0 B11R0.148 CCCCCCC\C=C\C(=O)O DY424008 [0,1,0,0,0,0|0,0,2]=3 1 B11R1.4 CCCCCCC1=CC=CS1 NO21710 [0,0,0,1,0,0|0,1,1]=3 2 B11R1.4 CCCCCCC1=CSC=C1 NO22304 [0,0,0,1,0,0|2,0,1]=4 3 B11R1.17 CCCOC1=C(O)C=CC=C1 DY20673 [0,0,0,1,0,0|1,0,2]=4 4 B11R1.17 N#CCCN1C=CC=CC1=O DY656416 [0,0,0,1,0,0|2,0,1]=4 5 B11R1.17 OCCCC1=C(O)C=CC=C1 DY791619 [0,0,0,1,0,0|1,0,2]=4 6 B11R1.28 BrCCCCC1=CC=CC=C1 DY519843 [0,0,0,1,0,0|2,0,0]=3 7 B11R1.28 BrCCCOC1=CC=CC=C1 NO15031 [0,0,0,1,0,0|3,0,0]=4 8 B11R1.28 BrCCOCC1=CC=CC=C1 NO10998 [0,0,0,1,0,0|3,0,0]=4 9 B11R1.28 CCCCCC1=CC=CC=C1 DY745567 [0,0,0,1,0,0|1,0,0]=2 10 B11R1.28 CNCCOC1=CC=CC=C1 DY551817 [0,0,0,1,0,0|3,0,0]=4 11 B11R1.28 COCCSC1=NC=CC=C1 DY713737 [0,0,0,1,0,0|3,0,0]=4 12 B11R1.28 N#CCCCC1=CC=CC=C1 DY461028 [0,0,0,1,0,0|2,0,1]=4 13 B11R1.28 NCCCCC1=NC=CC=C1 DY603285 [0,0,0,1,0,0|2,0,0]=3 14 B11R1.28 NCCOCC1=CC=CC=C1 NO20892 [0,0,0,1,0,0|3,0,0]=4 15 B11R1.28 OCCCCC1=CC=CC=C1 NO11170 [0,0,0,1,0,0|2,0,0]=3 16 B11R1.28 OCCCCC1=CC=NC=C1 NO13477 [0,0,0,1,0,0|3,0,0]=4 17 B11R1.28 OCCCCC1=NC=CC=C1 DY532905 [0,0,0,1,0,0|2,0,0]=3 18 B11R1.28 OCCOCC1=CC=CC=C1 DY20071 [0,0,0,1,0,0|3,0,0]=4 19 B8R0.4 CCC\C=C\C=C\CO NO17006 [2,0,0,0,0,0|0,0,2]=4 20 B10R0.91 CCCCCC(=O)\C=C\C=O DY503457 [1,1,0,0,0,0|0,0,0]=2 21 B10R0.91 CCCCCC(O)\C=C\C=O DY570585 [1,1,0,0,0,0|0,0,1]=3 22 B12R0.234 O=C(O)\C=C\CCCCCCCO NO13683 [0,2,0,0,0,0|0,0,2]=4 23 B12R0.248 CCC\C=C\C=C\C=C\C(=O)OC DY557847 [0,2,0,0,0,0|0,0,2]=4 24 B10R1.17 CCCC[N+]1=CC=CC=C1 DY538095 [1,0,0,1,0,0|1,0,0]=3 25 B10R1.17 CNCCC1=CC=CC=N1 DY455430 [1,0,0,1,0,0|2,0,0]=4 26 B10R1.20 CCC1=C(C=O)C=CC=C1 DY20141 [1,0,0,1,0,0|0,0,2]=4 27 B10R1.21 CCCCCc1cccs1 DY585146 [1,0,0,1,0,0|0,1,0]=3 28 B10R1.29 CCCCC1=C(Br)SC=C1 DY524589 [1,0,0,1,0,0|2,0,0]=4 29 B12R1.8 CCCCCCC1=CC=NC=C1 NO17088 [0,1,0,1,0,0|1,0,1]=4 30 B12R1.8 CCCCCCC1=NC=CC=C1 DY712183 [0,1,0,1,0,0|1,0,0]=3 31 B12R1.8 CCCCNCC1=CC=NC=C1 DY615027 [0,1,0,1,0,0|2,0,0]=4 32 B12R1.8 CCNCCCC1=CC=CC=C1 DY610544 [0,1,0,1,0,0|1,0,0]=3 33 B12R1.8 COCCNCC1=NC=CC=C1 DY614604 [0,1,0,1,0,0|2,0,0]=4 34 B12R1.8 NCCCNCC1=CC=CC=C1 NO11742 [0,1,0,1,0,0|2,0,0]=4 35 B12R1.8 OCCCNCC1=CC=CC=C1 DY555777 [0,1,0,1,0,0|2,0,0]=4 36 B12R1.267 CCCCOC1=NC=CC=C1Cl DY714650 [0,1,0,1,0,0|2,0,0]=4 37 B12R1.267 CCCCOC1=NC=CC=C1O