0 B9R1.69 CC1=C(Br)C=CC(Br)=N1 HY-W003282 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.69 CC1=CC(Br)=C(O)C=C1 HY-W016153 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.69 CC1=CC(Br)=CN=C1N HY-75420 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.69 CC1=CC(Br)=CNC1=O HY-75423 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.69 CC1=CC(O)=C(O)C=C1 HY-W012814 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.69 CC1=CC(O)=CC=C1N HY-W012824 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 CC1=CC(O)=CC=C1O HY-W012817 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 CC1=CN=C(C)C(C)=N1 HY-W010476 [0,0,0,0,0,0|0,0,0]=0 8 B9R1.69 CC1=NC=C(Br)C=C1N HY-W003575 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.69 CC1=NNC(=O)NC1=O HY-136559 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 HY-W001198 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.69 NC1=C(Br)C=C(F)C=N1 HY-W010023 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.69 NC1=C(Br)N=C(Br)C=N1 HY-79805 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.69 NC1=CC(Br)=CN=C1Cl HY-32828 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.69 NC1=CC=C(Cl)N=C1Cl HY-W002136 [0,0,0,0,0,0|4,0,0]=4 15 B8R1.3 BrC1=CN=C(I)C=C1 HY-W002668 [1,0,0,0,0,0|3,0,0]=4 16 B8R1.3 BrC1=NC=C(I)C=C1 HY-W003027 [1,0,0,0,0,0|3,0,0]=4 17 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [1,0,0,0,0,0|2,0,0]=3 18 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [1,0,0,0,0,0|2,0,0]=3 19 B8R1.3 CC1=CN=C(C)C=N1 HY-34439 [1,0,0,0,0,0|0,0,0]=1 20 B8R1.3 CC1=CN=C(N)C=N1 HY-65255 [1,0,0,0,0,0|1,0,0]=2 21 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [1,0,0,0,0,0|2,0,1]=4 22 B8R1.3 CC1=NN=C(Cl)C=C1 HY-W001297 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.3 ClC1=CN=C(Cl)C=C1 HY-W015626 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.3 ClC1=NC=C(Br)C=C1 HY-W002767 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.3 ClC1=NC=C(I)C=C1 HY-W002858 [1,0,0,0,0,0|3,0,0]=4 26 B8R1.3 FC1=NC=C(Br)C=C1 HY-32746 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.3 FC1=NC=C(I)C=C1 HY-W007531 [1,0,0,0,0,0|3,0,0]=4 28 B8R1.3 NC1=CC=C(F)N=C1 HY-65254 [1,0,0,0,0,0|3,0,0]=4 29 B8R1.3 NC1=CN=C(Br)C=C1 HY-W016849 [1,0,0,0,0,0|3,0,0]=4 30 B8R1.3 NC1=CN=C(Cl)C=C1 HY-W007481 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.3 NC1=NC=C(Br)N=C1 HY-59261 [1,0,0,0,0,0|2,0,0]=3 32 B8R1.4 BrC1=CC=CC(Br)=N1 HY-59162 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.4 