0 B14R2.781 CC(=O)C1=CC=C2C=CC=CC2=C1 HY-Y1819 [0,0,0,0,0,0|0,0,0]=0 1 B14R2.781 CC(C)C1=CC2=CC=CC=C2C=C1 HY-W150166 [0,0,0,0,0,0|1,0,1]=2 2 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=C1 HY-W007437 [0,0,0,0,0,0|1,0,0]=1 3 B14R2.781 O=C(O)C1=CC2=CC=CC=C2C=N1 HY-41004 [0,0,0,0,0,0|2,0,0]=2 4 B14R2.781 O=C(O)C1=CC=C2N=CC=CC2=C1 HY-W004855 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.781 O=C(O)C1=NC2=C(C=CC=C2)C=C1 HY-W002011 [0,0,0,0,0,0|2,0,0]=2 6 B14R2.781 OB(O)C1=CC2=CC=CC=C2C=C1 HY-W002570 [0,0,0,0,0,0|2,0,1]=3 7 B13R2.57 C=CC1=CC2=CC=CC=C2C=C1 HY-W015553 [1,0,0,0,0,0|0,0,1]=2 8 B13R2.57 COC1=CC2=C(C=CC=C2)C=C1 HY-W010179 [1,0,0,0,0,0|1,0,0]=2 9 B13R2.57 COC1=CC=C2N=CC=CC2=C1 HY-W017232 [1,0,0,0,0,0|2,0,0]=3 10 B13R2.57 O=CC1=CC2=C(C=CC=C2)C=C1 HY-Y0075 [1,0,0,0,0,0|0,0,0]=1 11 B13R2.57 O=CC1=NC2=CC=CC=C2C=C1 HY-W008168 [1,0,0,0,0,0|1,0,0]=2 12 B13R2.57 OCC1=CC2=C(C=CC=C2)C=C1 HY-W001953 [1,0,0,0,0,0|0,0,2]=3 13 B15R2.627 O=C(O)C1=C(O)C2=CC=CC=C2C=C1 HY-W016103 [0,1,0,0,0,0|1,0,0]=2 14 B15R2.984 CC(=O)C1=CC2=CC=CC=C2OC1=O HY-138554 [0,1,0,0,0,0|1,0,0]=2 15 B15R2.984 CC1=NC2=CC=CC=C2N=C1C(=O)O HY-W016099 [0,1,0,0,0,0|3,0,0]=4 16 B15R2.984 NC1=CC2=CC=CC=C2C=C1C(=O)O HY-W005148 [0,1,0,0,0,0|1,0,0]=2 17 B15R2.984 O=[N+]([O-])C1=C(Cl)C=C2N=CC=CC2=C1 HY-W021132 [0,1,0,0,0,0|3,0,0]=4 18 B15R2.1601 COC(=O)C1=NC2=C(C=CC=C2)C=C1 HY-W016141 [0,1,0,0,0,0|1,0,0]=2 19 B15R2.7180 CC(=O)C1=CC=C2C=C(N)C=CC2=C1 HY-42999 [0,1,0,0,0,0|0,0,0]=1 20 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)N1 HY-W110662 [0,1,0,0,0,0|2,0,0]=3 21 B15R2.14951 O=C(O)C1=CC(=O)C2=CC=CC=C2O1 HY-B1182 [0,1,0,0,0,0|2,0,0]=3 22 B15R2.61353 O=C(O)C1=NC2=C(O)C=CC=C2C=C1 HY-W067427 [0,1,0,0,0,0|2,0,0]=3 23 B13R1.74 CN(C)C1=CC=C(\C=C\C=O)C=C1 HY-W016729 [0,0,1,0,0,0|3,0,0]=4 24 B13R2.72 CC(=O)C1=CNC2=C1C=CC=C2 HY-W018667 [0,0,0,0,1,0|1,0,0]=2 25 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 HY-40161 [0,0,0,0,1,0|2,0,0]=3 26 B13R2.72 O=C(O)C1=CNC2=CC=CC=C21 HY-40161R [0,0,0,0,1,0|2,0,0]=3 27 B13R2.72 O=C(O)C1=NNC2=C1C=CC=C2 HY-W002518 [0,0,0,0,1,0|3,0,0]=4 28 B13R2.430 O=C(O)C1=CC2=C(C=C1)NC=C2 HY-59302 [0,0,0,0,1,0|2,0,0]=3 29 B13R2.430 