0 B9R1.69 CC1=CC(Br)=C(O)C=C1 HY-W016153 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.69 CC1=CC(Br)=CN=C1N HY-75420 [0,0,0,0,0,0|2,1,1]=4 2 B9R1.69 CC1=CC(Br)=CNC1=O HY-75423 [0,0,0,0,0,0|1,1,0]=2 3 B9R1.69 CC1=CC(Cl)=NC=C1Br HY-W014584 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.69 CC1=CC(O)=C(O)C=C1 HY-W012814 [0,0,0,0,0,0|2,0,1]=3 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|3,0,1]=4 7 B9R1.69 CC1=NC=C(Br)C=C1N HY-W003575 [0,0,0,0,0,0|2,1,1]=4 8 B9R1.69 ClC1=CN=C(Cl)C(Cl)=C1 HY-W001198 [0,0,0,0,0,0|2,0,1]=3 9 B9R1.69 FC1=C(I)C=CC(Br)=C1 HY-42121 [0,0,0,0,0,0|3,1,0]=4 10 B9R1.69 FC1=CC=C(F)C(Br)=C1 HY-79541 [0,0,0,0,0,0|3,1,0]=4 11 B9R1.69 NC1=C(Br)C=C(F)C=N1 HY-W010023 [0,0,0,0,0,0|2,1,1]=4 12 B9R1.69 NC1=C(O)C=C(F)C=C1 HY-W007345 [0,0,0,0,0,0|2,1,0]=3 13 B9R1.69 NC1=CC(Br)=CN=C1Cl HY-32828 [0,0,0,0,0,0|2,1,1]=4 14 B9R1.69 NC1=CC=C(Cl)N=C1Cl HY-W002136 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 NC1=CC=C(F)C(Cl)=C1 HY-Y0680 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.69 O=C1C=C(O)C(Cl)=CN1 HY-17469 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 OC1=C(F)C=C(F)C=C1 HY-W012725 [0,0,0,0,0,0|2,1,1]=4 18 B9R1.69 OC1=CC=C(Cl)C(O)=C1 HY-W015658 [0,0,0,0,0,0|3,0,0]=3 19 B9R1.69 OC1=CC=C(Cl)C=C1O HY-133597 [0,0,0,0,0,0|1,0,1]=2 20 B9R1.69 OC1=CC=C(F)C(O)=C1 HY-W003112 [0,0,0,0,0,0|3,0,0]=3 21 B9R1.69 OC1=CC=C(F)C=C1Br HY-W003971 [0,0,0,0,0,0|2,1,1]=4 22 B9R1.69 OC1=CC=C(O)C(O)=C1 HY-W010451 [0,0,0,0,0,0|2,0,1]=3 23 B8R1.3 BrC1=CN=C(I)C=C1 HY-W002668 [1,0,0,0,0,0|1,1,1]=4 24 B8R1.3 BrC1=NC=C(I)C=C1 HY-W003027 [1,0,0,0,0,0|1,1,1]=4 25 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [1,0,0,0,0,0|2,0,1]=4 26 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [1,0,0,0,0,0|2,0,1]=4 27 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [1,0,0,0,0,0|1,0,0]=2 28 B8R1.3 CC1=NN=C(Cl)C=C1 HY-W001297 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.3 ClC1=CC=C(Cl)C=C1 HY-Y0496 [1,0,0,0,0,0|2,0,0]=3 30 B8R1.3 ClC1=CN=C(Cl)C=C1 HY-W015626 [1,0,0,0,0,0|1,0,1]=3 31 B8R1.3 ClC1=NC=C(Br)C=C1 HY-W002767 [1,0,0,0,0,0|1,1,1]=4 32 B8R1.3 ClC1=NC=C(I)C=C1 HY-W002858 [1,0,0,0,0,0|1,1,1]=4 33 B8R1.3 FC1=NC=C(Br)C=C1 