0 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [0,0,0,0,0,0|2,0,0]=2 1 B8R1.5 CC1=C(C)N=CC=N1 HY-W015914 [0,0,0,0,0,0|0,0,0]=0 2 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.5 CC1=NC=CC=C1O HY-W002339 [0,0,0,0,0,0|2,0,0]=2 4 B8R1.5 ClC1=C(Br)N=CC=C1 HY-W007662 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.5 ClC1=C(Cl)N=CC=C1 HY-W012591 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.5 ClC1=NC=CC=C1Br HY-32751 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.5 ClC1=NC=CC=C1I HY-32753 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.5 FC1=CC=CC=C1I HY-34673 [0,0,0,0,0,0|4,0,0]=4 9 B8R1.5 NC1=C(Cl)N=CC=N1 HY-W007499 [0,0,0,0,0,0|2,0,0]=2 10 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.5 NC1=CC=CC=C1I HY-W007318 [0,0,0,0,0,0|4,0,0]=4 12 B8R1.5 NC1=CC=CN=C1Br HY-66051 [0,0,0,0,0,0|3,0,0]=3 13 B8R1.5 NC1=CC=CN=C1Cl HY-Y0244 [0,0,0,0,0,0|3,0,0]=3 14 B8R1.5 NC1=NC=CC=C1I HY-32813 [0,0,0,0,0,0|3,0,0]=3 15 B8R1.5 OC1=C(F)C=CC=C1 HY-41755 [0,0,0,0,0,0|4,0,0]=4 16 B8R1.5 OC1=CC=CN=C1Br HY-20026 [0,0,0,0,0,0|3,0,0]=3 17 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [0,0,0,0,0,0|3,0,0]=3 18 B7R1.3 BrC1=CN=CN=C1 HY-W008017 [1,0,0,0,0,0|3,0,0]=4 19 B7R1.3 CC1=NC=CN=C1 HY-W067358 [1,0,0,0,0,0|0,0,0]=1 20 B7R1.3 ClC1=NC=CN=C1 HY-Y0109 [1,0,0,0,0,0|1,0,0]=2 21 B7R1.3 IC1=CC=CC=C1 HY-Y0747 [1,0,0,0,0,0|3,0,0]=4 22 B7R1.3 IC1=CC=CC=N1 HY-W004126 [1,0,0,0,0,0|2,0,0]=3 23 B7R1.3 N=C1N=NC=CN1 HY-W004843 [1,0,0,0,0,0|2,0,1]=4 24 B7R1.3 NC1=CN=CN=C1 HY-60351 [1,0,0,0,0,0|3,0,0]=4 25 B7R1.3 NC1=NC=CC=N1 HY-41340 [1,0,0,0,0,0|3,0,0]=4 26 B7R1.3 NC1=NC=CN=C1 HY-34068 [1,0,0,0,0,0|1,0,0]=2 27 B7R1.3 O=C1C=CC=CN1 HY-Y0191 [1,0,0,0,0,0|2,0,1]=4 28 B7R1.3 OC1=CC=CN=C1 HY-Y1129 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.3 CC1=C(Br)C=CC=C1N HY-50097 [0,1,0,0,0,0|3,0,0]=4 30 B9R1.3 CC1=C(O)C(=O)C=CO1 HY-W012788 [0,1,0,0,0,0|3,0,0]=4 31 B9R1.3 CC1=C(O)C(O)=CC=C1 