O=C(O)C1=CC2=C(C=CN2)C=C1 HY-W015420 [0,0,0,0,1,0|2,0,0]=3 30 B13R2.430 O=C(O)C1=CC=C2N=CNC2=C1 HY-W002064 [0,0,0,0,1,0|3,0,0]=4 31 B13R2.430 O=C(O)C1=CC=C2N=COC2=C1 HY-33299 [0,0,0,0,1,0|3,0,0]=4 32 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)NC=C2 HY-59273 [0,0,0,0,1,0|3,0,0]=4 33 B13R2.430 O=[N+]([O-])C1=CC2=C(C=CN2)C=C1 HY-W001576 [0,0,0,0,1,0|3,0,0]=4 34 B13R2.430 O=[N+]([O-])C1=CC=C2OC=CC2=C1 HY-Z0576 [0,0,0,0,1,0|3,0,0]=4 35 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 HY-I0096 [0,0,0,0,1,0|2,0,0]=3 36 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)N1 HY-I0096R [0,0,0,0,1,0|2,0,0]=3 37 B15R2.1668 O=C(O)CC1=CC2=CC=CC=C2C=C1 HY-W016187 [0,0,0,0,0,1|1,0,0]=2 38 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 HY-W013605A [1,0,1,0,0,0|2,0,0]=4 39 B12R1.121 COC1=CC=CC=C1\C=C\C=O HY-W046353 [1,0,1,0,0,0|1,0,1]=4 40 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl HY-W016366 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O HY-W012531 [1,0,1,0,0,0|2,0,0]=4 42 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O HY-W012531R [1,0,1,0,0,0|2,0,0]=4 43 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 HY-W017212 [1,0,1,0,0,0|2,0,0]=4 44 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 HY-W067056 [1,0,1,0,0,0|2,0,0]=4 45 B12R2.24 BrC1=CC2=CN=CC=C2C=C1 HY-69055 [2,0,0,0,0,0|2,0,0]=4 46 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 HY-W004432 [2,0,0,0,0,0|2,0,0]=4 47 B12R2.24 BrC1=CC=C2C=NC=CC2=C1 HY-69092 [2,0,0,0,0,0|2,0,0]=4 48 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 HY-W007403 [2,0,0,0,0,0|2,0,0]=4 49 B12R2.24 ClC1=CC=C2C=CC=CC2=C1 HY-124451 [2,0,0,0,0,0|1,0,0]=3 50 B12R2.24 NC1=CC=C2N=CC=CC2=C1 HY-W007404 [2,0,0,0,0,0|2,0,0]=4 51 B12R2.24 NC1=NC2=CC=CC=C2C=C1 HY-W007524 [2,0,0,0,0,0|2,0,0]=4 52 B12R2.24 O=C1C=CC2=CC=CC=C2O1 HY-N0709 [2,0,0,0,0,0|1,0,0]=3 53 B12R2.24 O=C1C=NC2=CC=CC=C2N1 HY-W017519 [2,0,0,0,0,0|2,0,0]=4 54 B12R2.24 OC1=CC=C2C=CC=CC2=C1 HY-Y0110 [2,0,0,0,0,0|0,0,1]=3 55 B14R2.134 COC1=CC=C2C=CC(=O)OC2=C1 HY-N1366 [1,1,0,0,0,0|2,0,0]=4 56 B14R2.142 O=CC1=NC2=C(C=CC=C2O)C=C1 HY-W016840 [1,1,0,0,0,0|1,0,0]=3 57 B14R2.2332 COC1=CC2=CC=C(Br)C=C2C=C1 HY-Y0038 [1,1,0,0,0,0|1,0,0]=3 