,0,0,0,2|0,0,0]=2