HY-W012815 [0,1,0,0,0,0|3,0,0]=4 32 B9R1.15 CC1=CC=CC=C1C=O HY-Y0442 [0,1,0,0,0,0|2,0,1]=4 33 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [0,1,0,0,0,0|2,0,0]=3 34 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [0,1,0,0,0,0|2,0,0]=3 35 B9R1.15 COC1=CC=CC=C1O HY-B2115 [0,1,0,0,0,0|3,0,0]=4 36 B9R1.15 COC1=CC=CC=C1O HY-N1380 [0,1,0,0,0,0|3,0,0]=4 37 B9R1.15 COC1=CC=CC=C1O HY-N1380R [0,1,0,0,0,0|3,0,0]=4 38 B9R1.15 COC1=NC=CC=C1Br HY-32755 [0,1,0,0,0,0|2,0,0]=3 39 B9R1.15 N#CC1=NC=CC=C1Br HY-W002967 [0,1,0,0,0,0|2,0,1]=4 40 B9R1.15 NC1=C(C=O)C=CC=N1 HY-75813 [0,1,0,0,0,0|2,0,1]=4 41 B9R1.15 NC1=CC=CC=C1CO HY-W004705 [0,1,0,0,0,0|3,0,0]=4 42 B9R1.15 NCC1=CC=CC=C1O HY-34350 [0,1,0,0,0,0|3,0,0]=4 43 B9R1.15 O=CC1=CC=CN=C1Cl HY-32791 [0,1,0,0,0,0|2,0,1]=4 44 B9R1.15 O=CC1=NC=CC=C1F HY-W001028 [0,1,0,0,0,0|2,0,1]=4 45 B9R1.15 OCC1=CC=CC=C1I HY-W004678 [0,1,0,0,0,0|3,0,0]=4 46 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [0,1,0,0,0,0|3,0,0]=4 47 B9R1.69 CC1=C(Br)C=CC(Br)=N1 HY-W003282 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.69 CC1=CC(Br)=CN=C1N HY-75420 [0,1,0,0,0,0|2,0,0]=3 49 B9R1.69 CC1=CC(Br)=CNC1=O HY-75423 [0,1,0,0,0,0|2,0,1]=4 50 B9R1.69 CC1=CC(O)=CC=C1N HY-W012824 [0,1,0,0,0,0|3,0,0]=4 51 B9R1.69 CC1=CC(O)=CC=C1O HY-W012817 [0,1,0,0,0,0|3,0,0]=4 52 B9R1.69 CC1=CN=C(C)C(C)=N1 HY-W010476 [0,1,0,0,0,0|0,0,0]=1 53 B9R1.69 CC1=NC=C(Br)C=C1N HY-W003575 [0,1,0,0,0,0|2,0,0]=3 54 B9R1.69 CC1=NNC(=O)NC1=O HY-136559 [0,1,0,0,0,0|2,0,1]=4 55 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 HY-W001198 [0,1,0,0,0,0|3,0,0]=4 56 B9R1.69 NC1=C(Br)C=C(F)C=N1 HY-W010023 [0,1,0,0,0,0|3,0,0]=4 57 B9R1.69 NC1=C(Br)N=C(Br)C=N1 HY-79805 [0,1,0,0,0,0|2,0,0]=3 58 B9R1.69 NC1=CC(Br)=CN=C1Cl HY-32828 [0,1,0,0,0,0|3,0,0]=4 59 B9R1.69 NC1=CC=C(Cl)N=C1Cl HY-W002136 [0,1,0,0,0,0|3,0,0]=4 60 B7R1.4 CC1=CNN=C1C HY-W019334 [0,0,0,0,1,0|1,0,0]=2 61 B7R1.4 CN1C=CN=C1S HY-B0208 [0,0,0,0,1,0|2,0,0]=3 