0 B9R1.69 CC1=C(Br)C=CC(Br)=N1 HY-W003282 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.69 CC1=C(N)NC(=O)N=C1 HY-W008091 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.69 CC1=C(N)NC(=O)N=C1 HY-W008091R [0,0,0,0,0,0|4,0,0]=4 3 B9R1.69 CC1=CC(Br)=C(O)C=C1 HY-W016153 [0,0,0,0,0,0|2,0,0]=2 4 B9R1.69 CC1=CC(Br)=CN=C1N HY-75420 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.69 CC1=CC(Br)=CNC1=O HY-75423 [0,0,0,0,0,0|4,0,0]=4 6 B9R1.69 CC1=CC(Br)=NC=C1Br HY-W009498 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.69 CC1=CC(Cl)=NC=C1Br HY-W014584 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.69 CC1=CC(O)=C(O)C=C1 HY-W012814 [0,0,0,0,0,0|1,0,0]=1 9 B9R1.69 CC1=CC(O)=CC=C1N HY-W012824 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.69 CC1=CC(O)=CC=C1O HY-W012817 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.69 CC1=CN=C(C)C(C)=N1 HY-W010476 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.69 CC1=CNC(=O)NC1=O HY-W010450 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.69 CC1=NC=C(Br)C=C1N HY-W003575 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 HY-W001198 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 FC1=C(I)C=CC(Br)=C1 HY-42121 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.69 FC1=CC=C(F)C(Br)=C1 HY-79541 [0,0,0,0,0,0|3,0,0]=3 17 B9R1.69 NC1=C(Br)C=C(F)C=N1 HY-W010023 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.69 NC1=C(O)C=C(F)C=C1 HY-W007345 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.69 NC1=CC(Br)=CN=C1Cl HY-32828 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.69 NC1=CC=C(Cl)N=C1Cl HY-W002136 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 NC1=CC=C(F)C(Cl)=C1 HY-Y0680 [0,0,0,0,0,0|3,0,0]=3 22 B9R1.69 O=C1C=C(O)C(Cl)=CN1 HY-17469 [0,0,0,0,0,0|3,0,0]=3 23 B9R1.69 OC1=C(F)C=C(F)C=C1 HY-W012725 [0,0,0,0,0,0|3,0,0]=3 24 B9R1.69 OC1=CC=C(Cl)C(O)=C1 HY-W015658 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.69 OC1=CC=C(Cl)C=C1O HY-133597 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.69 OC1=CC=C(F)C(O)=C1 HY-W003112 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.69 OC1=CC=C(F)C=C1Br HY-W003971 [0,0,0,0,0,0|3,0,0]=3 28 B9R1.69 OC1=CC=C(O)C(O)=C1 HY-W010451 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.69 [15NH]1C=C([13CH3])C(=O)[15NH]C1=O HY-W747214 [0,0,0,0,0,0|3,0,1]=4 30 B8R1.3 BrC1=CN=C(I)C=C1 HY-W002668 [1,0,0,0,0,0|3,0,0]=4 31 B8R1.3 BrC1=NC=C(I)C=C1 HY-W003027 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [1,0,0,0,0,0|2,0,0]=3 33 