0 B10R1.3 C#CC1=CC=C(CC)C=C1 HY-W012717 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.3 C#CC1=CC=C(OC)C=C1 HY-W004104 [0,0,0,0,0,0|1,0,1]=2 2 B10R1.3 CCC1=CC=C(C=O)C=C1 HY-W012657 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.3 COC1=CC=C(C=O)C=C1 HY-Y0740 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.3 COC1=CC=C(C=O)C=N1 HY-32788 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.3 COC1=CC=C(CO)C=C1 HY-W015777 [0,0,0,0,0,0|2,0,0]=2 6 B10R1.3 COC1=CC=C(OC)C=C1 HY-W015780 [0,0,0,0,0,0|0,0,0]=0 7 B10R1.3 COC1=CC=C(OC)C=C1 HY-W015780R [0,0,0,0,0,0|0,0,0]=0 8 B10R1.3 COC1=CN=C(OC)C=C1 HY-W051248 [0,0,0,0,0,0|1,0,0]=1 9 B10R1.3 N#CC1=CC=C(CN)C=C1 HY-W007809 [0,0,0,0,0,0|4,0,0]=4 10 B10R1.3 N#CC1=CC=C(NN)C=C1 HY-41677 [0,0,0,0,0,0|4,0,0]=4 11 B10R1.3 O=CC1=CC=C(C=O)C=C1 HY-Y0425 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.1 C#CC1=CC=C(Br)C=C1 HY-W007542 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.1 C#CC1=CC=C(N)C=C1 HY-W004660 [1,0,0,0,0,0|2,0,1]=4 14 B9R1.1 C=CC1=CC=C(O)C=C1 HY-W005288 [1,0,0,0,0,0|1,0,1]=3 15 B9R1.1 CC1=CC=C(C=O)C=C1 HY-W012860 [1,0,0,0,0,0|2,0,0]=3 16 B9R1.1 CCC1=CC=C(O)C=C1 HY-W012836 [1,0,0,0,0,0|1,0,0]=2 17 B9R1.1 CNC1=CC=C(C)C=C1 HY-W017767 [1,0,0,0,0,0|1,0,0]=2 18 B9R1.1 COC1=CC=C(C)C=C1 HY-W012835 [1,0,0,0,0,0|0,0,0]=1 19 B9R1.1 COC1=CC=C(Cl)N=N1 HY-W001168 [1,0,0,0,0,0|3,0,0]=4 20 B9R1.1 COC1=CC=C(O)C=C1 HY-30270 [1,0,0,0,0,0|0,0,0]=1 21 B9R1.1 COC1=NC=C(Br)C=C1 HY-32756 [1,0,0,0,0,0|2,0,0]=3 22 B9R1.1 COC1=NC=C(N)C=C1 HY-W001994 [1,0,0,0,0,0|2,0,0]=3 23 B9R1.1 NC1=CC=C(C=O)C=C1 HY-W076836 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.1 NC1=CC=C(CO)C=C1 HY-W007465 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.1 NCC1=CC=C(I)C=C1 HY-W013964 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.1 NCC1=CC=C(O)C=C1 HY-W004078 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.1 O=CC1=CC=C(Br)C=C1 HY-W001138 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.1 O=CC1=CC=C(F)C=C1 HY-Y0197 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.1 O=CC1=CC=C(I)C=C1 HY-W002179 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313R [1,0,0,0,0,0|2,0,0]=3 32 B9R1.1 OCC1=CC=C(O)C=C1 HY-Y0892 [1,0,0,0,0,0|2,0,0]=3 33 B9R1.1 OCC1=NC=C(O)C=C1 HY-W007140 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.3 CC(C)C1=CC=C(C=O)C=C1 HY-Y0790 [0,1,0,0,0,0|3,0,0]=4 35 B11R1.3 CC(C)C1=CC=C(CO)C=C1 HY-N7069 [0,1,0,0,0,0|3,0,0]=4 36 B11R1.3 CN(C)C1=CC=C(C=O)C=C1 HY-Y0015 [0,1,0,0,0,0|3,0,0]=4 37 B11R1.3 COC1=CC=C(B(O)O)C=N1 HY-32957 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394R [0,1,0,0,0,0|2,0,0]=3 40 B11R1.3 COC1=CC=C(C(C)=O)C=C1 HY-Y0024 [0,1,0,0,0,0|1,0,0]=2 41 B11R1.3 COC1=CC=C(C(N)=O)C=N1 HY-112584 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.3 COC1=CC=C(C(N)=S)C=C1 HY-W017115 [0,1,0,0,0,0|2,0,0]=3 43 B11R1.83 C=CCC1=CC=C(OC)C=C1 HY-N5060 [0,1,0,0,0,0|1,0,1]=3 44 B11R1.83 COC1=CC=C(CCO)C=C1 