HY-32746 [1,0,0,0,0,0|1,1,1]=4 34 B8R1.3 FC1=NC=C(I)C=C1 HY-W007531 [1,0,0,0,0,0|1,1,1]=4 35 B8R1.3 IC1=CC=C(I)C=C1 HY-W007412 [1,0,0,0,0,0|2,1,0]=4 36 B8R1.3 NC1=CC=C(F)N=C1 HY-65254 [1,0,0,0,0,0|2,0,1]=4 37 B8R1.3 NC1=CC=C(I)C=C1 HY-I0210 [1,0,0,0,0,0|2,1,0]=4 38 B8R1.3 NC1=CN=C(Br)C=C1 HY-W016849 [1,0,0,0,0,0|2,0,1]=4 39 B8R1.3 NC1=CN=C(Cl)C=C1 HY-W007481 [1,0,0,0,0,0|2,0,1]=4 40 B8R1.3 NC1=NN=C(Cl)C=C1 HY-Y0141 [1,0,0,0,0,0|2,0,1]=4 41 B8R1.3 O=C1C=CC(=O)NN1 HY-59354 [1,0,0,0,0,0|2,0,0]=3 42 B8R1.3 O=C1C=CC(Br)=CN1 HY-59165 [1,0,0,0,0,0|0,1,0]=2 43 B8R1.3 O=C1C=CC(Cl)=CN1 HY-W008822 [1,0,0,0,0,0|0,0,0]=1 44 B8R1.4 BrC1=CC=CC(I)=C1 HY-32149 [1,0,0,0,0,0|2,1,0]=4 45 B8R1.4 BrC1=CN=CC(Br)=C1 HY-Y0491 [1,0,0,0,0,0|1,1,1]=4 46 B8R1.4 CC1=CC(Cl)=NC=C1 HY-W010423 [1,0,0,0,0,0|3,0,0]=4 47 B8R1.4 CC1=NC(Cl)=CC=C1 HY-W001993 [1,0,0,0,0,0|3,0,0]=4 48 B8R1.4 ClC1=CC=NC(Br)=C1 HY-W003129 [1,0,0,0,0,0|3,0,0]=4 49 B8R1.4 ClC1=CN=CC(Br)=C1 HY-W003165 [1,0,0,0,0,0|1,0,1]=3 50 B8R1.4 ClC1=CN=CC(Cl)=C1 HY-W015627 [1,0,0,0,0,0|1,0,1]=3 51 B8R1.4 ClC1=NC=CC(Br)=C1 HY-32752 [1,0,0,0,0,0|3,0,0]=4 52 B8R1.4 ClC1=NC=CC(I)=C1 HY-32754 [1,0,0,0,0,0|3,0,0]=4 53 B8R1.4 NC1=CC(Br)=CN=C1 HY-66052 [1,0,0,0,0,0|1,1,1]=4 54 B8R1.4 NC1=CN=CC(Cl)=N1 HY-59335 [1,0,0,0,0,0|2,0,1]=4 55 B8R1.4 NC1=NC=CC(Cl)=C1 HY-60325 [1,0,0,0,0,0|3,0,0]=4 56 B8R1.4 O=C1C=C(O)C=CN1 HY-Y0426 [1,0,0,0,0,0|3,0,0]=4 57 B8R1.4 O=C1C=CC=C(O)N1 HY-W036553 [1,0,0,0,0,0|3,0,0]=4 58 B8R1.4 OC1=CC(Cl)=NC=C1 HY-I0304 [1,0,0,0,0,0|2,0,0]=3 59 B8R1.4 OC1=CC=CC(I)=C1 HY-W007364 [1,0,0,0,0,0|1,1,0]=3 60 B8R1.4 OC1=CN=CC(Br)=C1 HY-66053 [1,0,0,0,0,0|0,1,1]=3 61 B8R1.4 OC1=NC=CC(Br)=C1 HY-65036 [1,0,0,0,0,0|2,1,0]=4 62 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [1,0,0,0,0,0|2,0,1]=4 63 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [1,0,0,0,0,0|2,0,1]=4 64 B8R1.5 CC1=NC=CC=C1O HY-W002339 [1,0,0,0,0,0|1,0,1]=3 65 B8R1.5 ClC1=C(Br)N=CC=C1 HY-W007662 [1,0,0,0,0,0|2,0,1]=4 66 B8R1.5 ClC1=C(Cl)N=CC=C1 HY-W012591 [1,0,0,0,0,0|2,0,1]=4 67 B8R1.5 ClC1=NC=CC=C1Br HY-32751 [1,0,0,0,0,0|2,0,1]=4 68 B8R1.5 ClC1=NC=CC=C1I HY-32753 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.5 FC1=CC=CC=C1I HY-34673 [1,0,0,0,0,0|3,0,0]=4 70 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [1,0,0,0,0,0|1,0,1]=3 71 B8R1.5 NC1=CC=CC=C1I HY-W007318 [1,0,0,0,0,0|3,0,0]=4 72 B8R1.5 NC1=CC=CN=C1Br HY-66051 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.5 NC1=CC=CN=C1Cl HY-Y0244 [1,0,0,0,0,0|2,0,1]=4 74 B8R1.5 NC1=NC=CC=C1I HY-32813 [1,0,0,0,0,0|2,0,1]=4 75 B8R1.5 O=C1C=COC=C1O HY-N1997 [1,0,0,0,0,0|2,0,0]=3 76 B8R1.5 OC1=C(F)C=CC=C1 HY-41755 [1,0,0,0,0,0|2,0,0]=3 77 B8R1.5 OC1=CC=CN=C1Br HY-20026 [1,0,0,0,0,0|1,0,1]=3 78 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [1,0,0,0,0,0|1,0,1]=3 79 B8R1.5 ON1C=CC=CC1=S HY-B1747 [1,0,0,0,0,0|2,1,0]=4 80 B10R1.22 CC1=CC(=O)C=C(C)C1=O HY-W015816 [0,1,0,0,0,0|3,0,0]=4 81 B10R1.22 CC1=CC(C)=C(C)C(O)=C1 HY-W015812 [0,1,0,0,0,0|3,0,0]=4 82 B10R1.22 OC1=CC(Cl)=CC(Cl)=C1O HY-133609 [0,1,0,0,0,0|1,0,1]=3 83 B10R1.25 CC1=CC(Cl)=CC=C1[N+]#N HY-D1490 [0,1,0,0,0,0|3,0,0]=4 84 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [0,1,0,0,0,0|2,0,0]=3 85 B10R1.25 CCC1=C(O)C=C(O)C=C1 HY-W015782 [0,1,0,0,0,0|3,0,0]=4 86 B10R1.25 N#[N+]C1=CC=C(Cl)C=C1Cl HY-D0898 [0,1,0,0,0,0|3,0,0]=4 87 B10R1.25 O=CC1=C(F)C=C(F)C=C1 HY-W007410 [0,1,0,0,0,0|2,1,0]=4 88 B10R1.25 O=CC1=CC=C(Br)C=C1O HY-W001114 [0,1,0,0,0,0|1,1,0]=3 89 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [0,1,0,0,0,0|2,0,0]=3 90 B10R1.25 OCC1=CC=C(Cl)C=C1Cl HY-W039454 [0,1,0,0,0,0|2,0,1]=4 91 B10R1.30 COC1=CC(Br)=CC=C1N HY-50822 [0,1,0,0,0,0|2,1,0]=4 92 B10R1.30 COC1=CC(Br)=CC=C1O HY-W007865 [0,1,0,0,0,0|1,1,1]=4 93 B10R1.30 COC1=CC(C)=CC=C1O HY-W040971 [0,1,0,0,0,0|2,0,1]=4 94 B10R1.30 COC1=CC(Cl)=CC=C1O HY-W039169 [0,1,0,0,0,0|1,0,1]=3 95 B10R1.118 CC1=CC(=O)C(C)=CC1=O HY-W090317 [0,1,0,0,0,0|3,0,0]=4 96 B10R1.118 NC1=CC(O)=C(F)C=C1F HY-W007272 [0,1,0,0,0,0|3,0,0]=4 97 B10R1.118 O=C1C=C(O)C(=O)C=C1O HY-W010323 [0,1,0,0,0,0|2,0,0]=3 98 B10R1.118 O=C1NC(Cl)=C(Cl)C=C1Cl HY-W018171 [0,1,0,0,0,0|1,0,0]=2 99 B10R1.119 CC1=C(O)C(=O)C=CN1C HY-B0568 [0,1,0,0,0,0|3,0,0]=4 100 B10R1.119 CC1=C(O)C(=O)C=CN1C HY-B0568R [0,1,0,0,0,0|3,0,0]=4 101 B10R1.119 OC1=CC=C(F)C(O)=C1F HY-124472 [0,1,0,0,0,0|3,0,0]=4 102 B10R1.176 NCC1=CC(O)=C(O)C=C1 HY-N3023 [0,1,0,0,0,0|2,0,1]=4 103 