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [1,0,0,0,0,0|2,0,0]=3 34 B8R1.3 CC1=CN=C(C)C=N1 HY-34439 [1,0,0,0,0,0|2,0,0]=3 35 B8R1.3 CC1=CN=C(N)C=N1 HY-65255 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [1,0,0,0,0,0|2,0,0]=3 37 B8R1.3 CC1=NN=C(Cl)C=C1 HY-W001297 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.3 ClC1=CC=C(Cl)C=C1 HY-Y0496 [1,0,0,0,0,0|2,0,0]=3 39 B8R1.3 ClC1=CN=C(Cl)C=C1 HY-W015626 [1,0,0,0,0,0|3,0,0]=4 40 B8R1.3 ClC1=NC=C(Br)C=C1 HY-W002767 [1,0,0,0,0,0|3,0,0]=4 41 B8R1.3 ClC1=NC=C(I)C=C1 HY-W002858 [1,0,0,0,0,0|3,0,0]=4 42 B8R1.3 FC1=NC=C(Br)C=C1 HY-32746 [1,0,0,0,0,0|3,0,0]=4 43 B8R1.3 FC1=NC=C(I)C=C1 HY-W007531 [1,0,0,0,0,0|3,0,0]=4 44 B8R1.3 IC1=CC=C(I)C=C1 HY-W007412 [1,0,0,0,0,0|2,0,0]=3 45 B8R1.3 NC1=CC=C(F)N=C1 HY-65254 [1,0,0,0,0,0|3,0,0]=4 46 B8R1.3 NC1=CC=C(I)C=C1 HY-I0210 [1,0,0,0,0,0|2,0,0]=3 47 B8R1.3 NC1=CN=C(Br)C=C1 HY-W016849 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.3 NC1=CN=C(Cl)C=C1 HY-W007481 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.3 O=C1C=CC(Br)=CN1 HY-59165 [1,0,0,0,0,0|3,0,0]=4 50 B8R1.3 O=C1C=CC(Cl)=CN1 HY-W008822 [1,0,0,0,0,0|3,0,0]=4 51 B8R1.4 BrC1=CC=CC(Br)=N1 HY-59162 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.4 BrC1=CC=CC(I)=C1 HY-32149 [1,0,0,0,0,0|2,0,0]=3 53 B8R1.4 BrC1=CN=CC(Br)=C1 HY-Y0491 [1,0,0,0,0,0|3,0,0]=4 54 B8R1.4 BrC1=NC=CC(I)=C1 HY-W008398 [1,0,0,0,0,0|3,0,0]=4 55 B8R1.4 CC1=CC(Br)=CC=N1 HY-W007447 [1,0,0,0,0,0|2,0,0]=3 56 B8R1.4 CC1=CC(Cl)=NC=C1 HY-W010423 [1,0,0,0,0,0|2,0,0]=3 57 B8R1.4 CC1=CC(N)=NC=C1 HY-W003969 [1,0,0,0,0,0|2,0,0]=3 58 B8R1.4 CC1=CN=CC(C)=N1 HY-W040790 [1,0,0,0,0,0|3,0,0]=4 59 B8R1.4 CC1=NC(Cl)=CC=C1 HY-W001993 [1,0,0,0,0,0|2,0,0]=3 60 B8R1.4 ClC1=CC=NC(Br)=C1 HY-W003129 [1,0,0,0,0,0|3,0,0]=4 61 B8R1.4 ClC1=CN=CC(Br)=C1 HY-W003165 [1,0,0,0,0,0|3,0,0]=4 62 B8R1.4 ClC1=CN=CC(Cl)=C1 HY-W015627 [1,0,0,0,0,0|3,0,0]=4 63 B8R1.4 ClC1=NC=CC(Br)=C1 HY-32752 [1,0,0,0,0,0|3,0,0]=4 64 B8R1.4 ClC1=NC=CC(I)=C1 HY-32754 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.4 FC1=CC(Br)=NC=C1 HY-W003601 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.4 FC1=NC=CC(Br)=C1 HY-32742 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.4 NC1=CC(Br)=CN=C1 HY-66052 [1,0,0,0,0,0|3,0,0]=4 68 B8R1.4 NC1=CC=CC(N)=N1 HY-Y0198 [1,0,0,0,0,0|3,0,0]=4 69 B8R1.4 NC1=NC(Br)=CC=C1 HY-Y1049 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.4 NC1=NC=CC(Br)=C1 HY-41000 [1,0,0,0,0,0|3,0,0]=4 71 B8R1.4 NC1=NC=CC(Cl)=C1 HY-60325 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.4 