0 B10R1.4 CCOC1=CC=CC=C1O HY-W022036 [0,0,0,0,0,0|1,0,0]=1 1 B10R1.4 O\N=C\C1=CC=CC=C1O HY-D0216 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.8 BrCCC1=CC=CC=C1 HY-Y0199 [1,0,0,0,0,0|1,0,0]=2 3 B9R1.8 CCOC1=CC=CC=C1 HY-Y1207 [1,0,0,0,0,0|1,0,0]=2 4 B9R1.8 CNCC1=CC=CC=C1 HY-W007426 [1,0,0,0,0,0|1,0,0]=2 5 B9R1.8 NOCC1=CC=CC=C1 HY-41915 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.8 OCCC1=CC=CC=C1 HY-B1290 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.8 ONCC1=CC=CC=C1 HY-W002216 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 [2H]OCC1=CC=CC=C1 HY-B0892S4 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.15 C#CC1=CC=CC=C1Cl HY-W002586 [1,0,0,0,0,0|1,0,2]=4 10 B9R1.15 CC1=CC=CC=C1C=O HY-Y0442 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.15 COC1=CC=CC=C1O HY-B2115 [1,0,0,0,0,0|1,0,0]=2 14 B9R1.15 COC1=CC=CC=C1O HY-N1380 [1,0,0,0,0,0|1,0,0]=2 15 B9R1.15 COC1=CC=CC=C1O HY-N1380R [1,0,0,0,0,0|1,0,0]=2 16 B9R1.15 COC1=NC=CC=C1Br HY-32755 [1,0,0,0,0,0|3,0,0]=4 17 B9R1.15 N#CC1=CC=CC=C1O HY-W012869 [1,0,0,0,0,0|1,0,1]=3 18 B9R1.15 NC1=CC=CC=C1CO HY-W004705 [1,0,0,0,0,0|2,0,0]=3 19 B9R1.15 NCC1=CC=CC=C1O HY-34350 [1,0,0,0,0,0|1,0,0]=2 20 B9R1.15 O=CC1=CC=CC=C1I HY-W007846 [1,0,0,0,0,0|2,0,1]=4 21 B9R1.15 OCC1=CC=CC=C1I HY-W004678 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,0,0,0,0,0|1,0,0]=2 23 B11R1.86 CC(=O)NC1=C(O)C=CC=C1 HY-W015600 [0,1,0,0,0,0|1,0,1]=3 24 B11R1.86 O=C(O)CC1=CC=CC=C1F HY-Y0357 [0,1,0,0,0,0|2,0,1]=4 25 B11R1.86 O=C(O)CC1=CC=CC=C1O HY-W015590 [0,1,0,0,0,0|1,0,1]=3 26 B11R1.222 COC(=O)C1=CC=CC=C1O HY-Y0189 [0,1,0,0,0,0|1,0,1]=3 27 B11R1.222 COC(=O)C1=CC=CC=C1O HY-Y0189R [0,1,0,0,0,0|1,0,1]=3 28 B11R1.222 O=C(CBr)C1=CC=CC=C1F HY-W004082 [0,1,0,0,0,0|2,0,1]=4 29 B11R1.222 O=C(NO)C1=CC=CC=C1O HY-18721 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.222 O=C(O[Na])C1=CC=CC=C1O HY-B0167A [0,1,0,0,0,0|2,0,1]=4 31 B9R0.15 C=CCC(CCC)C(=O)O HY-124087 [0,0,1,0,0,0|1,0,2]=4 32 B9R0.45 CCCC\C=C\C=C\C=O HY-W127521 [0,0,1,0,0,0|0,0,2]=3 33 B11R2.10 CC1=CC2=CC=CC=C2N1 HY-W007556 [0,0,0,1,0,0|1,0,2]=4 34 B11R2.10 CC1=NC2=CC=CC=C2O1 HY-W038287 [0,0,0,1,0,0|1,0,1]=3 35 B11R2.10 O=C1CC2=C(C=CC=C2)N1 HY-Y0061 [0,0,0,1,0,0|2,0,1]=4 36 B11R2.10 O=C1NC2=CC=CC=C2O1 HY-W015818 [0,0,0,1,0,0|2,0,1]=4 37 B11R2.106 OC1=CC=CC2=C1C=CN2 HY-34596 [0,0,0,1,0,0|1,0,2]=4 38 B11R2.106 OC1=CC=CC2=C1C=CN2 HY-34596R [0,0,0,1,0,0|1,0,2]=4 39 B8R1.2 BrCC1=CC=CN=C1 HY-W004131 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.2 CCC1=NC=CN=C1 HY-W040948 [2,0,0,0,0,0|2,0,0]=4 41 B8R1.2 COC1=CC=NC=C1 HY-W007634 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.2 