B10R1.176 O=CC1=CC=C(O)C(O)=C1 HY-N0295 [0,1,0,0,0,0|2,0,1]=4 104 B8R1.18 CC1=CC(=O)OC1=O HY-78035 [0,0,0,0,1,0|3,0,0]=4 105 B8R1.18 CN1SC(Cl)=CC1=O HY-W017982 [0,0,0,0,1,0|3,0,0]=4 106 B8R1.18 O=C1C=C(Br)C(=O)N1 HY-W076794 [0,0,0,0,1,0|2,0,0]=3 107 B8R1.50 CC1=C(O)C(=O)CO1 HY-W012927 [0,0,0,0,1,0|3,0,0]=4 108 B8R1.50 O=C1SSC(Cl)=C1Cl HY-W016149 [0,0,0,0,1,0|3,0,0]=4 109 B7R0.6 NC(=O)\C=C/C(=O)O HY-128750 [1,0,1,0,0,0|2,0,0]=4 110 B7R1.3 ClC1=NC=CN=C1 HY-Y0109 [2,0,0,0,0,0|1,0,1]=4 111 B7R1.3 IC1=CC=CC=C1 HY-Y0747 [2,0,0,0,0,0|1,1,0]=4 112 B7R1.3 IC1=CC=CC=N1 HY-W004126 [2,0,0,0,0,0|1,0,1]=4 113 B7R1.3 O=C1C=CC=CN1 HY-Y0191 [2,0,0,0,0,0|0,0,0]=2 114 B7R1.3 O=C1C=CCCN1 HY-W006454 [2,0,0,0,0,0|0,0,2]=4 115 B7R1.3 OC1=CC=CN=C1 HY-Y1129 [2,0,0,0,0,0|0,0,1]=3 116 B9R1.1 CC1=CC=C(C=O)C=C1 HY-W012860 [1,1,0,0,0,0|2,0,0]=4 117 B9R1.1 NC1=CC=C(C=O)C=C1 HY-W076836 [1,1,0,0,0,0|2,0,0]=4 118 B9R1.1 O=CC1=CC=C(Br)C=C1 HY-W001138 [1,1,0,0,0,0|1,1,0]=4 119 B9R1.1 O=CC1=CC=C(F)C=C1 HY-Y0197 [1,1,0,0,0,0|1,1,0]=4 120 B9R1.1 O=CC1=CC=C(I)C=C1 HY-W002179 [1,1,0,0,0,0|1,1,0]=4 121 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313 [1,1,0,0,0,0|2,0,0]=4 122 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313R [1,1,0,0,0,0|2,0,0]=4 123 B9R1.2 COC1=CC(Cl)=NC=C1 HY-W007914 [1,1,0,0,0,0|2,0,0]=4 124 B9R1.2 COC1=CC(O)=CC=C1 HY-Y1840 [1,1,0,0,0,0|2,0,0]=4 125 B9R1.2 COC1=CC=CC(C)=C1 HY-115127 [1,1,0,0,0,0|2,0,0]=4 126 B9R1.2 COC1=CN=CC(Br)=C1 HY-W007427 [1,1,0,0,0,0|0,1,1]=4 127 B9R1.2 COC1=NC(Cl)=CC=C1 HY-W001995 [1,1,0,0,0,0|2,0,0]=4 128 B9R1.2 NCC1=CC(O)=CC=C1 HY-W069508 [1,1,0,0,0,0|2,0,0]=4 129 B9R1.2 O=CC1=CC(Cl)=CC=C1 HY-Y1863 [1,1,0,0,0,0|1,0,1]=4 130 B9R1.2 O=CC1=CC=CC(O)=C1 HY-76006 [1,1,0,0,0,0|2,0,0]=4 131 B9R1.2 OCC1=CC(Cl)=NC=C1 HY-W003365 [1,1,0,0,0,0|2,0,0]=4 132 B9R1.3 CC1=C(O)C(O)=CC=C1 HY-W012815 [1,1,0,0,0,0|2,0,0]=4 133 B9R1.3 ClC1=CN=CC(Cl)=C1Cl HY-W016371 [1,1,0,0,0,0|1,0,1]=4 134 B9R1.3 OC1=CC=CC(F)=C1O HY-W007482 [1,1,0,0,0,0|1,1,0]=4 135 B9R1.3 OC1=CC=CC(O)=C1O HY-N1579 [1,1,0,0,0,0|2,0,0]=4 136 B9R1.3 OC1=CC=CC(O)=C1O HY-N1579R [1,1,0,0,0,0|2,0,0]=4 137 B9R1.34 CC1=CC(O)=CC(O)=C1 HY-D0168 [1,1,0,0,0,0|2,0,0]=4 138 B9R1.34 OC1=CC(Br)=CC(Br)=C1 