0 B12R0.98 CC(C)CNC(=O)C(N)CCSC Amb23555055 [0,0,0,0,0,0|2,0,1]=3 1 B12R0.98 CC(C)CNC(=O)C(N)CCSC Amb24769002 [0,0,0,0,0,0|2,0,1]=3 2 B12R0.98 CSCCC(C)N(C)CCC(O)=O Amb24769409 [0,0,0,0,0,0|4,0,0]=4 3 B11R0.11 CCCNC(=O)C(N)CCCC Amb18794439 [1,0,0,0,0,0|2,0,1]=4 4 B11R0.11 CCCNC(=O)C(N)CCSC Amb23442738 [1,0,0,0,0,0|1,0,1]=3 5 B11R0.11 CSCCC(N)C(=O)NCC=C Amb23511189 [1,0,0,0,0,0|1,0,0]=2 6 B11R0.11 CSCC[C@@H](N)C(=O)OCC=C Amb22746150 [1,0,0,0,0,0|2,0,0]=3 7 B11R0.11 CSCC[C@H]([NH3+])C(=O)OCC=C Amb22349473 [1,0,0,0,0,0|2,0,1]=4 8 B11R0.46 CC#CCNC(=O)NCC(O)=O Amb18801735 [1,0,0,0,0,0|2,0,1]=4 9 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [1,0,0,0,0,0|3,0,0]=4 10 B11R0.46 CCCCNC(=O)NCC(=O)O Amb1138541 [1,0,0,0,0,0|2,0,0]=3 11 B11R0.46 CCCCOC(=O)CCC(O)=O Amb19888684 [1,0,0,0,0,0|3,0,0]=4 12 B11R0.46 COCCNC(=O)CCC(=O)O Amb1840186 [1,0,0,0,0,0|2,1,0]=4 13 B11R0.46 COCCOC(=O)CCC(=O)O Amb2189153 [1,0,0,0,0,0|2,1,0]=4 14 B13R0.36 COCCC(C)S(=O)(=O)NCC(O)=O Amb25387567 [0,1,0,0,0,0|2,1,0]=4 15 B13R0.128 CC(C(=O)O)NC(=O)C(CCSC)N Amb17143796 [0,1,0,0,0,0|0,0,0]=1 16 B13R0.128 CCCCC(C)C(=O)NC(C)C(O)=O Amb25386910 [0,1,0,0,0,0|2,0,0]=3 17 B13R0.128 CCCCC(C)C(=O)N[C@@H](C)C(O)=O Amb25386912 [0,1,0,0,0,0|2,0,0]=3 18 B13R0.128 CCCCC(C)C(=O)N[C@H](C)C(O)=O Amb25386908 [0,1,0,0,0,0|2,0,0]=3 19 B13R0.128 C[C@@H](C(=O)O)NC(=O)C(CCCC)N Amb16227237 [0,1,0,0,0,0|1,0,0]=2 20 B13R0.128 C[C@@H](NC(=O)[C@H](N)CCSC)C(O)=O Amb22800450 [0,1,0,0,0,0|0,0,0]=1 21 B13R0.139 NCCCC[C@@H](N)C(=O)NCC(O)=O Amb22800696 [0,1,0,0,0,0|1,0,0]=2 22 B13R0.349 NC(=O)CC[C@@H](N)C(=O)NCC(O)=O Amb22745179 [0,1,0,0,0,0|2,0,0]=3 23 B13R0.349 N[C@@H](CCC(O)=O)C(=O)NCC(O)=O Amb22799750 [0,1,0,0,0,0|2,0,0]=3 24 B13R0.465 CCCCC(C)C(=O)N(C)CC(O)=O Amb25386911 [0,1,0,0,0,0|2,0,0]=3 25 B13R1.45 C=C(Br)CNC(=O)C1CCCCN1 Amb24769234 [0,0,0,1,0,0|3,0,0]=4 26 B13R1.45 C=C(Br)CNC(=O)[C@@H]1CCCCN1 Amb24769432 [0,0,0,1,0,0|3,0,0]=4 27 B13R1.45 C=C(Br)CNC(=O)[C@H]1CCCCN1 Amb24769431 [0,0,0,1,0,0|3,0,0]=4 28 B13R1.45 C=C(Br)CNC(=O)[C@H]1CCCCN1 Amb25098079 [0,0,0,1,0,0|3,0,0]=4 29 B13R1.45 C=C(Cl)CNC(=O)C1CCCCN1 Amb24769267 [0,0,0,1,0,0|3,0,0]=4 30 B13R1.45 C=C(Cl)CNC(=O)[C@@H]1CCCCN1 Amb24769430 [0,0,0,1,0,0|3,0,0]=4 31 B13R1.45 C=C(Cl)CNC(=O)[C@H]1CCCCN1 Amb24735538 [0,0,0,1,0,0|3,0,0]=4 32 B13R1.45 C=C(Cl)CNC(=O)[C@H]1CCCCN1 Amb24769429 [0,0,0,1,0,0|3,0,0]=4 33 B13R1.45 CC(=C)CNC(=O)C1CCSCC1 Amb25741294 [0,0,0,1,0,0|3,0,0]=4 34 B13R1.45 CC(=C)CNC(=O)[C@H]1CCCCN1 Amb25210754 [0,0,0,1,0,0|3,0,0]=4 35 B13R1.45 CC(=O)CNC(=O)C1CCNCC1 Amb25314790 [0,0,0,1,0,0|3,0,0]=4 36 B13R1.45 CC(=O)CNC(=O)C1CCOCC1 Amb25714064 [0,0,0,1,0,0|2,1,0]=4 37 B13R1.45 CC(O)CNC(=O)C1CCSCC1 Amb24457636 [0,0,0,1,0,0|2,0,1]=4 38 B13R1.45 C[C@@H](O)CNC(=O)C1CCSCC1 Amb24476356 [0,0,0,1,0,0|2,0,1]=4 39 B13R1.45 C[C@@H](O)CNC(=O)[C@H]1CCCCN1 Amb25248985 [0,0,0,1,0,0|2,0,1]=4 40 B13R1.45 C[C@H](O)CNC(=O)C1CCCCN1 Amb25276000 [0,0,0,1,0,0|2,0,1]=4 41 B13R1.45 C[C@H](O)CNC(=O)[C@@H]1CCCCN1 Amb24558348 [0,0,0,1,0,0|2,0,1]=4 42 B13R1.45 C[C@H](O)CNC(=O)[C@H]1CCCCN1 Amb24375056 [0,0,0,1,0,0|2,0,1]=4 43 B13R1.45 NC(=O)CNC(=O)C1CNCCN1 Amb25089047 [0,0,0,1,0,0|3,0,0]=4 44 B13R1.45 NC(=O)CNC(=O)C1COCCN1 Amb25035291 [0,0,0,1,0,0|3,0,0]=4 45 B13R1.45 NC(=O)CNC(=O)C1CSCCN1 Amb24715330 [0,0,0,1,0,0|3,0,0]=4 46 B13R1.45 NC(=O)CNC(=O)[C@H]1COCCN1 Amb25750640 [0,0,0,1,0,0|3,0,0]=4 47 B13R1.45 O=C(C1CCCCC1)NCC(=O)N Amb17234082 [0,0,0,1,0,0|3,0,0]=4 48 B13R1.45 O=C(C1CCCCC1)NCC(=O)O Amb1102851 [0,0,0,1,0,0|2,0,0]=3 49 B13R1.45 O=C(C1CCCCC1)NCC(=O)[O-] Amb1020369 [0,0,0,1,0,0|2,0,1]=4 50 B13R1.45 O=C(C1CCNCC1)NCC(=O)O Amb17143028 [0,0,0,1,0,0|2,0,0]=3 51 B13R1.45 OC(=O)CNC(=O)C1CCCCN1 