0 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 HY-20436 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 HY-60206 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.13 CC(=O)C1=CC=C(C)C=C1 HY-W012653 [0,0,0,0,0,0|3,0,0]=3 3 B10R1.13 CC(=O)C1=CC=C(F)C=C1 HY-Y0779 [0,0,0,0,0,0|3,0,0]=3 4 B10R1.13 CC(=O)C1=CC=C(N)C=C1 HY-W008818 [0,0,0,0,0,0|3,0,0]=3 5 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073 [0,0,0,0,0,0|2,0,1]=3 6 B10R1.13 CC(=O)C1=CC=C(O)C=C1 HY-Y0073R [0,0,0,0,0,0|2,0,1]=3 7 B10R1.13 CC(O)C1=CC=C(Cl)C=C1 HY-W074486 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.13 CC1=CC=C(B(O)O)C=C1 HY-21626 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.13 CC1=CC=C(C(=O)O)C=C1 HY-76547 [0,0,0,0,0,0|2,0,0]=2 10 B10R1.13 CC1=CC=C(C(N)=S)C=C1 HY-W017393 [0,0,0,0,0,0|3,1,0]=4 11 B10R1.13 CC1=CN=C(C(=O)O)C=N1 HY-32739 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.13 CC1=NC=C(C(=O)O)C=C1 HY-W008333 [0,0,0,0,0,0|1,0,1]=2 13 B10R1.13 CC1=NC=C(C(N)=O)C=C1 HY-W015815 [0,0,0,0,0,0|2,0,1]=3 14 B10R1.13 N=C(N)C1=CC=C(N)C=C1 HY-W018723 [0,0,0,0,0,0|4,0,0]=4 15 B10R1.13 NC(=O)C1=CC=C(N)C=C1 HY-W017041 [0,0,0,0,0,0|3,0,0]=3 16 B10R1.13 NC(=O)C1=CC=C(N)N=C1 HY-W010342 [0,0,0,0,0,0|2,0,1]=3 17 B10R1.13 NC(=O)C1=CC=C(O)C=C1 HY-W088191 [0,0,0,0,0,0|2,0,1]=3 18 B10R1.13 NC(=S)C1=CC=C(N)C=C1 HY-76144 [0,0,0,0,0,0|3,1,0]=4 19 B10R1.13 NC1=CC=C(C(=O)O)C=C1 HY-B1008 [0,0,0,0,0,0|2,0,0]=2 20 B10R1.13 NC1=CC=C(C(=O)O)C=C1 HY-B1008R [0,0,0,0,0,0|2,0,0]=2 21 B10R1.13 NC1=NC=C(C(=O)O)C=C1 HY-W015793 [0,0,0,0,0,0|1,0,1]=2 22 B10R1.13 O=C(O)C1=CC=C(Br)N=C1 HY-W002864 [0,0,0,0,0,0|1,0,1]=2 23 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 HY-41465 [0,0,0,0,0,0|2,0,0]=2 24 B10R1.13 O=C(O)C1=CC=C(F)C=C1 HY-W013677 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.13 O=C(O)C1=CC=C(I)C=C1 HY-W013396 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264 [0,0,0,0,0,0|1,0,1]=2 27 B10R1.13 O=C(O)C1=CC=C(O)C=C1 HY-Y0264R [0,0,0,0,0,0|1,0,1]=2 28 B10R1.13 O=C(O)C1=CC=C(O)N=C1 HY-W001996 [0,0,0,0,0,0|0,0,2]=2 29 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 HY-69142 [0,0,0,0,0,0|2,0,1]=3 30 B10R1.13 O=C(O)C1=NC=C(I)C=C1 HY-W041657 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.13 O=C(O)C1=NC=C(O)N=C1 HY-76210 [0,0,0,0,0,0|1,0,2]=3 32 B10R1.13 O=C1C=CC(C(=O)O)=CO1 HY-32004 [0,0,0,0,0,0|1,0,0]=1 33 B10R1.13 O=[N+]([O-])C1=CN=C(Br)C=C1 HY-W007858 [0,0,0,0,0,0|2,0,2]=4 