62 B7R1.4 CN1SC=CC1=O HY-W010243 [0,0,0,0,1,0|3,0,0]=4 63 B7R1.4 CN1SC=CC1=O HY-W010520 [0,0,0,0,1,0|3,0,0]=4 64 B7R1.4 NC1=NNC=C1Br HY-W007681 [0,0,0,0,1,0|3,0,0]=4 65 B6R0.3 CC(=O)\C(C)=N\O HY-Y0413 [1,0,1,0,0,0|2,0,0]=4 66 B6R1.1 C1=CC=NN=C1 HY-W007494 [2,0,0,0,0,0|2,0,0]=4 67 B6R1.1 C1=CN=CC=N1 HY-W013040 [2,0,0,0,0,0|0,0,0]=2 68 B6R1.1 C1=CN=CN=C1 HY-Y0519 [2,0,0,0,0,0|2,0,0]=4 69 B8R1.2 BrCC1=CC=CN=C1 HY-W004131 [1,1,0,0,0,0|1,0,0]=3 70 B8R1.2 C#CC1=CC=CN=C1 HY-34604 [1,1,0,0,0,0|1,0,1]=4 71 B8R1.2 CCC1=NC=CN=C1 HY-W040948 [1,1,0,0,0,0|0,0,0]=2 72 B8R1.2 COC1=CN=CC=C1 HY-W008119 [1,1,0,0,0,0|1,0,0]=3 73 B8R1.2 COC1=CN=CC=N1 HY-W010562 [1,1,0,0,0,0|0,0,0]=2 74 B8R1.2 ClCC1=NC=CC=N1 HY-52102 [1,1,0,0,0,0|2,0,0]=4 75 B8R1.2 N#CC1=NC=CN=C1 HY-Y0131 [1,1,0,0,0,0|0,0,1]=3 76 B8R1.2 NCC1=CC=CC=C1 HY-76253 [1,1,0,0,0,0|2,0,0]=4 77 B8R1.2 NCC1=CC=CN=C1 HY-Y0047 [1,1,0,0,0,0|1,0,0]=3 78 B8R1.2 NCC1=NC=CC=N1 HY-60347A [1,1,0,0,0,0|2,0,0]=4 79 B8R1.2 O=NC1=NC=CC=C1 HY-136590 [1,1,0,0,0,0|2,0,0]=4 80 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [1,1,0,0,0,0|2,0,0]=4 81 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [1,1,0,0,0,0|2,0,0]=4 82 B8R1.2 OCC1=CC=CN=C1 HY-B0893 [1,1,0,0,0,0|1,0,0]=3 83 B8R1.2 OCC1=NC=CC=C1 HY-Y0004 [1,1,0,0,0,0|1,0,0]=3 84 B8R1.3 BrC1=CN=C(I)C=C1 HY-W002668 [1,1,0,0,0,0|2,0,0]=4 85 B8R1.3 BrC1=NC=C(I)C=C1 HY-W003027 [1,1,0,0,0,0|2,0,0]=4 86 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [1,1,0,0,0,0|1,0,0]=3 87 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [1,1,0,0,0,0|1,0,0]=3 88 B8R1.3 CC1=CN=C(C)C=N1 HY-34439 [1,1,0,0,0,0|0,0,0]=2 89 B8R1.3 CC1=CN=C(N)C=N1 HY-65255 [1,1,0,0,0,0|0,0,0]=2 90 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [1,1,0,0,0,0|1,0,1]=4 91 B8R1.3 CC1=NN=C(Cl)C=C1 HY-W001297 [1,1,0,0,0,0|2,0,0]=4 92 B8R1.3 ClC1=CN=C(Cl)C=C1 HY-W015626 [1,1,0,0,0,0|2,0,0]=4 93 B8R1.3 ClC1=NC=C(Br)C=C1 HY-W002767 [1,1,0,0,0,0|2,0,0]=4 94 