Amb18972831 [0,0,0,1,0,0|1,0,0]=2 52 B13R1.45 OC(=O)CNC(=O)C1CCCCO1 Amb18987513 [0,0,0,1,0,0|2,0,0]=3 53 B13R1.45 OC(=O)CNC(=O)C1CCCCS1 Amb25113120 [0,0,0,1,0,0|2,0,0]=3 54 B13R1.45 OC(=O)CNC(=O)C1CCSCC1 Amb24769764 [0,0,0,1,0,0|1,0,0]=2 55 B13R1.45 OC(=O)CNC(=O)C1CNCCC1 Amb18972830 [0,0,0,1,0,0|3,0,0]=4 56 B13R1.45 OC(=O)CNC(=O)C1CNCCO1 Amb18293749 [0,0,0,1,0,0|3,0,0]=4 57 B13R1.45 OC(=O)CNC(=O)C1COCCC1 Amb18300816 [0,0,0,1,0,0|3,0,0]=4 58 B13R1.45 OC(=O)CNC(=O)C1COCCN1 Amb25155536 [0,0,0,1,0,0|2,0,0]=3 59 B13R1.45 OC(=O)CNC(=O)C1CSCCN1 Amb24669882 [0,0,0,1,0,0|2,0,0]=3 60 B13R1.45 OC(=O)CNC(=O)C1CSCCS1 Amb25749229 [0,0,0,1,0,0|3,0,0]=4 61 B13R1.45 OC(=O)CNC(=O)N1CCNCC1 Amb18287712 [0,0,0,1,0,0|3,0,0]=4 62 B13R1.45 OC(=O)CNC(=O)[C@@H]1CCCCN1 Amb24471471 [0,0,0,1,0,0|1,0,0]=2 63 B13R1.45 OC(=O)COC(=O)C1CCCCC1 Amb22001859 [0,0,0,1,0,0|3,0,0]=4 64 B13R1.129 CC1CCC(O1)C(=O)NCC(N)=O Amb25752088 [0,0,0,1,0,0|3,0,0]=4 65 B13R1.129 CC1CCC(O1)C(=O)NCC(O)=O Amb24520723 [0,0,0,1,0,0|2,0,0]=3 66 B13R1.129 CC1CN(CC1)C(=O)NCC(O)=O Amb18952936 [0,0,0,1,0,0|3,0,0]=4 67 B13R1.129 CN1CC(CC1)C(=O)NCC(N)=O Amb25668768 [0,0,0,1,0,0|3,0,0]=4 68 B13R1.129 CN1CC(CC1)C(=O)NCC(O)=O Amb18969959 [0,0,0,1,0,0|2,0,0]=3 69 B13R1.129 NC(=O)CNC(=O)C1CCC(=O)N1 Amb25815930 [0,0,0,1,0,0|3,0,0]=4 70 B13R1.129 NC1CC(CC1)C(=O)NCC(O)=O Amb24470394 [0,0,0,1,0,0|3,0,0]=4 71 B13R1.129 OC(=O)CNC(=O)C1CCC(=O)O1 Amb17883721 [0,0,0,1,0,0|3,0,0]=4 72 B13R1.129 OC(=O)CNC(=O)[C@@H]1CCC(=O)N1 Amb25160693 [0,0,0,1,0,0|2,0,0]=3 73 B13R1.129 OC(=O)CNC(=O)[C@@H]1CSC(=O)N1 Amb24769166 [0,0,0,1,0,0|3,0,0]=4 74 B13R1.885 CC1CCC(C)C(=O)C1CC(O)=O Amb25715554 [0,0,0,1,0,0|3,0,0]=4 75 B13R1.3499 N[C@@H]1CCCCN(CC(O)=O)C1=O Amb25708457 [0,0,0,1,0,0|1,0,0]=2 76 B13R1.3553 CC1CC1NC(=O)[C@@H](N)CCSC Amb24768747 [0,0,0,1,0,0|2,0,1]=4 77 B13R1.3711 N[C@H]1CSSC[C@@H](NC1=O)C(O)=O Amb25258492 [0,0,0,1,0,0|1,0,0]=2 78 B13R1.3711 OC(=O)C1CSSCC(C(=O)N1)N Amb17596056 [0,0,0,1,0,0|1,0,0]=2 79 B13R1.6294 C=C(Br)CNC(=O)C1(N)CCCC1 Amb24769246 [0,0,0,1,0,0|3,0,0]=4 80 B13R1.6294 C=C(Br)CNC(=O)C1(N)CCCC1 Amb25153862 [0,0,0,1,0,0|3,0,0]=4 81 B13R1.6294 C=C(Cl)CNC(=O)C1(N)CCCC1 Amb24769239 [0,0,0,1,0,0|3,0,0]=4 82 B13R1.6294 C=C(Cl)CNC(=O)C1(N)CCCC1 Amb25268852 [0,0,0,1,0,0|3,0,0]=4 83 B13R1.6294 C=C(Cl)CNC(=O)C1(N)CCOC1 Amb25815902 [0,0,0,1,0,0|2,1,0]=4 84 B13R1.6294 C=C(Cl)CNC(=O)C1(O)CCSC1 Amb24347444 [0,0,0,1,0,0|3,0,0]=4 85 B13R1.6294 CC(=C)CNC(=O)C1(N)CCCC1 Amb25859594 [0,0,0,1,0,0|3,0,0]=4 86 B13R1.6294 CC(=C)CNC(=O)C1(O)CCSC1 Amb25271271 [0,0,0,1,0,0|3,0,0]=4 87 B13R1.6294 CC(=O)CNC(=O)C1(C)CCCC1 Amb25056193 [0,0,0,1,0,0|3,0,0]=4 88 B13R1.6294 CC(O)CNC(=O)C1(N)CCCC1 Amb18968918 [0,0,0,1,0,0|2,0,1]=4 89 B13R1.6294 CC1(CCCC1)C(=O)NCC(N)=O Amb24437977 [0,0,0,1,0,0|3,0,0]=4 90 B13R1.6294 CC1(CCCN1)C(=O)NCC(O)=O Amb25335329 [0,0,0,1,0,0|3,0,0]=4 91 B13R1.6294 CC1(CCCS1)C(=O)NCC(O)=O Amb25710199 [0,0,0,1,0,0|3,0,0]=4 92 B13R1.6294 C[C@@H](O)CNC(=O)C1(N)CCCC1 Amb24374472 [0,0,0,1,0,0|2,0,1]=4 93 B13R1.6294 C[C@H](O)CNC(=O)C1(N)CCCC1 Amb25858399 [0,0,0,1,0,0|2,0,1]=4 94 B13R1.6294 C[C@H](O)CNC(=O)C1(O)CSCC1 Amb25728765 [0,0,0,1,0,0|2,0,1]=4 95 B13R1.6294 NC(=O)CNC(=O)C1(Br)CCCC1 Amb25675442 [0,0,0,1,0,0|3,0,0]=4 96 B13R1.6294 NC(=O)CNC(=O)C1(F)CNCC1 Amb24503109 [0,0,0,1,0,0|3,0,0]=4 97 B13R1.6294 NC(=O)CNC(=O)C1(F)COCC1 Amb25079754 [0,0,0,1,0,0|2,1,0]=4 98 B13R1.6294 NC(=O)CNC(=O)C1(N)CCCC1 Amb18289235 [0,0,0,1,0,0|2,0,0]=3 99 B13R1.6294 NC(=O)CNC(=O)C1(N)COCC1 Amb24390704 [0,0,0,1,0,0|1,1,0]=3 100 B13R1.6294 NC(=O)CNC(=O)C1(O)CSCC1 Amb25848249 [0,0,0,1,0,0|2,0,0]=3 101 B13R1.6294 NC1(CCCC1)C(=O)NCC(O)=O Amb18972838 [0,0,0,1,0,0|1,0,0]=2 