0 B11R0.164 CCCCC(CC)CNC(=O)C CSC000191438 [0,0,0,0,0,0|2,0,0]=2 1 B11R0.164 CCCCC(CC)COC(=O)C CSC000031748 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.78 CCCCC(=O)NCC(=O)O CSC000205572 [1,0,0,0,0,0|2,0,1]=4 3 B12R0.608 CCCCC(CC)CNS(=O)(=O)C CSC011242110 [0,1,0,0,0,0|2,0,1]=4 4 B12R1.21 CC1CCC(CC1)CNC(=O)C CSC011466729 [0,0,0,1,0,0|2,0,0]=3 5 B12R1.21 CC1CCN(CC1)CCC(=O)O CSC000740328 [0,0,0,1,0,0|1,0,0]=2 6 B12R1.21 CN1CCC(CC1)CNC(=O)C CSC011382780 [0,0,0,1,0,0|3,0,0]=4 7 B12R1.75 CCC1CCCCC1NC(=O)C CSC011265613 [0,0,0,1,0,0|2,0,0]=3 8 B12R1.75 CCC1CCCCN1CC(C)O CSC011366229 [0,0,0,1,0,0|2,0,1]=4 9 B12R1.75 CCC1CCCCN1C[C@H](C)O CSC013227944 [0,0,0,1,0,0|2,0,1]=4 10 B12R1.125 CC1CCCCC1CNC(=O)C CSC011500032 [0,0,0,1,0,0|2,0,0]=3 11 B12R1.125 CC1CCCCN1CCC(=O)O CSC000727554 [0,0,0,1,0,0|1,0,0]=2 12 B12R1.125 CC1COCCC1CNC(=O)C CSC015246556 [0,0,0,1,0,0|3,0,0]=4 13 B12R1.626 CCC1CN(CCCO1)C(=O)C CSC014537897 [0,0,0,1,0,0|3,0,0]=4 14 B9R0.40 CCCC(CC)NCCO CSC011608062 [2,0,0,0,0,0|1,0,1]=4 15 B9R0.40 CCCCN(CC)CCN CSC011208488 [2,0,0,0,0,0|2,0,0]=4 16 B9R0.43 CCC(CC)COC(=O)C CSC000036730 [2,0,0,0,0,0|2,0,0]=4 17 B9R0.2 CCCCCCCC(=O)N CSC011216093 [2,0,0,0,0,0|1,0,0]=3 18 B9R0.2 CCCCCCOC(=O)C CSC000032130 [2,0,0,0,0,0|2,0,0]=4 19 B11R0.46 CCCCNC(=O)CCC(=O)O CSC000199522 [1,1,0,0,0,0|1,0,1]=4 20 B11R0.70 COCCN(C)CCC(=O)OC CSC011397890 [1,1,0,0,0,0|2,0,0]=4 21 B13R0.153 CCOCCN(CC)CCCC(=O)O CSC011905687 [0,1,0,0,0,1|1,0,0]=3 22 B13R0.207 CCC(C)CC(CC)NCCC(=O)O CSC011260696 [0,1,0,0,0,1|0,0,0]=2 23 B13R0.207 CCC(C)CN(CC)CCCC(=O)O CSC012582804 [0,1,0,0,0,1|1,0,0]=3 24 B13R0.378 CCCCC(CC)C(=O)NCC(=O)O CSC011249630 [0,1,0,0,0,1|0,0,1]=3 25 B13R0.519 CCCCN(CCO)CCCC(=O)O CSC011479273 [0,1,0,0,0,1|1,0,0]=3 26 B13R0.343 COCCN(CCC(=O)O)CC(C)C CSC011501712 [0,2,0,0,0,0|2,0,0]=4 27 B13R0.391 CCCCCN(CCO)CCC(=O)O CSC009827666 [0,2,0,0,0,0|1,0,0]=3 28 B13R0.523 CCCCC(CCC)CNC(=O)CN CSC056779914 [0,2,0,0,0,0|2,0,0]=4 29 B13R0.1318 CCCCN(CCCC)CCC(=O)O CSC000177689 [0,2,0,0,0,0|1,0,0]=3 30 B13R0.1318 CCCCN(CCOC)CCC(=O)O CSC020344901 [0,2,0,0,0,0|1,0,0]=3 31 B13R0.256 COC(C)CN(CCC(=O)O)C(C)C CSC012178472 [0,2,0,0,0,0|2,0,0]=4 