B8R1.3 ClC1=NC=C(I)C=C1 HY-W002858 [1,1,0,0,0,0|2,0,0]=4 95 B8R1.3 FC1=NC=C(Br)C=C1 HY-32746 [1,1,0,0,0,0|2,0,0]=4 96 B8R1.3 FC1=NC=C(I)C=C1 HY-W007531 [1,1,0,0,0,0|2,0,0]=4 97 B8R1.3 NC1=CC=C(F)N=C1 HY-65254 [1,1,0,0,0,0|2,0,0]=4 98 B8R1.3 NC1=CN=C(Br)C=C1 HY-W016849 [1,1,0,0,0,0|2,0,0]=4 99 B8R1.3 NC1=CN=C(Cl)C=C1 HY-W007481 [1,1,0,0,0,0|2,0,0]=4 100 B8R1.3 NC1=NC=C(Br)N=C1 HY-59261 [1,1,0,0,0,0|1,0,0]=3 101 B8R1.4 BrC1=CC=CC(Br)=N1 HY-59162 [1,1,0,0,0,0|2,0,0]=4 102 B8R1.4 BrC1=CN=CC(Br)=C1 HY-Y0491 [1,1,0,0,0,0|2,0,0]=4 103 B8R1.4 BrC1=NC=CC(I)=C1 HY-W008398 [1,1,0,0,0,0|2,0,0]=4 104 B8R1.4 CC1=CC(Br)=CC=N1 HY-W007447 [1,1,0,0,0,0|1,0,0]=3 105 B8R1.4 CC1=CC(Cl)=NC=C1 HY-W010423 [1,1,0,0,0,0|2,0,0]=4 106 B8R1.4 CC1=CC(N)=NC=C1 HY-W003969 [1,1,0,0,0,0|2,0,0]=4 107 B8R1.4 CC1=CN=CC(C)=N1 HY-W040790 [1,1,0,0,0,0|0,0,0]=2 108 B8R1.4 CC1=NC(Cl)=CC=C1 HY-W001993 [1,1,0,0,0,0|1,0,0]=3 109 B8R1.4 ClC1=CC=NC(Br)=C1 HY-W003129 [1,1,0,0,0,0|2,0,0]=4 110 B8R1.4 ClC1=CN=CC(Br)=C1 HY-W003165 [1,1,0,0,0,0|2,0,0]=4 111 B8R1.4 ClC1=CN=CC(Cl)=C1 HY-W015627 [1,1,0,0,0,0|2,0,0]=4 112 B8R1.4 ClC1=NC=CC(Br)=C1 HY-32752 [1,1,0,0,0,0|2,0,0]=4 113 B8R1.4 ClC1=NC=CC(I)=C1 HY-32754 [1,1,0,0,0,0|2,0,0]=4 114 B8R1.4 FC1=CC(Br)=NC=C1 HY-W003601 [1,1,0,0,0,0|2,0,0]=4 115 B8R1.4 FC1=NC=CC(Br)=C1 HY-32742 [1,1,0,0,0,0|2,0,0]=4 116 B8R1.4 NC1=CC(Br)=CN=C1 HY-66052 [1,1,0,0,0,0|2,0,0]=4 117 B8R1.4 NC1=CC=CC(N)=N1 HY-Y0198 [1,1,0,0,0,0|2,0,0]=4 118 B8R1.4 NC1=CN=CC(Cl)=N1 HY-59335 [1,1,0,0,0,0|1,0,0]=3 119 B8R1.4 NC1=NC(Br)=CC=C1 HY-Y1049 [1,1,0,0,0,0|2,0,0]=4 120 B8R1.4 NC1=NC=CC(Br)=C1 HY-41000 [1,1,0,0,0,0|2,0,0]=4 121 B8R1.4 NC1=NC=CC(Cl)=C1 HY-60325 [1,1,0,0,0,0|2,0,0]=4 122 B8R1.4 NC1=NC=CC(F)=C1 HY-W005118 [1,1,0,0,0,0|2,0,0]=4 123 B8R1.4 OC1=CC(Cl)=NC=C1 HY-I0304 [1,1,0,0,0,0|2,0,0]=4 124 B8R1.4 OC1=CN=CC(Br)=C1 HY-66053 [1,1,0,0,0,0|2,0,0]=4 125 B8R1.4 OC1=NC=CC(Br)=C1 HY-65036 [1,1,0,0,0,0|2,0,0]=4 126 B8R1.18 CC1=CC(=O)OC1=O