102 B11R0.68 CC(C)NC(=O)C(N)CCSC Amb23555042 [0,0,0,0,1,0|2,0,1]=4 103 B13R0.345 CC(C)CCNC(=O)C(N)CCSC Amb25387244 [0,0,0,0,0,1|2,0,1]=4 104 B13R0.345 CCCCC(C)C(=O)NCCC(O)=O Amb25386909 [0,0,0,0,0,1|2,0,0]=3 105 B13R0.345 CCCCN(C(=O)NCCC(=O)O)C Amb17042892 [0,0,0,0,0,1|3,0,0]=4 106 B10R0.19 CCCC(N)C(=O)NCC#N Amb18305862 [2,0,0,0,0,0|1,0,1]=4 107 B10R0.19 CCCCC(N)C(=O)NCC Amb18179826 [2,0,0,0,0,0|1,0,1]=4 108 B10R0.19 CCNC(=O)C(N)CCSC Amb23555057 [2,0,0,0,0,0|0,0,1]=3 109 B10R0.19 CSCC[C@@H](N)C(=O)NC#N Amb25380387 [2,0,0,0,0,0|1,0,1]=4 110 B10R0.4 CCCCC\C=C\CC(=O)O Amb17593915 [2,0,0,0,0,0|2,0,0]=4 111 B10R0.78 C#CCCC(=O)NCC(O)=O Amb24754735 [2,0,0,0,0,0|0,0,2]=4 112 B10R0.78 CCCCC(=O)NNC(=O)N Amb2228600 [2,0,0,0,0,0|2,0,0]=4 113 B10R0.78 CCCCS(=O)CCC(=O)O Amb10669585 [2,0,0,0,0,0|2,0,0]=4 114 B10R0.78 CCCNC(=O)CCC(=O)O Amb1783633 [2,0,0,0,0,0|2,0,0]=4 115 B10R0.78 CCCNC(=O)NCC(=O)O Amb1137768 [2,0,0,0,0,0|1,0,0]=3 116 B10R0.78 CSCCC(=O)NNC(N)=O Amb24755474 [2,0,0,0,0,0|2,0,0]=4 117 B10R0.78 CS\C=C\C(=O)NCC(O)=O Amb24761761 [2,0,0,0,0,0|0,0,2]=4 118 B10R0.78 NCCNC(=O)NCC(O)=O Amb19016059 [2,0,0,0,0,0|2,0,0]=4 119 B10R0.78 OC(=O)CNC(=O)NCCF Amb25381874 [2,0,0,0,0,0|2,0,0]=4 120 B10R0.57 CC(=C)CNC(=O)C(N)CC Amb24755279 [2,0,0,0,0,0|2,0,0]=4 121 B10R0.57 CC(=C)CNC(=O)[C@H](N)CC Amb24755283 [2,0,0,0,0,0|2,0,0]=4 122 B10R0.57 CC(C(=O)NCC(=O)O)CC Amb1135061 [2,0,0,0,0,0|1,0,0]=3 123 B10R0.57 CC(C(=O)NCC(=O)O)CS Amb17616846 [2,0,0,0,0,0|1,0,0]=3 124 B10R0.57 CC(C(=O)NCC(=O)O)SC Amb17617821 [2,0,0,0,0,0|1,0,0]=3 125 B10R0.57 CC(CN)C(=O)NCC(O)=O Amb18313433 [2,0,0,0,0,0|2,0,0]=4 126 B10R0.57 CC(O)CNC(=O)[C@@H](N)CS Amb25384010 [2,0,0,0,0,0|1,0,1]=4 127 B10R0.57 CCC(N)C(=O)NCC(O)=O Amb19010174 [2,0,0,0,0,0|0,0,0]=2 128 B10R0.57 CC[C@@H](N)C(=O)NCC(O)=O Amb23438948 [2,0,0,0,0,0|0,0,0]=2 129 B10R0.57 CNC(C)C(=O)NCC(O)=O Amb19026576 [2,0,0,0,0,0|2,0,0]=4 130 B10R0.57 CN[C@@H](C)C(=O)NCC(O)=O Amb25382219 [2,0,0,0,0,0|2,0,0]=4 131 B10R0.57 NC(=O)CNC(=O)C(N)CN Amb24764647 [2,0,0,0,0,0|2,0,0]=4 132 B10R0.57 NC(=O)CNC(=O)[C@@H](N)CN Amb24085846 [2,0,0,0,0,0|2,0,0]=4 133 B10R0.57 NC(C(=O)NCC(=O)O)CS Amb17594540 [2,0,0,0,0,0|0,0,0]=2 134 B10R0.57 NCC(N)C(=O)NCC(O)=O Amb24762063 [2,0,0,0,0,0|1,0,0]=3 135 B10R0.57 NC[C@H](N)C(=O)NCC(O)=O Amb25384899 [2,0,0,0,0,0|1,0,0]=3 136 B10R0.57 N[C@@H](CO)C(=O)NCC(O)=O Amb22801360 [2,0,0,0,0,0|0,1,0]=3 137 B10R0.57 N[C@@H](CS)C(=O)NCC(O)=O Amb22230806 [2,0,0,0,0,0|0,0,0]=2 138 B10R0.57 N[C@@H](CS)C(=O)NCC(O)=O Amb22800051 [2,0,0,0,0,0|0,0,0]=2 139 B12R0.252 CC(CC)NC(=O)C(N)CCSC Amb23555056 [1,1,0,0,0,0|1,0,1]=4 140 B12R0.252 CC(CC)NC(=O)C(N)CCSC Amb24768992 [1,1,0,0,0,0|1,0,1]=4 141 B12R0.353 CCCN(C)C(=O)[C@@H](N)CCSC Amb24768664 [1,1,0,0,0,0|1,0,1]=4 142 B12R0.353 CSCC[C@H](N)C(=O)N(C)CC=C Amb24769170 [1,1,0,0,0,0|1,0,0]=3 143 B12R0.648 CCCCC(N)C(=O)NCCOC Amb19059892 [1,1,0,0,0,0|1,0,1]=4 144 B12R0.648 COCCNC(=O)C(N)CCSC Amb23555044 [1,1,0,0,0,0|0,0,1]=3 145 B12R0.123 CCCSCC(=O)NC(C)C(O)=O Amb24769291 [1,1,0,0,0,0|2,0,0]=4 146 B12R0.123 CCCSCC(=O)N[C@@H](C)C(O)=O Amb24769283 [1,1,0,0,0,0|2,0,0]=4 147 B12R0.123 CCCSCC(=O)N[C@H](C)C(O)=O Amb24769298 [1,1,0,0,0,0|2,0,0]=4 148 B12R0.123 CSCCCC(=O)NC(C)C(O)=O Amb18411852 [1,1,0,0,0,0|0,0,0]=2 149 B12R0.123 CSCCCC(=O)N[C@@H](C)C(O)=O Amb24769711 [1,1,0,0,0,0|0,0,0]=2 150 B12R0.123 CSCCCC(=O)N[C@H](C)C(O)=O Amb24769712 [1,1,0,0,0,0|0,0,0]=2 151 B12R0.141 CCCSCC(=O)N(C)CC(O)=O Amb24769292 [1,1,0,0,0,0|2,0,0]=4 152 B12R0.141 CSCCCC(=O)N(C)CC(O)=O Amb17954984 [1,1,0,0,0,0|0,0,0]=2 153 B12R0.255 COCCCNC(=O)CCC(=O)O Amb2102010 [1,1,0,0,0,0|1,1,0]=4 154 B12R0.255 CSCCCCC(=O)NCC(O)=O Amb24769713 [1,1,0,0,0,0|0,0,0]=2 155 B12R0.255 CSCCCNC(=O)CCC(O)=O Amb24768850 [1,1,0,0,0,0|1,0,0]=3 156 B12R0.645 CCCCCS(=O)(=O)NCC(O)=O Amb24769167 [1,1,0,0,0,0|2,0,0]=4 157 B12R0.645 COCCCS(=O)(=O)NCC(O)=O Amb20668292 [1,1,0,0,0,0|1,1,0]=4 158 B12R0.76 CC(NC(=O)C(C)CSC)C(O)=O Amb24769286 [1,1,0,0,0,0|1,0,0]=3 159 B12R0.76 C[C@@H](NC(=O)C(C)CSC)C(O)=O Amb24769299 [1,1,0,0,0,0|1,0,0]=3 160 B12R0.76 C[C@H](NC(=O)C(C)CSC)C(O)=O Amb24769284 [1,1,0,0,0,0|1,0,0]=3 161 B12R0.88 C[C@@H](CC)[C@H](N)C(=O)NCC(O)=O Amb18324097 [1,1,0,0,0,0|0,0,0]=2 162 B12R0.191 CSCC(C)C(=O)N(C)CC(O)=O Amb24769285 [1,1,0,0,0,0|1,0,0]=3 163 B12R0.258 CC(=C)CNC(=O)C(N)CC(C)C Amb23511185 [1,1,0,0,0,0|2,0,0]=4 164 B12R0.258 CC(C)CC(N)C(=O)NCC(=C)Br Amb23511186 [1,1,0,0,0,0|2,0,0]=4 165 B12R0.258 CC(C)CC(N)C(=O)NCC(=C)Cl Amb23511187 [1,1,0,0,0,0|2,0,0]=4 166 B12R0.258 CC(C)CC(N)C(=O)NCC(N)=O Amb22352717 [1,1,0,0,0,0|1,0,0]=3 167 B12R0.258 CC(C)C[C@@H](N)C(=O)NCC(O)=O Amb18324095 [1,1,0,0,0,0|0,0,0]=2 168 B12R0.258 CC(C)C[C@H](N)C(=O)NCC(O)=O Amb22353097 [1,1,0,0,0,0|0,0,0]=2 169 B12R0.258 CC(CC(C(=O)NNC(=O)C)N)C Amb17335923 [1,1,0,0,0,0|2,0,0]=4 170 B12R0.258 N[C@@H](CC(O)=O)C(=O)NCC(O)=O Amb22745769 [1,1,0,0,0,0|0,1,1]=4 171 B14R0.44 CCCCC(C)C(=O)NC(C)CC(O)=O Amb24775431 [0,1,0,0,0,1|2,0,0]=4 172 B14R0.186 CCCCSC(C)C(=O)NCCC(O)=O Amb25391892 [0,1,0,0,0,1|2,0,0]=4 173 B14R0.396 CCCCC(C)C(=O)NCC(C)C(O)=O Amb24775423 [0,1,0,0,0,1|2,0,0]=4 174 B14R0.473 CCCCSC(C)C(=O)NCC(=O)OC Amb21699461 [0,2,0,0,0,0|2,0,0]=4 175 B14R0.597 CC(CNC(=O)[C@@H](N)CCSC)COC Amb24772331 [0,2,0,0,0,0|1,0,1]=4 176 B14R0.597 CCOC(=O)CNC(=O)[C@@H](N)CCSC Amb24770278 [0,2,0,0,0,0|0,0,0]=2 177 B14R0.1026 COC(C)(C)CNC(=O)[C@@H](N)CCSC Amb25391537 [0,2,0,0,0,0|1,0,1]=4 178 B14R0.403 C[C@@H](NC(=O)[C@H](N)CCC(O)=O)C(O)=O Amb22800170 [0,2,0,0,0,0|2,0,0]=4 179 B14R0.241 CC(NC(=O)C(N)CCCCN)C(O)=O Amb22352093 [0,2,0,0,0,0|1,0,0]=3 180 B14R0.241 CCCCOC(C)C(=O)NC(C)C(O)=O Amb25391932 [0,2,0,0,0,0|2,0,0]=4 181 B14R0.241 CCCCOC(C)C(=O)N[C@@H](C)C(O)=O Amb25391879 [0,2,0,0,0,0|2,0,0]=4 182 B14R0.241 CCCCOC(C)C(=O)N[C@H](C)C(O)=O Amb25392073 [0,2,0,0,0,0|2,0,0]=4 183 B14R0.241 CCCCSC(C)C(=O)NC(C)C(O)=O Amb25392017 [0,2,0,0,0,0|2,0,0]=4 184 B14R0.241 CCCCSC(C)C(=O)N[C@@H](C)C(O)=O Amb25391874 [0,2,0,0,0,0|2,0,0]=4 185 B14R0.241 CCCCSC(C)C(=O)N[C@H](C)C(O)=O Amb25392068 [0,2,0,0,0,0|2,0,0]=4 186 B14R0.241 C[C@@H](NC(=O)[C@H](N)CCCCN)C(O)=O Amb22799971 [0,2,0,0,0,0|1,0,0]=3 187 B14R0.241 C[C@@H](NC(=O)[C@H](N)CCCCN)C(O)=O Amb22801076 [0,2,0,0,0,0|1,0,0]=3 188 B14R0.367 C[C@@H](NC(=O)C(CCCC)CC)C(O)=O Amb24771395 [0,2,0,0,0,0|2,0,0]=4 189 B14R0.588 CCCCC(C)C(=O)NC(C)(C)C(O)=O Amb24775432 [0,2,0,0,0,0|2,0,0]=4 190 B14R0.591 CSCCC(N)C(=O)NC(CO)C(O)=O Amb22349776 [0,2,0,0,0,0|0,0,0]=2 191 B14R0.591 CSCC[C@@H](N)C(=O)N[C@H](CO)C(O)=O Amb22799816 [0,2,0,0,0,0|0,0,0]=2 192 B14R0.594 CCCCC(C)C(=O)N(C)C(C)C(O)=O Amb24775422 [0,2,0,0,0,0|2,0,0]=4 193 B14R0.511 CCOCCOC(C)C(=O)NCC(O)=O Amb25391692 [0,2,0,0,0,0|1,1,0]=4 194 B14R0.2380 CCCCOC(C)C(=O)N(C)CC(O)=O Amb25391911 [0,2,0,0,0,0|2,0,0]=4 195 B14R0.592 CCCCC(C)C(=O)N(CC(O)=O)CC Amb24775421 [0,2,0,0,0,0|2,0,0]=4 196 B12R1.30 C=CCNC(=O)C1CCCCN1 Amb21958705 [1,0,0,1,0,0|2,0,0]=4 197 B12R1.30 C=CCNC(=O)C1CCSCC1 Amb24371783 [1,0,0,1,0,0|2,0,0]=4 198 B12R1.30 C=CCNC(=O)[C@@H]1CCCCN1 Amb25306502 [1,0,0,1,0,0|2,0,0]=4 199 B12R1.30 O=CCNC(=O)C1CCCCC1 Amb17102060 [1,0,0,1,0,0|2,0,0]=4 200 B12R1.30 O=CCNC(=O)C1CCOCC1 Amb22896804 [1,0,0,1,0,0|1,1,0]=4 201 B12R1.30 OCCNC(=O)C1CCCCN1 Amb21958728 [1,0,0,1,0,0|1,0,1]=4 202 B12R1.374 CC1CNC(=O)[C@@H](CCSC)N1 Amb18820658 [1,0,0,1,0,0|1,0,1]=4 203 B12R1.374 CC=1NC(CCSC)C(=O)NN1 