58 B14R2.95 COC(=O)C1=CNC2=CC=CC=C21 HY-79635 [0,1,0,0,1,0|1,0,0]=3 59 B14R2.95 O=C(CCl)C1=CNC2=CC=CC=C21 HY-16666 [0,1,0,0,1,0|1,0,0]=3 60 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)N2 HY-33838 [0,1,0,0,1,0|2,0,0]=4 61 B14R2.4529 O=C(O)C1=CC2=C(C=CC(Br)=C2)N1 HY-W007593 [0,1,0,0,1,0|2,0,0]=4 62 B16R2.3989 CC(=O)NC1=CC2=C(C=CC=C2)OC1=O HY-W014750 [0,1,0,0,0,1|1,0,0]=3 63 B16R2.23331 O=C(O)C1=C(O)C2=CC=CC=C2C(O)=C1 HY-W014701 [0,2,0,0,0,0|1,0,0]=3 64 B16R2.23521 O=C(O)C1=CC2=CC(Br)=CC=C2OC1=O HY-100667 [0,2,0,0,0,0|2,0,0]=4 65 B16R2.23521 O=C(O)C1=CC2=CC(O)=CC=C2OC1=O HY-W023023 [0,2,0,0,0,0|2,0,0]=4 66 B16R2.33887 O=C(O[Na])C1=NC2=CC=CC=C2C(O)=C1 HY-107512 [0,2,0,0,0,0|2,0,0]=4 67 B16R2.26103 CC1=CC(=O)OC2=CC(S(C)=O)=CC=C12 HY-D1256 [0,2,0,0,0,0|2,0,0]=4 68 B16R2.133406 O=C(O)C1=NC2=CC(Cl)=CC=C2C(O)=C1 HY-100811 [0,2,0,0,0,0|2,0,0]=4 69 B16R2.7486 COC1=CC2=CC=C(C(=O)O)C=C2C=C1 HY-B2121 [0,2,0,0,0,0|1,0,0]=3 70 B16R2.7486 COC1=CC2=CC=C(C(C)=O)C=C2C=C1 HY-Y0235 [0,2,0,0,0,0|0,0,0]=2 71 B16R2.7486 COC1=CC=C2C=C(C(C)O)C=CC2=C1 HY-W101437 [0,2,0,0,0,0|0,0,2]=4 72 B16R2.27376 CC(=O)C1=CC=C2OC(C)(C)C=CC2=C1 HY-77173 [0,2,0,0,0,0|1,0,1]=4 73 B16R2.22890 O=C(O)C1=CC(O)=C2C=CC=C(O)C2=N1 HY-W014666 [0,2,0,0,0,0|2,0,0]=4 74 B14R2.2 CC(=O)OC1=CNC2=C1C=CC=C2 HY-137884 [0,0,1,1,0,0|2,0,0]=4 75 B14R2.31359 CN(C)C1=C2C=CC=CC2=CC=C1 HY-D0222 [0,0,1,1,0,0|2,0,0]=4 76 B14R2.31359 C[C@@H](N)C1=CC=CC2=CC=CC=C21 HY-75070 [0,0,1,1,0,0|1,0,1]=4 77 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=C1 HY-Y0236 [0,0,1,1,0,0|1,0,0]=3 78 B14R2.31359 O=C(O)C1=CC=CC2=C1C=CC=N2 HY-W004029 [0,0,1,1,0,0|2,0,0]=4 79 B14R2.31359 O=C(O)C1=CC=CC2=C1N=CC=C2 HY-W007371 [0,0,1,1,0,0|2,0,0]=4 80 B14R2.31359 O=C(O)C1=CC=NC2=CC=CC=C21 HY-Y0057 [0,0,1,1,0,0|2,0,0]=4 81 B12R2.1 O=CC1=CNC2=CC=CC=C12 HY-W007376 [1,0,0,0,1,0|1,0,0]=3 82 B12R2.1 O=CC1=COC2=CC=CC=C12 HY-W004801 [1,0,0,0,1,0|1,0,0]=3 83 B12R2.1 O=CC1=CSC2=C1C=CC=C2 HY-W002251 [1,0,0,0,1,0|1,0,0]=3 84 B12R2.32 O=CC1=CC2=CC=CC=C2N1 HY-W015650 [1,0,0,0,1,0|1,0,0]=3 85 B12R2.44 COC1=CC=C2NC=CC2=C1 HY-W007328 [1,0,0,0,1,0|2,0,0]=4 86 B16R2.477 O=C(O)COC1=CC=C2C=CC=CC2=C1 HY-W014796 [0,0,0,0,0,2|1,0,0]=3