32 B13R0.346 CCCCCN(CCC(=O)O)C(C)C CSC011355855 [0,2,0,0,0,0|1,0,0]=3 33 B13R0.375 CCCC(=O)N(CCC(=O)O)C(C)C CSC011354933 [0,2,0,0,0,0|1,0,1]=4 34 B13R0.108 CCC(C)C(=O)N(CC)CCC(=O)O CSC011395373 [0,2,0,0,0,0|1,0,1]=4 35 B13R0.129 CCCCC(=O)N(CC)CCC(=O)O CSC011395376 [0,2,0,0,0,0|1,0,0]=3 36 B13R0.129 CCN(CCC(=O)O)C(=O)CCOC CSC011707608 [0,2,0,0,0,0|1,0,1]=4 37 B13R0.129 CCOCC(=O)N(CC)CCC(=O)O CSC011395429 [0,2,0,0,0,0|1,0,1]=4 38 B13R0.1876 CCN(CCC(=O)O)C(=O)CC(C)C CSC011395396 [0,2,0,0,0,0|1,0,1]=4 39 B13R0.199 CCC(C)CC(CC)NC(C)C(=O)O CSC011487813 [0,2,0,0,0,0|1,0,0]=3 40 B13R0.199 CCC(C)CC(CC)N[C@@H](C)C(=O)O CSC014704727 [0,2,0,0,0,0|1,0,0]=3 41 B13R0.199 CCC(C)CC(CC)N[C@H](C)C(=O)O CSC014705282 [0,2,0,0,0,0|1,0,0]=3 42 B13R0.1230 CCC(CC)CN(CC)CCC(=O)O CSC011478151 [0,2,0,0,0,0|1,0,0]=3 43 B13R0.305 CCCCC(CC)CNC(=O)CCN CSC011437074 [0,2,0,0,0,0|2,0,0]=4 44 B13R0.305 CCCCC(CC)CNC(=O)CNC CSC000225777 [0,2,0,0,0,0|2,0,0]=4 45 B13R0.305 CCCCC(CC)CNC(=O)COC CSC000191442 [0,2,0,0,0,0|1,0,0]=3 46 B11R1.1 CC1CCN(CC1)CCCO CSC000213400 [1,0,0,1,0,0|1,0,1]=4 47 B11R1.17 CC1CCCCN1CCCO CSC000213889 [1,0,0,1,0,0|1,0,1]=4 48 B11R1.41 CCN1CCCCC1CCO CSC000228433 [1,0,0,1,0,0|1,0,1]=4 49 B11R1.203 OCCCN1CCCCCC1 CSC000212468 [1,0,0,1,0,0|1,0,1]=4 50 B11R1.81 CCNC1CCC(=O)NC1C CSC015312158 [1,0,0,1,0,0|2,0,0]=4 51 B11R1.91 CC(=O)NCC1CCCCC1 CSC000159420 [1,0,0,1,0,0|2,0,0]=4 52 B11R1.91 CC(=O)OCC1CCCCC1 CSC000000618 [1,0,0,1,0,0|2,0,0]=4 53 B11R1.91 NC(=O)CCC1CCCCC1 CSC000162346 [1,0,0,1,0,0|1,0,0]=3 54 B11R1.91 NC(=O)CCC1CCNCC1 CSC000695769 [1,0,0,1,0,0|2,0,0]=4 55 B11R1.91 NC(=O)CSC1CCCCC1 CSC000149379 [1,0,0,1,0,0|2,0,0]=4 56 B11R1.266 CCC1CC(CCO1)C(=O)N CSC015400545 [1,0,0,1,0,0|2,0,0]=4 57 B11R1.86 CC1CCCCC1CC(=O)N CSC000055404 [1,0,0,1,0,0|1,0,0]=3 58 B11R1.86 CC1CCCCC1NC(=O)N CSC000184843 [1,0,0,1,0,0|2,0,0]=4 59 B11R1.86 CC1CCCCN1CC(=O)C CSC000180633 [1,0,0,1,0,0|2,0,0]=4 60 B11R1.86 CC1CCCCN1CC(=O)N CSC000174848 [1,0,0,1,0,0|2,0,0]=4 61 B11R1.20 CC1CCN(CC1)CC(=O)N CSC000174812 [0,0,0,1,1,0|2,0,0]=4 62 B11R1.20 CC1CCN(CC1)CC(=O)O CSC020604374 [0,0,0,1,1,0|1,0,0]=3 63 B11R1.20 CN1CCC(CC1)CC(=O)N