Amb18454733 [1,0,0,1,0,0|2,0,0]=4 204 B12R1.374 CCCCC1NC(=O)CNC1=O Amb25103661 [1,0,0,1,0,0|1,0,0]=3 205 B12R1.374 CCCC[C@H]1NC(=O)CNC1=O Amb25368428 [1,0,0,1,0,0|1,0,0]=3 206 B12R1.374 CCOCC1NC(=O)CNC1=O Amb25114053 [1,0,0,1,0,0|2,0,0]=4 207 B12R1.374 CSCC[C@H]1NC(=O)CNC1=O Amb24420004 [1,0,0,1,0,0|0,0,0]=2 208 B12R1.374 NCCCC1NC(=O)CNC1=O Amb25835027 [1,0,0,1,0,0|2,0,0]=4 209 B12R1.374 NCCC[C@@H]1NC(=O)CNC1=O Amb25152510 [1,0,0,1,0,0|2,0,0]=4 210 B12R1.2022 C=CCNC(=O)C1(N)CCCC1 Amb18968898 [1,0,0,1,0,0|2,0,0]=4 211 B12R1.2022 C=CCNC(=O)C1(N)COCC1 Amb24465774 [1,0,0,1,0,0|1,1,0]=4 212 B12R1.2022 C=CCNC(=O)C1(O)CSCC1 Amb24497947 [1,0,0,1,0,0|2,0,0]=4 213 B12R1.2022 NC1(CCCC1)C(=O)NCCO Amb18968903 [1,0,0,1,0,0|1,0,1]=4 214 B12R1.2022 NC1(COCC1)C(=O)NCCO Amb25724307 [1,0,0,1,0,0|0,1,1]=4 215 B12R1.2022 OCCNC(=O)C1(O)CSCC1 Amb25787093 [1,0,0,1,0,0|1,0,1]=4 216 B12R1.54 C=C(Br)CNC(=O)C1CSCC1 Amb24464031 [1,0,0,1,0,0|2,0,0]=4 217 B12R1.54 CC(=O)CNC(=O)C1CCCC1 Amb24341601 [1,0,0,1,0,0|2,0,0]=4 218 B12R1.54 CC(O)CNC(=O)C1CCSC1 Amb25825731 [1,0,0,1,0,0|1,0,1]=4 219 B12R1.54 NC(=O)CNC(=O)C1CCCC1 Amb25152479 [1,0,0,1,0,0|2,0,0]=4 220 B12R1.54 NC(=O)CNC(=O)C1CNCC1 Amb18302719 [1,0,0,1,0,0|2,0,0]=4 221 B12R1.54 NC(=O)CNC(=O)C1COCC1 Amb25848867 [1,0,0,1,0,0|1,1,0]=4 222 B12R1.54 NC(=O)CNC(=O)[C@@H]1CNCC1 Amb25086241 [1,0,0,1,0,0|2,0,0]=4 223 B12R1.54 NC(=O)CNC(=O)[C@H]1CNCC1 Amb24347513 [1,0,0,1,0,0|2,0,0]=4 224 B12R1.54 NC(=O)CNC(=O)[C@H]1CSCN1 Amb24459138 [1,0,0,1,0,0|2,0,0]=4 225 B12R1.54 NC(=S)CNC(=O)C1CSCC1 Amb25375631 [1,0,0,1,0,0|1,1,0]=4 226 B12R1.54 O=C(C1CCCC1)NCC(=O)O Amb1116958 [1,0,0,1,0,0|1,0,0]=3 227 B12R1.54 OC(=O)CCC(=O)C1CNCC1 Amb18198662 [1,0,0,1,0,0|2,0,0]=4 228 B12R1.54 OC(=O)CCC(=O)C1CSCC1 Amb18820774 [1,0,0,1,0,0|1,0,0]=3 229 B12R1.54 OC(=O)CNC(=O)C1CC=CC1 Amb24751704 [1,0,0,1,0,0|1,0,1]=4 230 B12R1.54 OC(=O)CNC(=O)C1CCC=N1 Amb24429067 [1,0,0,1,0,0|2,0,0]=4 231 B12R1.54 OC(=O)CNC(=O)C1CCCN1 Amb24271199 [1,0,0,1,0,0|2,0,0]=4 232 B12R1.54 OC(=O)CNC(=O)C1CCCO1 Amb1110838 [1,0,0,1,0,0|2,0,0]=4 233 B12R1.54 OC(=O)CNC(=O)C1CNCC1 Amb19001621 [1,0,0,1,0,0|1,0,0]=3 234 B12R1.54 OC(=O)CNC(=O)C1COCC1 Amb18974292 [1,0,0,1,0,0|0,1,0]=3 235 B12R1.54 OC(=O)CNC(=O)C1CSCN1 Amb17143082 [1,0,0,1,0,0|1,0,0]=3 236 B12R1.54 OC(=O)CNC(=O)[C@@H]1CCCN1 Amb18794315 [1,0,0,1,0,0|2,0,0]=4 237 B12R1.147 CC1CC1NC(=O)NCC(O)=O Amb18990746 [1,0,0,1,0,0|2,0,0]=4 238 B12R1.210 CC(=O)CN1CCCCCC1=O Amb18806130 [1,0,0,1,0,0|2,0,0]=4 239 B12R1.210 OC(=O)CC1CCCCCC1=O Amb18825694 [1,0,0,1,0,0|2,0,0]=4 240 B12R1.276 CCCC1CC(=O)CC1C(O)=O Amb25138701 [1,0,0,1,0,0|2,0,0]=4 241 B12R1.276 CCCC1CC(=O)NC1C(O)=O Amb25732823 [1,0,0,1,0,0|1,0,0]=3 242 B12R1.276 CCCC1OC(=O)NC1C(O)=O Amb18127008 [1,0,0,1,0,0|2,0,0]=4 243 B12R1.276 CCC[C@@H]1OC(=O)N[C@@H]1C(O)=O Amb24617229 [1,0,0,1,0,0|2,0,0]=4 244 B12R1.551 OC(=O)CNC(=O)NC1CCC1 Amb18298120 [1,0,0,1,0,0|2,0,0]=4 245 B12R1.620 CCC1CCC(=O)N1CC(N)=O Amb25088260 [1,0,0,1,0,0|2,0,0]=4 246 B12R1.1009 CC(=O)CN1C(C)CCCC1=O Amb24708287 [1,0,0,1,0,0|2,0,0]=4 247 B12R1.1011 OC(=O)C1CC(=O)CCCCC1 Amb25187509 [1,0,0,1,0,0|2,0,0]=4 248 B12R1.1011 OC(=O)[C@@H]1CSSCCC(=O)N1 Amb24496033 [1,0,0,1,0,0|1,0,0]=3 249 B12R1.1343 OC(=O)CNC1=NCCCCC1 Amb1083417 [1,0,0,1,0,0|2,0,0]=4 250 B12R1.125 NC1CCCCC1NCC(O)=O Amb25714554 [1,0,0,1,0,0|1,0,1]=4 251 B12R1.125 N[C@@H]1CCCC[C@H]1NCC(O)=O Amb24512945 [1,0,0,1,0,0|1,0,1]=4 252 B12R1.221 CC1CC(C1)C(=O)NCC(N)=O Amb25222017 [1,0,0,1,0,0|2,0,0]=4 253 B12R1.221 CC1CC(C1)C(=O)NCC(O)=O Amb25295764 [1,0,0,1,0,0|1,0,0]=3 254 B12R1.224 C=C(Br)CN1CCCC(N)C1=O Amb25327257 [1,0,0,1,0,0|2,0,0]=4 255 B12R1.224 C=C1CCCN(CC(O)=O)C1=O Amb18647143 [1,0,0,1,0,0|1,0,1]=4 256 B12R1.224 CC(=O)CN1CCCC(C)C1=O Amb25273526 [1,0,0,1,0,0|2,0,0]=4 257 B12R1.224 CC(O)CN1CCCC(N)C1=O Amb25283375 [1,0,0,1,0,0|1,0,1]=4 258 B12R1.224 CC1C(N)CCCN1CC(O)=O Amb25231548 [1,0,0,1,0,0|1,0,1]=4 259 B12R1.224 CC1CCCC(CC(O)=O)C1=O Amb24635682 [1,0,0,1,0,0|2,0,0]=4 260 B12R1.224 CC1CCCN(CC(N)=O)C1=O Amb24408814 [1,0,0,1,0,0|2,0,0]=4 261 B12R1.224 CC1CCCN(CC(O)=O)C1=O Amb24557402 [1,0,0,1,0,0|1,0,0]=3 262 B12R1.224 CN1CCCN(CC(O)=O)C1=O Amb18198334 [1,0,0,1,0,0|2,0,0]=4 263 B12R1.224 NC(=O)CN1CCC[C@@H](N)C1=O Amb24563973 [1,0,0,1,0,0|1,0,0]=3 264 B12R1.224 N[C@H]1CCCN(CC(O)=O)C1=O Amb25264768 [1,0,0,1,0,0|0,0,0]=2 265 B12R1.274 CCCC1CC(CC1=O)C(O)=O Amb18647385 [1,0,0,1,0,0|2,0,0]=4 266 B12R1.274 CCCC1CC(NC1=O)C(O)=O Amb24404690 [1,0,0,1,0,0|1,0,0]=3 267 B12R1.274 CCCC1CC(OC1=O)C(O)=O Amb17705263 [1,0,0,1,0,0|2,0,0]=4 268 B12R1.274 CCCN1CC(NC1=O)C(O)=O Amb25350364 [1,0,0,1,0,0|2,0,0]=4 269 B12R1.2243 C=C(Br)CNC(=O)C1(N)CCC1 Amb24768511 [1,0,0,1,0,0|2,0,0]=4 270 B12R1.2243 CC(=C)CNC(=O)C1(N)CCC1 Amb25094940 [1,0,0,1,0,0|2,0,0]=4 271 B12R1.2243 CC1(CCC1)C(=O)NCC(N)=O Amb24352680 [1,0,0,1,0,0|2,0,0]=4 272 B12R1.2243 CC1(CCC1)C(=O)NCC(O)=O Amb24613360 [1,0,0,1,0,0|1,0,0]=3 273 B12R1.2243 C[C@@H](O)CNC(=O)C1(N)CCC1 Amb25845735 [1,0,0,1,0,0|1,0,1]=4 274 B12R1.2243 C[C@H](O)CNC(=O)C1(N)CCC1 Amb25158105 [1,0,0,1,0,0|1,0,1]=4 275 B12R1.2243 NC(=O)CNC(=O)C1(F)CCC1 Amb25050973 [1,0,0,1,0,0|2,0,0]=4 276 B12R1.2243 NC(=O)CNC(=O)C1(O)CCC1 Amb25669954 [1,0,0,1,0,0|2,0,0]=4 277 B12R1.2243 NC1(CCC1)C(=O)NCC(O)=O Amb24569436 [1,0,0,1,0,0|0,0,0]=2 278 B12R1.337 CSCCC1NC(CS1)C(O)=O Amb19003936 [1,0,0,1,0,0|2,0,0]=4 279 B12R1.69 CSCCC1NCC(=O)NC1=O Amb25067262 [0,0,0,1,1,0|1,0,0]=3 280 B12R1.107 NC(=O)NC(=O)C1CCCCN1 Amb25048046 [0,0,0,1,1,0|2,0,0]=4 281 B12R1.107 OC(=O)CC(=O)N1CCSCC1 Amb18284926 [0,0,0,1,1,0|2,0,0]=4 282 B12R1.1355 NC(=O)NC(=O)C(N)CC1CC1 Amb25817367 [0,0,0,1,1,0|2,0,0]=4 283 B12R1.1355 NC(=O)NC(=O)[C@@H](N)CC1CC1 Amb25182957 [0,0,0,1,1,0|2,0,0]=4 284 B12R1.2261 COCCC1(C)OC(=O)NC1=O Amb25361850 [0,0,0,1,1,0|1,1,0]=4 285 B12R1.2261 CSCCC1(C)NC(=O)NC1=O Amb25696059 [0,0,0,1,1,0|2,0,0]=4 286 B14R1.129 CC1CC(CC1)NC(=O)NCC(O)=O Amb25808308 [0,0,0,1,0,1|2,0,0]=4 287 B14R1.129 CN1CC(CC1)NC(=O)NCC(O)=O Amb18979339 [0,0,0,1,0,1|2,0,0]=4 288 B14R1.160 NC(=O)CNC(=O)C1CCCCC1N Amb18997572 [0,0,0,1,0,1|2,0,0]=4 289 B14R1.423 O=C(NC1CCCCC1)NCC(=O)O Amb1119472 [0,0,0,1,0,1|2,0,0]=4 290 B14R1.423 OC(=O)CNC(=O)CC1CCNCC1 Amb19010176 [0,0,0,1,0,1|2,0,0]=4 291 B14R1.423 OC(=O)CNC(=O)CC1CCOCC1 Amb25387605 [0,0,0,1,0,1|1,1,0]=4 292 B14R1.423 OC(=O)CNC(=O)NC1CCNCC1 Amb18977800 [0,0,0,1,0,1|2,0,0]=4 293 B14R1.423 OC(=O)CNC(=O)NC1CCSCC1 Amb24368951 [0,0,0,1,0,1|1,0,0]=3 294 B14R1.10391 CC1(CCCC1)NC(=O)NCC(O)=O Amb24510716 [0,0,0,1,0,1|2,0,0]=4 295 B14R1.420 O=C(C1CCCCC1)NCCC(=O)O Amb1121032 [0,0,0,1,0,1|2,0,0]=4 296 B14R1.420 OC(=O)CCNC(=O)C1CCCCO1 Amb19091343 [0,0,0,1,0,1|2,0,0]=4 297 B14R1.420 OC(=O)CCNC(=O)C1CCSCC1 Amb25387618 [0,0,0,1,0,1|1,0,0]=3 298 B14R1.420 OC(=O)CCNC(=O)N1CCSCC1 Amb18973171 [0,0,0,1,0,1|2,0,0]=4 299 B14R1.163 CNC(=O)CNC(=O)[C@@H]1CCCCN1 Amb24381874 [0,1,0,1,0,0|2,0,0]=4 300 B14R1.163 ONC(=O)CNC(=O)C1CCCCC1 Amb24500566 [0,1,0,1,0,0|2,0,0]=4 301 B14R1.10161 COC(=O)CN1C=CCC[C@H](N)C1=O Amb25301394 [0,1,0,1,0,0|1,0,1]=4 302 B14R1.10161 COC(=O)CN1CC=CCC(N)C1=O Amb25167725 [0,1,0,1,0,0|1,0,1]=4 303 B14R1.10161 COC(=O)CN1CCCC[C@H](N)C1=O Amb25141994 [0,1,0,1,0,0|1,0,0]=3 304 B14R1.13577 CNC(=O)CNC(=O)C1(N)CCCC1 Amb18968910 [0,1,0,1,0,0|2,0,0]=4 305 B14R1.13577 CNC(=O)CNC(=O)C1(N)COCC1 Amb24709961 [0,1,0,1,0,0|1,1,0]=4 306 B14R1.19457 COC(=O)[C@@H]1CSSC[C@H](N)C(=O)N1 