0 B10R1.20 COC1=CC=CC=C1C=O HY-77995 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.20 COC1=CC=CC=C1OC HY-B1812 [0,0,0,0,0,0|0,0,0]=0 2 B10R1.20 O=CC1=CC=CC=C1C=O HY-W012669 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.15 C#CC1=CC=CC=C1Cl HY-W002586 [1,0,0,0,0,0|2,0,1]=4 4 B9R1.15 CC1=CC=CC=C1C=O HY-Y0442 [1,0,0,0,0,0|2,0,0]=3 5 B9R1.15 COC1=C(Br)N=CC=C1 HY-W007501 [1,0,0,0,0,0|2,0,0]=3 6 B9R1.15 COC1=C(C)C=CC=C1 HY-W027751 [1,0,0,0,0,0|0,0,0]=1 7 B9R1.15 COC1=CC=CC=C1O HY-B2115 [1,0,0,0,0,0|0,0,0]=1 8 B9R1.15 COC1=CC=CC=C1O HY-N1380 [1,0,0,0,0,0|0,0,0]=1 9 B9R1.15 COC1=CC=CC=C1O HY-N1380R [1,0,0,0,0,0|0,0,0]=1 10 B9R1.15 COC1=NC=CC=C1Br HY-32755 [1,0,0,0,0,0|2,0,0]=3 11 B9R1.15 N#CC1=CC=CC=C1O HY-W012869 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.15 NC1=CC=CC=C1CO HY-W004705 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.15 NCC1=CC=CC=C1O HY-34350 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.15 O=CC1=CC=CC=C1I HY-W007846 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.15 OCC1=CC=CC=C1I HY-W004678 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.15 OCC1=CC=CC=C1O HY-B1419 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.37 COC1=CC=C(F)C=C1C=O HY-W005085 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.37 COC1=CC=C(O)C=C1OC HY-N1780 [0,1,0,0,0,0|0,0,0]=1 19 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] HY-Z0129 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.53 COC1=C(B(O)O)C=CC=C1 HY-W002569 [0,1,0,0,0,0|2,0,0]=3 21 B11R1.53 COC1=CC=CC=C1C(=O)O HY-N1393 [0,1,0,0,0,0|2,0,0]=3 22 B11R1.53 COC1=NC=CC=C1B(O)O HY-32956 [0,1,0,0,0,0|3,0,0]=4 23 B11R1.265 COC1=C(C#N)C(=O)NC=C1 HY-65008 [0,1,0,0,0,0|3,0,0]=4 24 B11R1.265 COC1=C(OC)C(C)=NC=C1 HY-W106075 [0,1,0,0,0,0|1,0,0]=2 25 B11R2.1 CC1=CNC2=CC=CC=C12 HY-W007355 [0,0,0,1,0,0|2,0,1]=4 26 B11R2.1 CC1=CNC2=CC=CC=C12 HY-W007355R [0,0,0,1,0,0|2,0,1]=4 27 B11R2.1 CN1C=CC2=C1C=CC=C2 HY-Y1162 [0,0,0,1,0,0|2,0,1]=4 28 B11R2.1 O=C1CCC2=C1C=CC=C2 HY-W004333 [0,0,0,1,0,0|3,0,0]=4 29 B8R1.2 COC1=CC=NC=C1 HY-W007634 [2,0,0,0,0,0|1,0,0]=3 30 B8R1.2 COC1=CN=CC=C1 HY-W008119 [2,0,0,0,0,0|1,0,0]=3 31 B8R1.2 COC1=CN=CC=N1 HY-W010562 [2,0,0,0,0,0|2,0,0]=4 32 B8R1.2 NCC1=CC=CC=C1 HY-76253 [2,0,0,0,0,0|2,0,0]=4 33 B8R1.2 O=NC1=CC=CC=C1 HY-121641 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.2 O=[As]C1=CC=CC=C1 HY-131901 