0 B14R0.393 CCCCCCCCCNC(=O)CC#N CSC010006857 [0,0,0,0,0,0|3,0,1]=4 1 B13R0.2 CCCCCCCCCC(=O)OCC CSC011217761 [1,0,0,0,0,0|0,0,0]=1 2 B13R0.2 CCCCCCCCOC(=O)CCC CSC000047179 [1,0,0,0,0,0|2,0,0]=3 3 B13R0.147 CCCCCCCCCCC(=O)NN CSC000048412 [1,0,0,0,0,0|2,0,0]=3 4 B13R0.147 CCCCCCCCCCC(=O)OC CSC011215520 [1,0,0,0,0,0|0,0,0]=1 5 B15R0.244 CCOC(=O)CCCNC(=O)CCCNC CSC005882268 [0,1,0,0,0,0|2,0,1]=4 6 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC CSC047175229 [0,1,0,0,0,0|3,0,0]=4 7 B15R1.778 CCNC(=O)NCCCC1CCCCO1 CSC061014528 [0,0,0,1,0,0|3,0,0]=4 8 B15R1.778 CCOC(=O)CSCCN1CCCCC1 CSC047626562 [0,0,0,1,0,0|2,0,0]=3 9 B15R1.778 CNCC(=O)NCCCC1CCCCC1 CSC017421860 [0,0,0,1,0,0|3,0,0]=4 10 B15R1.778 NCCC(=O)NCCCC1CCCCC1 CSC022268857 [0,0,0,1,0,0|3,0,0]=4 11 B15R1.795 CCNC(=O)NCCCOC1CCCC1 CSC061378027 [0,0,0,1,0,0|3,0,0]=4 12 B15R1.795 CNCC(=O)NCCCCC1CCCC1 CSC056822032 [0,0,0,1,0,0|3,0,0]=4 13 B15R1.795 NCCC(=O)NCCCCC1CCCC1 CSC057291510 [0,0,0,1,0,0|3,0,0]=4 14 B15R1.843 CCOC(=O)C1CCCCN1CCC#N CSC000177105 [0,0,0,1,0,0|2,0,1]=4 15 B15R1.854 CCCCC1CCCC1NC(=O)CCN CSC057720406 [0,0,0,1,0,0|3,0,0]=4 16 B15R1.854 CCCCC1CCCC1NC(=O)CNC CSC057289441 [0,0,0,1,0,0|3,0,0]=4 17 B15R1.854 CCCCC1CCCC1NC(=O)NCC CSC025953199 [0,0,0,1,0,0|2,0,0]=3 18 B15R1.854 CCNC(=O)CN1CCCC1CCCO CSC011682830 [0,0,0,1,0,0|3,0,0]=4 19 B15R1.1252 CC1CCCCC1CCNC(=O)CCN CSC057382487 [0,0,0,1,0,0|3,0,0]=4 20 B15R1.1252 CNCC(=O)NCCC1CCCCC1C CSC057466619 [0,0,0,1,0,0|3,0,0]=4 21 B15R1.3880 CCCC1CNCCN1CC(=O)NCC CSC056982864 [0,0,0,1,0,0|3,0,0]=4 22 B15R1.3880 CCNC(=O)CN1CCCCC1CCN CSC011919237 [0,0,0,1,0,0|3,0,0]=4 23 B15R1.3880 CCNC(=O)CN1CCCCC1CCO CSC000228438 [0,0,0,1,0,0|3,0,0]=4 24 B15R1.3880 CCOC(=O)CN1CCCCC1CCN CSC011972623 [0,0,0,1,0,0|2,0,0]=3 25 B15R1.9209 CCOC(=O)[C@H]1CCCN1CCCC#N CSC061738427 [0,0,0,1,0,0|2,0,1]=4 26 B12R0.1 CCCCCCCCC(=O)OCC CSC011218606 [2,0,0,0,0,0|0,0,0]=2 27 B12R0.248 CCCCCCCCCC(=O)NN CSC011221126 [2,0,0,0,0,0|2,0,0]=4 28 B12R0.248 CCCCCCCCCC(=O)OC CSC011215519 [2,0,0,0,0,0|0,0,0]=2 29 B12R0.248 CCCCCCCCOC(=O)CC CSC000054043 [2,0,0,0,0,0|1,0,0]=3 30 B12R0.248 CCCCCCCSCC(=O)OC CSC000048336 [2,0,0,0,0,0|1,0,0]=3 31 B12R0.234 CCCCCCCCCOC(=O)C CSC000210669 [2,0,0,0,0,0|1,0,0]=3 32 B12R0.234 