Amb24544375 [0,1,0,1,0,0|1,0,0]=3 307 B14R1.54 CCC1CCC(O1)C(=O)NCC(O)=O Amb25387483 [0,1,0,1,0,0|2,0,0]=4 308 B14R1.149 CC1CC(CCC1)C(=O)NCC(O)=O Amb25131321 [0,1,0,1,0,0|2,0,0]=4 309 B14R1.149 CC1CC(CCO1)C(=O)NCC(O)=O Amb25387551 [0,1,0,1,0,0|1,1,0]=4 310 B14R1.149 CC1CC(CNC1)C(=O)NCC(O)=O Amb24543118 [0,1,0,1,0,0|2,0,0]=4 311 B14R1.149 CC1CC(NCC1)C(=O)NCC(O)=O Amb25753777 [0,1,0,1,0,0|1,0,0]=3 312 B14R1.149 CC1CN(CCS1)C(=O)NCC(O)=O Amb24499450 [0,1,0,1,0,0|2,0,0]=4 313 B14R1.149 CN1CC(CCC1)C(=O)NCC(O)=O Amb20414322 [0,1,0,1,0,0|2,0,0]=4 314 B14R1.149 CN1CC(OCC1)C(=O)NCC(O)=O Amb25814215 [0,1,0,1,0,0|2,0,0]=4 315 B14R1.149 NC1CC(CCC1)C(=O)NCC(O)=O Amb19002381 [0,1,0,1,0,0|2,0,0]=4 316 B14R1.415 CC(C(=O)O)NC(=O)C1CCCCC1 Amb1115546 [0,1,0,1,0,0|2,0,0]=4 317 B14R1.415 CC(C(=O)O)NC(=O)C1CCNCC1 Amb17143228 [0,1,0,1,0,0|2,0,0]=4 318 B14R1.415 CC(NC(=O)C1CCCCN1)C(O)=O Amb18972879 [0,1,0,1,0,0|1,0,0]=3 319 B14R1.415 CC(NC(=O)C1CCCCO1)C(O)=O Amb18987514 [0,1,0,1,0,0|2,0,0]=4 320 B14R1.415 CC(NC(=O)C1CCCCS1)C(O)=O Amb25757709 [0,1,0,1,0,0|2,0,0]=4 321 B14R1.415 CC(NC(=O)C1CCSCC1)C(O)=O Amb25206546 [0,1,0,1,0,0|1,0,0]=3 322 B14R1.415 CC(NC(=O)C1COCCN1)C(O)=O Amb25664273 [0,1,0,1,0,0|2,0,0]=4 323 B14R1.415 CC(NC(=O)C1CSCCN1)C(O)=O Amb24359522 [0,1,0,1,0,0|2,0,0]=4 324 B14R1.415 CC(NC(=O)N1CCSCC1)C(O)=O Amb18951758 [0,1,0,1,0,0|2,0,0]=4 325 B14R1.415 CC(NC(=O)[C@@H]1CCCCN1)C(N)=O Amb24734193 [0,1,0,1,0,0|2,0,0]=4 326 B14R1.415 CC(NC(=O)[C@H]1CCCCN1)C(N)=O Amb25753821 [0,1,0,1,0,0|2,0,0]=4 327 B14R1.415 CC(NC(=O)[C@H]1CCCCN1)C(O)=O Amb24553179 [0,1,0,1,0,0|1,0,0]=3 328 B14R1.415 C[C@@H](C(=O)O)NC(=O)C1CCCCC1 Amb10609753 [0,1,0,1,0,0|2,0,0]=4 329 B14R1.415 C[C@@H](NC(=O)C1CCCCC1)C(O)=O Amb19295779 [0,1,0,1,0,0|2,0,0]=4 330 B14R1.415 C[C@@H](NC(=O)C1CCCCN1)C(N)=O Amb24455409 [0,1,0,1,0,0|2,0,0]=4 331 B14R1.415 C[C@@H](NC(=O)C1CCCCN1)C(O)=O Amb19048027 [0,1,0,1,0,0|1,0,0]=3 332 B14R1.415 C[C@@H](NC(=O)C1CCCCO1)C(O)=O Amb19091344 [0,1,0,1,0,0|2,0,0]=4 333 B14R1.415 C[C@@H](NC(=O)C1CCCCS1)C(O)=O Amb24465372 [0,1,0,1,0,0|2,0,0]=4 334 B14R1.415 C[C@@H](NC(=O)C1CCNCC1)C(O)=O Amb19048025 [0,1,0,1,0,0|2,0,0]=4 335 B14R1.415 C[C@@H](NC(=O)C1CCOCC1)C(O)=O Amb19049140 [0,1,0,1,0,0|1,1,0]=4 336 B14R1.415 C[C@@H](NC(=O)C1CCSCC1)C(O)=O Amb24448578 [0,1,0,1,0,0|1,0,0]=3 337 B14R1.415 C[C@@H](NC(=O)C1CSCCN1)C(O)=O Amb24385808 [0,1,0,1,0,0|2,0,0]=4 338 B14R1.415 C[C@@H](NC(=O)[C@@H]1CCCCN1)C(N)=O Amb24383485 [0,1,0,1,0,0|2,0,0]=4 339 B14R1.415 C[C@@H](NC(=O)[C@@H]1CCCCN1)C(O)=O Amb25211043 [0,1,0,1,0,0|1,0,0]=3 340 B14R1.415 C[C@@H](NC(=O)[C@H]1CCCCN1)C(N)=O Amb24594211 [0,1,0,1,0,0|2,0,0]=4 341 B14R1.415 C[C@H](NC(=O)C1CCCCN1)C(N)=O Amb24366377 [0,1,0,1,0,0|2,0,0]=4 342 B14R1.415 C[C@H](NC(=O)C1CCCCN1)C(O)=O Amb25697407 [0,1,0,1,0,0|1,0,0]=3 343 B14R1.415 C[C@H](NC(=O)C1CCCCO1)C(O)=O Amb24546951 [0,1,0,1,0,0|2,0,0]=4 344 B14R1.415 C[C@H](NC(=O)C1CCSCC1)C(O)=O Amb25387586 [0,1,0,1,0,0|1,0,0]=3 345 B14R1.415 C[C@H](NC(=O)C1CSCCN1)C(O)=O Amb25078268 [0,1,0,1,0,0|2,0,0]=4 346 B14R1.415 C[C@H](NC(=O)[C@@H]1CCCCN1)C(N)=O Amb24711768 [0,1,0,1,0,0|2,0,0]=4 347 B14R1.415 C[C@H](NC(=O)[C@H]1CCCCN1)C(O)=O Amb24441327 [0,1,0,1,0,0|1,0,0]=3 348 B14R1.4267 CC(NC(=O)C1CN(C)CC1)C(O)=O Amb18969960 [0,1,0,1,0,0|2,0,0]=4 349 B14R1.4267 CC(NC(=O)[C@@H]1CCC(=O)N1)C(O)=O Amb25813420 [0,1,0,1,0,0|2,0,0]=4 350 B14R1.4267 CC1CCC(O1)C(=O)NC(C)C(O)=O Amb24521310 [0,1,0,1,0,0|2,0,0]=4 351 B14R1.4267 C[C@@H](NC(=O)C1CCC(=O)N1)C(O)=O Amb19047890 [0,1,0,1,0,0|2,0,0]=4 352 B14R1.4267 C[C@@H](NC(=O)C1CN(C)CC1)C(O)=O Amb19047988 [0,1,0,1,0,0|2,0,0]=4 353 B14R1.4267 C[C@H]1CC[C@H](O1)C(=O)NC(C)C(O)=O Amb24971568 [0,1,0,1,0,0|2,0,0]=4 354 B14R1.4267 C[C@H]1CC[C@H](O1)C(=O)N[C@@H](C)C(O)=O Amb24972147 [0,1,0,1,0,0|2,0,0]=4 355 B14R1.4267 C[C@H]1CC[C@H](O1)C(=O)N[C@H](C)C(O)=O Amb24972124 [0,1,0,1,0,0|2,0,0]=4 356 B14R1.4943 CC(C(O)=O)N1CCSCC(N)C1=O Amb25216182 [0,1,0,1,0,0|2,0,0]=4 357 B14R1.16470 CC(NC(=O)C1(C)CNCC1)C(O)=O Amb25164730 [0,1,0,1,0,0|2,0,0]=4 358 B14R1.16470 CC(NC(=O)C1(N)CCCC1)C(N)=O Amb18289243 [0,1,0,1,0,0|2,0,0]=4 359 B14R1.16470 CC(NC(=O)C1(N)CCCC1)C(O)=O Amb18972885 [0,1,0,1,0,0|1,0,0]=3 360 B14R1.16470 CC(NC(=O)C1(N)COCC1)C(N)=O Amb24374323 [0,1,0,1,0,0|1,1,0]=4 361 B14R1.16470 C[C@@H](NC(=O)C1(N)CCCC1)C(O)=O Amb19048031 [0,1,0,1,0,0|1,0,0]=3 362 B14R1.16470 C[C@@H](NC(=O)C1(N)COCC1)C(N)=O Amb24366417 [0,1,0,1,0,0|1,1,0]=4 363 B14R1.16470 C[C@H](NC(=O)C1(C)CNCC1)C(O)=O Amb25121436 [0,1,0,1,0,0|2,0,0]=4 364 B14R1.16470 C[C@H](NC(=O)C1(N)CCCC1)C(N)=O Amb25211572 [0,1,0,1,0,0|2,0,0]=4 365 B14R1.16470 C[C@H](NC(=O)C1(N)CCCC1)C(O)=O Amb25302881 [0,1,0,1,0,0|1,0,0]=3 366 B14R1.16470 C[C@H](NC(=O)C1(N)COCC1)C(O)=O Amb25760144 [0,1,0,1,0,0|0,1,0]=3 367 B14R1.4500 CC1(COCC1N)C(=O)NCC(O)=O Amb25054366 [0,1,0,1,0,0|1,1,0]=4 368 B14R1.4900 NC1CCCCCN(CC(O)=O)C1=O Amb24666798 [0,1,0,1,0,0|1,0,0]=3 369 B14R1.10371 OC(=O)CNC(=O)C1CCCCCC1 Amb18299593 [0,1,0,1,0,0|2,0,0]=4 370 B14R1.10371 OC(=O)CNC(=O)C1CCCCCN1 Amb25279447 [0,1,0,1,0,0|1,0,0]=3 371 B14R1.10371 OC(=O)CNC(=O)N1CCCSCC1 Amb18955289 [0,1,0,1,0,0|2,0,0]=4 372 B14R1.10382 CC1(CCCCC1)C(=O)NCC(O)=O Amb24436253 [0,1,0,1,0,0|2,0,0]=4 373 B14R1.10382 CC1(CCOCC1)C(=O)NCC(O)=O Amb24351800 [0,1,0,1,0,0|1,1,0]=4 374 B14R1.10382 NC1(CCCCC1)C(=O)NCC(O)=O Amb18972834 [0,1,0,1,0,0|1,0,0]=3 375 B14R1.10382 NC1(CCOCC1)C(=O)NCC(O)=O Amb24736606 [0,1,0,1,0,0|0,1,0]=3 376 B14R1.10382 OC(=O)CNC(=O)C1(O)CCCCC1 Amb24473867 [0,1,0,1,0,0|2,0,0]=4 377 B14R1.678 CC1CCC(CC1)C(=O)NCC(=O)O Amb1805496 [0,1,0,1,0,0|2,0,0]=4 378 B14R1.678 CN1CCC(CC1)C(=O)NCC(O)=O Amb20414336 [0,1,0,1,0,0|2,0,0]=4 379 B14R1.678 C[C@@H]1CC[C@H](CC1)C(=O)NCC(O)=O Amb25685374 [0,1,0,1,0,0|2,0,0]=4 380 B14R1.678 NC1CCC(CC1)C(=O)NCC(O)=O Amb18290466 [0,1,0,1,0,0|2,0,0]=4 381 B14R1.15724 CC1(C)SCC(N)C(=O)NC1C(O)=O Amb25827152 [0,1,0,1,0,0|2,0,0]=4 382 B14R1.1396 COCCC1(CC1)C(=O)NCC(O)=O Amb25387573 [0,1,0,1,0,0|1,1,0]=4 383 B14R1.417 CN(C(=O)C1CCCCC1)CC(=O)O Amb1115423 [0,1,0,1,0,0|2,0,0]=4 384 B14R1.417 CN(CC(O)=O)C(=O)C1CCCCO1 Amb18987515 [0,1,0,1,0,0|2,0,0]=4 385 B14R1.417 CN(CC(O)=O)C(=O)C1CCSCC1 Amb25387379 [0,1,0,1,0,0|1,0,0]=3 386 B14R1.4266 C[C@@H]1CC[C@@H](O1)C(=O)N(C)CC(O)=O Amb24971545 [0,1,0,1,0,0|2,0,0]=4 387 B14R2.15567 OC(=O)CNC(=O)C1C2CCCC21 Amb25332695 [0,0,0,2,0,0|2,0,0]=4 388 B14R2.25733 OC(=O)C1CC(=O)C2CCCCN12 Amb18823389 [0,0,0,2,0,0|2,0,0]=4 389 B14R2.5062 NC(=O)C1CSC2CC(N)C(=O)N21 Amb25670240 [0,0,0,2,0,0|1,0,0]=3 390 B14R2.5062 NC(=O)[C@H]1CS[C@@H]2C[C@@H](N)C(=O)N21 Amb24630757 [0,0,0,2,0,0|1,0,0]=3 391 B14R2.5062 NC1CC2SCC(C(O)=O)N2C1=O Amb24071889 [0,0,0,2,0,0|0,0,0]=2 392 B14R2.5412 NC1C2SCCC(C(O)=O)N2C1=O Amb24092000 [0,0,0,2,0,0|2,0,0]=4 393 B10R0.6 CC(=O)NC(=O)CCCCC Amb25383542 [1,0,0,0,1,0|2,0,0]=4 394 B10R0.6 CCCCCC(=O)CC(=O)C Amb10807435 [1,0,0,0,1,0|2,0,0]=4 395 B10R0.6 CCCCCC(=O)NC(N)=O Amb24755476 [1,0,0,0,1,0|2,0,0]=4 396 B10R0.32 CCCC(C)C(=O)NC(N)=O Amb24538123 [1,0,0,0,1,0|2,0,0]=4 397 B10R0.32 CCCC(N)C(=O)NC(N)=O Amb25295150 [1,0,0,0,1,0|1,0,0]=3 398 B10R0.32 CCC[C@@H](N)C(=O)NC(N)=O Amb25148152 [1,0,0,0,1,0|1,0,0]=3 399 B10R0.32 CCC[C@H](N)C(=O)NC(N)=O Amb25797864 [1,0,0,0,1,0|1,0,0]=3 400 B10R0.32 COCC(N)C(=O)NC(N)=O Amb24453979 [1,0,0,0,1,0|1,1,0]=4 401 B14R0.46 CCCCC(C)C(=O)NCCCC(O)=O Amb24775430 [0,0,0,0,0,2|2,0,0]=4