0 B12R0.1 CCCCCC\C=C\C(=O)OCC AC9668 [0,1,0,0,0,0|2,0,1]=4 1 B12R1.8 CCCNCCC1=NC=CC=C1 76839 [0,0,0,1,0,0|2,0,0]=3 2 B12R1.8 CNCCCOC1=CC=CC=C1 C77854 [0,0,0,1,0,0|3,0,0]=4 3 B12R1.37 CCCCCCCC1=CNC=C1 T73026 [0,0,0,1,0,0|2,0,1]=4 4 B12R1.37 CCCCCCCC1=CSC=C1 T72775 [0,0,0,1,0,0|2,0,1]=4 5 B12R1.37 CCCCCCSC1=CC=CS1 E10053 [0,0,0,1,0,0|1,1,0]=3 6 B12R1.267 BrCCCCC1=C(Br)C=CC=C1 AT22148 [0,0,0,1,0,0|2,0,1]=4 7 B12R1.267 CCCNCC1=C(Br)C=CC=C1 C78484 [0,0,0,1,0,0|2,0,1]=4 8 B12R1.267 CCCNCC1=C(C)C=CC=C1 C78482 [0,0,0,1,0,0|2,0,1]=4 9 B12R1.267 CCCNCC1=C(Cl)C=CC=C1 C78483 [0,0,0,1,0,0|2,0,1]=4 10 B12R1.267 CCCNCC1=C(F)C=CC=C1 C78370 [0,0,0,1,0,0|2,0,1]=4 11 B12R1.267 CCNCCC1=C(F)C=CC=C1 AC6701 [0,0,0,1,0,0|2,0,1]=4 12 B12R1.372 CCCCCCC1=C(Cl)SC=C1 T71352 [0,0,0,1,0,0|2,0,0]=3 13 B9R0.45 C=CCCCCCCCC T73018 [2,0,0,0,0,0|0,0,2]=4 14 B9R0.45 C\C=C/CCCCCCC T70533 [2,0,0,0,0,0|0,0,2]=4 15 B13R0.54 CCCCCCCCC\C=C\C(=O)O W16764 [0,2,0,0,0,0|0,0,2]=4 16 B11R1.4 CCCCOCC1=CC=CO1 S11931 [1,0,0,1,0,0|1,0,1]=4 17 B11R1.17 NCCCN1C=CC=CC1=O AT19227 [1,0,0,1,0,0|2,0,0]=4 18 B11R1.17 O=C1C=CC=CN1CCCO AT19228 [1,0,0,1,0,0|2,0,0]=4 19 B11R1.28 CCNCCC1=CC=CC=C1 AC5622 [1,0,0,1,0,0|1,0,1]=4 20 B13R1.6 CCCCNCC1=CC(C)=CC=C1 C78344 [0,1,0,1,0,0|2,0,0]=4 21 B13R1.6 CCCCNCC1=CC=CC(Br)=C1 C78341 [0,1,0,1,0,0|2,0,0]=4 22 B13R1.6 CCCCNCC1=CC=CC(Cl)=C1 C77945 [0,1,0,1,0,0|2,0,0]=4 23 B13R1.6 CCCCNCC1=CC=CC(F)=C1 C78338 [0,1,0,1,0,0|2,0,0]=4 24 B13R1.42 CCC[C@H](O)CCC1=CC=CC=C1 F19746 [0,1,0,1,0,0|1,0,0]=3 25 B13R1.470 CCC[C@H](N)CC1=C(Br)C=CC=C1 N14511 [0,1,0,1,0,0|1,0,1]=4 26 B13R1.470 CCC[C@H](N)CC1=C(C)C=CC=C1 N14513 [0,1,0,1,0,0|1,0,1]=4 27 B13R1.470 CCC[C@H](N)CC1=C(Cl)C=CC=C1 N14501 [0,1,0,1,0,0|1,0,1]=4 28 B13R1.470 CCC[C@H](N)CC1=C(F)C=CC=C1 N14506 [0,1,0,1,0,0|1,0,1]=4 29 B13R1.28 CCCCOCCC1=CC=CC=C1 S10144 [0,1,0,1,0,0|1,0,0]=3 