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|2,0,0]=4 36 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [2,0,0,0,0,0|2,0,0]=4 37 B8R1.5 CC1=C(Br)N=CC=C1 HY-W007712 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.5 CC1=C(C)N=CC=N1 HY-W015914 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.5 CC1=NC=CC=C1Br HY-W002494 [2,0,0,0,0,0|2,0,0]=4 40 B8R1.5 CC1=NC=CC=C1O HY-W002339 [2,0,0,0,0,0|1,0,0]=3 41 B8R1.5 FC1=CC=CC=C1I HY-34673 [2,0,0,0,0,0|2,0,0]=4 42 B8R1.5 NC1=C(O)C=CC=N1 HY-W007794 [2,0,0,0,0,0|2,0,0]=4 43 B8R1.5 NC1=CC=CC=C1I HY-W007318 [2,0,0,0,0,0|2,0,0]=4 44 B8R1.5 O=C1C=COC=C1O HY-N1997 [2,0,0,0,0,0|1,0,1]=4 45 B8R1.5 OC1=C(F)C=CC=C1 HY-41755 [2,0,0,0,0,0|1,0,0]=3 46 B8R1.5 OC1=CC=CN=C1Br HY-20026 [2,0,0,0,0,0|2,0,0]=4 47 B8R1.5 OC1=CC=CN=C1Cl HY-32833 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.5 ON1C=CC=CC1=S HY-B1747 [2,0,0,0,0,0|1,1,0]=4 49 B10R1.2 CC1=C(O)C(C=O)=CC=C1 HY-W007934 [1,1,0,0,0,0|2,0,0]=4 50 B10R1.2 CCC1=C(O)C(=O)C=CO1 HY-W010320 [1,1,0,0,0,0|2,0,0]=4 51 B10R1.2 CCC1=C(O)C(=O)C=CO1 HY-W010320R [1,1,0,0,0,0|2,0,0]=4 52 B10R1.2 CCC1=CC=CC(C)=C1O HY-W089538 [1,1,0,0,0,0|1,0,0]=3 53 B10R1.4 CCOC1=CC=CC=C1O HY-W022036 [1,1,0,0,0,0|0,0,0]=2 54 B10R1.4 O\N=C\C1=CC=CC=C1O HY-D0216 [1,1,0,0,0,0|2,0,0]=4 55 B10R1.25 CC1=CC(Cl)=CC=C1[N+]#N HY-D1490 [1,1,0,0,0,0|2,0,0]=4 56 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [1,1,0,0,0,0|2,0,0]=4 57 B10R1.25 CCC1=C(O)C=C(O)C=C1 HY-W015782 [1,1,0,0,0,0|1,0,0]=3 58 B10R1.25 COC1=CC=C(F)C=C1Br HY-W001094 [1,1,0,0,0,0|1,0,0]=3 59 B10R1.25 O=CC1=CC=C(Br)C=C1O HY-W001114 [1,1,0,0,0,0|2,0,0]=4 60 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [1,1,0,0,0,0|2,0,0]=4 61 B10R1.30 CCC1=NC(C)=CC=C1O HY-W002620A [1,1,0,0,0,0|2,0,0]=4 62 B10R1.30 COC1=CC(Br)=CC=C1N HY-50822 [1,1,0,0,0,0|1,0,0]=3 63 B10R1.30 COC1=CC(Br)=CC=C1O HY-W007865 [1,1,0,0,0,0|0,0,0]=2 64 B10R1.30 COC1=CC(C)=CC=C1O HY-W040971 [1,1,0,0,0,0|0,0,0]=2 65 B10R1.30 COC1=CC(Cl)=CC=C1O HY-W039169 [1,1,0,0,0,0|0,0,0]=2 66 B10R1.30 O=CC1=CC(F)=CC=C1O HY-W007331 [1,1,0,0,0,0|2,0,0]=4 67 B10R1.61 CC(=O)C1=CC=CC=C1Br HY-W007689 [1,1,0,0,0,0|2,0,0]=4 68 B10R1.61 CC(=O)C1=CC=CC=C1F HY-Y1133 [1,1,0,0,0,0|2,0,0]=4 69 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501R [1,1,0,0,0,0|2,0,0]=4 70 B10R1.61 CC(=O)C1=CC=CC=C1O HY-Y1426 [1,1,0,0,0,0|1,0,0]=3 71 B10R1.61 CC1=C(B(O)O)C=CC=C1 HY-W001232 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.61 