0 B9R1.34 CC1CC(CC(N1)C)O MB01439 [1,0,0,0,0,0|1,0,0]=2 1 B9R1.66 C1CC(CC(C1)(F)F)N MB10651 [1,0,0,0,0,0|3,0,0]=4 2 B9R1.66 CC1CC(CCN1)(F)F PB34897 [1,0,0,0,0,0|3,0,0]=4 3 B11R2.526 CC1(CC2CCC(C1)N2)O PB11500 [0,0,0,1,0,0|3,0,0]=4 4 B9R1.36 C1[C@H]([C@@H](CC1(F)F)O)O AB85518 [0,0,0,0,1,0|3,0,0]=4 5 B8R0.24 C[N+](C)(C)CC(CCl)O AB03783 [1,0,1,0,0,0|2,0,0]=4 6 B8R1.4 CC1CC(CCN1)O PB10241 [2,0,0,0,0,0|1,0,0]=3 7 B8R1.4 CC1CC(CCO1)O PB22789 [2,0,0,0,0,0|1,0,0]=3 8 B8R1.4 CC1COCC(N1)C AB02607 [2,0,0,0,0,0|2,0,0]=4 9 B8R1.4 CN1CCCC(C1)N PB12415 [2,0,0,0,0,0|2,0,0]=4 10 B8R1.4 CN1CCCC(C1)O PB17042 [2,0,0,0,0,0|1,0,0]=3 11 B8R1.4 CN1CCC[C@@H](C1)N PB25450 [2,0,0,0,0,0|2,0,0]=4 12 B8R1.4 CN1CCC[C@@H](C1)N PB28836 [2,0,0,0,0,0|2,0,0]=4 13 B8R1.4 CN1CCC[C@@H](C1)O PB31843 [2,0,0,0,0,0|1,0,0]=3 14 B8R1.4 CN1CCC[C@H](C1)N PB33333 [2,0,0,0,0,0|2,0,0]=4 15 B8R1.4 CN1CCC[C@H](C1)O PB31692 [2,0,0,0,0,0|1,0,0]=3 16 B8R1.4 C[C@@H]1CCC[C@@H](N1)C AB02692 [2,0,0,0,0,0|1,0,0]=3 17 B8R1.4 C[C@@H]1CCC[C@H](N1)C AB76289 [2,0,0,0,0,0|1,0,0]=3 18 B8R1.4 C[C@@H]1CNC[C@@H](N1)C PB23510 [2,0,0,0,0,0|2,0,0]=4 19 B8R1.4 C[C@@H]1CNC[C@@H](O1)C PB30593 [2,0,0,0,0,0|2,0,0]=4 20 B8R1.4 C[C@@H]1CNC[C@H](N1)C AB48105 [2,0,0,0,0,0|2,0,0]=4 21 B8R1.4 C[C@@H]1CNC[C@H](O1)C AB85737 [2,0,0,0,0,0|2,0,0]=4 22 B8R1.4 C[C@@H]1COC[C@@H](N1)C PB22631 [2,0,0,0,0,0|2,0,0]=4 23 B8R1.4 C[C@@H]1C[C@@H](CCN1)O PB38196 [2,0,0,0,0,0|1,0,0]=3 24 B8R1.4 C[C@H]1CNC[C@@H](N1)C AB48104 [2,0,0,0,0,0|2,0,0]=4 25 B8R1.4 C[C@H]1CNC[C@@H](O1)C AB85738 [2,0,0,0,0,0|2,0,0]=4 26 B8R1.4 C[C@H]1CNC[C@@H](O1)C PB23755 [2,0,0,0,0,0|2,0,0]=4 27 B8R1.4 C[C@H]1COC[C@@H](N1)C MB13620 [2,0,0,0,0,0|2,0,0]=4 28 B8R1.4 C[C@H]1C[C@H](CCN1)O PB35360 [2,0,0,0,0,0|1,0,0]=3 29 B8R1.72 CC1(CCCCN1)C AB58454 [2,0,0,0,0,0|1,0,0]=3 30 B8R1.72 CC1(CCCNC1)O PB32801 [2,0,0,0,0,0|2,0,0]=4 31 B8R1.72 CC1(CCNCC1)C AB17027 [2,0,0,0,0,0|1,0,0]=3 32 B8R1.72 CC1(CCNCC1)C PB14098 [2,0,0,0,0,0|1,0,0]=3 33 B8R1.72 CC1(CCNCC1)N AB48443 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.72 CC1(CCNCC1)O PB10877 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.72 CC1(CCNCC1)O PB32903 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.72 CC1(CCOCC1)N PB22590 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.72 CC1(CNCCN1)C AB29948 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.72 CC1(CNCCO1)C AB51044 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.72 CC1(COCCN1)C AB50978 [2,0,0,0,0,0|2,0,0]=4 40 B10R1.171 CC1(CC(CCO1)C=O)C AB09953 [1,1,0,0,0,0|1,0,1]=4 41 B10R1.171 CC1(CC(CCO1)CN)C AB61238 [1,1,0,0,0,0|1,0,0]=3 42 B10R1.307 CC1(CNCC(O1)(C)C)C AB54598 [1,1,0,0,0,0|2,0,0]=4 43 B10R1.307 CC1(COCC(N1)(C)C)C AB10487 [1,1,0,0,0,0|2,0,0]=4 44 B12R1.242 CC1(CC(CC(O1)(C)C)C=O)C AB72941 [0,2,0,0,0,0|1,0,1]=4 45 B10R2.71 C1C[C@H]2C[C@@H](C[C@@H]1N2)F PB12879 [1,0,0,1,0,0|2,0,0]=4 46 B10R2.71 C1C[C@H]2C[C@@H](C[C@@H]1N2)O PB17241 [1,0,0,1,0,0|1,0,0]=3 47 B10R2.71 C1C[C@H]2C[C@@H](C[C@@H]1N2)O PB24470 [1,0,0,1,0,0|1,0,0]=3 48 B10R2.71 C1C[C@H]2C[C@H](C[C@@H]1N2)O PB32100 [1,0,0,1,0,0|1,0,0]=3 49 B8R1.51 CC1(CCC(C1)N)O PB38754 [1,0,0,0,1,0|2,0,0]=4