COC1=CN=CC=C1 HY-W008119 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.2 NCC1=CC=CC=C1 HY-76253 [2,0,0,0,0,0|1,0,0]=3 44 B8R1.2 NCC1=CC=CN=C1 HY-Y0047 [2,0,0,0,0,0|2,0,0]=4 45 B8R1.2 NCC1=CC=NC=C1 HY-W007632 [2,0,0,0,0,0|2,0,0]=4 46 B8R1.2 O=NC1=CC=CC=C1 HY-121641 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.2 O=[As]C1=CC=CC=C1 HY-131901 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|1,0,0]=3 49 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [2,0,0,0,0,0|1,0,0]=3 50 B8R1.2 OCC1=CC=CN=C1 HY-B0893 [2,0,0,0,0,0|2,0,0]=4 51 B8R1.2 OCC1=NC=CC=C1 HY-Y0004 [2,0,0,0,0,0|2,0,0]=4 52 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [2,0,0,0,0,0|2,0,0]=4 53 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [2,0,0,0,0,0|2,0,0]=4 54 B8R1.5 CC1=NC=CC=C1O HY-W002339 [2,0,0,0,0,0|1,0,0]=3 55 B8R1.5 FC1=CC=CC=C1I HY-34673 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.5 NC1=CC=CC=C1I HY-W007318 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.5 O=C1C=COC=C1O HY-N1997 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.5 OC1=C(F)C=CC=C1 HY-41755 [2,0,0,0,0,0|1,0,0]=3 60 B8R1.5 OC1=CC=CN=C1Br HY-20026 [2,0,0,0,0,0|2,0,0]=4 61 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.5 ON1C=CC=CC1=S HY-B1747 [2,0,0,0,0,0|2,0,0]=4 63 B10R0.71 CCCCC\C=C\C=C\C=O HY-W013627 [0,1,1,0,0,0|0,0,2]=4 64 B10R0.71 CCCCC\C=C\C=C\C=O HY-W760733 [0,1,1,0,0,0|0,0,2]=4 65 B10R1.1 C=CCC1=CC=C(C)C=C1 HY-W074514 [1,1,0,0,0,0|0,0,2]=4 66 B10R1.1 C=CCC1=CC=C(O)C=C1 HY-W159754 [1,1,0,0,0,0|0,0,2]=4 67 B10R1.1 CCOC1=CC=C(O)C=C1 HY-W015786 [1,1,0,0,0,0|1,0,0]=3 68 B10R1.1 CNCC1=CC=C(F)C=C1 HY-W114781 [1,1,0,0,0,0|1,0,0]=3 69 B10R1.1 N#CCC1=CC=C(Cl)C=C1 HY-W017390 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.1 N#CCC1=CC=C(O)C=C1 HY-W015823 [1,1,0,0,0,0|1,0,1]=4 71 B10R1.1 NCCC1=CC=C(Br)C=C1 HY-42346 [1,1,0,0,0,0|1,0,0]=3 72 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606 [1,1,0,0,0,0|1,0,0]=3 73 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606R [1,1,0,0,0,0|1,0,0]=3 74 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W016823 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474 [1,1,0,0,0,0|1,0,0]=3 76 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474R [1,1,0,0,0,0|1,0,0]=3 77 B10R1.10 NCCC1=CC(O)=CC=C1 HY-128975 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.15 CC(CN)C1=CC=CC=C1 HY-W005394 [1,1,0,0,0,0|1,0,0]=3 79 B10R1.15 CCC(O)C1=CC=CC=C1 HY-W012618 [1,1,0,0,0,0|0,0,0]=2 80 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-135848 [1,1,0,0,0,0|1,0,1]=4 81 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-KE7004 [1,1,0,0,0,0|1,0,1]=4 82 B10R1.15 NCC(O)C1=CC=CC=C1 HY-59132 [1,1,0,0,0,0|1,0,0]=3 83 B10R1.15 N[C@@H](CO)C1=CC=CC=C1 HY-W002038 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.15 OCC(O)C1=CC=CC=C1 HY-W015788 [1,1,0,0,0,0|1,0,0]=3 85 B10R1.17 C=CCNC1=CC=CC=C1 HY-W087043 [1,1,0,0,0,0|0,0,2]=4 86 B10R1.17 CNCCC1=CC=CC=C1 HY-30170 [1,1,0,0,0,0|0,0,0]=2 87 B10R1.17 CNCCC1=CC=CC=N1 HY-B0524A [1,1,0,0,0,0|1,0,0]=3 88 B10R1.17 CNCCC1=NC=CC=C1 HY-B0524 [1,1,0,0,0,0|1,0,0]=3 89 B10R1.17 CNCCC1=NC=CC=C1 HY-D0237 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.17 OCCCC1=CC=CC=C1 HY-41304 [1,1,0,0,0,0|0,0,0]=2 91 B10R1.17 OCCOC1=CC=CC=C1 HY-B1729 [1,1,0,0,0,0|1,0,0]=3 92 B10R1.17 OCCOC1=CC=CC=C1 HY-B1729R [1,1,0,0,0,0|1,0,0]=3 93 B10R1.17 OC\C=C\C1=CC=CC=C1 HY-N1867 [1,1,0,0,0,0|0,0,2]=4 94 B10R1.17 OC\C=C\C1=CC=CC=C1 HY-Y0078 [1,1,0,0,0,0|0,0,2]=4 95 B10R1.17 S=C=NCC1=CC=CC=C1 HY-77813 [1,1,0,0,0,0|1,0,1]=4 96 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733 [1,1,0,0,0,0|1,0,1]=4 97 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733R [1,1,0,0,0,0|1,0,1]=4 98 B10R1.18 CC(=S)NC1=CC=CC=C1 HY-129756 [1,1,0,0,0,0|1,0,1]=4 99 B10R1.18 CC(O)CC1=CC=CC=C1 HY-W101415 [1,1,0,0,0,0|0,0,0]=2 100 B10R1.18 NC(=O)CC1=CC=CC=C1 HY-W018197 [1,1,0,0,0,0|1,0,1]=4 101 B10R1.2 CC1=C(O)C(C=O)=CC=C1 HY-W007934 [1,1,0,0,0,0|1,0,1]=4 102 B10R1.2 CCC1=C(O)C(=O)C=CO1 HY-W010320 [1,1,0,0,0,0|1,0,0]=3 103 B10R1.2 CCC1=C(O)C(=O)C=CO1 HY-W010320R [1,1,0,0,0,0|1,0,0]=3 104 B10R1.2 CCC1=CC=CC(C)=C1O HY-W089538 [1,1,0,0,0,0|0,0,0]=2 105 B10R1.20 COC1=CC=CC=C1C=O HY-77995 [1,1,0,0,0,0|1,0,1]=4 106 B10R1.20 COC1=CC=CC=C1OC HY-B1812 [1,1,0,0,0,0|1,0,0]=3 107 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.25 CCC1=C(O)C=C(O)C=C1 HY-W015782 [1,1,0,0,0,0|0,0,0]=2 109 B10R1.25 COC1=CC=C(F)C=C1Br HY-W001094 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.25 O=CC1=CC=C(Br)C=C1O HY-W001114 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.25 OCC1=CC=C(Cl)C=C1Cl HY-W039454 [1,1,0,0,0,0|2,0,0]=4 113 B10R1.30 CCC1=NC(C)=CC=C1O HY-W002620A [1,1,0,0,0,0|1,0,0]=3 114 B10R1.30 COC1=CC(Br)=CC=C1N HY-50822 [1,1,0,0,0,0|2,0,0]=4 115 B10R1.30 COC1=CC(Br)=CC=C1O HY-W007865 [1,1,0,0,0,0|1,0,0]=3 116 B10R1.30 COC1=CC(C)=CC=C1O HY-W040971 [1,1,0,0,0,0|1,0,0]=3 117 B10R1.30 COC1=CC(Cl)=CC=C1O HY-W039169 [1,1,0,0,0,0|1,0,0]=3 118 B10R1.30 O=CC1=CC(F)=CC=C1O HY-W007331 [1,1,0,0,0,0|1,0,1]=4 119 B10R1.61 CC(=O)C1=CC=CC=C1Br HY-W007689 [1,1,0,0,0,0|1,0,1]=4 120 B10R1.61 CC(=O)C1=CC=CC=C1F HY-Y1133 [1,1,0,0,0,0|1,0,1]=4 121 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501R [1,1,0,0,0,0|1,0,1]=4 122 