0 B11R1.166 CC(=O)C1=C(O)C=C(O)C=C1 BBL012128 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl BBL027300 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.166 CC(=O)C1=CC=C(N)C=C1O BBL028202 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.166 CC(N)C1=C(Cl)C=C(Cl)C=C1 BBL017839 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.166 CC1=C(C(C)C)C=CC(N)=C1 BBL030263 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 BBL011604 [0,0,0,0,0,0|0,0,0]=0 6 B11R1.166 CN(C)C1=C(N)C=C(Cl)C=C1 BBL012002 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 BBL011673 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.166 O=[N+]([O-])C1=CC=C(F)C=C1O BBL011551 [0,0,0,0,0,0|4,0,0]=4 9 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 BBL013140 [1,0,0,0,0,0|2,0,1]=4 10 B10R1.13 CC(N)C1=CC=C(Br)C=C1 BBL034684 [1,0,0,0,0,0|2,0,0]=3 11 B10R1.13 CC(N)C1=CC=C(Cl)C=C1 BBL017845 [1,0,0,0,0,0|2,0,0]=3 12 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 BBL027306 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.25 CC1=CC(C)=C(NN)C=C1 BBL020466 [1,0,0,0,0,0|3,0,0]=4 14 B10R1.25 COC1=CC=C(N)C=C1F BBL100259 [1,0,0,0,0,0|3,0,0]=4 15 B10R1.25 ClCC1=C(Cl)C=C(Cl)C=C1 BBL009650 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.25 NCC1=CC=C(F)C=C1Cl BBL037739 [1,0,0,0,0,0|3,0,0]=4 17 B10R1.25 O=CC1=CC=C(O)C=C1O BBL012171 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.61 CC(=O)C1=C(O)C=CC=C1 BBL012126 [1,0,0,0,0,0|1,0,1]=3 19 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 BBL017883 [1,0,0,0,0,0|2,0,0]=3 20 B10R1.61 NC(=O)C1=C(O)C=CC=C1 BBL016007 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.61 NC(C)C1=C(C)C=CC=C1 BBL036386 [1,0,0,0,0,0|2,0,0]=3 22 B10R1.61 O=C([O-])C1=C(O)C=CC=C1 BBL000698 [1,0,0,0,0,0|2,0,1]=4 23 B12R1.232 CC1=CC(O)=C(C(=O)O)C=C1C BBL018906 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.232 CC1=CC(O)=C(C(C)C)C=C1N BBL019122 [0,1,0,0,0,0|0,0,0]=1 25 B12R1.232 CC1=CC(O)=C([N+](=O)[O-])C=C1C BBL022755 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.452 CN(C)C1=C(Br)C=C(C=O)C=C1 BBL036237 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.452 COC1=CC(F)=C(C(C)=O)C=C1 BBL011052 [0,1,0,0,0,0|2,0,1]=4 28 B12R1.452 COC1=CC(O)=C(C(C)=O)C=C1 BBL012127 [0,1,0,0,0,0|1,0,1]=3 29 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 BBL034248 [0,1,0,0,0,0|3,0,0]=4 30 B12R1.893 CC(=O)C1=CC=C(O)C(O)=C1O BBL027373 [0,1,0,0,0,0|2,0,1]=4 31 B12R1.893 CC1=C(C)C(O)=C(C(=O)O)C=C1 BBL023509 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 BBL036382 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.1703 O=C(CCl)C1=CC=C(O)C=C1O BBL011800 [0,1,0,0,0,0|2,0,1]=4 34 B12R2.612 O=C1COC2=CC(O)=CC=C12 BBL028131 [0,0,0,1,0,0|2,0,1]=4 35 B12R1.233 CC(=O)NC1=CC=C(C)C=C1N BBL002359 [0,0,0,0,0,1|2,0,1]=4 36 B12R1.233 CC1=CC=C(OC(F)F)C(N)=C1 BBL038901 [0,0,0,0,0,1|3,0,0]=4 37 B9R0.1 C\C=C(C)\C=C\C=C(C)C BBL027750 [1,0,1,0,0,0|0,0,2]=4 38 B9R1.1 BrCC1=CC=C(I)C=C1 BBL028392 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.1 COC1=CC=C(S)C=C1 BBL027485 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.1 CSC1=CC=C(O)C=C1 BBL104214 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.1 ClCC1=CC=C(Br)C=C1 BBL027953 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.1 NCC1=CC=C(N)C=C1 BBL012240 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.1 OCC1=CC=C(Cl)C=C1 BBL011936 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.1 OCC1=CC=C(F)C=C1 BBL027470 