0 B12R0.98 CSCCC(C)N(C)CCC(=O)O CSC012954040 [0,0,0,0,0,0|4,0,0]=4 1 B12R0.98 CSCCC(N)C(=O)NCC(C)C CSC000030925 [0,0,0,0,0,0|2,0,1]=3 2 B12R0.98 CSCCC(O)C(=O)NCC(C)O CSC019308738 [0,0,0,0,0,0|2,0,1]=3 3 B11R0.46 CCCCNC(=O)CCC(=O)O CSC000199522 [1,0,0,0,0,0|3,0,0]=4 4 B11R0.46 CCCCNC(=O)NCC(=O)O CSC011205310 [1,0,0,0,0,0|2,0,0]=3 5 B11R0.46 COCCNC(=O)CCC(=O)O CSC011309817 [1,0,0,0,0,0|2,1,0]=4 6 B13R0.36 COCCC(C)S(=O)(=O)NCC(=O)O CSC019903542 [0,1,0,0,0,0|2,1,0]=4 7 B13R0.40 CSCCC(N)C(=O)NCC(C)SC CSC023995721 [0,1,0,0,0,0|1,1,1]=4 8 B13R0.42 CSCCC(O)C(=O)NCC(C)(C)O CSC059250588 [0,1,0,0,0,0|2,0,1]=4 9 B13R0.42 CSCC[C@H](N)C(=O)NCC(C)(C)C CSC011425582 [0,1,0,0,0,0|2,0,1]=4 10 B13R0.42 CSCC[C@H](N)C(=O)NCC(F)(F)F CSC011423189 [0,1,0,0,0,0|2,0,1]=4 11 B13R0.128 CCCCC(C)C(=O)NC(C)C(=O)O CSC014590849 [0,1,0,0,0,0|2,0,0]=3 12 B13R0.128 CCCCC(C)C(=O)N[C@@H](C)C(=O)O CSC014590879 [0,1,0,0,0,0|2,0,0]=3 13 B13R0.128 CCCCC(C)C(=O)N[C@H](C)C(=O)O CSC014590888 [0,1,0,0,0,0|2,0,0]=3 14 B13R0.128 CSCC[C@H](N)C(=O)NC(C)C(C)C CSC011423288 [0,1,0,0,0,0|2,0,1]=4 15 B13R0.139 CC(OCCC=C)C(=O)NCC(=O)O CSC012904592 [0,1,0,0,0,0|2,0,1]=4 16 B13R0.139 CCCCOC(C)C(=O)NCC(=O)O CSC012904591 [0,1,0,0,0,0|2,0,0]=3 17 B13R0.139 CCCCSC(C)C(=O)NCC(=O)O CSC012904540 [0,1,0,0,0,0|2,0,0]=3 18 B13R0.378 CCCCC(CC)C(=O)NCC(=O)O CSC011249630 [0,1,0,0,0,0|2,0,0]=3 19 B13R0.465 CCCCC(C)C(=O)N(C)CC(=O)N CSC059352376 [0,1,0,0,0,0|3,0,0]=4 20 B13R0.465 CCCCC(C)C(=O)N(C)CC(=O)O CSC014590856 [0,1,0,0,0,0|2,0,0]=3 21 B13R0.698 COCCC(C)(C)C(=O)NCC(=O)N CSC059965718 [0,1,0,0,0,0|2,1,0]=4 22 B13R1.45 OC(=O)CNC(=O)C1CCSCC1 CSC015505854 [0,0,0,1,0,0|1,0,0]=2 23 B13R1.45 OC(=O)CNC(=O)N1CCSCC1 CSC011297506 [0,0,0,1,0,0|2,0,0]=3 24 B13R1.3553 CSCC[C@H](N)C(=O)NC1CC1C CSC011669759 [0,0,0,1,0,0|2,0,1]=4 25 B13R1.6294 CC(O)CNC(=O)C1(CCSC1)O CSC015520025 [0,0,0,1,0,0|2,0,1]=4 26 