34 B10R1.13 O=[N+]([O-])C1=CN=C(Cl)C=C1 HY-W012564 [0,0,0,0,0,0|2,0,2]=4 35 B10R1.13 OB(O)C1=CC=C(Br)N=C1 HY-W014815 [0,0,0,0,0,0|2,0,2]=4 36 B10R1.13 OB(O)C1=CC=C(Cl)N=C1 HY-32955 [0,0,0,0,0,0|2,0,2]=4 37 B10R1.13 OB(O)C1=CC=C(F)C=C1 HY-I0201 [0,0,0,0,0,0|3,0,1]=4 38 B10R1.13 OB(O)C1=CC=C(F)N=C1 HY-32952 [0,0,0,0,0,0|2,0,2]=4 39 B10R1.13 OB(O)C1=CC=C(O)N=C1 HY-W003943 [0,0,0,0,0,0|1,0,3]=4 40 B9R1.1 C=CC1=CC=C(O)C=C1 HY-W005288 [1,0,0,0,0,0|2,0,1]=4 41 B9R1.1 CC1=CC=C(C=O)C=C1 HY-W012860 [1,0,0,0,0,0|2,0,0]=3 42 B9R1.1 NC1=CC=C(C=O)C=C1 HY-W076836 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.1 NC1=CC=C(CO)C=C1 HY-W007465 [1,0,0,0,0,0|2,0,1]=4 44 B9R1.1 O=CC1=CC=C(Br)C=C1 HY-W001138 [1,0,0,0,0,0|2,0,0]=3 45 B9R1.1 O=CC1=CC=C(Br)N=C1 HY-32786 [1,0,0,0,0,0|1,0,1]=3 46 B9R1.1 O=CC1=CC=C(F)C=C1 HY-Y0197 [1,0,0,0,0,0|2,0,0]=3 47 B9R1.1 O=CC1=CC=C(I)C=C1 HY-W002179 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313 [1,0,0,0,0,0|1,0,1]=3 49 B9R1.1 O=CC1=CC=C(O)C=C1 HY-Y0313R [1,0,0,0,0,0|1,0,1]=3 50 B9R1.1 OCC1=CC=C(Br)N=C1 HY-W016116 [1,0,0,0,0,0|1,0,2]=4 51 B9R1.1 OCC1=CC=C(O)C=C1 HY-Y0892 [1,0,0,0,0,0|1,0,2]=4 52 B9R1.6 CC(=O)C1=CC=CC=C1 HY-Y0989 [1,0,0,0,0,0|2,0,0]=3 53 B9R1.6 CC(=O)C1=CC=NC=C1 HY-Y0179 [1,0,0,0,0,0|3,0,0]=4 54 B9R1.6 CC(=O)C1=CN=CC=N1 HY-W007692 [1,0,0,0,0,0|2,0,1]=4 55 B9R1.6 N=C(N)C1=CC=CC=C1 HY-125913 [1,0,0,0,0,0|3,0,0]=4 56 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W018781 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.6 N=C(N)C1=CC=CC=C1 HY-W087937 [1,0,0,0,0,0|3,0,0]=4 58 B9R1.6 NC(=O)C1=CC=CC=C1 HY-Z0283 [1,0,0,0,0,0|2,0,0]=3 59 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150 [1,0,0,0,0,0|1,0,1]=3 60 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150R [1,0,0,0,0,0|1,0,1]=3 61 B9R1.6 NC(=O)C1=CC=NC=C1 HY-W012843 [1,0,0,0,0,0|3,0,0]=4 62 B9R1.6 NC(=O)C1=CC=NC=C1 HY-W012843R [1,0,0,0,0,0|3,0,0]=4 63 B9R1.6 NC(=O)C1=NC=CC=C1 HY-101020 [1,0,0,0,0,0|3,0,0]=4 64 B9R1.6 NC(=O)C1=NC=CN=C1 HY-B0271 [1,0,0,0,0,0|2,0,1]=4 65 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216 [1,0,0,0,0,0|1,0,0]=2 66 B9R1.6 O=C(O)C1=CC=CC=C1 HY-N0216R [1,0,0,0,0,0|1,0,0]=2 67 B9R1.6 O=C(O)C1=CC=CC=C1 HY-W015761 [1,0,0,0,0,0|1,0,0]=2 68 B9R1.6 O=C(O)C1=CC=CC=N1 HY-I0660 [1,0,0,0,0,0|2,0,0]=3 69 B9R1.6 O=C(O)C1=CC=CC=N1 HY-I0660R [1,0,0,0,0,0|2,0,0]=3 70 B9R1.6 O=C(O)C1=CC=CN=C1 HY-B0143 [1,0,0,0,0,0|0,0,1]=2 71 B9R1.6 O=C(O)C1=CC=CN=C1 