0 B11R1.645 NC(=O)CN1CC(CC1=O)O Z1178486698 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.645 NC(=O)CN1C[C@@H](CC1=O)O Z1255379534 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.645 O=C(O)CN1CC(=O)NC1=O Z1143271959 [0,0,0,0,0,0|2,0,2]=4 3 B10R1.54 C=C(Br)CN1CC[C@H](C1)O Z1206290581 [1,0,0,0,0,0|2,0,1]=4 4 B10R1.54 CC1CCN(C1)CC(=O)O Z1459983829 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.64 CC(N)CN1CCCC1=O Z607822380 [1,0,0,0,0,0|1,0,1]=3 6 B10R1.64 CC(N)CN1CCOC1=O Z1262237181 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.64 NC(=O)CN1CCCC1=O Z56865289 [1,0,0,0,0,0|0,0,0]=1 8 B10R1.64 NC(=S)CN1CCOC1=O Z323040472 [1,0,0,0,0,0|1,1,0]=3 9 B10R1.64 O=C(O)CN1CCCC1=O Z57980672 [1,0,0,0,0,0|1,0,0]=2 10 B10R1.64 O=C(O)CN1CCOC1=O Z323040332 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.64 O=C(O)CN1CCSC1=O Z90122427 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.64 O=C(O)CN1CSCC1=O Z56347574 [1,0,0,0,0,0|2,0,0]=3 13 B10R1.130 CCCN1CC(CC1=O)N Z2418193630 [1,0,0,0,0,0|2,0,1]=4 14 B12R1.844 CC1(CC(=O)N(O1)CC(=O)O)C Z2732518368 [0,1,0,0,0,0|3,0,0]=4 15 B10R0.32 CCOC(=O)N(C)CC(=O)O Z64442393 [0,0,1,0,0,0|3,0,0]=4 16 B10R0.32 COCC(=O)N(C)CC(=O)O Z85895324 [0,0,1,0,0,0|3,0,0]=4 17 B10R0.96 CC(N)CC(=O)NCC(=O)O Z760081580 [0,0,1,0,0,0|2,0,0]=3 18 B10R0.96 CN(C)CC(=O)NCC(=O)O Z1262518101 [0,0,1,0,0,0|3,0,0]=4 19 B12R2.1145 O=C(O)C1C[C@H]2CC(=O)[C@@H]1C2 Z2275489981 [0,0,0,1,0,0|3,0,0]=4 20 B12R1.101 CC1CC(CN(C1)CC(=O)N)C Z54748868 [0,0,0,0,0,1|2,0,1]=4 21 B9R0.2 CCCCCNCC(=O)N Z104536260 [1,0,1,0,0,0|1,0,1]=4 22 B9R0.15 CC(=O)N(CCO)CCO Z797582614 [1,0,1,0,0,0|0,0,2]=4 23 B9R0.23 COC(=O)N(C)CC(=O)O Z319610256 [1,0,1,0,0,0|2,0,0]=4 24 B9R0.48 CCCC(=O)NCC(=O)O Z285193236 [1,0,1,0,0,0|1,0,0]=3 25 B9R0.48 CCOC(=O)NCC(=O)O Z64434253 [1,0,1,0,0,0|2,0,0]=4 26 B9R0.48 NCCC(=O)NCC(=O)O Z1901071297 [1,0,1,0,0,0|2,0,0]=4 27 B9R1.13 N=C(N)CN1CCCC1 Z744754604 [2,0,0,0,0,0|1,0,1]=4 28 B9R1.13 NC(=O)CC1CCCC1 Z33546662 [2,0,0,0,0,0|1,0,1]=4 29 B9R1.13 NC(=O)CC1CCCN1 Z1459435572 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.13 NC(=O)CN1CCCC1 Z1184886892 [2,0,0,0,0,0|0,0,1]=3 31 