B13R0.345 CCCCC(C)C(=O)NCCC(=O)O CSC014590845 [0,0,0,0,0,1|2,0,0]=3 27 B13R0.345 CCCCN(C)C(=O)NCCC(=O)O CSC011427974 [0,0,0,0,0,1|3,0,0]=4 28 B13R0.345 COCCN(C)C(=O)NCCC(=O)O CSC011477063 [0,0,0,0,0,1|2,1,0]=4 29 B13R0.345 CSCCC(N)C(=O)NCCC(C)C CSC019357268 [0,0,0,0,0,1|2,0,1]=4 30 B10R0.78 CCCCC(=O)NCC(=O)O CSC000205572 [2,0,0,0,0,0|0,0,0]=2 31 B12R0.252 CCC(C)NC(=O)C(N)CCSC CSC000030916 [1,1,0,0,0,0|1,0,1]=4 32 B12R0.252 CSCCC(O)C(=O)NC(C)CO CSC017453501 [1,1,0,0,0,0|1,0,1]=4 33 B12R0.353 CCCN(C)C(=O)[C@@H](N)CCSC CSC011423399 [1,1,0,0,0,0|1,0,1]=4 34 B12R0.353 CSCC[C@H](N)C(=O)N(C)CC=C CSC013050954 [1,1,0,0,0,0|1,0,0]=3 35 B12R0.123 CCCSCC(=O)NC(C)C(=O)O CSC012905436 [1,1,0,0,0,0|2,0,0]=4 36 B12R0.123 CCCSCC(=O)N[C@@H](C)C(=O)O CSC012905627 [1,1,0,0,0,0|2,0,0]=4 37 B12R0.123 CCCSCC(=O)N[C@H](C)C(=O)O CSC012905774 [1,1,0,0,0,0|2,0,0]=4 38 B12R0.141 CCCSCC(=O)N(C)CC(=O)O CSC012904764 [1,1,0,0,0,0|2,0,0]=4 39 B12R0.255 CSCCCCC(=O)NCC(=O)O CSC019889757 [1,1,0,0,0,0|0,0,0]=2 40 B12R0.255 CSCCCNC(=O)CCC(=O)O CSC011957421 [1,1,0,0,0,0|1,0,0]=3 41 B12R0.255 CSCCCNC(=O)NC[C@@H](C)O CSC019711513 [1,1,0,0,0,0|1,0,1]=4 42 B12R0.645 CCCCCS(=O)(=O)NCC(=O)O CSC010439251 [1,1,0,0,0,0|2,0,0]=4 43 B12R0.645 COCCCS(=O)(=O)NCC(=O)O CSC000690538 [1,1,0,0,0,0|1,1,0]=4 44 B12R0.76 CSCC(C)C(=O)NC(C)C(=O)O CSC012905469 [1,1,0,0,0,0|1,0,0]=3 45 B12R0.76 CSCC(C)C(=O)N[C@@H](C)C(=O)O CSC012905654 [1,1,0,0,0,0|1,0,0]=3 46 B12R0.76 CSCC(C)C(=O)N[C@H](C)C(=O)O CSC012905809 [1,1,0,0,0,0|1,0,0]=3 47 B12R0.174 CSCC(C)(C)C(=O)NCC(=O)N CSC017474651 [1,1,0,0,0,0|2,0,0]=4 48 B12R0.191 CSCC(C)C(=O)N(C)CC(=O)O CSC012904797 [1,1,0,0,0,0|1,0,0]=3 49 B12R0.193 CCCC(C)C(=O)NCC(=O)OC CSC011257914 [1,1,0,0,0,0|1,0,0]=3 50 B14R0.2268 CCCCC(CC)CC(=O)NCC(=O)O CSC018646110 [0,1,0,0,0,1|2,0,0]=4 51 B14R0.42 CCC(O)CCNC(=O)[C@@H](N)CCSC CSC012917367 [0,1,0,0,0,1|1,0,1]=4 