0 B12R1.891 CC(C)(C)CCN1CCOCC1 CSC000224588 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.91 CC(C)CCN1CCOCC1 CSC000224585 [1,0,0,0,0,0|3,0,0]=4 2 B13R1.157 CC1COCCC1CNS(=O)(=O)C CSC015237274 [0,1,0,0,0,0|3,0,0]=4 3 B13R1.254 CCS(=O)(=O)CCN1CCCCC1 CSC012073746 [0,1,0,0,0,0|2,0,0]=3 4 B13R1.254 CCS(=O)(=O)NCC1CCOCC1 CSC011653727 [0,1,0,0,0,0|3,0,0]=4 5 B13R1.254 CNS(=O)(=O)CCC1CCCCC1 CSC025788048 [0,1,0,0,0,0|3,0,0]=4 6 B13R1.254 CNS(=O)(=O)CCC1CCOCC1 CSC010774706 [0,1,0,0,0,0|2,0,0]=3 7 B13R1.254 CNS(=O)(=O)CCN1CCOCC1 CSC010117328 [0,1,0,0,0,0|1,0,0]=2 8 B13R1.352 CC(NS(=O)(=O)C)C1CCOCC1 CSC012820403 [0,1,0,0,0,0|3,0,0]=4 9 B13R1.352 CS(=O)(=O)CC(=O)N1CCSCC1 CSC015389998 [0,1,0,0,0,0|1,1,1]=4 10 B13R1.353 CN(CC1CCOCC1)S(=O)(=O)C CSC012064672 [0,1,0,0,0,0|3,0,0]=4 11 B13R1.838 CC1CC(CCO1)CNS(=O)(=O)C CSC016126828 [0,1,0,0,0,0|3,0,0]=4 12 B13R1.7986 CC1(CCOCC1)CNS(=O)(=O)C CSC012691786 [0,1,0,0,0,0|3,0,0]=4 13 B11R1.510 CS(=O)(=O)CCC1CCCO1 CSC016057751 [0,0,0,0,1,0|3,0,0]=4 14 B13R1.3523 CS(=O)(=O)NCCC1CCCCC1 CSC011255690 [0,0,0,0,0,1|3,0,0]=4 15 B13R1.3523 CS(=O)(=O)NCCC1CCNCC1 CSC011370078 [0,0,0,0,0,1|3,0,0]=4 16 B13R1.3523 CS(=O)(=O)NCCN1CCNCC1 CSC011323230 [0,0,0,0,0,1|2,0,0]=3 17 B13R1.3523 CS(=O)(=O)NCCN1CCOCC1 CSC000168733 [0,0,0,0,0,1|1,0,0]=2 18 B13R1.3523 CS(=O)(=O)NCCN1CCOCC1 CSC000168733 [0,0,0,0,0,1|1,0,0]=2 19 B10R0.22 CCOCCCNS(=O)(=O)C CSC000169738 [1,0,1,0,0,0|2,0,0]=4 20 B10R1.17 CCCCN1CCOCC1 CSC000224583 [2,0,0,0,0,0|2,0,0]=4 21 B10R1.17 COCCN1CCOCC1 CSC000234383 [2,0,0,0,0,0|1,1,0]=4 22 B10R1.17 NCCCN1CCOCC1 CSC000210481 [2,0,0,0,0,0|2,0,0]=4 23 B12R0.410 COCCN(C)C(=O)CS(=O)(=O)C CSC020021608 [0,1,1,0,0,0|1,0,1]=4 24 B12R0.31 CCN(CCO)C(C)CS(=O)(=O)C CSC060563054 [0,1,1,0,0,0|1,0,0]=3 25 B12R1.21 CC1CCN(CC1)CCC(=O)O CSC000740328 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.27 CNC(=O)CCN1CCOCC1 CSC011255422 [1,1,0,0,0,0|2,0,0]=4 27 B12R1.27 COC(=O)CCN1CCOCC1 CSC000177612 [1,1,0,0,0,0|1,0,0]=3 28 B12R1.125 CC1CCCCN1CCC(=O)O