0 B11R0.46 CCCCNC(=O)CCC(=O)O CSC000199522 [0,0,0,0,0,0|2,0,1]=3 1 B11R0.46 CCCCNC(=O)NCC(=O)O CSC011205310 [0,0,0,0,0,0|3,0,1]=4 2 B11R0.46 CCCCOC(=O)CCC(=O)C CSC011212340 [0,0,0,0,0,0|3,0,1]=4 3 B11R0.46 COCCNC(=O)CCC(=O)O CSC011309817 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.4 CCCCCCCNC(=O)C CSC009862821 [1,0,0,0,0,0|2,0,0]=3 5 B10R0.4 CCCCCCCNC(=O)N CSC009878357 [1,0,0,0,0,0|2,0,0]=3 6 B10R0.4 CCCCCCCOC(=O)C CSC000036323 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.4 CCCCOCCOC(=O)C CSC000032999 [1,0,0,0,0,0|3,0,0]=4 8 B10R0.78 CCCCC(=O)NCC(=O)O CSC000205572 [1,0,0,0,0,0|2,0,1]=4 9 B12R0.44 CC(C)CCNC(=O)CCC(=O)O CSC000199397 [0,1,0,0,0,0|2,0,1]=4 10 B12R0.98 CSCCC(C)N(C)CCC(=O)O CSC012954040 [0,1,0,0,0,0|2,0,0]=3 11 B12R0.255 CSCCCCC(=O)NCC(=O)O CSC019889757 [0,1,0,0,0,0|2,0,1]=4 12 B12R0.255 CSCCCNC(=O)CCC(=O)O CSC011957421 [0,1,0,0,0,0|2,0,1]=4 13 B12R0.645 CCCCCS(=O)(=O)NCC(=O)O CSC010439251 [0,1,0,0,0,0|3,0,0]=4 14 B12R1.46 CCC1COC(CN1C(=O)N)C CSC011406799 [0,0,0,1,0,0|3,0,0]=4 15 B12R1.54 OC(=O)CCC(=O)N1CCCC1 CSC000187315 [0,0,0,1,0,0|2,0,1]=4 16 B12R1.226 CC(O)CNC1CCCC(C1)C CSC000202052 [0,0,0,1,0,0|2,0,1]=4 17 B12R1.226 CC1CC(CCO1)CNC(=O)C CSC015329359 [0,0,0,1,0,0|3,0,0]=4 18 B12R1.226 CC1CCCC(C1)CNC(=O)C CSC011466721 [0,0,0,1,0,0|2,0,0]=3 19 B12R1.226 CC1CCCN(C1)CCC(=O)O CSC025718150 [0,0,0,1,0,0|1,0,0]=2 20 B12R1.1009 C[C@H]1CNC[C@H](N1CC(=O)N)C [0,0,0,1,0,0|3,0,0]=4 21 B12R1.1009 C[C@H]1CNC[C@H](N1CC(=O)N)C CSC009951244 [0,0,0,1,0,0|3,0,0]=4 22 B12R1.3110 CC(=O)NCC1(CCCCC1)C CSC012768579 [0,0,0,1,0,0|2,0,0]=3 23 B12R1.3110 CC(=O)NCC1(CCCNC1)C CSC013328373 [0,0,0,1,0,0|3,0,0]=4 24 B12R1.3110 CC(=O)NCC1(CCNCC1)C CSC013328399 [0,0,0,1,0,0|3,0,0]=4 25 B12R1.3110 CC(=O)NCC1(CCOCC1)C CSC012691598 [0,0,0,1,0,0|3,0,0]=4 26 B12R0.233 CCCSCC(=O)NCCC(=O)O CSC012904872 [0,0,0,0,0,1|2,0,1]=4 27 B9R0.2 CCCCCCCC(=O)N CSC011216093 [2,0,0,0,0,0|1,0,0]=3 28 B9R0.2 CCCCCCOC(=O)C CSC000032130 [2,0,0,0,0,0|2,0,0]=4 29 B9R0.45 CCCCCCSCCO CSC011304839 [2,0,0,0,0,0|1,0,1]=4 30 B11R0.40 CCCCCCCCC(=O)NN CSC011203378 [1,1,0,0,0,0|1,0,0]=3 31 B11R0.40 CCCCCCCCC(=O)OC CSC011215467 [1,1,0,0,0,0|0,0,0]=2 32 B11R0.40 CCCCCCCOC(=O)CC CSC000054044 [1,1,0,0,0,0|2,0,0]=4 33 B11R0.148 CCCCCCCCCC(=O)N CSC011216713 [1,1,0,0,0,0|1,0,0]=3 34 B11R0.70 COCCN(C)CCC(=O)OC CSC011397890 [1,1,0,0,0,0|2,0,0]=4 35 B11R0.164 CCCCC(CC)CNC(=O)C CSC000191438 [1,1,0,0,0,0|2,0,0]=4 36 B11R0.164 CCCCC(CC)COC(=O)C CSC000031748 [1,1,0,0,0,0|2,0,0]=4 37 B11R0.81 CCCCCCC(C)NCCO CSC011257444 [1,1,0,0,0,0|1,0,1]=4 38 B13R0.1 CCCCOCC(=O)NCCC(=O)O CSC012904886 [0,1,0,0,0,1|1,0,1]=4 39 B13R0.1 CCOCCCC(=O)NCCC(=O)O CSC011593163 [0,1,0,0,0,1|1,0,1]=4 40 B13R0.1 COCCCCC(=O)NCCC(=O)O CSC019947150 [0,1,0,0,0,1|1,0,1]=4 41 B13R0.1 CSCCCCC(=O)NCCC(=O)O CSC018722141 [0,1,0,0,0,1|1,0,1]=4 42 B13R0.139 CCCCCC(=O)N(C)CCC(=O)O CSC011389226 [0,1,0,0,0,1|1,0,1]=4 43 B13R0.139 CCCCOC(C)C(=O)NCC(=O)O CSC012904591 [0,1,0,0,0,1|1,0,1]=4 44 B13R0.139 CCCCSC(C)C(=O)NCC(=O)O CSC012904540 [0,1,0,0,0,1|1,0,1]=4 45 B13R0.139 CCSCCC(C)N(C)CCC(=O)O CSC017484153 [0,1,0,0,0,1|1,0,0]=3 46 B13R0.153 CCOCCN(CC)CCCC(=O)O CSC011905687 [0,1,0,0,0,1|2,0,0]=4 47 B13R0.331 CCCC(C)CC(=O)NCCC(=O)O CSC012904899 [0,1,0,0,0,1|1,0,1]=4 48 B13R0.333 CCCCCC(=O)NC(C)CC(=O)O CSC000244157 [0,1,0,0,0,1|1,0,1]=4 49 B13R0.339 CCCCCC(=O)NCC(C)C(=O)O CSC011724763 [0,1,0,0,0,1|1,0,1]=4 50 B13R0.345 CCCCC(C)C(=O)NCCC(=O)O CSC014590845 [0,1,0,0,0,1|1,0,1]=4 51 B13R0.345 CCCCC(C)C(C)NCCC(=O)O CSC057009880 [0,1,0,0,0,1|0,0,0]=2 52 B13R0.345 CSCCC(C)N(C)CCCC(=O)O CSC012996122 [0,1,0,0,0,1|2,0,0]=4 53 B13R0.1259 CCCCCS(=O)(=O)NCCC(=O)O CSC017469898 [0,1,0,0,0,1|2,0,0]=4 54 B13R0.349 CC(C)CCC(=O)N(C)CCC(=O)O CSC011389192 [0,2,0,0,0,0|1,0,1]=4 55 B13R0.351 CN(CCCC(C)(C)C)CCC(=O)O CSC014526329 [0,2,0,0,0,0|1,0,0]=3 56 B13R0.444 CC(C)CCCC(C)NC(C)C(=O)O CSC011536795 [0,2,0,0,0,0|1,0,0]=3 57 B13R0.444 CC(C)CCCC(C)N[C@@H](C)C(=O)O