CSC000051843 [0,0,0,1,1,0|2,0,0]=4 64 B11R1.20 C[C@H]1CC[C@@H](CC1)NC(=O)C [0,0,0,1,1,0|2,0,0]=4 65 B11R1.53 CCC1CCCCN1C(=O)N CSC000748989 [0,0,0,1,1,0|2,0,0]=4 66 B11R1.742 CC(=O)NC1CCCCCC1 CSC000161067 [0,0,0,1,1,0|2,0,0]=4 67 B11R1.742 NC(=O)CC1CCCCCC1 CSC012282423 [0,0,0,1,1,0|1,0,0]=3 68 B11R1.742 NC(=O)NC1CCCCCC1 CSC000238987 [0,0,0,1,1,0|2,0,0]=4 69 B13R1.74 CCNCC1CCN(CC1)C(=O)C CSC012662836 [0,0,0,1,0,1|2,0,0]=4 70 B13R1.90 CCC1CCCCN1CCC(=O)O CSC015187846 [0,0,0,1,0,1|0,0,0]=2 71 B13R1.158 CC1CSCCN1CCCC(=O)O CSC011976763 [0,0,0,1,0,1|2,0,0]=4 72 B13R1.392 CSCC1CCCN1CCC(=O)O CSC018911493 [0,1,0,1,0,0|2,0,0]=4 73 B13R1.643 CCC1CN(CCS1)CCC(=O)O CSC012493617 [0,1,0,1,0,0|1,0,0]=3 74 B13R1.1022 OC(=O)CCN1CCCCCCC1 CSC015187237 [0,1,0,1,0,0|1,0,0]=3 75 B13R1.589 CC(=O)N1CCCCC1CC(=O)O CSC000748614 [0,1,0,1,0,0|1,0,1]=4 76 B13R1.3787 CC1CCCC(N1CCC(=O)O)C CSC046098707 [0,1,0,1,0,0|1,0,0]=3 77 B13R1.150 CC1SCCN(C1C)CCC(=O)O CSC012074059 [0,1,0,1,0,0|1,0,0]=3 78 B13R1.658 CCSCCN1CCC(C1)C(=O)O CSC012934413 [0,1,0,1,0,0|1,0,0]=3 79 B13R1.14 CNC(=O)CCN1CCC(CC1)C CSC015259175 [0,1,0,1,0,0|2,0,0]=4 80 B13R1.14 CNC(=O)NCC1CCC(CC1)C CSC011466346 [0,1,0,1,0,0|2,0,0]=4 81 B13R1.14 COC(=O)CCN1CCC(CC1)C CSC000178060 [0,1,0,1,0,0|1,0,0]=3 82 B13R1.14 COC(=O)CCN1CCN(CC1)C CSC000177413 [0,1,0,1,0,0|2,0,0]=4 83 B13R1.91 CCC1CCCCC1NC(=O)NC CSC011276899 [0,1,0,1,0,0|2,0,0]=4 84 B13R1.528 CNC(=O)NCC1CCCCC1C CSC011500114 [0,1,0,1,0,0|2,0,0]=4 85 B13R1.528 COC(=O)CCN1CCCCC1C CSC000176925 [0,1,0,1,0,0|1,0,0]=3 86 B13R1.1711 COC(=O)CCN1CCCCCC1 CSC000177403 [0,1,0,1,0,0|1,0,0]=3 87 B13R1.89 CCC1CCCCN1C(=O)C(=O)O CSC011297375 [0,1,0,1,0,0|1,0,1]=4 88 B13R1.6192 OC(=O)C(=O)NC1CCCCCC1 CSC011297277 [0,1,0,1,0,0|1,0,1]=4 89 B13R1.8682 CC1(CCCCCC1)CNC(=O)N CSC015525790 [0,1,0,1,0,0|2,0,0]=4 90 B13R1.341 CC(=O)NCC1CCC(CC1)(C)C CSC013084305 [0,1,0,1,0,0|2,0,0]=4 91 B13R1.341 CC1(CCC(CC1)CNC(=O)N)C CSC013079241 [0,1,0,1,0,0|2,0,0]=4 92 B13R2.5551 CC(=O)OCC1CC2CCC1C2 CSC000026639 [0,0,0,2,0,0|2,0,0]=4 93 B9R0.14 CCCC(CC)NC(=O)N CSC011593831 [1,0,0,0,1,0|2,0,0]=4 94 B13R0.300 CCCCN(CC)CCCCC(=O)O CSC011248781 [0,0,0,0,0,2|1,0,0]=3