B9R1.13 O=C(O)CN1CCCC1 Z197269292 [2,0,0,0,0,0|1,0,1]=4 32 B9R1.33 C#CCN1CCCC1=O Z804945966 [2,0,0,0,0,0|1,0,1]=4 33 B9R1.33 NCCN1CCNC1=O Z285171810 [2,0,0,0,0,0|1,0,1]=4 34 B9R1.33 O=C1CCCN1CCO Z104478410 [2,0,0,0,0,0|0,0,2]=4 35 B9R1.33 O=CCC1CCOC1=O Z1511761046 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.22 CCN1CC(CC1=O)N Z2235810233 [2,0,0,0,0,0|1,0,1]=4 37 B11R0.149 CC(C)CC(=O)N(C)CC(=O)O Z85895242 [0,1,1,0,0,0|2,0,0]=4 38 B11R0.35 C=CCN(CC(=O)N)CC(C)C Z416786184 [0,1,1,0,0,0|2,0,0]=4 39 B11R0.34 CC(C)(C)CC(=O)NCC(=O)O Z239873652 [0,1,1,0,0,0|2,0,0]=4 40 B11R0.107 CNC(=O)CNC(=O)CN(C)C Z168911958 [0,1,1,0,0,0|2,0,0]=4 41 B11R1.89 CC(C(=O)O)N1CCOC1=O Z323040336 [1,1,0,0,0,0|2,0,0]=4 42 B11R1.228 CC(CN)CN1CCCC1=O Z406339364 [1,1,0,0,0,0|1,0,1]=4 43 B11R1.228 COC(=O)CC1CCCC1=O Z1198182980 [1,1,0,0,0,0|2,0,0]=4 44 B11R1.228 COC(=O)CN1CCNC1=O Z1491195501 [1,1,0,0,0,0|2,0,0]=4 45 B11R1.495 CC(=O)CN1C(=O)CCC1=O Z19746500 [1,1,0,0,0,0|1,0,1]=4 46 B11R1.495 NC(=S)CN1C(=O)CCC1=O Z295394660 [1,1,0,0,0,0|0,1,1]=4 47 B11R1.495 O=C(O)CN1C(=O)CCC1=O Z57229213 [1,1,0,0,0,0|1,0,1]=4 48 B13R1.138 NC(=O)CN1CC(CC1=O)C(=O)O Z239137536 [0,2,0,0,0,0|0,0,0]=2 49 B11R1.86 NC(=O)CN1CCNCC1=O Z975809934 [0,0,1,1,0,0|1,0,0]=3 50 B11R1.178 CC(=O)N1CCC[C@@H]1C(=O)O Z1078490036 [0,0,1,1,0,0|2,0,0]=4 51 B11R1.178 CC(=O)N1CCC[C@H]1C(=O)O Z85923459 [0,0,1,1,0,0|2,0,0]=4 52 B11R1.159 CN1C(=O)CCCC1C(=O)O Z1262558916 [0,0,1,1,0,0|2,0,0]=4 53 B11R1.103 CC1CC1C(=O)NCC(=O)O Z85886818 [0,0,1,1,0,0|2,0,0]=4 54 B11R2.36 O=C1CN2CCCC2CN1 Z1203745969 [1,0,0,1,0,0|1,0,1]=4 55 B9R0.7 CC(C)C(=O)NCC(=O)O Z85886685 [0,0,1,0,1,0|2,0,0]=4 56 B9R0.7 CC(S)C(=O)NCC(=O)O Z2681891170 [0,0,1,0,1,0|1,1,0]=4 57 B9R1.35 CC(=O)N1CCC(C1)O Z1037571952 [1,0,0,0,1,0|1,0,1]=4 58 B9R1.35 NC(=O)C1CC(CN1)O Z56960275 [1,0,0,0,1,0|2,0,0]=4 59 B9R1.35 NC(=O)N1CCC(C1)N Z1342879018 [1,0,0,0,1,0|1,0,1]=4 60 B9R1.53 NC(=O)CC1CC(C1)N Z2831568112 [1,0,0,0,1,0|2,0,0]=4 61 B9R1.53 NC1CN(C1)CC(=O)O Z4201331449 [1,0,0,0,1,0|2,0,0]=4 62 B11R0.85 CC(C)CCC(=O)NCC(=O)O Z351723094 [0,0,1,0,0,1|2,0,0]=4 63 B11R0.85 CC(N)CCC(=O)NCC(=O)O Z1190333059 [0,0,1,0,0,1|2,0,0]=4