DY715646 [0,1,0,1,0,0|1,0,1]=4 38 B12R1.372 CCCCCCC1=C(Br)SC=C1 NO21339 [0,1,0,1,0,0|1,0,1]=4 39 B12R1.372 CCCCNCC1=C(C)C=CS1 DY609789 [0,1,0,1,0,0|2,0,0]=4 40 B12R1.32 COC[C@@H](N)CC1=CC=CC=C1 DY623915 [0,1,0,1,0,0|2,0,0]=4 41 B12R1.32 NCCC(F)CC1=CC=CC=C1 DY527259 [0,1,0,1,0,0|2,0,0]=4 42 B12R1.1 CCCCSC1=NC=C(Cl)C=C1 DY715244 [0,1,0,1,0,0|2,0,0]=4 43 B12R1.1 FC1=CC=C(CCCCCl)C=C1 DY559677 [0,1,0,1,0,0|2,0,0]=4 44 B12R1.27 CCC(C)NCc1ccccc1 DY555507 [0,1,0,1,0,0|2,0,0]=4 45 B12R1.27 NCC(F)CCC1=CC=CC=C1 DY527373 [0,1,0,1,0,0|2,0,0]=4 46 B12R1.30 CCCCC(N)C1=CC=CN=C1 DY604358 [0,1,0,1,0,0|2,0,0]=4 47 B12R1.30 NC(CCCO)C1=CC=CC=C1 DY554247 [0,1,0,1,0,0|2,0,0]=4 48 B12R1.1631 CC1=CC=CC(=O)N1CCCN DY610751 [0,1,0,1,0,0|2,0,0]=4 49 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 NO20248 [0,1,0,1,0,0|2,0,0]=4 50 B12R1.252 O=C(Cl)\C=C\CN1CCCCC1 DY775059 [0,1,0,1,0,0|1,0,1]=4 51 B12R1.386 CCCCN1N=CC=C1C(=O)O DY645094 [0,1,0,1,0,0|2,0,0]=4 52 B12R2.2 C1=CC=C(C2CCCN2)C=C1 DY666606 [0,0,0,2,0,0|2,0,0]=4 53 B12R2.2 C1=CC=C(C2CCCN2)C=C1 NO11140 [0,0,0,2,0,0|2,0,0]=4 54 B12R2.2 C1=CC=C([C@@H]2CCCN2)C=C1 NO17953 [0,0,0,2,0,0|2,0,0]=4 55 B12R2.2 C1=CN=C(C2CCNC2)C=C1 DY525903 [0,0,0,2,0,0|2,0,0]=4 56 B12R2.315 O=CC1=CC=CC2=C1CCC2 DY744601 [0,0,0,2,0,0|0,0,2]=4 57 B12R2.41 C1=CC2=C(C=C1)CNCCC2 NO12567 [0,0,0,2,0,0|2,0,0]=4 58 B12R2.41 C1=CC2=C(C=C1)NCCCC2 NO18041 [0,0,0,2,0,0|1,0,1]=4 59 B12R2.41 C1=CN=C2CCCCCC2=C1 DY568809 [0,0,0,2,0,0|1,0,0]=3 60 B12R2.225 OC1=C(CC2CC2)C=CC=C1 DY757669 [0,0,0,2,0,0|0,0,2]=4 61 B12R2.1081 BrC1=C2CCCCC2=CC=C1 DY768527 [0,0,0,2,0,0|1,0,1]=4 62 B12R2.1081 CC1CCNC2=CC=CC=C21 NO17518 [0,0,0,2,0,0|2,0,0]=4 63 B12R2.1081 CC1CNCC2=CC=CC=C21 NO17240 [0,0,0,2,0,0|2,0,0]=4 64 B12R2.1081 CC1NCCC2=CC=CC=C21 NO12178 [0,0,0,2,0,0|2,0,0]=4 65 B12R2.1081 CC1NCCC2=CC=CC=C21 NO15270 [0,0,0,2,0,0|2,0,0]=4 66 B12R2.1081 C[C@@H]1CNCC2=CC=CC=C21 DY550353 [0,0,0,2,0,0|2,0,0]=4 67 B12R2.1081 IC1CCCC2=CC=CC=C21 DY528825 [0,0,0,2,0,0|2,0,0]=4 68 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 NO13980 [0,0,0,2,0,0|2,0,0]=4 69 B12R2.1081 O=C1CCCC2=C1C=CC=N2 NO18351 [0,0,0,2,0,0|1,0,1]=4 70 B12R2.1081 O=C1CCCC2=CC=CC=C12 NO14809 [0,0,0,2,0,0|0,0,2]=4 71 B12R2.44 O=CC1=CC=C2CCCC2=C1 DY547221 [0,0,0,2,0,0|0,0,2]=4