NC1=NC=CC(F)=C1 HY-W005118 [1,0,0,0,0,0|3,0,0]=4 73 B8R1.4 O=C1C=C(O)C=CN1 HY-Y0426 [1,0,0,0,0,0|2,0,0]=3 74 B8R1.4 O=C1C=CC=C(O)N1 HY-W036553 [1,0,0,0,0,0|2,0,0]=3 75 B8R1.4 OC1=CC(Cl)=NC=C1 HY-I0304 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.4 OC1=CC(O)=NC=N1 HY-W015902 [1,0,0,0,0,0|3,0,0]=4 77 B8R1.4 OC1=CC=CC(I)=C1 HY-W007364 [1,0,0,0,0,0|1,0,0]=2 78 B8R1.4 OC1=CN=CC(Br)=C1 HY-66053 [1,0,0,0,0,0|2,0,0]=3 79 B8R1.4 OC1=NC=CC(Br)=C1 HY-65036 [1,0,0,0,0,0|2,0,0]=3 80 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [1,0,0,0,0,0|2,0,0]=3 81 B8R1.5 CC1=C(C)N=CC=N1 HY-W015914 [1,0,0,0,0,0|3,0,0]=4 82 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.5 CC1=NC=CC=C1O HY-W002339 [1,0,0,0,0,0|1,0,0]=2 84 B8R1.5 ClC1=C(Br)N=CC=C1 HY-W007662 [1,0,0,0,0,0|3,0,0]=4 85 B8R1.5 ClC1=C(Cl)N=CC=C1 HY-W012591 [1,0,0,0,0,0|3,0,0]=4 86 B8R1.5 ClC1=NC=CC=C1Br HY-32751 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.5 ClC1=NC=CC=C1I HY-32753 [1,0,0,0,0,0|3,0,0]=4 88 B8R1.5 FC1=CC=CC=C1I HY-34673 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.5 FC1=CN=CC=C1I HY-W012392 [1,0,0,0,0,0|3,0,0]=4 90 B8R1.5 NC1=C(Cl)C=CN=C1 HY-33868 [1,0,0,0,0,0|3,0,0]=4 91 B8R1.5 NC1=C(I)C=NC=C1 HY-W002945 [1,0,0,0,0,0|3,0,0]=4 92 B8R1.5 NC1=C(N)C=NC=C1 HY-14946 [1,0,0,0,0,0|3,0,0]=4 93 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [1,0,0,0,0,0|2,0,0]=3 94 B8R1.5 NC1=CC=CC=C1I HY-W007318 [1,0,0,0,0,0|2,0,0]=3 95 B8R1.5 NC1=CC=CN=C1Br HY-66051 [1,0,0,0,0,0|3,0,0]=4 96 B8R1.5 NC1=CC=CN=C1Cl HY-Y0244 [1,0,0,0,0,0|3,0,0]=4 97 B8R1.5 NC1=NC=CC=C1I HY-32813 [1,0,0,0,0,0|3,0,0]=4 98 B8R1.5 O=C1C=COC=C1O HY-N1997 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.5 OC1=C(F)C=CC=C1 HY-41755 [1,0,0,0,0,0|1,0,0]=2 100 B8R1.5 OC1=CC=CN=C1Br HY-20026 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [1,0,0,0,0,0|2,0,0]=3 102 B8R1.5 ON1C=CC=CC1=S HY-B1747 [1,0,0,0,0,0|2,0,0]=3 103 B8R1.5 [O-][N+]1=CC=CC=C1[S-] HY-125785A [1,0,0,0,0,0|2,0,1]=4 104 B10R1.22 CC1=CC(=O)C=C(C)C1=O HY-W015816 [0,1,0,0,0,0|3,0,0]=4 105 B10R1.22 CC1=CC(C)=C(C)C(O)=C1 HY-W015812 [0,1,0,0,0,0|0,0,0]=1 106 B10R1.22 CC1=CC(C)=C(O)C(C)=C1 HY-W038786 [0,1,0,0,0,0|2,0,0]=3 107 B10R1.22 CC1=CC(O)=CC(C)=C1Cl HY-B1414 [0,1,0,0,0,0|3,0,0]=4 108 B10R1.22 CC1=CC(O)=CC(C)=C1O HY-W004874 [0,1,0,0,0,0|3,0,0]=4 109 B10R1.22 OC1=C(I)C=C(I)C=C1I HY-W073687 [0,1,0,0,0,0|3,0,0]=4 110 B10R1.22 OC1=CC(Cl)=CC(Cl)=C1O HY-133609 [0,1,0,0,0,0|2,0,0]=3 111 B10R1.25 CC1=CC(Cl)=CC=C1[N+]#N HY-D1490 [0,1,0,0,0,0|3,0,0]=4 112 