CCCCCCCCSCC(=O)N CSC046179943 [2,0,0,0,0,0|2,0,0]=4 33 B14R0.1 CCOC(=O)CCCCCC(=O)OCC CSC000034585 [1,1,0,0,0,0|1,0,1]=4 34 B14R0.493 CCCCCCCCCC(=O)NCCO CSC011221072 [1,1,0,0,0,0|1,0,0]=3 35 B14R0.493 CCCCCCCCNC(=O)CCCC CSC010535684 [1,1,0,0,0,0|2,0,0]=4 36 B14R0.140 CCCCCCCC(=O)NCC(=O)OC CSC011221095 [1,1,0,0,0,0|1,0,1]=4 37 B14R0.197 COC(=O)CCCCCCCC(=O)OC CSC000043244 [1,1,0,0,0,0|1,0,1]=4 38 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC CSC046562968 [0,2,0,0,0,0|2,0,0]=4 39 B14R1.263 CCOC(=O)C1CCCCN1CCN CSC013030127 [1,0,0,1,0,0|2,0,0]=4 40 B14R1.273 CCOC(=O)CN1CCCC1CNC CSC012985980 [1,0,0,1,0,0|2,0,0]=4 41 B14R1.598 CCOC(=O)CCN1CCNCC1C CSC010951974 [1,0,0,1,0,0|2,0,0]=4 42 B14R1.619 CCNC(=O)N1CCCCCC1CC CSC012140202 [1,0,0,1,0,0|2,0,0]=4 43 B14R1.965 CCOC(=O)CN1CCCCC1CC CSC000224124 [1,0,0,1,0,0|1,0,0]=3 44 B14R1.965 CCOC(=O)CN1CCCCC1CN CSC011552762 [1,0,0,1,0,0|2,0,0]=4 45 B14R1.6816 CCCCCCCCNC(=O)C1CC1 CSC013040397 [1,0,0,1,0,0|2,0,0]=4 46 B14R1.7146 CCOC(=O)CCN1CCCNCC1 CSC011472474 [1,0,0,1,0,0|2,0,0]=4 47 B14R1.7343 CCOC(=O)CN1CCCCCCC1 CSC000227866 [1,0,0,1,0,0|1,0,0]=3 48 B14R1.272 COC(=O)CNC1CCCC1CCO CSC019256596 [1,0,0,1,0,0|2,0,0]=4 49 B14R1.483 COC(=O)CN1CCCCC1CCN CSC011972594 [1,0,0,1,0,0|2,0,0]=4 50 B14R1.716 CCC(=O)NCCCN1CCCCC1 CSC000207121 [1,0,0,1,0,0|2,0,0]=4 51 B14R1.730 CCC(=O)NCCCOC1CCCC1 CSC047285948 [1,0,0,1,0,0|2,0,0]=4 52 B14R1.837 COC(=O)CCCN1CCCCC1C CSC011293843 [1,0,0,1,0,0|1,0,0]=3 53 B14R1.863 CCC1CCCCN1CCC(=O)OC CSC000177499 [1,0,0,1,0,0|1,0,0]=3 54 B14R1.1586 CNC(=O)CSCC1CCCCCC1 CSC027558395 [1,0,0,1,0,0|2,0,0]=4 55 B14R1.1586 COC(=O)CCCN1CCCCCC1 CSC011293848 [1,0,0,1,0,0|1,0,0]=3 56 B14R1.7684 COC(=O)CCN1CCCCCCC1 CSC000176933 [1,0,0,1,0,0|1,0,0]=3 57 B14R1.123 CCCCCCCCN1CCOCC1 CSC011995786 [1,0,0,1,0,0|1,0,1]=4 58 B14R1.123 CCOCCCNCC1CCCCC1 CSC000201939 [1,0,0,1,0,0|1,0,1]=4 59 B16R1.889 CCNC(=O)NCCOC1CCCCC1C CSC061562990 [0,1,0,1,0,0|2,0,0]=4 60 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 CSC060969534 [0,1,0,1,0,0|2,0,0]=4 61 B16R1.1482 NCCCC(=O)NCCCCC1CCCC1 CSC056752273 [0,1,0,1,0,0|2,0,0]=4 62 B16R1.929 CCOC(=O)CCNC(=O)C1CCCCC1 CSC011553399 [0,1,0,1,0,0|1,0,1]=4 63 B16R1.289 CC(C)NC(=O)CCNC1CCCCC1C CSC020038460 [0,1,0,1,0,0|2,0,0]=4 64 B16R1.289 CC(C)NC(=O)CNCC1CCCCC1C CSC005549473 [0,1,0,1,0,0|2,0,0]=4 65 B16R1.289 CC(N)CC(=O)NCCC1CCCCC1C CSC056677457 [0,1,0,1,0,0|2,0,0]=4 66 B16R1.4459 CCCC1CCCCC1NC(=O)CC(C)C CSC026723402 [0,1,0,1,0,0|2,0,0]=4 67 B16R1.6929 CC(C)NC(=O)CCNCC1CCCCC1 CSC000328739 [0,1,0,1,0,0|2,0,0]=4 68 B16R1.58444 CC(C)NC(=O)CCNC1CCCCCC1 CSC000328745 [0,1,0,1,0,0|2,0,0]=4 69 B16R1.1554 CCNC(=O)CN1CCCCC1CC(C)O CSC006793534 [0,1,0,1,0,0|2,0,0]=4 70 B16R1.14019 CCOC(=O)CCNC1CCNCC1(C)C CSC007410360 [0,1,0,1,0,0|2,0,0]=4 71 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 CSC011463436 [0,1,0,1,0,0|1,0,0]=3 72 B16R1.934 CCOC(=O)CNC(=O)CC1CCCCC1 CSC011354230 [0,1,0,1,0,0|1,0,1]=4 73 B16R1.13209 CCOC(=O)CCN1CCCC(C1)CNC CSC011473616 [0,1,0,1,0,0|2,0,0]=4 74 B16R1.31952 CCOC(=O)CNC(=O)C1CCCCCC1 CSC011707515 [0,1,0,1,0,0|1,0,1]=4 75 B16R1.15047 CCNC(=O)NCCNC1CCCCCC1 CSC006398843 [0,1,0,1,0,0|2,0,0]=4 76 B16R1.15047 CCNC(=O)NCCOC1CCCCCC1 CSC059587630 [0,1,0,1,0,0|2,0,0]=4 77 B16R1.295 CCCC1CCCCC1NC(=O)N(C)CC CSC026629975 [0,1,0,1,0,0|2,0,0]=4 78 B16R1.1011 CCCCC1CCCC1NC(=O)N(C)CC CSC027354306 [0,1,0,1,0,0|2,0,0]=4 79 B16R1.6945 CCN(C)C(=O)CNCC1CCCCC1C CSC005549460 [0,1,0,1,0,0|2,0,0]=4 80 B16R1.12723 CCOC(=O)C1CCCCN1CCCC#N CSC000229301 [0,1,0,1,0,0|1,0,1]=4 81 B16R1.1454 CCC1CCCCC1OCC(=O)NCCO CSC061187455 [0,1,0,1,0,0|2,0,0]=4 82 B16R1.1465 NCCCC(=O)NCCCC1CCCCC1 CSC022261835 [0,1,0,1,0,0|2,0,0]=4 83 B16R1.1465 OCCNC(=O)NCCCC1CCCCC1 CSC061849023 [0,1,0,1,0,0|2,0,0]=4 84 B16R1.4473 CC1CCCCC1CCNC(=O)CCCN CSC056843200 [0,1,0,1,0,0|2,0,0]=4 85 B16R1.4473 CNCCC(=O)NCCC1CCCCC1C CSC057318609 [0,1,0,1,0,0|2,0,0]=4 86 B16R1.16105 CCCCC1CCCC1NC(=O)CCCN CSC056669939 [0,1,0,1,0,0|2,0,0]=4 87 B16R1.16105 CCCCC1CCCC1NC(=O)NCCO CSC060768238 [0,1,0,1,0,0|2,0,0]=4 88 B16R2.11928 O=C1CN(CCN1)CC2CCCCCC2 CSC046858512 [0,0,0,2,0,0|2,0,0]=4 89 B16R2.105 CCCC(=O)N1CCCC12CCCCC2 CSC049028986 [0,0,0,2,0,0|2,0,0]=4 90 B16R2.105 CCNC(=O)N1CCCC12CCCCC2 CSC047540039 [0,0,0,2,0,0|2,0,0]=4 91 B16R2.3258 O=C1CCN(CCN1)CC2CCCCC2 CSC047012853 [0,0,0,2,0,0|2,0,0]=4 92 B16R2.724 CCNC(=O)N1CCCC1C2CCCC2 CSC011407053 [0,0,0,2,0,0|2,0,0]=4 93 B16R2.2151 CCOC(=O)CN1CCC2NCCC2C1 CSC017193965 [0,0,0,2,0,0|2,0,0]=4