CSC000727554 [1,1,0,0,0,0|2,0,0]=4 29 B12R1.226 CC1CCCN(C1)CCC(=O)O CSC025718150 [1,1,0,0,0,0|2,0,0]=4 30 B14R1.147 CC1CN(CCN1)CCNS(=O)(=O)C CSC057695888 [0,1,0,0,0,1|2,0,0]=4 31 B14R1.147 CC1CN(CCS1)CCNS(=O)(=O)C CSC047241971 [0,1,0,0,0,1|1,1,0]=4 32 B14R1.147 CS(=O)(=O)CCCN1CCCC(C1)O CSC011823434 [0,1,0,0,0,1|2,0,0]=4 33 B14R1.147 CS(=O)(=O)NCCN1CCCC(C1)N CSC057557340 [0,1,0,0,0,1|2,0,0]=4 34 B14R1.147 CS(=O)(=O)NCCN1CCC[C@H](C1)N CSC057731726 [0,1,0,0,0,1|2,0,0]=4 35 B14R1.242 CC1CNCCN1CCNS(=O)(=O)C CSC057398709 [0,1,0,0,0,1|2,0,0]=4 36 B14R1.242 CC1CSCCN1CCNS(=O)(=O)C CSC048022540 [0,1,0,0,0,1|1,1,0]=4 37 B14R1.242 C[C@@H]1CNCCN1CCNS(=O)(=O)C CSC057393543 [0,1,0,0,0,1|2,0,0]=4 38 B14R1.242 C[C@H]1CNCCN1CCNS(=O)(=O)C CSC057688074 [0,1,0,0,0,1|2,0,0]=4 39 B14R1.292 CCS(=O)(=O)NCCN1CCNCC1 CSC011323232 [0,1,0,0,0,1|2,0,0]=4 40 B14R1.292 CCS(=O)(=O)NCCN1CCOCC1 CSC000171116 [0,1,0,0,0,1|1,0,0]=3 41 B14R1.433 CS(=O)(=O)NC(=O)CN1CCOCC1 CSC037145879 [0,1,0,0,0,1|1,0,1]=4 42 B14R1.3098 CS(=O)(=O)CCC(=O)N1CCSCC1 CSC041546103 [0,1,0,0,0,1|1,1,0]=4 43 B14R1.4451 CC1COCCN1C(=O)CS(=O)(=O)C CSC054653711 [0,2,0,0,0,0|1,0,1]=4 44 B14R1.290 CCS(=O)(=O)CC(=O)N1CCOCC1 CSC000047451 [0,2,0,0,0,0|1,0,1]=4 45 B14R1.290 CNS(=O)(=O)CC(=O)N1CCOCC1 CSC042189769 [0,2,0,0,0,0|1,0,1]=4 46 B14R1.6395 CN(C)S(=O)(=O)CCN1CCSCC1 CSC048177969 [0,2,0,0,0,0|1,1,0]=4 47 B14R1.5966 CC1CN(CCO1)C(=O)CS(=O)(=O)C CSC033710283 [0,2,0,0,0,0|1,0,1]=4 48 B14R1.4405 CC(CN1CCSC(C1)C)S(=O)(=O)C CSC028561645 [0,2,0,0,0,0|1,1,0]=4 49 B10R1.18 CC(=O)CN1CCOCC1 CSC000180433 [1,0,0,0,1,0|2,0,0]=4 50 B10R1.18 CC(O)CN1CCOCC1 CSC000696257 [1,0,0,0,1,0|2,0,0]=4 51 B10R1.28 CS(=O)(=O)N1CCCCC1 CSC000169496 [0,0,0,0,2,0|2,0,0]=4 52 B10R1.28 CS(=O)(=O)N1CCOCC1 CSC000169602 [0,0,0,0,2,0|1,0,0]=3 53 B12R0.230 CCN(CCO)CCNS(=O)(=O)C CSC059867722 [0,0,1,0,0,1|1,0,0]=3 54 B14R1.10310 CS(=O)(=O)NCCN1CCCNCC1 CSC057732211 [0,0,0,0,0,2|2,0,0]=4 55 B14R1.10310 NS(=O)(=O)NCCN1CCCOCC1 CSC060081689 [0,0,0,0,0,2|1,0,0]=3