CC1=CC=CC=C1C(=O)O HY-41494 [1,1,0,0,0,0|2,0,0]=4 73 B10R1.61 NC(=O)C1=CC=CC=C1O HY-B0811 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167 [1,1,0,0,0,0|2,0,0]=4 75 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167R [1,1,0,0,0,0|2,0,0]=4 76 B10R1.61 OB(O)C1=CC=CC=C1O HY-W002733 [1,1,0,0,0,0|2,0,0]=4 77 B12R1.46 COC1=CC=C(C)C=C1[N+](=O)[O-] HY-78878 [0,2,0,0,0,0|2,0,0]=4 78 B12R1.46 COC1=CC=C(F)C=C1B(O)O HY-32924 [0,2,0,0,0,0|2,0,0]=4 79 B12R1.57 COC1=C(C(C)C)C=CC(C)=C1 HY-W290527 [0,2,0,0,0,0|1,0,0]=3 80 B12R1.57 COC1=CC(Cl)=CC=C1B(O)O HY-41551 [0,2,0,0,0,0|2,0,0]=4 81 B12R1.78 COC1=CC(OC)=C(CO)C=C1 HY-W007584 [0,2,0,0,0,0|2,0,0]=4 82 B12R1.78 COC1=CC=C(C=O)C=C1OC HY-N1096 [0,2,0,0,0,0|0,0,0]=2 83 B12R1.78 COC1=CC=C(CO)C=C1OC HY-107858 [0,2,0,0,0,0|0,0,0]=2 84 B12R1.448 COC1=C(OC)C=C(N)C(N)=C1 HY-77873 [0,2,0,0,0,0|0,0,0]=2 85 B12R1.448 COC1=C(OC)C=C(N)C(N)=C1 HY-W097960 [0,2,0,0,0,0|0,0,0]=2 86 B12R1.448 [2H]C1=CC(OC)=C(OC)C=C1[2H] HY-B1812S1 [0,2,0,0,0,0|0,0,0]=2 87 B12R1.77 CNC1=CC=CC=C1C(=O)OC HY-76705 [0,2,0,0,0,0|1,0,0]=3 88 B12R1.77 COC1=CC=CC=C1C(=O)CBr HY-W012267 [0,2,0,0,0,0|1,0,0]=3 89 B12R1.121 COC1=C(OCCN)C=CC=C1 HY-107847 [0,2,0,0,0,0|0,0,0]=2 90 B12R1.121 COC1=CC=CC=C1\C=C\C=O HY-W046353 [0,2,0,0,0,0|1,0,1]=4 91 B12R1.283 CCOC1=CC=CC=C1C(N)=O HY-B1428 [0,2,0,0,0,0|2,0,0]=4 92 B12R1.76 [2H]C([2H])([2H])C1=CC=CC=C1OC HY-W027751S [0,2,0,0,0,0|2,0,0]=4 93 B12R1.437 COC1=CC=CC(F)=C1B(O)O HY-59289 [0,2,0,0,0,0|2,0,0]=4 94 B12R1.1879 COC1=CC=CC(C=O)=C1OC HY-41407 [0,2,0,0,0,0|0,0,0]=2 95 B12R1.1879 COC1=CC=CC(CO)=C1OC HY-Z0549 [0,2,0,0,0,0|0,0,0]=2 96 B12R1.1879 COC1=CC=CC(OC)=C1C=O HY-W001249 [0,2,0,0,0,0|2,0,0]=4 97 B12R1.1879 COC1=CC=CC(OC)=C1OC HY-W017092 [0,2,0,0,0,0|0,0,0]=2 98 B12R1.1879 COC1=CC=NC(CCl)=C1OC HY-W013510 [0,2,0,0,0,0|1,0,0]=3 99 B10R2.7 C1=CC=C2OCCC2=C1 HY-75247 [1,0,0,1,0,0|0,0,0]=2 100 B10R2.7 C1=CC=C2ON=CC2=C1 HY-W103317 [1,0,0,1,0,0|1,0,1]=4 101 B10R2.7 C1=CN=C2NCCC2=C1 HY-30156 [1,0,0,1,0,0|2,0,0]=4 102 B12R2.24 BrC1=CC=C2OCCOC2=C1 HY-W002191 [0,1,0,1,0,0|0,0,0]=2 103 B12R2.24 O=C1CCC2=CC=CC=C2O1 HY-N1926 [0,1,0,1,0,0|1,0,1]=4 104 B12R2.315 COC1=C2C=CNC2=CC=C1 HY-59301 [0,1,0,1,0,0|1,0,1]=4 105 B12R2.315 COC1=CC=CC2=C1NC=C2 HY-W001536 [0,1,0,1,0,0|1,0,1]=4 106 B12R2.1081 O=C1CCCC2=C1C=CC=C2 HY-76194A [0,1,0,1,0,0|2,0,0]=4 107 B12R2.1081 OC1=CC=CC2=C1NCCC2 HY-W002942 [0,1,0,1,0,0|2,0,0]=4