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [0,1,0,0,0,0|0,0,1]=2 113 B10R1.25 CCC1=C(O)C=C(O)C=C1 HY-W015782 [0,1,0,0,0,0|1,0,0]=2 114 B10R1.25 COC1=CC=C(F)C=C1Br HY-W001094 [0,1,0,0,0,0|2,0,0]=3 115 B10R1.25 N#CC1=CC=C(I)C=C1F HY-W008356 [0,1,0,0,0,0|2,0,1]=4 116 B10R1.25 N#[N+]C1=CC=C(Cl)C=C1Cl HY-D0898 [0,1,0,0,0,0|3,0,0]=4 117 B10R1.25 O=CC1=C(F)C=C(F)C=C1 HY-W007410 [0,1,0,0,0,0|2,0,1]=4 118 B10R1.25 O=CC1=CC=C(Br)C=C1O HY-W001114 [0,1,0,0,0,0|1,0,1]=3 119 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [0,1,0,0,0,0|1,0,1]=3 120 B10R1.25 OCC1=CC=C(Cl)C=C1Cl HY-W039454 [0,1,0,0,0,0|2,0,0]=3 121 B10R1.30 CCC1=NC(C)=CC=C1O HY-W002620A [0,1,0,0,0,0|3,0,0]=4 122 B10R1.30 COC1=CC(Br)=CC=C1N HY-50822 [0,1,0,0,0,0|2,0,0]=3 123 B10R1.30 COC1=CC(Br)=CC=C1O HY-W007865 [0,1,0,0,0,0|2,0,0]=3 124 B10R1.30 COC1=CC(C)=CC=C1O HY-W040971 [0,1,0,0,0,0|1,0,0]=2 125 B10R1.30 COC1=CC(Cl)=CC=C1O HY-W039169 [0,1,0,0,0,0|2,0,0]=3 126 B10R1.30 N#CC1=CC(Br)=CC=C1N HY-W014967 [0,1,0,0,0,0|3,0,0]=4 127 B10R1.30 O=CC1=CC(Br)=CC=C1F HY-I0561 [0,1,0,0,0,0|2,0,1]=4 128 B10R1.30 O=CC1=CC(F)=CC=C1O HY-W007331 [0,1,0,0,0,0|2,0,1]=4 129 B10R1.30 O=CC1=CC(O)=CC=C1Br HY-W007430 [0,1,0,0,0,0|2,0,1]=4 130 B10R1.118 CC1=CC(=O)C(C)=CC1=O HY-W090317 [0,1,0,0,0,0|0,0,1]=2 131 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0264 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.118 CC1=NC(C)=C(C)N=C1C HY-N0935 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.118 NC1=CC(N)=C(N)C=C1N HY-12444 [0,1,0,0,0,0|3,0,0]=4 134 B10R1.118 NC1=CC(O)=C(F)C=C1F HY-W007272 [0,1,0,0,0,0|2,0,0]=3 135 B10R1.118 O=C1C=C(O)C(=O)C=C1O HY-W010323 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.119 CC1=C(C)C(C)=C(C)C=C1 HY-W006416 [0,1,0,0,0,0|1,0,0]=2 137 B10R1.119 CC1=C(O)C(=O)C=CN1C HY-B0568 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.119 CC1=C(O)C(=O)C=CN1C HY-B0568R [0,1,0,0,0,0|2,0,0]=3 139 B10R1.119 OC1=CC=C(F)C(O)=C1F HY-124472 [0,1,0,0,0,0|2,0,0]=3 140 B10R1.176 NCC1=CC(O)=C(O)C=C1 HY-N3023 [0,1,0,0,0,0|1,0,0]=2 141 B10R1.176 O=C1C=C(CO)OC=C1O HY-W050154 [0,1,0,0,0,0|2,0,1]=4 142 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 HY-W007518 [0,1,0,0,0,0|2,0,1]=4 143 B10R1.176 O=CC1=CC=C(O)C(O)=C1 HY-N0295 [0,1,0,0,0,0|1,0,1]=3 144 B8R1.18 CC1=CC(=O)C(C)O1 HY-W010553 [0,0,0,0,1,0|1,0,2]=4 145 B8R1.18 CC1=CC(=O)OC1=O HY-78035 [0,0,0,0,1,0|2,0,1]=4 146 B8R1.18 CC1=CC(C)=NN1C HY-N7086 [0,0,0,0,1,0|3,0,0]=4 147 B8R1.18 CC1=NC(C)=C(C)S1 HY-W100945 [0,0,0,0,1,0|3,0,0]=4 148 B8R1.50 CC1=C(O)C(=O)CO1 