30 B13R1.28 CNCCCOCC1=CC=CC=C1 C78008 [0,1,0,1,0,0|2,0,0]=4 31 B13R1.137 CCCCCCC1=C(C=O)SC=C1 S11879 [0,1,0,1,0,0|0,0,0]=2 32 B13R1.555 CCCCNCC1=C(Br)C=CC=C1 C78340 [0,1,0,1,0,0|1,0,1]=4 33 B13R1.555 CCCCNCC1=C(C)C=CC=C1 C78343 [0,1,0,1,0,0|1,0,1]=4 34 B13R1.555 CCCCNCC1=C(Cl)C=CC=C1 C77946 [0,1,0,1,0,0|1,0,1]=4 35 B13R1.555 CCCCNCC1=C(F)C=CC=C1 C78337 [0,1,0,1,0,0|1,0,1]=4 36 B13R1.24 CCCCC[C@H](N)C1=CC=CC=C1 N12530 [0,1,0,1,0,0|1,0,0]=3 37 B13R1.666 CCCCOC1=CC=CC(C=O)=C1 S11902 [0,1,0,1,0,0|1,0,1]=4 38 B13R1.27 CCCCCCSC1=CC=C(Br)S1 D88044 [0,1,0,1,0,0|1,1,0]=4 39 B13R1.337 CC(C)CCNCC1=CC=CC=C1 F52160 [0,1,0,1,0,0|2,0,0]=4 40 B13R1.337 C[C@H](O)CCOCC1=CC=CC=C1 AT15545 [0,1,0,1,0,0|2,0,0]=4 41 B13R1.9 CCCCNCC1=CC=C(Br)C=C1 C78342 [0,1,0,1,0,0|2,0,0]=4 42 B13R1.9 CCCCNCC1=CC=C(C)C=C1 C77943 [0,1,0,1,0,0|2,0,0]=4 43 B13R1.9 CCCCNCC1=CC=C(Cl)C=C1 C77944 [0,1,0,1,0,0|2,0,0]=4 44 B13R1.9 CCCCNCC1=CC=C(F)C=C1 C78339 [0,1,0,1,0,0|2,0,0]=4 45 B13R2.3 C1=CC=C([C@@H]2CCCCN2)C=C1 AT22864 [0,0,0,2,0,0|2,0,0]=4 46 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 AC8554 [0,0,0,2,0,0|2,0,0]=4 47 B13R2.3 C1=CC=C([C@H]2CCCNC2)C=C1 F20832 [0,0,0,2,0,0|2,0,0]=4 48 B13R2.3 C1=CN=C(C2CCNCC2)C=C1 C77433 [0,0,0,2,0,0|2,0,0]=4 49 B13R2.3 C1=CN=C(C2CCNCC2)C=C1 C77434 [0,0,0,2,0,0|2,0,0]=4 50 B13R2.3 C1=CN=C([C@@H]2CCCCN2)C=C1 N10817 [0,0,0,2,0,0|2,0,0]=4 51 B13R2.3 C1=CN=C([C@@H]2CCCCN2)C=C1 Y11624 [0,0,0,2,0,0|2,0,0]=4 52 B13R2.3 C1=CN=C([C@H]2CCCNC2)C=C1 98580 [0,0,0,2,0,0|2,0,0]=4 53 B13R2.3 C1=CN=C([C@H]2CCCNC2)C=C1 98581 [0,0,0,2,0,0|2,0,0]=4 54 B13R2.15 BrC1=C(C2CCCCC2)C=CS1 T70623 [0,0,0,2,0,0|2,0,0]=4 55 B13R2.15 OC1CCCC1C2=NC=CC=C2 72502 [0,0,0,2,0,0|2,0,0]=4 56 B13R2.1613 CC[C@@H]1NCCC2=C1C=CC=C2 AT22655 [0,0,0,2,0,0|2,0,0]=4 57 B13R2.1613 NC[C@H]1CCCC2=C1C=CC=C2 AC7012 [0,0,0,2,0,0|2,0,0]=4