B10R1.61 CC(=O)C1=CC=CC=C1O HY-Y1426 [1,1,0,0,0,0|0,0,1]=3 123 B10R1.61 NC(=O)C1=CC=CC=C1O HY-B0811 [1,1,0,0,0,0|1,0,1]=4 124 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167 [1,1,0,0,0,0|1,0,1]=4 125 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167R [1,1,0,0,0,0|1,0,1]=4 126 B10R1.61 OB(O)C1=CC=CC=C1O HY-W002733 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.69 CCCCC1=C(O)C=C(O)C=C1 HY-107369 [0,2,0,0,0,0|0,0,0]=2 128 B12R1.69 NC1=CC(N)=C(OCCO)C=C1 HY-W012081 [0,2,0,0,0,0|2,0,0]=4 129 B12R1.121 COC1=C(OCCN)C=CC=C1 HY-107847 [0,2,0,0,0,0|1,0,0]=3 130 B12R1.125 O=C(O)CCC1=CC=CC=C1O HY-W017158 [0,2,0,0,0,0|0,0,1]=3 131 B12R1.308 CCOC(=O)C1=CC=CC=C1O HY-Y1074 [0,2,0,0,0,0|0,0,1]=3 132 B12R1.75 COC1=C(CC(C)C)N=CC=N1 HY-W017141 [0,2,0,0,0,0|2,0,0]=4 133 B12R1.77 CCC(C)C1=C(OC)N=CC=N1 HY-W017140 [0,2,0,0,0,0|2,0,0]=4 134 B12R1.77 COC1=CC=CC=C1C(=O)CBr HY-W012267 [0,2,0,0,0,0|1,0,1]=4 135 B12R1.283 CCOC1=CC=CC=C1C(N)=O HY-B1428 [0,2,0,0,0,0|1,0,1]=4 136 B12R1.1123 NCCC1=C(O)C=C(O)C(O)=C1 HY-B1081 [0,2,0,0,0,0|1,0,0]=3 137 B12R1.1123 NCCC1=C(O)C=C(O)C(O)=C1 HY-B1081A [0,2,0,0,0,0|1,0,0]=3 138 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 HY-W010076 [0,2,0,0,0,0|1,0,1]=4 139 B12R1.127 O=C(O)CC1=CC(O)=CC=C1O HY-113283 [0,2,0,0,0,0|1,0,1]=4 140 B12R1.151 [2H]C([2H])([2H])OC1=CC=CC=C1O HY-N1380S1 [0,2,0,0,0,0|2,0,0]=4 141 B12R1.270 CCOC1=CC(C=O)=CC=C1O HY-B0940 [0,2,0,0,0,0|1,0,0]=3 142 B12R1.354 COC(=O)C1=C(O)C=CC(O)=C1 HY-W012518 [0,2,0,0,0,0|1,0,1]=4 143 B12R1.3441 COC(=O)C1=C(O)C=CC=C1O HY-W001154 [0,2,0,0,0,0|1,0,1]=4 144 B10R1.113 NC1C=CC=C(C(=O)O)C1 HY-15377 [0,0,1,1,0,0|2,0,0]=4 145 B10R1.21 CCCCCC1=CC=CO1 HY-N7398 [0,0,1,1,0,0|0,0,2]=4 146 B10R2.7 C1=CC=C2OCCC2=C1 HY-75247 [1,0,0,1,0,0|1,0,0]=3 147 B10R2.7 C1=CN=C2NCCC2=C1 HY-30156 [1,0,0,1,0,0|2,0,0]=4 148 B12R2.1081 CC1=CC=NC2=C1CCCC2 HY-W049311 [0,1,0,1,0,0|2,0,0]=4 149 B12R2.1081 O=C1CCCC2=C1C=CC=C2 HY-76194A [0,1,0,1,0,0|0,0,1]=3 150 B12R2.1081 OC1=CC=CC2=C1NCCC2 HY-W002942 [0,1,0,1,0,0|0,0,0]=2 151 B12R2.24 BrC1=CC=C2OCCOC2=C1 HY-W002191 [0,1,0,1,0,0|1,0,0]=3 152 B12R2.24 O=C1CCC2=CC=CC=C2N1 HY-W002108 [0,1,0,1,0,0|1,0,1]=4 153 B12R2.24 O=C1CCC2=CC=CC=C2O1 HY-N1926 [0,1,0,1,0,0|0,0,1]=3 154 B12R2.32 CNC1CC2=C(C=CC=C2)C1 HY-113833 [0,1,0,1,0,0|1,0,0]=3 155 B12R2.196 O=C1CCC2=C1C=CC=C2O HY-W001217 [0,1,0,1,0,0|0,0,1]=3 156 B12R2.606 CC1=NC2=CC=C(O)C=C2O1 HY-65172 [0,1,0,1,0,0|1,0,1]=4 157 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 HY-W017445 [0,1,0,1,0,0|1,0,1]=4 158 B12R2.221 OC1=CC=C(Cl)C2=C1CCC2 HY-B0999 [0,1,0,1,0,0|0,0,0]=2 159 B8R1.8 CCCN1C=CC=N1 HY-Z1093 [1,0,0,0,1,0|2,0,0]=4