HY-W012927 [0,0,0,0,1,0|2,0,1]=4 149 B8R1.50 CC1=NNC(C)=C1Br HY-W016754 [0,0,0,0,1,0|3,0,0]=4 150 B7R0.1 C(C=O)=C/C=CCC HY-W012952 [1,0,1,0,0,0|0,0,2]=4 151 B7R0.5 CC\C=C(/C)C(=O)O HY-W010533 [1,0,1,0,0,0|1,0,1]=4 152 B7R0.4 C\C=C\C=C\C(=O)O HY-N0626 [1,0,1,0,0,0|1,0,0]=3 153 B7R0.4 C\C=C\C=C\C(=O)O HY-N0626R [1,0,1,0,0,0|1,0,0]=3 154 B7R0.4 C\C=C\C=C\C(=O)[O-] HY-N0626A [1,0,1,0,0,0|1,0,1]=4 155 B7R0.4 C\C=C\C=C\C(=O)[O-] HY-N0626AR [1,0,1,0,0,0|1,0,1]=4 156 B7R1.3 CC1=NC=CN=C1 HY-W067358 [2,0,0,0,0,0|2,0,0]=4 157 B7R1.3 IC1=CC=CC=C1 HY-Y0747 [2,0,0,0,0,0|1,0,0]=3 158 B7R1.3 IC1=CC=CC=N1 HY-W004126 [2,0,0,0,0,0|2,0,0]=4 159 B7R1.3 O=C1C=CC=CN1 HY-Y0191 [2,0,0,0,0,0|1,0,1]=4 160 B7R1.3 OC1=CC=CN=C1 HY-Y1129 [2,0,0,0,0,0|1,0,0]=3 161 B9R1.1 C#CC1=CC=C(Br)C=C1 HY-W007542 [1,1,0,0,0,0|1,0,1]=4 162 B9R1.1 C#CC1=CC=C(N)C=C1 HY-W004660 [1,1,0,0,0,0|1,0,1]=4 163 B9R1.1 C=CC1=CC=C(O)C=C1 HY-W005288 [1,1,0,0,0,0|1,0,1]=4 164 B9R1.1 CC1=CC=C(C=O)C=C1 HY-W012860 [1,1,0,0,0,0|0,0,1]=3 165 B9R1.1 CCC1=CC=C(O)C=C1 HY-W012836 [1,1,0,0,0,0|1,0,0]=3 166 B9R1.1 CNC1=CC=C(C)C=C1 HY-W017767 [1,1,0,0,0,0|0,0,0]=2 167 B9R1.1 COC1=CC=C(C)C=C1 HY-W012835 [1,1,0,0,0,0|0,0,0]=2 168 B9R1.1 COC1=CC=C(O)C=C1 HY-30270 [1,1,0,0,0,0|1,0,0]=3 169 B9R1.1 COC1=NC=C(Br)C=C1 HY-32756 [1,1,0,0,0,0|2,0,0]=4 170 B9R1.1 COC1=NC=C(N)C=C1 HY-W001994 [1,1,0,0,0,0|2,0,0]=4 171 B9R1.1 NC1=CC=C(C=O)C=C1 HY-W076836 [1,1,0,0,0,0|1,0,1]=4 172 B9R1.1 NC1=CC=C(CO)C=C1 HY-W007465 [1,1,0,0,0,0|1,0,0]=3 173 B9R1.1 NCC1=CC=C(I)C=C1 HY-W013964 [1,1,0,0,0,0|1,0,0]=3 174 B9R1.1 NCC1=CC=C(O)C=C1 HY-W004078 [1,1,0,0,0,0|1,0,0]=3 175 B9R1.1 O=CC1=CC=C(Br)C=C1 HY-W001138 [1,1,0,0,0,0|1,0,1]=4 176 B9R1.1 O=CC1=CC=C(F)C=C1 HY-Y0197 [1,1,0,0,0,0|1,0,1]=4 177 B9R1.1 O=CC1=CC=C(I)C=C1 HY-W002179 [1,1,0,0,0,0|1,0,1]=4 178 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313 [1,1,0,0,0,0|1,0,1]=4 179 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313R [1,1,0,0,0,0|1,0,1]=4 180 B9R1.1 OCC1=CC=C(Br)N=C1 HY-W016116 [1,1,0,0,0,0|2,0,0]=4 181 B9R1.1 OCC1=CC=C(O)C=C1 HY-Y0892 [1,1,0,0,0,0|1,0,0]=3 182 B9R1.1 OCC1=NC=C(Br)C=C1 HY-32837 [1,1,0,0,0,0|2,0,0]=4 183 B9R1.1 OCC1=NC=C(O)C=C1 HY-W007140 [1,1,0,0,0,0|2,0,0]=4 184 B9R1.2 C#CC1=CC(N)=CC=C1 HY-W007423 [1,1,0,0,0,0|1,0,1]=4 185 B9R1.2 CC1=CC(C=O)=CC=C1 HY-78086 [1,1,0,0,0,0|0,0,1]=3 186 B9R1.2 CC1=CC=CC(C#N)=N1 HY-W002490 [1,1,0,0,0,0|2,0,0]=4 187 B9R1.2 COC1=CC(Cl)=NC=C1 HY-W007914 [1,1,0,0,0,0|2,0,0]=4 188 B9R1.2 COC1=CC(N)=NC=C1 HY-20459 [1,1,0,0,0,0|2,0,0]=4 189 B9R1.2 COC1=CC(O)=CC=C1 