52 B14R0.44 CCCCC(C)C(=O)NC(C)CC(=O)O CSC014590868 [0,1,0,0,0,1|2,0,0]=4 53 B14R0.186 CCCCOC(C)C(=O)NCCC(=O)O CSC012904891 [0,1,0,0,0,1|2,0,0]=4 54 B14R0.186 CCCCSC(C)C(=O)NCCC(=O)O CSC012904882 [0,1,0,0,0,1|2,0,0]=4 55 B14R0.186 CSCCCN(C)C(=O)NCCC(=O)O CSC014570043 [0,1,0,0,0,1|2,0,0]=4 56 B14R0.396 CCCCC(C)C(=O)NCC(C)C(=O)O CSC014590899 [0,1,0,0,0,1|2,0,0]=4 57 B14R0.2905 CCCCC(CC)C(=O)NCCC(=O)O CSC011249631 [0,1,0,0,0,1|2,0,0]=4 58 B14R0.597 CCCC(O)CNC(=O)[C@@H](N)CCSC CSC012917900 [0,2,0,0,0,0|1,0,1]=4 59 B14R0.597 CCOC(=O)CNC(=O)C(N)CCSC CSC009990870 [0,2,0,0,0,0|0,0,0]=2 60 B14R0.597 CCOC(=O)CNC(=O)[C@@H](N)CCSC CSC011423780 [0,2,0,0,0,0|0,0,0]=2 61 B14R0.597 COCC(C)CNC(=O)[C@@H](N)CCSC CSC011583644 [0,2,0,0,0,0|1,0,1]=4 62 B14R0.1026 COC(C)(C)CNC(=O)[C@@H](N)CCSC CSC012918314 [0,2,0,0,0,0|1,0,1]=4 63 B14R0.241 CCCCOC(C)C(=O)NC(C)C(=O)O CSC012905467 [0,2,0,0,0,0|2,0,0]=4 64 B14R0.241 CCCCOC(C)C(=O)N[C@@H](C)C(=O)O CSC012905651 [0,2,0,0,0,0|2,0,0]=4 65 B14R0.241 CCCCOC(C)C(=O)N[C@H](C)C(=O)O CSC012905806 [0,2,0,0,0,0|2,0,0]=4 66 B14R0.241 CCCCSC(C)C(=O)NC(C)C(=O)O CSC012905456 [0,2,0,0,0,0|2,0,0]=4 67 B14R0.241 CCCCSC(C)C(=O)N[C@@H](C)C(=O)O CSC012905641 [0,2,0,0,0,0|2,0,0]=4 68 B14R0.241 CCCCSC(C)C(=O)N[C@H](C)C(=O)O CSC012905794 [0,2,0,0,0,0|2,0,0]=4 69 B14R0.367 CCCCC(CC)C(=O)NC(C)C(=O)O CSC011249633 [0,2,0,0,0,0|2,0,0]=4 70 B14R0.367 CCCCC(CC)C(=O)N[C@@H](C)C(=O)O CSC011416979 [0,2,0,0,0,0|2,0,0]=4 71 B14R0.367 CCCCC(CC)C(=O)N[C@H](C)C(=O)O CSC011504728 [0,2,0,0,0,0|2,0,0]=4 72 B14R0.588 CCCCC(C)C(=O)NC(C)(C)C(=O)O CSC014590886 [0,2,0,0,0,0|2,0,0]=4 73 B14R0.594 CCCCC(C)C(=O)N(C)C(C)C(=O)O CSC014590898 [0,2,0,0,0,0|2,0,0]=4 74 B14R0.511 CCOCCOC(C)C(=O)NCC(=O)O CSC011593116 [0,2,0,0,0,0|1,1,0]=4 75 B14R0.2380 CCCCOC(C)C(=O)N(C)CC(=O)O CSC012904794 [0,2,0,0,0,0|2,0,0]=4 76 B14R0.2380 CCCCSC(C)C(=O)N(C)CC(=O)O