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.15 ClCC1=C(Cl)C=CC=C1 BBL012560 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.15 NC1=CC=CC=C1CO BBL027657 [2,0,0,0,0,0|2,0,0]=4 47 B9R1.69 CC1=C(F)C=C(N)C=C1 BBL100253 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.69 CC1=C(N)C=C(N)C=C1 BBL011285 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.69 CC1=CC(C)=C(O)C=C1 BBL011443 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.69 CC1=CC(N)=C(N)C=C1 BBL013178 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.69 CC1=CC(N)=C(O)C=C1 BBL001485 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.69 CC1=CC(O)=C(N)C=C1 BBL002991 [2,0,0,0,0,0|1,0,0]=3 53 B9R1.69 NC1=CC=C(Cl)C=C1O BBL018708 [2,0,0,0,0,0|2,0,0]=4 54 B11R1.3 CC(C)C1=CC=C(CCl)C=C1 BBL027849 [1,1,0,0,0,0|0,0,0]=2 55 B11R1.3 CC(C)C1=CC=C(CN)C=C1 BBL037227 [1,1,0,0,0,0|0,0,0]=2 56 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 BBL027748 [1,1,0,0,0,0|1,0,1]=4 57 B11R1.3 CCC1=CC=C(C(C)N)C=C1 BBL037374 [1,1,0,0,0,0|1,0,0]=3 58 B11R1.3 CN(C)C1=CC=C(CN)C=C1 BBL037746 [1,1,0,0,0,0|1,0,0]=3 59 B11R1.3 COC1=CC=C(C(C)N)C=C1 BBL036328 [1,1,0,0,0,0|1,0,0]=3 60 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 BBL009965 [1,1,0,0,0,0|1,0,1]=4 61 B11R1.21 CC(C)C1=CC(N)=C(O)C=C1 BBL008043 [1,1,0,0,0,0|1,0,0]=3 62 B11R1.21 CC1=C(C)C=C(C(C)N)C=C1 BBL036329 [1,1,0,0,0,0|1,0,0]=3 63 B11R1.22 CCC(N)C1=CC=C(Cl)C=C1 BBL017840 [1,1,0,0,0,0|2,0,0]=4 64 B11R1.22 CCC(N)C1=CC=C(O)C=C1 BBL023689 [1,1,0,0,0,0|2,0,0]=4 65 B11R1.22 NCC(O)C1=CC=C(O)C=C1 BBL009983 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.37 COC1=C(C=O)C=CC(C)=C1 BBL034934 [1,1,0,0,0,0|1,0,1]=4 67 B11R1.37 COC1=CC=C(I)C=C1OC BBL034724 [1,1,0,0,0,0|2,0,0]=4 68 B11R1.81 CCOC1=C(Cl)C=C(N)C=C1 BBL034970 [1,1,0,0,0,0|2,0,0]=4 69 B11R1.81 CCOC1=C(N)C=C(Cl)C=C1 BBL034405 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.277 CC1=CC(O)=C(C=O)C=C1Br BBL035895 [1,1,0,0,0,0|1,0,1]=4 71 B11R1.279 COC1=CC=C(C=O)C=C1O BBL023550 [1,1,0,0,0,0|1,0,1]=4 72 B11R1.464 CC1=CC(C)=C(CN)C(C)=C1 BBL036407 [1,1,0,0,0,0|2,0,0]=4 73 B11R1.53 CC(C)C1=CC=CC=C1NN BBL022211 [1,1,0,0,0,0|1,0,0]=3 74 B11R1.159 CC1=CC=CC(C(C)C)=C1N BBL036472 [1,1,0,0,0,0|1,0,0]=3 75 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 BBL028124 [1,1,0,0,0,0|1,0,1]=4 76 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 BBL027378 [1,1,0,0,0,0|1,0,1]=4 77 B11R1.167 CC(=O)C1=CC(N)=CC=C1O BBL028200 [1,1,0,0,0,0|1,0,1]=4 78 B11R1.222 CCC(=O)C1=CC=CC=C1O BBL011846 [1,1,0,0,0,0|1,0,1]=4 79 B11R1.222 CNC(=O)C1=CC=CC=C1O BBL010949 [1,1,0,0,0,0|1,0,1]=4 80 B11R1.222 COC(=O)C1=CC=CC=C1O BBL010504 [1,1,0,0,0,0|1,0,1]=4 81 B11R1.222 C\C(=N\O)C1=C(O)C=CC=C1 BBL023001 [1,1,0,0,0,0|1,0,1]=4 82 B13R1.51 CC(C)OC1=C(C=O)C=C(Br)C=C1 BBL013915 [0,1,0,0,0,1|1,0,1]=4 83 B13R1.51 CC(C)OC1=C(C=O)C=C(Cl)C=C1 BBL013914 [0,1,0,0,0,1|1,0,1]=4 84 B13R1.51 CC(C)OC1=C(CN)C=C(Cl)C=C1 BBL022972 [0,1,0,0,0,1|2,0,0]=4 85 B13R1.51 CC(C)OC1=CC=C(Br)C=C1C#N BBL016900 [0,1,0,0,0,1|2,0,0]=4 86 B13R1.653 CC(C)OC1=CC=C(C=O)C=C1Br BBL034346 [0,1,0,0,0,1|1,0,1]=4 87 B13R1.99 COC1=CC(OC)=C(C(C)=O)C=C1 BBL027722 [0,2,0,0,0,0|1,0,1]=4 88 B13R1.165 CN(C)C1=CC=C(N)C=C1C(=O)O BBL030596 [0,2,0,0,0,0|2,0,0]=4 89 B11R2.36 OC1=CC2=C(C=C1)OCO2 BBL027539 [1,0,0,1,0,0|2,0,0]=4 90 B13R2.3683 CC1CCC2=CC(F)=CC=C2N1 BBL027959 [0,0,0,1,0,1|2,0,0]=4 91 B11R1.20 CC(C)OC1=CC=C(N)C=C1 BBL028078 [1,0,0,0,0,1|1,0,0]=3 92 B11R1.86 CC(C)SC1=CC=CC=C1N BBL034974 [1,0,0,0,0,1|1,0,0]=3