0 B8R1.3 C1CC(=O)NC[C@@H]1O BC659466 [0,0,0,0,0,0|2,0,2]=4 1 B8R1.3 C1[C@@H](CC[C@H](C1)N)N BC676644 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.3 C1[C@@H](CC[C@H](C1)O)N BC207753 [0,0,0,0,0,0|3,0,0]=3 3 B8R1.3 C1[C@@H](CC[C@H](C1)O)N BC684348 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.3 CC1CCC(CC1)N BC214314 [0,0,0,0,0,0|4,0,0]=4 5 B8R1.3 CN1CCC(CC1)O BC205735 [0,0,0,0,0,0|4,0,0]=4 6 B8R1.3 C[C@@H]1CN[C@H](CN1)C BC209523 [0,0,0,0,0,0|4,0,0]=4 7 B7R1.3 C1CC(CNC1)N BC205656 [1,0,0,0,0,0|3,0,0]=4 8 B7R1.3 C1CC(CNC1)N BC226535 [1,0,0,0,0,0|3,0,0]=4 9 B7R1.3 C1CC(COC1)O BC666036 [1,0,0,0,0,0|1,1,0]=3 10 B7R1.3 C1CCC(CC1)N BC206665 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.3 C1CCNC(C1)O BC219297 [1,0,0,0,0,0|2,0,0]=3 12 B7R1.3 C1CNCCC1O BC274718 [1,0,0,0,0,0|3,0,0]=4 13 B7R1.3 C1COCCC1O BC653702 [1,0,0,0,0,0|3,0,0]=4 14 B7R1.3 C1C[C@@H](CNC1)O BC208981 [1,0,0,0,0,0|2,0,0]=3 15 B7R1.3 C1C[C@H](CNC1)N BC209976 [1,0,0,0,0,0|3,0,0]=4 16 B7R1.3 C1C[C@H](CNC1)O BC679086 [1,0,0,0,0,0|2,0,0]=3 17 B7R1.3 CC1CCCCN1 BC200305 [1,0,0,0,0,0|3,0,0]=4 18 B7R1.3 CC1COCCN1 BC678917 [1,0,0,0,0,0|2,1,0]=4 19 B7R1.3 C[C@@H]1COCCN1 BC239042 [1,0,0,0,0,0|2,1,0]=4 20 B7R1.3 C[C@@H]1COCCN1 BC640295 [1,0,0,0,0,0|2,1,0]=4 21 B7R1.3 C[C@H]1CCCCN1 BC209006 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.3 C[C@H]1CCCNC1 BC208984 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.3 C[C@H]1CNCCN1 BC200168 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.10 C1CC(CCC1O)(F)F BC645437 [0,1,0,0,0,0|3,0,0]=4 25 B9R1.69 C1[C@H]([C@H](CO[C@@H]1O)O)O BC222612 [0,1,0,0,0,0|1,1,0]=3 26 B7R1.2 C1C[C@@H](C[C@H]1N)O BC243140 [0,0,0,0,1,0|2,0,0]=3 27 B7R1.2 C1C[C@H](C[C@@H]1N)O BC666823 [0,0,0,0,1,0|2,0,0]=3 28 B7R1.2 C1C[C@H](C[C@H]1N)O BC243224 [0,0,0,0,1,0|2,0,0]=3 29 B7R1.2 C1[C@@H](CNC1=O)O BC206869 [0,0,0,0,1,0|1,0,2]=4 30 B7R1.2 C1[C@H](CNC1=O)O BC676893 [0,0,0,0,1,0|1,0,2]=4 31 B7R1.2 CN1CCC(C1)O BC202129 [0,0,0,0,1,0|3,0,0]=4 