CSC012904783 [0,2,0,0,0,0|2,0,0]=4 77 B14R0.964 CCCCC(CC)C(=O)N(C)CC(=O)O CSC011249634 [0,2,0,0,0,0|2,0,0]=4 78 B14R0.592 CCCCC(C)C(=O)N(CC)CC(=O)O CSC014590875 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.210 NC(=O)CN1CCCCCC1=O CSC000162079 [1,0,0,1,0,0|2,0,0]=4 80 B14R1.160 CC1CCCCC1C(=O)NCC(=O)O CSC000092554 [0,0,0,1,0,1|2,0,0]=4 81 B14R1.423 OC(=O)CNC(=O)CC1CCCCO1 CSC012735774 [0,0,0,1,0,1|2,0,0]=4 82 B14R1.423 OC(=O)CNC(=O)CC1CCOCC1 CSC016384630 [0,0,0,1,0,1|1,1,0]=4 83 B14R1.423 OC(=O)CNC(=O)NC1CCCCC1 CSC011190636 [0,0,0,1,0,1|2,0,0]=4 84 B14R1.420 NC(=O)CCNC(=O)C1CCSCC1 CSC061521337 [0,0,0,1,0,1|2,0,0]=4 85 B14R1.420 OC(=O)CCNC(=O)C1CCCCO1 CSC011625457 [0,0,0,1,0,1|2,0,0]=4 86 B14R1.420 OC(=O)CCNC(=O)C1CCSCC1 CSC016379853 [0,0,0,1,0,1|1,0,0]=3 87 B14R1.420 OC(=O)CCNC(=O)N1CCSCC1 CSC011428339 [0,0,0,1,0,1|2,0,0]=4 88 B14R1.162 COC(=O)CNC(=O)C1CCC(O1)C CSC012840616 [0,1,0,1,0,0|2,0,0]=4 89 B14R1.163 CNC(=O)CNC(=O)C1CCSCC1 CSC050950156 [0,1,0,1,0,0|2,0,0]=4 90 B14R1.163 COC(=O)CNC(=O)C1CCCCN1 CSC011368980 [0,1,0,1,0,0|1,0,0]=3 91 B14R1.163 COC(=O)CNC(=O)C1CCCCO1 CSC011625675 [0,1,0,1,0,0|2,0,0]=4 92 B14R1.163 COC(=O)CNC(=O)C1CCCCS1 CSC012790688 [0,1,0,1,0,0|2,0,0]=4 93 B14R1.163 COC(=O)CNC(=O)[C@@H]1CCCCN1 CSC012931243 [0,1,0,1,0,0|1,0,0]=3 94 B14R1.163 COC(=O)CNC(=O)[C@H]1CCCCN1 CSC012931240 [0,1,0,1,0,0|1,0,0]=3 95 B14R1.13577 COC(=O)CNC(=O)C1(CCCC1)O CSC061308025 [0,1,0,1,0,0|2,0,0]=4 96 B14R1.13577 COC(=O)CNC(=O)C1(CCNC1)C CSC011813716 [0,1,0,1,0,0|2,0,0]=4 97 B14R1.13577 COC(=O)CNC(=O)C1(CCSC1)O CSC061937409 [0,1,0,1,0,0|1,0,0]=3 98 B14R1.54 CCC1CCC(O1)C(=O)NCC(=O)O CSC016381083 [0,1,0,1,0,0|2,0,0]=4 99 B14R1.149 CC1CC(CCO1)C(=O)NCC(=O)O CSC015262338 [0,1,0,1,0,0|1,1,0]=4 100 B14R1.415 CC(NC(=O)C1CCCCC1)C(=O)O CSC000186443 [0,1,0,1,0,0|2,0,0]=4 101 B14R1.415 CC(NC(=O)C1CCCCO1)C(=O)O CSC011625459 [0,1,0,1,0,0|2,0,0]=4 102 B14R1.415 CC(NC(=O)C1CCSCC1)C(=O)O CSC015613161 [0,1,0,1,0,0|1,0,0]=3 103 B14R1.415 CC(NC(=O)N1CCSCC1)C(=O)O CSC011428344 [0,1,0,1,0,0|2,0,0]=4 104 B14R1.415 C[C@@H](NC(=O)C1CCCCO1)C(=O)O CSC011625481 [0,1,0,1,0,0|2,0,0]=4 105 B14R1.415 C[C@@H](NC(=O)C1CCOCC1)C(=O)O CSC011504707 [0,1,0,1,0,0|1,1,0]=4 106 B14R1.415 C[C@@H](NC(=O)C1CCSCC1)C(=O)O CSC015378846 [0,1,0,1,0,0|1,0,0]=3 107 B14R1.415 C[C@@H](NC(=O)N1CCSCC1)C(=O)O CSC011505098 [0,1,0,1,0,0|2,0,0]=4 108 B14R1.415 C[C@H](NC(=O)C1CCCCO1)C(=O)O CSC011625474 [0,1,0,1,0,0|2,0,0]=4 109 B14R1.415 C[C@H](NC(=O)C1CCOCC1)C(=O)O CSC011416958 [0,1,0,1,0,0|1,1,0]=4 110 B14R1.415 C[C@H](NC(=O)C1CCSCC1)C(=O)O CSC015261311 [0,1,0,1,0,0|1,0,0]=3 111 B14R1.415 C[C@H](NC(=O)N1CCSCC1)C(=O)O CSC011428355 [0,1,0,1,0,0|2,0,0]=4 112 B14R1.4267 CC(NC(=O)[C@H]1CC[C@H](O1)C)C(=O)O [0,1,0,1,0,0|2,0,0]=4 113 B14R1.4267 C[C@@H](NC(=O)[C@H]1CC[C@H](O1)C)C(=O)O [0,1,0,1,0,0|2,0,0]=4 114 B14R1.4354 CC1CC(C(O1)C(=O)NCC(=O)O)C CSC057243752 [0,1,0,1,0,0|2,0,0]=4 115 B14R1.1396 COCCC1(CC1)C(=O)NCC(=O)O CSC017471728 [0,1,0,1,0,0|1,1,0]=4 116 B14R1.417 CN(CC(=O)O)C(=O)C1CCCCC1 CSC000194979 [0,1,0,1,0,0|2,0,0]=4 117 B14R1.417 CN(CC(=O)O)C(=O)C1CCCCO1 CSC011625461 [0,1,0,1,0,0|2,0,0]=4 118 B14R1.417 CN(CC(=O)O)C(=O)C1CCOCC1 CSC011238870 [0,1,0,1,0,0|1,1,0]=4 119 B14R1.417 CN(CC(=O)O)C(=O)C1CCSCC1 CSC016378690 [0,1,0,1,0,0|1,0,0]=3 120 B14R1.417 CN(CC(=O)O)C(=O)N1CCSCC1 CSC011259637 [0,1,0,1,0,0|2,0,0]=4 121 B14R1.4266 CN(CC(=O)O)C(=O)C1CCC(=O)N1 CSC011222629 [0,1,0,1,0,0|2,0,0]=4 122 B14R1.4266 CN(CC(=O)O)C(=O)[C@@H]1CCC(=O)N1 CSC012924338 [0,1,0,1,0,0|2,0,0]=4 123 B14R1.4266 CN(CC(=O)O)C(=O)[C@H]1CCC(=O)N1 CSC012924346 [0,1,0,1,0,0|2,0,0]=4 124 B14R1.4266 C[C@H]1CC[C@H](O1)C(=O)N(C)CC(=O)O [0,1,0,1,0,0|2,0,0]=4 125 B14R0.46 CCCCC(C)C(=O)NCCCC(=O)O CSC014590848 [0,0,0,0,0,2|2,0,0]=4