0 B9R0.5 CCO/C=C/C(=O)OCC AC180239 [0,0,0,0,0,0|1,0,1]=2 1 B8R0.1 CCOC(=O)/C=C/C=O AC511142 [1,0,0,0,0,0|1,0,0]=2 2 B8R0.1 CCOC(=O)CCNC AC020893 [1,0,0,0,0,0|1,0,2]=4 3 B10R0.2 CCOC(=N)CC(=O)OCC LN00010043 [0,1,0,0,0,0|1,0,2]=4 4 B10R1.10 CC1=CC(=CC=C1)CCO LN00183333 [0,0,0,1,0,0|3,0,0]=4 5 B10R1.10 CCCC1=CC(N)=CC=C1 AC160362 [0,0,0,1,0,0|3,0,0]=4 6 B10R1.10 CCOC1=CC=CC(N)=C1 AC020532 [0,0,0,1,0,0|2,0,0]=3 7 B10R1.10 CCOC1=NC=CC(N)=C1 AC180955 [0,0,0,1,0,0|3,0,0]=4 8 B10R1.11 CCOC(=O)C1=CC=CN1 AC100116 [0,0,0,1,0,0|1,0,0]=2 9 B10R1.11 CCOC(=O)C1=CN=CO1 AC181819 [0,0,0,1,0,0|2,0,0]=3 10 B10R1.11 CCOC(=O)C1=CNC=N1 AC181470 [0,0,0,1,0,0|2,0,0]=3 11 B10R1.11 CCOC(=O)C1=CNN=C1 AC180262 [0,0,0,1,0,0|2,0,1]=4 12 B10R1.11 CCOC(=O)C1=COC=N1 AC181820 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.11 CCOC(=O)C1=CSC=C1 AC181421 [0,0,0,1,0,0|1,0,1]=3 14 B10R1.11 CCOC(=O)C1=CSC=N1 AC181711 [0,0,0,1,0,0|2,0,0]=3 15 B10R1.11 CCOC(=O)C1=NC=CN1 AC181654 [0,0,0,1,0,0|2,0,0]=3 16 B10R1.11 CCOC(=O)C1=NN=CS1 AC051030 [0,0,0,1,0,0|3,0,0]=4 17 B10R1.11 CCOC(=O)C1=NNC=C1 AC180805 [0,0,0,1,0,0|2,0,0]=3 18 B10R1.245 CC1=CC=CC(C)=C1CBr AC511906 [0,0,0,1,0,0|3,0,0]=4 19 B10R1.245 CC1=CC=CC(C)=C1CN AC511863 [0,0,0,1,0,0|3,0,0]=4 20 B9R0.34 CCOC(=O)CC(=O)CC AC511712 [1,1,0,0,0,0|0,0,2]=4 21 B9R0.48 CCOC(=O)CCC(C)=O AC510825 [1,1,0,0,0,0|0,0,2]=4 22 B9R0.24 COC(=O)/C=C/C(=O)OC HY-17363 [1,1,0,0,0,0|1,0,0]=3 23 B11R0.191 CCO/C=C(\C#N)C(=O)OCC AC130328 [0,2,0,0,0,0|1,0,1]=4 24 B9R1.15 CCC1=CC=CC=C1Br AC500247 [1,0,0,1,0,0|2,0,0]=4 25 B9R1.14 CCN1C=CC=C1C=O AC330025 [1,0,0,1,0,0|2,0,0]=4 26 B9R1.11 COC(=O)C1=CC=CN1 AC511475 [1,0,0,1,0,0|1,0,0]=3 27 B9R1.11 COC(=O)C1=CC=CS1 LN00186303 [1,0,0,1,0,0|1,0,0]=3 28 B9R1.11 COC(=O)C1=CCCC1 AC180978 [1,0,0,1,0,0|0,0,2]=4 29 B9R1.11 COC(=O)C1=CN=CN1 AC180901 [1,0,0,1,0,0|2,0,0]=4 30 B9R1.11 COC(=O)C1=CN=CN1 LN00009425 [1,0,0,1,0,0|2,0,0]=4 31 B9R1.11 COC(=O)C1=CN=CS1 AC021342 [1,0,0,1,0,0|2,0,0]=4 32 B9R1.11 COC(=O)C1=CNC=C1 AC511033 [1,0,0,1,0,0|1,0,1]=4 33 B9R1.11 COC(=O)C1=COC=N1 AC050400 [1,0,0,1,0,0|2,0,0]=4 34 B9R1.11 COC(=O)C1=CSC=C1 AC500266 [1,0,0,1,0,0|1,0,1]=4 35 B9R1.11 COC(=O)C1=CSC=N1 AC181967 [1,0,0,1,0,0|2,0,0]=4 36 B9R1.11 COC(=O)C1=NC=CN1 AC131054 [1,0,0,1,0,0|2,0,0]=4 37 