HY-Y1840 [1,1,0,0,0,0|0,0,0]=2 190 B9R1.2 COC1=CC=CC(C)=C1 HY-115127 [1,1,0,0,0,0|0,0,0]=2 191 B9R1.2 COC1=CN=CC(Br)=C1 HY-W007427 [1,1,0,0,0,0|2,0,0]=4 192 B9R1.2 COC1=NC(Cl)=CC=C1 HY-W001995 [1,1,0,0,0,0|2,0,0]=4 193 B9R1.2 NCC1=CC(Cl)=NC=C1 HY-101771A [1,1,0,0,0,0|2,0,0]=4 194 B9R1.2 NCC1=CC(O)=CC=C1 HY-W069508 [1,1,0,0,0,0|0,0,0]=2 195 B9R1.2 O=CC1=CC(Cl)=CC=C1 HY-Y1863 [1,1,0,0,0,0|1,0,1]=4 196 B9R1.2 O=CC1=CC=CC(O)=C1 HY-76006 [1,1,0,0,0,0|0,0,1]=3 197 B9R1.2 OCC1=CC(Cl)=NC=C1 HY-W003365 [1,1,0,0,0,0|2,0,0]=4 198 B9R1.2 OCC1=NC(Br)=CC=C1 HY-32836 [1,1,0,0,0,0|2,0,0]=4 199 B9R1.3 CC1=C(Br)C=CC=C1N HY-50097 [1,1,0,0,0,0|2,0,0]=4 200 B9R1.3 CC1=C(O)C(=O)C=CO1 HY-W012788 [1,1,0,0,0,0|1,0,1]=4 201 B9R1.3 CC1=C(O)C(O)=CC=C1 HY-W012815 [1,1,0,0,0,0|0,0,0]=2 202 B9R1.3 CC1=CN=CC(F)=C1N HY-W100209 [1,1,0,0,0,0|2,0,0]=4 203 B9R1.3 OC1=C(Br)C=CC=C1Br HY-Y1667 [1,1,0,0,0,0|2,0,0]=4 204 B9R1.3 OC1=CC=CC(F)=C1O HY-W007482 [1,1,0,0,0,0|1,0,0]=3 205 B9R1.3 OC1=CC=CC(O)=C1O HY-N1579 [1,1,0,0,0,0|1,0,0]=3 206 B9R1.3 OC1=CC=CC(O)=C1O HY-N1579R [1,1,0,0,0,0|1,0,0]=3 207 B9R1.34 CC1=CC(=O)C=C(C)O1 HY-W010469 [1,1,0,0,0,0|1,0,1]=4 208 B9R1.34 CC1=CC(Br)=CC(Br)=C1 HY-W011934 [1,1,0,0,0,0|1,0,0]=3 209 B9R1.34 CC1=CC(O)=CC(O)=C1 HY-D0168 [1,1,0,0,0,0|0,0,0]=2 210 B9R1.34 OC1=CC(Br)=CC(Br)=C1 HY-W007905 [1,1,0,0,0,0|1,0,0]=3 211 B9R1.15 C#CC1=CC=CC=C1Cl HY-W002586 [1,1,0,0,0,0|1,0,1]=4 212 B9R1.15 CC1=CC=CC=C1C=O HY-Y0442 [1,1,0,0,0,0|0,0,1]=3 213 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [1,1,0,0,0,0|2,0,0]=4 214 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [1,1,0,0,0,0|0,0,0]=2 215 B9R1.15 COC1=CC=CC=C1O HY-B2115 [1,1,0,0,0,0|0,0,0]=2 216 B9R1.15 COC1=CC=CC=C1O HY-N1380 [1,1,0,0,0,0|0,0,0]=2 217 B9R1.15 COC1=CC=CC=C1O HY-N1380R [1,1,0,0,0,0|0,0,0]=2 218 B9R1.15 COC1=NC=CC=C1Br HY-32755 [1,1,0,0,0,0|2,0,0]=4 219 B9R1.15 N#CC1=CC=CC=C1O HY-W012869 [1,1,0,0,0,0|0,0,1]=3 220 B9R1.15 NC1=CC=CC=C1CO HY-W004705 [1,1,0,0,0,0|1,0,0]=3 221 B9R1.15 NCC1=CC=CC=C1O HY-34350 [1,1,0,0,0,0|0,0,0]=2 222 B9R1.15 O=CC1=CC=CC=C1I HY-W007846 [1,1,0,0,0,0|1,0,1]=4 223 B9R1.15 OCC1=CC=CC=C1I HY-W004678 [1,1,0,0,0,0|1,0,0]=3 224 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,1,0,0,0,0|0,0,0]=2 225 B9R1.37 CC1=C(O)C(=O)C(C)O1 HY-N7093 [0,1,0,0,1,0|1,0,1]=4 226 B11R1.8 OCC1=CC(O)=CC(Cl)=C1O HY-151168 [0,2,0,0,0,0|2,0,0]=4 227 B11R1.14 O=CC1=CC(O)=C(O)C(O)=C1 HY-W004486 [0,2,0,0,0,0|1,0,1]=4 228 B11R1.32 CC1=C(Cl)C(C)=C(Cl)C(O)=C1 HY-W140799 [0,2,0,0,0,0|1,0,0]=3 229 B11R1.32 CC1=C(O)C(C)=C(C)C(O)=C1 