HY-W004056 [0,1,0,0,0,0|1,0,0]=2 45 B11R1.83 COC1=CC=C(N=C=S)C=C1 HY-W540232 [0,1,0,0,0,0|1,0,1]=3 46 B11R1.83 C\C=C\C1=CC=C(OC)C=C1 HY-N0367 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.279 COC1=C(F)C=C(C=O)C=C1 HY-W007614 [0,1,0,0,0,0|2,0,0]=3 48 B11R1.279 COC1=CC=C(C=O)C=C1O HY-I0637 [0,1,0,0,0,0|2,0,0]=3 49 B9R0.24 COC(=O)\C=C\C(=O)OC HY-17363 [0,0,1,0,0,0|2,0,0]=3 50 B9R0.24 COC(=O)\C=C\C(=O)OC HY-17363R [0,0,1,0,0,0|2,0,0]=3 51 B8R0.6 C\C=C\C=C\C(=O)OC HY-W068700 [1,0,1,0,0,0|2,0,0]=4 52 B8R0.9 COC(=O)\C=C\C(=O)O HY-103252 [1,0,1,0,0,0|2,0,0]=4 53 B8R1.2 COC1=CC=NC=C1 HY-W007634 [2,0,0,0,0,0|1,0,0]=3 54 B8R1.2 COC1=CN=CC=C1 HY-W008119 [2,0,0,0,0,0|1,0,0]=3 55 B8R1.2 COC1=CN=CC=N1 HY-W010562 [2,0,0,0,0,0|2,0,0]=4 56 B8R1.2 NCC1=CC=CC=C1 HY-76253 [2,0,0,0,0,0|2,0,0]=4 57 B8R1.2 O=NC1=CC=CC=C1 HY-121641 [2,0,0,0,0,0|2,0,0]=4 58 B8R1.2 O=[As]C1=CC=CC=C1 HY-131901 [2,0,0,0,0,0|2,0,0]=4 59 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|2,0,0]=4 60 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [2,0,0,0,0,0|2,0,0]=4 61 B8R1.3 CC1=CC=C(N)C=N1 HY-66048 [2,0,0,0,0,0|2,0,0]=4 62 B8R1.3 CC1=CN=C(Br)C=C1 HY-W007353 [2,0,0,0,0,0|2,0,0]=4 63 B8R1.3 CC1=CN=C(C)C=N1 HY-34439 [2,0,0,0,0,0|2,0,0]=4 64 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [2,0,0,0,0,0|1,0,1]=4 65 B8R1.3 ClC1=CC=C(Cl)C=C1 HY-Y0496 [2,0,0,0,0,0|2,0,0]=4 66 B8R1.3 IC1=CC=C(I)C=C1 HY-W007412 [2,0,0,0,0,0|2,0,0]=4 67 B8R1.3 NC1=CC=C(I)C=C1 HY-I0210 [2,0,0,0,0,0|2,0,0]=4 68 B10R1.1 C=CCC1=CC=C(C)C=C1 HY-W074514 [1,1,0,0,0,0|1,0,1]=4 69 B10R1.1 C=CCC1=CC=C(O)C=C1 HY-W159754 [1,1,0,0,0,0|1,0,1]=4 70 B10R1.1 CCOC1=CC=C(O)C=C1 HY-W015786 [1,1,0,0,0,0|0,0,0]=2 71 B10R1.1 CNCC1=CC=C(F)C=C1 HY-W114781 [1,1,0,0,0,0|2,0,0]=4 72 B10R1.1 N#CCC1=CC=C(O)C=C1 HY-W015823 [1,1,0,0,0,0|1,0,1]=4 73 B10R1.1 NCCC1=CC=C(Br)C=C1 HY-42346 [1,1,0,0,0,0|2,0,0]=4 74 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606 [1,1,0,0,0,0|1,0,0]=3 75 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W007606R [1,1,0,0,0,0|1,0,0]=3 76 B10R1.1 NCCC1=CC=C(O)C=C1 HY-W016823 [1,1,0,0,0,0|1,0,0]=3 77 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474 [1,1,0,0,0,0|1,0,0]=3 78 B10R1.1 OCCC1=CC=C(O)C=C1 HY-N0474R [1,1,0,0,0,0|1,0,0]=3 79 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HY-20436 [1,1,0,0,0,0|2,0,0]=4 80 B10R1.13 CC(=O)C1=CC=C(C)C=C1 HY-W012653 [1,1,0,0,0,0|1,0,0]=3 81 B10R1.13 CC(=O)C1=CC=C(F)C=C1 HY-Y0779 [1,1,0,0,0,0|2,0,0]=4 82 B10R1.13 CC(=O)C1=CC=C(N)C=C1 HY-W008818 [1,1,0,0,0,0|2,0,0]=4 83 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073 [1,1,0,0,0,0|1,0,0]=3 84 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073R [1,1,0,0,0,0|1,0,0]=3 85 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 HY-W074486 [1,1,0,0,0,0|2,0,0]=4 86 B10R1.13 CC1=CC=C(B(O)O)C=C1 HY-21626 [1,1,0,0,0,0|2,0,0]=4 87 B10R1.13 CC1=CC=C(C(=O)O)C=C1 HY-76547 [1,1,0,0,0,0|2,0,0]=4 88 B10R1.13 CC1=CC=C(C(N)=S)C=C1 