CSC056813209 [0,2,0,0,0,0|1,0,0]=3 58 B13R0.444 CC(C)CCCC(C)N[C@H](C)C(=O)O CSC057713259 [0,2,0,0,0,0|1,0,0]=3 59 B13R0.444 CC(C)CCCN(C)CC(C)C(=O)O CSC013183016 [0,2,0,0,0,0|1,0,0]=3 60 B13R0.615 CC(C)CC(C)CN(C)CCC(=O)O CSC014510497 [0,2,0,0,0,0|1,0,0]=3 61 B13R0.73 CCC(C)CC(=O)N(C)CCC(=O)O CSC013759485 [0,2,0,0,0,0|1,0,1]=4 62 B13R0.128 CCCCC(=O)N(C)CC(C)C(=O)O CSC011509883 [0,2,0,0,0,0|1,0,1]=4 63 B13R0.128 CCCCC(C)C(C)NC(C)C(=O)O CSC056824524 [0,2,0,0,0,0|1,0,0]=3 64 B13R0.128 CCCCC(C)C(C)N[C@@H](C)C(=O)O CSC056753374 [0,2,0,0,0,0|1,0,0]=3 65 B13R0.129 CCCCC(=O)N(CC)CCC(=O)O CSC011395376 [0,2,0,0,0,0|1,0,1]=4 66 B13R0.698 CCCCS(=O)(=O)N(C)CCC(=O)O CSC011389299 [0,2,0,0,0,0|2,0,0]=4 67 B13R0.346 CCCCCN(CCC(=O)O)C(C)C CSC011355855 [0,2,0,0,0,0|1,0,0]=3 68 B13R0.391 CCCCCN(CCO)CCC(=O)O CSC009827666 [0,2,0,0,0,0|1,0,0]=3 69 B13R0.294 CCC(C)(C)CCN(C)CCC(=O)O CSC019652033 [0,2,0,0,0,0|1,0,0]=3 70 B13R0.154 CCCCCCNC(=O)CCC(=O)O CSC000199496 [0,2,0,0,0,0|1,0,1]=4 71 B13R0.182 CC(C)OCCCN(C)CCC(=O)O CSC018705084 [0,2,0,0,0,0|1,0,0]=3 72 B13R0.1518 CCCC(=O)NC(C)(C)CCC(=O)O CSC011597021 [0,2,0,0,0,0|1,0,1]=4 73 B11R1.53 CCC1CCCCN1C(=O)N CSC000748989 [1,0,0,1,0,0|2,0,0]=4 74 B11R1.86 CC1CCCCC1CC(=O)N CSC000055404 [1,0,0,1,0,0|1,0,0]=3 75 B11R1.86 CC1CCCCC1NC(=O)N CSC000184843 [1,0,0,1,0,0|2,0,0]=4 76 B11R1.86 CC1CCCCN1CC(=O)C CSC000180633 [1,0,0,1,0,0|2,0,0]=4 77 B11R1.86 CC1CCCCN1CC(=O)N CSC000174848 [1,0,0,1,0,0|2,0,0]=4 78 B11R1.91 CC(=O)NCC1CCCCC1 CSC000159420 [1,0,0,1,0,0|2,0,0]=4 79 B11R1.91 CC(=O)OCC1CCCCC1 CSC000000618 [1,0,0,1,0,0|2,0,0]=4 80 B11R1.91 NC(=O)CCC1CCCCC1 CSC000162346 [1,0,0,1,0,0|1,0,0]=3 81 B11R1.91 NC(=O)CCC1CCNCC1 CSC000695769 [1,0,0,1,0,0|2,0,0]=4 82 B11R1.91 NC(=O)CSC1CCCCC1 CSC000149379 [1,0,0,1,0,0|2,0,0]=4 83 B11R1.742 CC(=O)NC1CCCCCC1 CSC000161067 [1,0,0,1,0,0|2,0,0]=4 84 B11R1.742 NC(=O)CC1CCCCCC1 CSC012282423 [1,0,0,1,0,0|1,0,0]=3 85 B11R1.742 NC(=O)NC1CCCCCC1 CSC000238987 [1,0,0,1,0,0|2,0,0]=4 86 B11R1.203 OCCCN1CCCCCC1 CSC000212468 [1,0,0,1,0,0|1,0,1]=4 87 B11R1.605 CC1CCCC(N1CCO)C CSC011305576 [1,0,0,1,0,0|1,0,1]=4 88 B11R1.156 CC1CCCC(N1C(=O)C)C CSC000243328 [0,0,0,1,1,0|2,0,0]=4 89 B11R1.157 CC1CCCC(C1)CC(=O)N CSC000058057 [0,0,0,1,1,0|1,0,0]=3 90 B11R1.157 CC1CCCN(C1)CC(=O)C CSC000180394 [0,0,0,1,1,0|2,0,0]=4 91 B11R1.928 CC(=O)NC1(CCCCC1)C CSC000243741 [0,0,0,1,1,0|2,0,0]=4 92 B11R1.928 CC1(CCCCC1)CC(=O)N CSC009956530 [0,0,0,1,1,0|1,0,0]=3 93 B13R1.149 CC1CN(CCS1)CCCC(=O)O CSC012047031 [0,0,0,1,0,1|2,0,0]=4 94 B13R1.658 CCSCCN1CCC(C1)C(=O)O CSC012934413 [0,0,0,1,0,1|2,0,0]=4 95 B13R1.3787 CC1CCCC(N1CCC(=O)O)C CSC046098707 [0,0,0,1,0,1|0,0,0]=2 96 B13R1.1035 CC1(CCCC(C1)CNC(=O)N)C CSC035220125 [0,1,0,1,0,0|2,0,0]=4 97 B13R1.1035 CC1(CN(CCS1)CCC(=O)O)C CSC012676320 [0,1,0,1,0,0|2,0,0]=4 98 B13R1.45 CN(CCC(=O)N)C1CCCCC1 CSC000177527 [0,1,0,1,0,0|2,0,0]=4 99 B13R1.45 OC(=O)CCC(=O)N1CCCCC1 CSC000243808 [0,1,0,1,0,0|1,0,1]=4 100 B13R1.6192 OC(=O)C(=O)NC1CCCCCC1 CSC011297277 [0,1,0,1,0,0|1,0,1]=4 101 B13R1.150 CC1SCCN(C1C)CCC(=O)O CSC012074059 [0,1,0,1,0,0|2,0,0]=4 102 B13R1.1022 OC(=O)CCN1CCCCCCC1 CSC015187237 [0,1,0,1,0,0|1,0,0]=3 103 B13R1.15 CNC(=O)NCC1CCCC(C1)C CSC011466341 [0,1,0,1,0,0|2,0,0]=4 104 B13R1.1711 COC(=O)CCN1CCCCCC1 CSC000177403 [0,1,0,1,0,0|1,0,0]=3 105 B13R1.2045 CNC(=O)NCC1(CCCCC1)C CSC012767747 [0,1,0,1,0,0|2,0,0]=4 106 B13R1.4641 CCC(=O)N1CC(CCCC1C)C CSC015417843 [0,1,0,1,0,0|2,0,0]=4 107 B13R1.4641 CNC(=O)N1CC(CCCC1C)C CSC016164088 [0,1,0,1,0,0|2,0,0]=4 108 B13R1.4928 CCC(=O)NC1C(CCCC1C)C CSC015610582 [0,1,0,1,0,0|2,0,0]=4 109 B13R1.4928 CNC(=O)NC1C(CCCC1C)C CSC016055431 [0,1,0,1,0,0|2,0,0]=4 110 B13R1.643 CCC1CN(CCS1)CCC(=O)O CSC012493617 [0,1,0,1,0,0|1,0,0]=3 111 B13R1.8682 CC1(CCCCCC1)CNC(=O)N CSC015525790 [0,1,0,1,0,0|2,0,0]=4 112 B13R2.5551 CC(=O)OCC1CC2CCC1C2 CSC000026639 [0,0,0,2,0,0|2,0,0]=4 113 B13R0.188 CCCCCC(=O)NCCCC(=O)O CSC000244082 [0,0,0,0,0,2|1,0,1]=4