HY-W017378 [0,2,0,0,0,0|0,0,0]=2 230 B11R1.32 CC1=NC(C)=C(Cl)C(O)=C1Cl HY-B1088 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.32 CC1=NC(C)=C(Cl)C(O)=C1Cl HY-B1088R [0,2,0,0,0,0|2,0,0]=4 232 B11R1.464 CC1=CC(C)=C(C=O)C(C)=C1 HY-W017469 [0,2,0,0,0,0|1,0,1]=4 233 B11R1.464 COC1=C(I)C=C(I)C=C1I HY-24268 [0,2,0,0,0,0|2,0,0]=4 234 B11R1.464 COC1=C(O)C=C(O)C=C1O HY-13938 [0,2,0,0,0,0|1,0,0]=3 235 B11R1.464 O=CC1=C(O)C=C(O)C=C1O HY-W005130 [0,2,0,0,0,0|1,0,1]=4 236 B11R1.37 COC1=CC=C(F)C=C1C=O HY-W005085 [0,2,0,0,0,0|1,0,1]=4 237 B11R1.37 COC1=CC=C(O)C=C1OC HY-N1780 [0,2,0,0,0,0|1,0,0]=3 238 B11R1.166 CC(=O)C1=CC=C(C)C=C1C HY-W015618 [0,2,0,0,0,0|1,0,0]=3 239 B11R1.166 CC(=O)C1=CC=C(C)C=C1O HY-34204 [0,2,0,0,0,0|0,0,0]=2 240 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1O HY-22225 [0,2,0,0,0,0|1,0,0]=3 241 B11R1.166 CC(=O)C1=CC=C(O)C=C1C HY-W010254 [0,2,0,0,0,0|2,0,0]=4 242 B11R1.166 CC(=O)C1=CC=C(O)C=C1O HY-Y0694 [0,2,0,0,0,0|1,0,0]=3 243 B11R1.166 CC1=CC=C(B(O)O)C(Cl)=C1 HY-32915 [0,2,0,0,0,0|2,0,0]=4 244 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 HY-78144 [0,2,0,0,0,0|0,0,1]=3 245 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 HY-N6810 [0,2,0,0,0,0|0,0,0]=2 246 B11R1.166 CC1=CC=C(C(C)C)C(O)=C1 HY-N6810R [0,2,0,0,0,0|0,0,0]=2 247 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-B1048 [0,2,0,0,0,0|1,0,1]=4 248 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-I0447 [0,2,0,0,0,0|1,0,1]=4 249 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 HY-W016867 [0,2,0,0,0,0|1,0,1]=4 250 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 HY-W008186 [0,2,0,0,0,0|1,0,1]=4 251 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 HY-W012575 [0,2,0,0,0,0|1,0,1]=4 252 B11R1.278 CC1=NC=C(CO)C(C)=C1O HY-W015210 [0,2,0,0,0,0|1,0,0]=3 253 B11R1.279 COC1=C(F)C=C(C=O)C=C1 HY-W007614 [0,2,0,0,0,0|1,0,1]=4 254 B11R1.279 COC1=CC=C(C=O)C=C1O HY-I0637 [0,2,0,0,0,0|0,0,1]=3 255 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 HY-W100681 [0,2,0,0,0,0|1,0,1]=4 256 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 HY-W008213 [0,2,0,0,0,0|1,0,0]=3 257 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 HY-W002036 [0,2,0,0,0,0|1,0,0]=3 258 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 HY-78573 [0,2,0,0,0,0|1,0,0]=3 259 B11R1.167 CC1=CC=C(Br)C=C1[N+](=O)[O-] HY-W041357 [0,2,0,0,0,0|1,0,1]=4 260 B11R1.167 CC1=CC=C(C)C(B(O)O)=C1 HY-32909 [0,2,0,0,0,0|0,0,0]=2 261 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 HY-15027R [0,2,0,0,0,0|2,0,0]=4 