0 B10R0.97 CC(C)CCNCCC(C)C PH012262 [0,0,0,0,0,0|3,0,0]=3 1 B10R0.97 CC(C)CCNCCC(C)C PH015267 [0,0,0,0,0,0|3,0,0]=3 2 B10R0.97 CC(C)CCSCCC(C)C S570478 [0,0,0,0,0,0|2,1,0]=3 3 B9R0.2 CCCCCCCC(C)Br S438758 [1,0,0,0,0,0|2,0,0]=3 4 B9R0.2 CCCNOCCC(=O)C S581321 [1,0,0,0,0,0|1,0,2]=4 5 B11R0.85 CC(C)CCC(=O)CCC(C)C S704180 [0,1,0,0,0,0|3,0,0]=4 6 B11R0.85 CC(C)CCS(=O)CCC(C)C S369284 [0,1,0,0,0,0|2,1,0]=4 7 B11R0.85 CC(C)CC[Sn](=O)CCC(C)C S395730 [0,1,0,0,0,0|3,0,0]=4 8 B11R0.30 CC(C)CCSSCCC(C)C S570559 [0,0,0,0,0,1|2,1,0]=4 9 B8R0.4 CCCCCCCSC S570729 [2,0,0,0,0,0|2,0,0]=4 10 B8R0.4 CCCCCSCCO S357928 [2,0,0,0,0,0|2,0,0]=4 11 B8R0.4 CCCCNCCCC S367869 [2,0,0,0,0,0|1,0,0]=3 12 B8R0.4 CCCCNCCCC S503894 [2,0,0,0,0,0|1,0,0]=3 13 B8R0.4 CCCCNCCCC S566152 [2,0,0,0,0,0|1,0,0]=3 14 B8R0.4 CCNCCCCCO PH007898 [2,0,0,0,0,0|2,0,0]=4 15 B8R0.4 CSCCCCCCO S931667 [2,0,0,0,0,0|2,0,0]=4 16 B8R0.4 NCCCOCCCN PH000107 [2,0,0,0,0,0|2,0,0]=4 17 B8R0.4 OCCCNCCCO PH010217 [2,0,0,0,0,0|1,0,0]=3 18 B8R0.4 [NH2+](CCCC)CCCC S348880 [2,0,0,0,0,0|1,0,0]=3 19 B8R0.7 CC(C)CCCCCN CDS001505 [2,0,0,0,0,0|2,0,0]=4 20 B8R0.7 CC(C)CCNCCO S393983 [2,0,0,0,0,0|2,0,0]=4 21 B8R0.7 CCCCCCC(C)C S430935 [2,0,0,0,0,0|1,0,0]=3 22 B8R0.7 CCCCCCC(C)Cl S564516 [2,0,0,0,0,0|1,0,0]=3 23 B8R0.7 CCCCOCC(=O)O CDS008145 [2,0,0,0,0,0|1,0,1]=4 24 B8R0.7 CCCCSCC(C)C S570567 [2,0,0,0,0,0|1,1,0]=4 25 B8R0.7 O=C(O)CCOCCO CDS021155 [2,0,0,0,0,0|1,0,1]=4 26 B10R0.4 CC(C)CCCCCCCO PH008704 [1,1,0,0,0,0|2,0,0]=4 27 B10R0.4 CC(O)COCCOCCO S346039 [1,1,0,0,0,0|2,0,0]=4 28 B10R0.4 CCCCCCCCC(C)N T151068 [1,1,0,0,0,0|2,0,0]=4 29 B10R0.6 CCCCCC(O)CC(C)C S417432 [1,1,0,0,0,0|2,0,0]=4 30 B10R0.74 CCCCCCCC(O)CC CDS001495 [1,1,0,0,0,0|1,0,0]=3 31 B10R0.75 CCCCCCC(O)C(C)C S417424 [1,1,0,0,0,0|2,0,0]=4 32 B10R0.98 CC(C)CCOC(=O)C(C)O PH011490 [0,1,0,0,1,0|1,0,1]=4 33 B10R1.10 CN1CCOC(C1)CCO CBR00293 [1,0,0,1,0,0|2,0,0]=4 34 B10R1.18 CC(C)CC1CCCCC1 S564869 [1,0,0,1,0,0|2,0,0]=4 35 B10R1.18 CC(C)OC1CCCCO1 T332879 [1,0,0,1,0,0|2,0,0]=4 36 B10R1.18 CC(O)CN1CCCCC1 S418854 [1,0,0,1,0,0|2,0,0]=4 37 B10R1.38 C[C@@]1(CCCC[C@H]1CN)O BBO000381 [1,0,0,1,0,0|2,0,0]=4 38 B10R1.61 CC(O)C1CCCCC1O S362417 [1,0,0,1,0,0|1,0,0]=3 39 B10R1.78 CC1CCCCCCCC1 T187364 [1,0,0,1,0,0|2,0,0]=4 40 B12R1.1280 CC1CCC(C(C1)(C)O)C(C)C S311359 [0,1,0,1,0,0|2,0,0]=4 41 B8R0.28 CC(C)COCC(C)O CDS018532 [0,0,0,0,2,0|1,0,0]=3 42 B8R0.28 CC(O)COCC(C)O PH011069 [0,0,0,0,2,0|0,0,0]=2