HY-W017393 [1,1,0,0,0,0|2,0,0]=4 89 B10R1.13 CN(C)C1=CC=C(O)C=C1 HY-34154 [1,1,0,0,0,0|1,0,0]=3 90 B10R1.13 Cc1ccc(C(C)C)cc1 HY-79986 [1,1,0,0,0,0|1,0,0]=3 91 B10R1.13 NC(=O)C1=CC=C(O)C=C1 HY-W088191 [1,1,0,0,0,0|2,0,0]=4 92 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264 [1,1,0,0,0,0|2,0,0]=4 93 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264R [1,1,0,0,0,0|2,0,0]=4 94 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [1,1,0,0,0,0|2,0,0]=4 95 B10R1.25 CCC1=C(O)C=C(O)C=C1 HY-W015782 [1,1,0,0,0,0|1,0,0]=3 96 B10R1.25 COC1=CC=C(F)C=C1Br HY-W001094 [1,1,0,0,0,0|1,0,0]=3 97 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [1,1,0,0,0,0|2,0,0]=4 98 B10R1.176 NCC1=CC(O)=C(O)C=C1 HY-N3023 [1,1,0,0,0,0|2,0,0]=4 99 B10R1.176 O=CC1=CC=C(O)C(O)=C1 HY-N0295 [1,1,0,0,0,0|2,0,0]=4 100 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 HY-78000 [0,2,0,0,0,0|2,0,0]=4 101 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 HY-W008542 [0,2,0,0,0,0|1,0,1]=4 102 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 HY-W099871 [0,2,0,0,0,0|1,0,0]=3 103 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 HY-W015342 [0,2,0,0,0,0|0,0,0]=2 104 B12R1.5 COC(=O)C1=CC=C(O[Na])C=C1 HY-W016806 [0,2,0,0,0,0|1,0,0]=3 105 B12R1.5 COC1=CC=C(C(=O)CBr)C=C1 HY-W013478 [0,2,0,0,0,0|1,0,0]=3 106 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 HY-N6864 [0,2,0,0,0,0|2,0,0]=4 107 B12R1.48 COC1=CC=C(B(O)O)C=C1F HY-32922 [0,2,0,0,0,0|2,0,0]=4 108 B12R1.48 COC1=CC=C(C(=O)O)C=C1C HY-59384 [0,2,0,0,0,0|2,0,0]=4 109 B12R1.48 COC1=CC=C(C(C)=O)C=C1O HY-W002484 [0,2,0,0,0,0|1,0,0]=3 110 B12R1.256 CN(C)C1=CC=C(N(C)C)C=C1 HY-W012145 [0,2,0,0,0,0|2,0,0]=4 111 B12R1.256 CN(C)C1=CC=C(N(C)C)C=C1 HY-W021358 [0,2,0,0,0,0|2,0,0]=4 112 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 HY-75625 [0,2,0,0,0,0|2,0,0]=4 113 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159 [0,2,0,0,0,0|1,0,0]=3 114 B12R1.452 COC1=CC=C(C(C)=O)C(O)=C1 HY-N0159R [0,2,0,0,0,0|1,0,0]=3 115 B12R1.4 CC(C)OC1=CC=C(C=O)C=C1 HY-W017186 [0,2,0,0,0,0|2,0,0]=4 116 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 HY-W004206 [0,2,0,0,0,0|1,0,1]=4 117 B12R1.4 COC1=CC=C(OC(=O)Cl)C=C1 HY-23963 [0,2,0,0,0,0|0,0,1]=3 118 B12R1.71 COC1=CC=C(\C=C\C=O)C=C1 HY-W013605A [0,2,0,0,0,0|1,0,1]=4 119 B12R1.288 COC1=CC=C(CCN)C=C1O HY-W041498 [0,2,0,0,0,0|1,0,0]=3 120 B12R1.78 COC1=CC(OC)=C(CO)C=C1 HY-W007584 [0,2,0,0,0,0|2,0,0]=4 121 B12R1.78 COC1=CC=C(C=O)C=C1OC HY-N1096 [0,2,0,0,0,0|2,0,0]=4 122 B12R1.78 COC1=CC=C(CO)C=C1OC HY-107858 [0,2,0,0,0,0|2,0,0]=4 123 B12R2.44 COC1=CC=C2NC=CC2=C1 HY-W007328 [0,1,0,1,0,0|1,0,1]=4 124 B12R2.44 N#CC1=CC=C2OCOC2=C1 HY-Y1347 [0,1,0,1,0,0|2,0,0]=4 125 B12R2.44 O=CC1=CC2=C(C=C1)OCC2 HY-75251 [0,1,0,1,0,0|2,0,0]=4 126 B12R2.44 OCC1=CC2=C(C=C1)OCO2 HY-W028108 [0,1,0,1,0,0|2,0,0]=4 127 B10R1.172 COC1=CC(C=O)=CC=C1 HY-W007346 [0,0,0,0,1,1|2,0,0]=4 128 B10R1.172 COC1=CC=CC(OC)=C1 HY-34487 [0,0,0,0,1,1|0,0,0]=2