B9R1.11 COC(=O)C1=NNC=C1 AC510661 [1,0,0,1,0,0|2,0,0]=4 38 B9R1.11 COC(=O)C1CC=CC1 AC181768 [1,0,0,1,0,0|0,0,2]=4 39 B11R1.16 CCOC(=O)C1=CC=CC=N1 LN00174068 [0,1,0,1,0,0|0,0,1]=3 40 B11R1.16 CCOC(=O)C1=CC=NC=N1 AC182470 [0,1,0,1,0,0|1,0,0]=3 41 B11R1.16 CCOC(=O)C1=NC=CN=N1 AC050203 [0,1,0,1,0,0|2,0,0]=4 42 B11R1.16 ClCOC(=O)C1=CC=CC=C1 AC511140 [0,1,0,1,0,0|1,0,1]=4 43 B11R1.24 CC1=CC(CCCO)=CC=C1 AC021440 [0,1,0,1,0,0|2,0,0]=4 44 B11R1.30 CCOC(=O)C=C1CCCC1 LN00214045 [0,1,0,1,0,0|0,0,2]=4 45 B11R1.30 CCOC(=O)CC1=NC=CS1 AC182689 [0,1,0,1,0,0|1,0,1]=4 46 B11R1.199 CCOC(=O)C1=C(Br)C=NN1 AC040015 [0,1,0,1,0,0|2,0,0]=4 47 B11R1.199 CCOC(=O)C1=C(Br)N=CS1 AC290034 [0,1,0,1,0,0|2,0,0]=4 48 B11R1.199 CCOC(=O)C1=C(Br)SC=N1 AC182581 [0,1,0,1,0,0|2,0,0]=4 49 B11R1.199 CCOC(=O)C1=C(C)C=CN1 AC280070 [0,1,0,1,0,0|0,0,0]=2 50 B11R1.199 CCOC(=O)C1=C(C)NC=C1 AC180694 [0,1,0,1,0,0|0,0,0]=2 51 B11R1.199 CCOC(=O)C1=C(F)C=CN1 AC210016 [0,1,0,1,0,0|1,0,0]=3 52 B11R1.199 CCOC(=O)C1=C(N)C=CN1 AC181769 [0,1,0,1,0,0|1,0,0]=3 53 B11R1.199 CCOC(=O)C1=C(N)C=CO1 AC050729 [0,1,0,1,0,0|1,0,0]=3 54 B11R1.199 CCOC(=O)C1=C(N)N=CS1 AC290035 [0,1,0,1,0,0|2,0,0]=4 55 B11R1.199 CCOC(=O)C1=C(N)NC=N1 AC051038 [0,1,0,1,0,0|2,0,0]=4 56 B11R1.199 CCOC(=O)C1=CNN=C1C LN00009814 [0,1,0,1,0,0|1,0,0]=3 57 B11R1.199 CCOC(=O)C1=NC=CN1C AC511650 [0,1,0,1,0,0|1,0,0]=3 58 B11R1.15 CCOC(=O)C1=CC=C(Br)S1 AC181496 [0,1,0,1,0,0|1,0,0]=3 59 B11R1.15 CCOC(=O)C1=CC=C(C)N1 AC181161 [0,1,0,1,0,0|0,0,0]=2 60 B11R1.15 CCOC(=O)C1=CN=C(Br)O1 AC511325 [0,1,0,1,0,0|2,0,0]=4 61 B11R1.15 CCOC(=O)C1=CN=C(Br)S1 AC181027 [0,1,0,1,0,0|2,0,0]=4 62 B11R1.15 CCOC(=O)C1=CN=C(Cl)O1 AC040053 [0,1,0,1,0,0|2,0,0]=4 63 B11R1.15 CCOC(=O)C1=CN=C(N)N1 AC182494 [0,1,0,1,0,0|2,0,0]=4 64 B11R1.15 CCOC(=O)C1=CN=C(N)S1 AC181055 [0,1,0,1,0,0|2,0,0]=4 65 B11R1.15 CCOC(=O)C1=COC(=N1)C LN00182974 [0,1,0,1,0,0|1,0,0]=3 66 B11R1.15 CCOC(=O)C1=CSC(C)=N1 AC180796 [0,1,0,1,0,0|1,0,0]=3 67 B11R1.157 CC(=O)OC1=CC=CC(C)=C1 HY-B0948 [0,1,0,1,0,0|1,0,1]=4 68 B11R1.157 CC(C)OC1=CC(Br)=CC=C1 AC021391 [0,1,0,1,0,0|2,0,0]=4 69 B11R1.83 CCOC1=CC=C(C=C1)C=O LN00173935 [0,1,0,1,0,0|2,0,0]=4 70 B11R2.106 C1CC2=C(C1)C(=CC=C2)Br LN02012267 [0,0,0,2,0,0|2,0,0]=4 71 B11R2.106 NC1=C2CCOC2=CC=C1 AC512103 [0,0,0,2,0,0|2,0,0]=4