HY-78035 [0,1,0,0,1,0|2,0,0]=4 127 B8R1.18 CC1=CC(C)=NN1C HY-N7086 [0,1,0,0,1,0|1,0,0]=3 128 B8R1.18 CC1=NC(C)=C(C)S1 HY-W100945 [0,1,0,0,1,0|1,0,0]=3 129 B8R1.50 CC1=NNC(C)=C1Br HY-W016754 [0,1,0,0,1,0|2,0,0]=4 130 B8R1.50 CC1=NOC(N)=C1Cl HY-70065 [0,1,0,0,1,0|2,0,0]=4 131 B10R1.22 CC1=CC(C)=C(C)C(O)=C1 HY-W015812 [0,2,0,0,0,0|2,0,0]=4 132 B10R1.119 CC1=C(C)C(C)=C(C)C=C1 HY-W006416 [0,2,0,0,0,0|2,0,0]=4 133 B10R1.20 COC1=CC=CC=C1OC HY-B1812 [0,2,0,0,0,0|2,0,0]=4 134 B10R1.30 CCC1=NC(C)=CC=C1O HY-W002620A [0,2,0,0,0,0|2,0,0]=4 135 B10R1.30 FC1=CC=C(Br)N=C1CBr HY-43727 [0,2,0,0,0,0|2,0,0]=4 136 B10R1.30 N#CC1=NC(Br)=CN=C1Cl HY-Z1112 [0,2,0,0,0,0|1,0,1]=4 137 B10R1.61 NC(=O)C1=NC=CN=C1O HY-W015764 [0,2,0,0,0,0|1,0,1]=4 138 B10R1.61 NC1=NC=CN=C1C(=O)O HY-Y1702 [0,2,0,0,0,0|1,0,1]=4 139 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0264 [0,2,0,0,0,0|0,0,0]=2 140 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0935 [0,2,0,0,0,0|0,0,0]=2 141 B10R1.118 [2H]C1=NC([2H])=C([2H])N=C1[2H] HY-W013040S [0,2,0,0,0,0|2,0,0]=4 142 B8R1.7 CC(=O)C1=NC=CS1 HY-Y0045 [0,0,1,1,0,0|2,0,0]=4 143 B10R2.7 C1=CC=C2OCCC2=C1 HY-75247 [0,1,0,1,0,0|2,0,0]=4 144 B10R2.7 C1=CN=C2NCCC2=C1 HY-30156 [0,1,0,1,0,0|1,0,0]=3 145 B6R1.2 BrC1=CNC=N1 HY-W002226 [1,0,0,0,1,0|1,0,1]=4 146 B6R1.2 BrC1=CNN=C1 HY-78243 [1,0,0,0,1,0|2,0,0]=4 147 B6R1.2 BrC1=CSC=C1 HY-59299 [1,0,0,0,1,0|2,0,0]=4 148 B6R1.2 BrC1=NC=CS1 HY-W001223 [1,0,0,0,1,0|2,0,0]=4 149 B6R1.2 CC1=CC=CS1 HY-W010615 [1,0,0,0,1,0|1,0,0]=3 150 B6R1.2 CC1=CNN=C1 HY-B0876A [1,0,0,0,1,0|1,0,0]=3 151 B6R1.2 CC1=NNC=C1 HY-66054 [1,0,0,0,1,0|1,0,0]=3 152 B6R1.2 CN1C=CN=C1 HY-59137 [1,0,0,0,1,0|1,0,0]=3 153 B6R1.2 IC1=CN=CN1 HY-W002802 [1,0,0,0,1,0|1,0,1]=4 154 B6R1.2 NC1=NC=CN1 HY-W062216 [1,0,0,0,1,0|1,0,1]=4 155 B6R1.2 NC1=NC=CS1 HY-12396 [1,0,0,0,1,0|2,0,0]=4 156 B6R1.2 NC1=NNC=N1 HY-W027592 [1,0,0,0,1,0|2,0,0]=4 157 B6R1.2 NC1=NOC=C1 HY-W007329 [1,0,0,0,1,0|2,0,0]=4