HY-W007905 [1,1,0,0,0,0|1,1,0]=4 139 B9R1.15 CC1=CC=CC=C1C=O HY-Y0442 [1,1,0,0,0,0|2,0,0]=4 140 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [1,1,0,0,0,0|1,0,1]=4 141 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [1,1,0,0,0,0|2,0,0]=4 142 B9R1.15 COC1=CC=CC=C1O HY-B2115 [1,1,0,0,0,0|1,0,1]=4 143 B9R1.15 COC1=CC=CC=C1O HY-N1380 [1,1,0,0,0,0|1,0,1]=4 144 B9R1.15 COC1=CC=CC=C1O HY-N1380R [1,1,0,0,0,0|1,0,1]=4 145 B9R1.15 N#CC1=CC=CC=C1O HY-W012869 [1,1,0,0,0,0|2,0,0]=4 146 B9R1.15 NC1=CC=CC=C1CO HY-W004705 [1,1,0,0,0,0|2,0,0]=4 147 B9R1.15 NCC1=CC=CC=C1O HY-34350 [1,1,0,0,0,0|2,0,0]=4 148 B9R1.15 O=CC1=CC=CC=C1I HY-W007846 [1,1,0,0,0,0|2,0,0]=4 149 B9R1.15 O=CC1=NC=CC=C1F HY-W001028 [1,1,0,0,0,0|1,0,1]=4 150 B9R1.15 OCC1=CC=CC=C1I HY-W004678 [1,1,0,0,0,0|2,0,0]=4 151 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,1,0,0,0,0|1,0,1]=4 152 B9R1.37 O=C1NC(=O)C(Br)=C1Br HY-W004756 [0,1,0,0,1,0|2,0,0]=4 153 B11R1.14 O=C1C(Cl)=CC(=NCl)C=C1Cl HY-W105135 [0,2,0,0,0,0|2,0,0]=4 154 B11R1.464 O=CC1=C(O)C=C(O)C=C1O HY-W005130 [0,2,0,0,0,0|2,0,0]=4 155 B11R1.166 CC(=O)C1=CC=C(C)C=C1O HY-34204 [0,2,0,0,0,0|2,0,0]=4 156 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1O HY-22225 [0,2,0,0,0,0|1,0,0]=3 157 B11R1.166 CC(=O)C1=CC=C(O)C=C1O HY-Y0694 [0,2,0,0,0,0|2,0,0]=4 158 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 HY-78144 [0,2,0,0,0,0|2,0,0]=4 159 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-B1048 [0,2,0,0,0,0|2,0,0]=4 160 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-I0447 [0,2,0,0,0,0|2,0,0]=4 161 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 HY-W016769 [0,2,0,0,0,0|2,0,0]=4 162 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 HY-W016867 [0,2,0,0,0,0|1,0,0]=3 163 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 HY-W008186 [0,2,0,0,0,0|1,1,0]=4 164 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 HY-W012575 [0,2,0,0,0,0|2,0,0]=4 165 B11R1.167 O=C(O)C1=C(O)C=CC(Cl)=C1 HY-W016866 [0,2,0,0,0,0|1,0,1]=4 166 B11R1.167 O=C1NC=C(Br)C=C1[N+](=O)[O-] HY-W002138 [0,2,0,0,0,0|0,1,1]=4 167 B9R1.5 O=C1C=CC=CC=C1O HY-N7135 [0,0,1,1,0,0|2,0,0]=4 168 B7R1.2 O=C1C=CC(=O)N1 HY-W007324 [1,0,0,0,1,0|1,0,0]=3