BrC1=CN=CC(Br)=C1 HY-Y0491 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.4 CC1=CN=CC(C)=N1 HY-W040790 [1,0,0,0,0,0|0,0,0]=1 35 B8R1.4 CC1=NC(Cl)=CC=C1 HY-W001993 [1,0,0,0,0,0|2,0,0]=3 36 B8R1.4 ClC1=CN=CC(Br)=C1 HY-W003165 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.4 ClC1=CN=CC(Cl)=C1 HY-W015627 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.4 NC1=CC(Br)=CN=C1 HY-66052 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.4 NC1=CC=CC(N)=N1 HY-Y0198 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.4 NC1=CN=CC(Cl)=N1 HY-59335 [1,0,0,0,0,0|2,0,0]=3 41 B8R1.4 NC1=NC(Br)=CC=C1 HY-Y1049 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.4 OC1=CN=CC(Br)=C1 HY-66053 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [1,0,0,0,0,0|2,0,0]=3 44 B8R1.5 CC1=C(C)N=CC=N1 HY-W015914 [1,0,0,0,0,0|0,0,0]=1 45 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [1,0,0,0,0,0|2,0,0]=3 46 B8R1.5 CC1=NC=CC=C1O HY-W002339 [1,0,0,0,0,0|2,0,0]=3 47 B8R1.5 ClC1=C(Br)N=CC=C1 HY-W007662 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.5 ClC1=C(Cl)N=CC=C1 HY-W012591 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.5 ClC1=NC=CC=C1Br HY-32751 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.5 ClC1=NC=CC=C1I HY-32753 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.5 NC1=C(Cl)N=CC=N1 HY-W007499 [1,0,0,0,0,0|2,0,0]=3 52 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.5 NC1=CC=CN=C1Br HY-66051 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.5 NC1=CC=CN=C1Cl HY-Y0244 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.5 NC1=NC=CC=C1I HY-32813 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.5 OC1=CC=CN=C1Br HY-20026 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [1,0,0,0,0,0|3,0,0]=4 58 B10R1.22 CC1=CC(C)=C(C)C(O)=C1 HY-W015812 [0,1,0,0,0,0|2,0,0]=3 59 B10R1.22 CC1=CC(C)=C(O)C(C)=C1 HY-W038786 [0,1,0,0,0,0|3,0,0]=4 60 B10R1.30 CCC1=NC(C)=CC=C1O HY-W002620A [0,1,0,0,0,0|2,0,0]=3 61 B10R1.30 COC1=CC(C)=CC=C1O HY-W040971 [0,1,0,0,0,0|3,0,0]=4 62 B10R1.30 FC1=CC=C(Br)N=C1CBr HY-43727 [0,1,0,0,0,0|3,0,0]=4 63 B10R1.30 N#CC1=NC(Br)=CN=C1Cl HY-Z1112 [0,1,0,0,0,0|2,0,1]=4 64 B10R1.118 CC1=CC(=O)C(C)=CC1=O HY-W090317 [0,1,0,0,0,0|3,0,0]=4 65 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0264 [0,1,0,0,0,0|0,0,0]=1 66 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0935 [0,1,0,0,0,0|0,0,0]=1 67 B10R1.118 [2H]C1=NC([2H])=C([2H])N=C1[2H] HY-W013040S [0,1,0,0,0,0|3,0,0]=4 68 B10R1.119 CC1=C(C)C(C)=C(C)C=C1 HY-W006416 [0,1,0,0,0,0|2,0,0]=3 69 B8R1.18 CC1=CC(=O)C(C)O1 HY-W010553 [0,0,0,0,1,0|2,0,1]=4 70 B8R1.18 CC1=CC(=O)OC1=O HY-78035 [0,0,0,0,1,0|3,0,0]=4 71 B8R1.18 CC1=CC(C)=NN1C HY-N7086 [0,0,0,0,1,0|1,0,0]=2 72 B8R1.18 CC1=NC(C)=C(C)S1 HY-W100945 [0,0,0,0,1,0|1,0,0]=2 73 B8R1.50 CC1=NNC(C)=C1Br HY-W016754 [0,0,0,0,1,0|2,0,0]=3 74 B8R1.50 CC1=NOC(N)=C1Cl HY-70065 [0,0,0,0,1,0|3,0,0]=4 75 B7R1.3 CC1=NC=CN=C1 HY-W067358 [2,0,0,0,0,0|0,0,0]=2 76 B7R1.3 ClC1=NC=CN=C1 HY-Y0109 [2,0,0,0,0,0|1,0,0]=3 77 B7R1.3 IC1=CC=CC=N1 HY-W004126 [2,0,0,0,0,0|2,0,0]=4 78 B7R1.3 NC1=NC=CN=C1 HY-34068 [2,0,0,0,0,0|1,0,0]=3 79 B7R1.3 OC1=CC=CN=C1 HY-Y1129 [2,0,0,0,0,0|2,0,0]=4 80 B9R1.1 CNC1=CC=C(C)C=C1 HY-W017767 [1,1,0,0,0,0|2,0,0]=4 81 B9R1.1 COC1=CC=C(C)C=C1 HY-W012835 [1,1,0,0,0,0|2,0,0]=4 82 B9R1.1 COC1=NC=C(Br)C=C1 HY-32756 [1,1,0,0,0,0|2,0,0]=4 83 B9R1.1 COC1=NC=C(N)C=C1 HY-W001994 [1,1,0,0,0,0|2,0,0]=4 84 B9R1.1 OCC1=CC=C(Br)N=C1 HY-W016116 [1,1,0,0,0,0|2,0,0]=4 85 B9R1.1 OCC1=NC=C(Br)C=C1 HY-32837 [1,1,0,0,0,0|2,0,0]=4 86 B9R1.1 OCC1=NC=C(O)C=C1 HY-W007140 [1,1,0,0,0,0|2,0,0]=4 87 B9R1.2 CC1=CC=CC(C#N)=N1 HY-W002490 [1,1,0,0,0,0|1,0,1]=4 88 B9R1.2 COC1=CC=CC(C)=C1 HY-115127 [1,1,0,0,0,0|2,0,0]=4 89 B9R1.2 COC1=CN=CC(Br)=C1 HY-W007427 [1,1,0,0,0,0|2,0,0]=4 90 B9R1.2 COC1=NC(Cl)=CC=C1 HY-W001995 [1,1,0,0,0,0|2,0,0]=4 91 B9R1.2 OCC1=NC(Br)=CC=C1 HY-32836 [1,1,0,0,0,0|2,0,0]=4 92 B9R1.3 CC1=CN=CC(F)=C1N HY-W100209 [1,1,0,0,0,0|2,0,0]=4 93 B9R1.34 CC1=CC(=O)C=C(C)O1 HY-W010469 [1,1,0,0,0,0|2,0,0]=4 94 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [1,1,0,0,0,0|2,0,0]=4 95 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [1,1,0,0,0,0|2,0,0]=4 96 B9R1.15 COC1=NC=CC=C1Br HY-32755 [1,1,0,0,0,0|2,0,0]=4 97 B11R1.32 CC1=C(O)C(C)=C(C)C(O)=C1 HY-W017378 [0,2,0,0,0,0|2,0,0]=4 98 B11R1.32 CC1=NC(C)=C(Cl)C(O)=C1Cl HY-B1088 [0,2,0,0,0,0|2,0,0]=4 99 B11R1.32 CC1=NC(C)=C(Cl)C(O)=C1Cl HY-B1088R [0,2,0,0,0,0|2,0,0]=4 100 B11R1.166 CC(=O)C1=CC=C(C)C=C1C HY-W015618 [0,2,0,0,0,0|2,0,0]=4 101 B11R1.278 CC1=NC=C(CO)C(C)=C1O HY-W015210 [0,2,0,0,0,0|2,0,0]=4 102 B11R1.280 COC1=CC=C(C)C(OC)=C1 HY-W324424 [0,2,0,0,0,0|2,0,0]=4 103 B7R1.2 CC1=CC(N)=NN1 HY-75637 [1,0,0,0,1,0|2,0,0]=4 104 B7R1.2 CC1=CC(N)=NO1 HY-W041676 [1,0,0,0,1,0|2,0,0]=4 105 B7R1.2 CC1=CN=C(N)S1 HY-WAA0093 [1,0,0,0,1,0|2,0,0]=4 106 B7R1.2 CC1=NN(C)C=C1 HY-W002168 [1,0,0,0,1,0|2,0,0]=4 107 B7R1.4 CC1=CNN=C1C HY-W019334 [1,0,0,0,1,0|1,0,1]=4