0 B11R0.4 CCCCCCOC(=O)CCC CSC000037829 [0,0,0,0,0,0|2,0,1]=3 1 B11R0.4 CCCCSCCC(=O)OCC CSC011325042 [0,0,0,0,0,0|1,0,2]=3 2 B11R0.4 CCNC(=O)NCCCCCO CSC012017630 [0,0,0,0,0,0|3,0,1]=4 3 B10R0.1 CCCC(=O)OCCCCO CSC000073227 [1,0,0,0,0,0|3,0,0]=4 4 B10R0.1 CCCCCCC(=O)OCC CSC011219609 [1,0,0,0,0,0|0,0,1]=2 5 B10R0.1 CCCCCNC(=O)CNC CSC000225776 [1,0,0,0,0,0|3,0,0]=4 6 B10R0.1 CCCCCNC(=O)COC CSC000157996 [1,0,0,0,0,0|3,0,0]=4 7 B10R0.1 CCCCCOC(=O)CCC CSC000039025 [1,0,0,0,0,0|2,0,0]=3 8 B10R0.1 CCOC(=O)CCSCCO CSC011325821 [1,0,0,0,0,0|2,0,1]=4 9 B10R0.74 CCCCCCCC(=O)OC CSC011217195 [1,0,0,0,0,0|0,0,2]=3 10 B10R0.74 CCCCCCNC(=O)NC CSC000235370 [1,0,0,0,0,0|2,0,1]=4 11 B10R0.74 CCOCCCNC(=O)CC CSC000161224 [1,0,0,0,0,0|2,0,1]=4 12 B10R0.74 CCOCCSCC(=O)OC CSC000001124 [1,0,0,0,0,0|2,0,1]=4 13 B12R0.1 CCCCCCCCC(=O)OCC CSC011218606 [0,1,0,0,0,0|0,0,2]=3 14 B12R0.1 CCCCOCCOC(=O)CCC CSC000053117 [0,1,0,0,0,0|2,0,1]=4 15 B12R0.4 CCCCCCNC(=O)CC(C)C CSC017395171 [0,1,0,0,0,0|2,0,1]=4 16 B12R0.4 CCCCCCOC(=O)CC(C)C CSC000047473 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.32 CCCC(=O)OC1CCCCC1 CSC000026545 [0,0,0,1,0,0|2,0,1]=4 18 B12R1.32 CCOC(=O)CC1=CCCCC1 CSC011899744 [0,0,0,1,0,0|0,0,2]=3 19 B12R1.32 CCOC(=O)CC1CCCCC1 CSC000171474 [0,0,0,1,0,0|0,0,2]=3 20 B12R1.32 CCOC(=O)CC1CCOCC1 CSC011218914 [0,0,0,1,0,0|1,0,2]=4 21 B12R1.32 CCOC(=O)CN1CCOCC1 CSC000188100 [0,0,0,1,0,0|2,0,1]=4 22 B12R1.32 CCOC(=O)CN1CCSCC1 CSC011247055 [0,0,0,1,0,0|2,0,1]=4 23 B12R1.51 CCNC(=O)CCC1CCCC1 CSC000160163 [0,0,0,1,0,0|1,0,2]=4 24 B12R1.51 CCOC(=O)CCC1CCCC1 CSC000170312 [0,0,0,1,0,0|0,0,2]=3 25 B12R1.51 CCOC(=O)NN=C1CCCC1 CSC015438957 [0,0,0,1,0,0|2,0,1]=4 26 B12R1.308 CCOC(=O)C1=C(OCCC1)C CSC000036422 [0,0,0,1,0,0|1,0,2]=4 27 B12R1.316 CCOC(=O)c1ccnn1CC CSC012558227 [0,0,0,1,0,0|2,0,1]=4 28 B12R1.1564 CCNC(=O)C1CCCCCC1 CSC011750764 [0,0,0,1,0,0|1,0,2]=4 29 B12R1.1564 CCOC(=O)C1CCCCCC1 CSC011707495 [0,0,0,1,0,0|0,0,2]=3 30 B9R0.5 CCCCCC(=O)OCC CSC000170156 [2,0,0,0,0,0|0,0,0]=2 31 B9R0.5 CCCCNC(=O)NCC CSC000163430 [2,0,0,0,0,0|2,0,0]=4 32 B9R0.5 CCCCOC(=O)CCC CSC011212260 [2,0,0,0,0,0|2,0,0]=4 33 B9R0.5 CCOC(=O)CCCC#N CSC009871613 [2,0,0,0,0,0|1,0,1]=4 34 B9R0.46 CCC(=O)NCCCOC CSC000159236 [2,0,0,0,0,0|2,0,0]=4 35 B9R0.46 CCCCCCC(=O)OC CSC011215249 [2,0,0,0,0,0|0,0,1]=3 36 B9R0.46 CCCCCNC(=O)CC CSC000157985 [2,0,0,0,0,0|1,0,0]=3 37 B9R0.46 CCCCCOC(=O)CC CSC000031694 [2,0,0,0,0,0|1,0,0]=3 38 B9R0.2 CCCCCCOC(=O)C CSC000032130 [2,0,0,0,0,0|1,0,1]=4 39 B11R0.2 CCCCCOC(=O)CC(C)C CSC000054031 [1,1,0,0,0,0|2,0,0]=4 40 B11R0.5 CCCNC(=O)CC(=O)OCC CSC000058579 [1,1,0,0,0,0|1,0,1]=4 41 B11R0.81 CCCCCCC(=O)OCC=C CSC000033353 [1,1,0,0,0,0|0,0,2]=4 42 B11R0.81 CCCCCNC(=O)NCCC CSC000163177 [1,1,0,0,0,0|2,0,0]=4 43 B11R0.81 CCCCCOC(=O)CCCC CSC000033676 [1,1,0,0,0,0|2,0,0]=4 44 B11R0.142 CCCCCOC(=O)C(C)CC CSC000054049 [1,1,0,0,0,0|2,0,0]=4 45 B11R0.42 CCCCCCOC(=O)C(C)C CSC000047476 [1,1,0,0,0,0|1,0,1]=4 46 B11R0.154 CCCCCC(C)NC(=O)CC CSC000174102 [1,1,0,0,0,0|1,0,1]=4 47 B11R0.154 CCCCCC(O)CC(=O)OC CSC000074991 [1,1,0,0,0,0|0,0,2]=4 48 B13R0.2 CCCCCCCCCC(=O)OCC CSC011217761 [0,2,0,0,0,0|0,0,2]=4 49 B13R0.193 CCOC(=O)CNC(=O)CCCNC CSC011367938 [0,2,0,0,0,0|1,0,1]=4 50 B13R0.154 CCCCCCCC(=O)OCC(C)O CSC010286083 [0,2,0,0,0,0|0,0,2]=4 51 B11R1.16 CCNC(=O)C1CCCCC1 CSC000160126 [1,0,0,1,0,0|1,0,1]=4 52 B11R1.30 CCCC(=O)OC1CCCC1 CSC016221133 [1,0,0,1,0,0|2,0,0]=4 53 B11R1.30 CCOC(=O)C=C1CCCC1 CSC000054197 [1,0,0,1,0,0|0,0,0]=2 54 B11R1.30 CCOC(=O)CC1CCCO1 CSC011219920 [1,0,0,1,0,0|1,0,1]=4 55 B11R1.30 CCOC(=O)CN1CCCC1 CSC000188105 [1,0,0,1,0,0|1,0,1]=4 56 B11R1.356 CCCCCNC(=O)C1CC1 CSC000157986 [1,0,0,1,0,0|2,0,0]=4 57 B11R1.40 CCC(=O)NC1CCCCC1 CSC000158241 [1,0,0,1,0,0|1,0,1]=4 58 B11R1.40 COC(=O)C=C1CCCCC1 CSC011528868 [1,0,0,1,0,0|0,0,0]=2 59 B11R1.40 COC(=O)CN1CCCCC1 CSC000188175 [1,0,0,1,0,0|1,0,1]=4 60 B11R1.40 COC(=O)NC1CCCCC1 CSC000235984 [1,0,0,1,0,0|1,0,1]=4 61 B11R1.222 COC(=O)C1CCCCC1C CSC023680028 [1,0,0,1,0,0|0,0,2]=4 62 B11R1.852 CCC(=O)N1CCCCCC1 CSC000157761 [1,0,0,1,0,0|1,0,1]=4 63 B11R1.852 COC(=O)C1CCCCCC1 CSC000699111 [1,0,0,1,0,0|0,0,2]=4 64 B13R1.42 CCOC(=O)CCC1CCCCC1 CSC000170578 [0,1,0,1,0,0|0,0,2]=4 65 B13R1.42 CCOC(=O)NN=C1CCSCC1 CSC016133966 [0,1,0,1,0,0|2,0,0]=4 66 B13R1.470 CCOC(=O)CN1CCCCC1C CSC000227853 [0,1,0,1,0,0|0,0,2]=4 67 B13R1.1464 CCOC(=O)C1CCCCCCC1 CSC012002886 [0,1,0,1,0,0|0,0,2]=4 68 B13R1.1575 CCOC(=O)CC1CCCCCC1 CSC011830452 [0,1,0,1,0,0|0,0,2]=4 69 B13R1.1575 CCOC(=O)CN1CCCCCC1 CSC000223717 [0,1,0,1,0,0|0,0,2]=4 70 B13R1.47 CCOC(=O)C(C)N1CCCCC1 CSC011537677 [0,1,0,1,0,0|1,0,1]=4 71 B13R1.44 CCCOC(=O)NC1CCCCC1 CSC000178457 [0,1,0,1,0,0|1,0,1]=4 72 B13R1.20 CCOC(=O)CN1CCCC(C1)C CSC000224320 [0,1,0,1,0,0|1,0,1]=4 73 B13R1.33 CCOC(=O)CC(=O)N1CCCC1 CSC019441113 [0,1,0,1,0,0|1,0,1]=4 74 B13R1.19 CCOC(=O)CN1CCC(CC1)C CSC000188102 [0,1,0,1,0,0|1,0,1]=4 75 B13R2.856 CCOC(=O)C1CC2CCC1C2 CSC011213090 [0,0,0,2,0,0|0,0,2]=4