262 B11R1.167 NC1=CC=C(F)C=C1C(=O)O HY-34053 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.167 NC1=CC=C(O)C=C1C(=O)O HY-W002035 [0,2,0,0,0,0|2,0,0]=4 264 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 HY-W016866 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 HY-W001179 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.167 O=C(O)C1=CC(Br)=CC=C1I HY-W002338 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.167 OB(O)C1=CC(F)=CC=C1F HY-32884 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.280 C=CC1=CC=C(O)C(OC)=C1 HY-W019940 [0,2,0,0,0,0|1,0,1]=4 269 B11R1.280 C=CC1=CC=C(O)C(OC)=C1 HY-W019940R [0,2,0,0,0,0|1,0,1]=4 270 B11R1.280 COC1=C(O)C=CC(CN)=C1 HY-W015211 [0,2,0,0,0,0|1,0,0]=3 271 B11R1.280 COC1=CC(C=O)=CC=C1O HY-N0098 [0,2,0,0,0,0|1,0,1]=4 272 B11R1.280 COC1=CC(C=O)=CC=C1O HY-N0098R [0,2,0,0,0,0|1,0,1]=4 273 B11R1.280 COC1=CC(CO)=CC=C1O HY-N2067 [0,2,0,0,0,0|1,0,0]=3 274 B11R1.280 COC1=CC=C(Br)C(OC)=C1 HY-Y0159 [0,2,0,0,0,0|1,0,0]=3 275 B11R1.280 COC1=CC=C(C)C(OC)=C1 HY-W324424 [0,2,0,0,0,0|0,0,0]=2 276 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 HY-W001663 [0,2,0,0,0,0|2,0,0]=4 277 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 HY-N1775 [0,2,0,0,0,0|1,0,0]=3 278 B11R1.21 CC1=C(Cl)C=C(B(O)O)C=C1 HY-W016963 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.21 CC1=CC=C(C(=O)O)C=C1C HY-W017434 [0,2,0,0,0,0|1,0,1]=4 280 B11R1.21 CC1=CC=C(C(=O)O)C=C1O HY-Y0026 [0,2,0,0,0,0|0,0,1]=3 281 B11R1.21 CC1=CC=C(C(C)C)C=C1O HY-N0711 [0,2,0,0,0,0|0,0,0]=2 282 B11R1.21 NC1=CC=C(C(=O)O)C=C1O HY-W002114 [0,2,0,0,0,0|1,0,1]=4 283 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 HY-N0294 [0,2,0,0,0,0|1,0,1]=4 284 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 HY-N0294R [0,2,0,0,0,0|1,0,1]=4 285 B11R1.21 O=[N+]([O-])C1=CC=C(O)C(O)=C1 HY-W066890 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.192 C=CCC1=CC=C(O)C(O)=C1 HY-N1887 [0,2,0,0,0,0|1,0,0]=3 287 B11R1.192 NCCC1=CC=C(O)C(O)=C1 HY-B0451 [0,2,0,0,0,0|1,0,0]=3 288 B11R1.192 NCCC1=CC=C(O)C(O)=C1 HY-B0451A [0,2,0,0,0,0|1,0,0]=3 289 B11R1.192 OCCC1=CC=C(O)C(O)=C1 HY-N0570 [0,2,0,0,0,0|1,0,0]=3 290 B9R1.5 O=C1C=CC=CC=C1O HY-N7135 [0,0,1,1,0,0|1,0,1]=4 291 B11R2.36 BrC1=CC=C2OCOC2=C1 HY-75212 [0,1,0,1,0,0|1,0,0]=3 292 B11R2.36 CC1=CC2=C(C=C1)NC=C2 HY-W001972 [0,1,0,1,0,0|1,0,1]=4 293 B11R2.36 CC1=CC2=C(C=CN2)C=C1 HY-W007349 [0,1,0,1,0,0|1,0,1]=4 294 B11R2.36 CC1=CC=C2NN=NC2=C1 HY-W086988 [0,1,0,1,0,0|2,0,0]=4 295 B7R1.2 CC1=NN(C)C=C1 HY-W002168 [1,0,0,0,1,0|2,0,0]=4