32 B6R0.1 C(CO)[C@@H](CO)O BC206874 [1,0,1,0,0,0|0,1,0]=3 33 B6R0.6 C(CCO)CCCl BC220627 [1,0,1,0,0,0|2,0,0]=4 34 B6R0.6 CCCCCCS BC231905 [1,0,1,0,0,0|2,0,0]=4 35 B6R1.1 C1COCCN1 BC630685 [2,0,0,0,0,0|1,1,0]=4 36 B6R1.1 C1CSCSC1 BC219460 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.2 C1CC(CNC1)CO BC202762 [1,1,0,0,0,0|2,0,0]=4 38 B8R1.2 C1COC(CN1)CO BC202830 [1,1,0,0,0,0|1,1,0]=4 39 B8R1.2 C1COC[C@@H](N1)CO BC202773 [1,1,0,0,0,0|1,1,0]=4 40 B8R1.4 C1CC(CC(C1)O)N BC677022 [1,1,0,0,0,0|2,0,0]=4 41 B8R1.4 CN1CCCC(C1)O BC219296 [1,1,0,0,0,0|2,0,0]=4 42 B8R1.5 C1COCC(C1=O)O BC600171 [1,1,0,0,0,0|1,1,0]=4 43 B8R1.5 CC1CCCCC1O BC219008 [1,1,0,0,0,0|2,0,0]=4 44 B10R1.3 C1[C@@H](CCC(C1)CO)CO BC215698 [0,2,0,0,0,0|2,0,0]=4 45 B10R1.13 C1CC(CCC1C(=O)O)O BC200625 [0,2,0,0,0,0|2,0,0]=4 46 B10R1.13 C1[C@@H](CC[C@H](C1)O)C(=O)O BC684720 [0,2,0,0,0,0|2,0,0]=4 47 B10R1.119 C1[C@@H]([C@@H]([C@@H](C(O1)O)O)O)O BC206943 [0,2,0,0,0,0|1,1,0]=4 48 B8R2.25 C1CCC2C(C1)O2 BC211222 [1,0,0,1,0,0|2,0,0]=4 49 B6R1.2 C1C=CCC1O BC649956 [1,0,0,0,1,0|1,0,1]=4 50 B6R1.2 C1CCC(C1)Cl BC221902 [1,0,0,0,1,0|2,0,0]=4 51 B6R1.2 C1CNCC1O BC208993 [1,0,0,0,1,0|1,0,0]=3 52 B6R1.2 C1CNC[C@@H]1O BC677867 [1,0,0,0,1,0|1,0,0]=3 53 B6R1.2 C1CNC[C@@H]1O BC678742 [1,0,0,0,1,0|1,0,0]=3 54 B6R1.2 C1CNC[C@H]1O BC201989 [1,0,0,0,1,0|1,0,0]=3 55 B6R1.2 C1CNC[C@H]1O BC677872 [1,0,0,0,1,0|1,0,0]=3 56 B6R1.2 C1COCC1O BC201032 [1,0,0,0,1,0|0,1,0]=3 57 B6R1.2 C1COC[C@@H]1N BC675401 [1,0,0,0,1,0|1,1,0]=4 58 B6R1.2 C1COC[C@@H]1O BC678095 [1,0,0,0,1,0|0,1,0]=3 59 B6R1.2 C1COC[C@H]1N BC213397 [1,0,0,0,1,0|1,1,0]=4 60 B6R1.2 C1COC[C@H]1O BC206872 [1,0,0,0,1,0|0,1,0]=3 61 B6R1.2 C1COC[C@H]1O BC623081 [1,0,0,0,1,0|0,1,0]=3 62 B6R1.2 CC1CCCN1 BC208988 [1,0,0,0,1,0|2,0,0]=4 63 B6R1.2 CC1CCCO1 BC205640 [1,0,0,0,1,0|1,1,0]=4 64 B6R1.2 C[C@@H]1CCCN1 BC677871 [1,0,0,0,1,0|2,0,0]=4 65 B6R1.2 C[C@H]1CCCN1 BC208991 [1,0,0,0,1,0|2,0,0]=4 66 B6R1.5 C1[C@@H](C[C@@H]1N)O BC295270 [0,0,0,0,2,0|1,0,0]=3