HY-B0143R [1,0,0,0,0,0|0,0,1]=2 72 B9R1.6 O=C(O)C1=CC=NC=C1 HY-I0736 [1,0,0,0,0,0|2,0,0]=3 73 B9R1.6 O=C(O)C1=CC=NN=C1 HY-W002066 [1,0,0,0,0,0|1,0,1]=3 74 B9R1.6 O=C(O)C1=CCCNC1 HY-100809 [1,0,0,0,0,0|0,0,3]=4 75 B9R1.6 O=C(O)C1=CCCNC1 HY-N2482A [1,0,0,0,0,0|0,0,3]=4 76 B9R1.6 O=C(O)C1=NC=CC=N1 HY-60346 [1,0,0,0,0,0|3,0,0]=4 77 B9R1.6 O=C(O)C1=NC=CN=C1 HY-76353 [1,0,0,0,0,0|1,0,1]=3 78 B9R1.6 O=C(O)C1=NC=CN=C1 HY-76353R [1,0,0,0,0,0|1,0,1]=3 79 B9R1.6 O=C(O)C1=NC=NC=C1 HY-W002404 [1,0,0,0,0,0|3,0,0]=4 80 B9R1.6 O=[PH](O)C1=CC=CC=C1 HY-116210 [1,0,0,0,0,0|2,0,0]=3 81 B9R1.6 OB(O)C1=CC=CC=C1 HY-W001090 [1,0,0,0,0,0|2,0,1]=4 82 B9R1.6 OB(O)C1=CC=CN=C1 HY-75129 [1,0,0,0,0,0|1,0,2]=4 83 B9R1.6 [15NH2]C(=O)C1=CC=CC=C1 HY-Z0283S [1,0,0,0,0,0|2,0,0]=3 84 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 HY-W007533 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394 [0,1,0,0,0,0|1,0,1]=3 86 B11R1.3 COC1=CC=C(C(=O)O)C=C1 HY-N1394R [0,1,0,0,0,0|1,0,1]=3 87 B11R1.3 COC1=CC=C(C(C)=O)C=C1 HY-Y0024 [0,1,0,0,0,0|2,0,1]=4 88 B11R1.3 COC1=CC=C(C(N)=O)C=N1 HY-112584 [0,1,0,0,0,0|1,0,2]=4 89 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 HY-B1258 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 HY-W017382 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 HY-21496 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 HY-W017384 [0,1,0,0,0,0|1,0,1]=3 93 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 HY-W017446 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.3 O=CC1=CC=C([N+](=O)[O-])C=C1 HY-W007577 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 HY-W015175 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 HY-W001663 [0,1,0,0,0,0|2,0,1]=4 97 B11R1.21 CC(=O)C1=CC=C(O)C(O)=C1 HY-N1775 [0,1,0,0,0,0|2,0,1]=4 98 B11R1.21 CC1=CC(C(=O)O)=CC=C1O HY-W002587 [0,1,0,0,0,0|1,0,1]=3 99 B11R1.21 CC1=CC=C(C(=O)O)C=C1C HY-W017434 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.21 CC1=CC=C(C(=O)O)C=C1O HY-Y0026 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.21 CC1=[N+]([O-])C=C(C(=O)O)N=C1 HY-B0283 [0,1,0,0,0,0|2,0,1]=4 102 B11R1.21 CN1C=C(C(=O)O)C=CC1=O HY-N4226 [0,1,0,0,0,0|0,0,0]=1 103 B11R1.21 CN1C=C(C(N)=O)C=CC1=O HY-113432 [0,1,0,0,0,0|1,0,0]=2 104 B11R1.21 CN1C=C(C(N)=O)C=CC1=O HY-113432R [0,1,0,0,0,0|1,0,0]=2 105 B11R1.21 NC(=O)C1=CC(F)=C(F)C=C1 HY-Z0853 [0,1,0,0,0,0|3,0,0]=4 106 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 HY-W010224 [0,1,0,0,0,0|1,0,1]=3 107 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br HY-W008472 [0,1,0,0,0,0|2,0,0]=3 108 B11R1.21 NC1=CC=C(C(=O)O)C=C1O HY-W002114 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 HY-W018697 [0,1,0,0,0,0|2,0,0]=3 110 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 HY-W002863 [0,1,0,0,0,0|1,0,1]=3 111 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)N=C1 HY-W007398 [0,1,0,0,0,0|1,0,1]=3 112 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 HY-N0294 [0,1,0,0,0,0|1,0,1]=3 113 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 HY-N0294R [0,1,0,0,0,0|1,0,1]=3 114 B11R1.22 CC1=CC=C(C(=N)NO)C=C1 HY-W055845 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.22 CCC(=O)C1=CC=C(O)C=C1 HY-B1353 [0,1,0,0,0,0|2,0,1]=4 116 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349 [0,1,0,0,0,0|1,0,1]=3 117 B11R1.22 COC(=O)C1=CC=C(O)C=C1 HY-N0349R [0,1,0,0,0,0|1,0,1]=3 118 B11R1.22 COC(=O)C1=CN=C(C)C=C1 HY-76047 [0,1,0,0,0,0|1,0,1]=3 119 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 HY-32778 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.22 COC(=O)C1=NC=C(O)C=C1 HY-W005963 [0,1,0,0,0,0|2,0,1]=4 121 B11R1.22 C\C(=N/O)C1=CC=C(O)C=C1 HY-135325 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.22 NC1=CC=C(C(=O)O[Na])C=C1 HY-W010169 [0,1,0,0,0,0|2,0,0]=3 123 B11R1.22 NNC(=O)C1=CC=C(N)C=C1 HY-B0880 [0,1,0,0,0,0|3,0,0]=4 124 B11R1.22 O=C(CBr)C1=CC=C(F)C=C1 HY-W008598 [0,1,0,0,0,0|3,0,0]=4 125 B11R1.22 O=C(CBr)C1=CC=C(O)C=C1 HY-W002314 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.22 O=C(O[Na])C1=CC=C(O)C=C1 HY-W010164 [0,1,0,0,0,0|1,0,1]=3 127 B11R1.166 CC(=O)C1=CC=C(C)C=C1C HY-W015618 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.166 CC(=O)C1=CC=C(C)C=C1O HY-34204 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1O HY-22225 [0,1,0,0,0,0|3,0,0]=4 130 B11R1.166 CC(=O)C1=CC=C(O)C=C1C HY-W010254 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.166 CC(=O)C1=CC=C(O)C=C1O HY-Y0694 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.166 CC1=CC(Br)=CC=C1C(=O)O HY-W004863 [0,1,0,0,0,0|2,0,0]=3 133 B11R1.166 CC1=CC=C(C(=O)O)C(O)=C1 HY-78144 [0,1,0,0,0,0|2,0,0]=3 134 B11R1.166 NC1=C([N+](=O)[O-])C=CC(=O)N1 HY-50071 [0,1,0,0,0,0|1,0,1]=3 135 B11R1.166 NC1=CC(Br)=CC=C1C(=O)O HY-W003093 [0,1,0,0,0,0|2,0,0]=3 136 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 HY-W007847 [0,1,0,0,0,0|2,0,0]=3 137 B11R1.166 NC1=CC=C(C(=O)O)C(Cl)=C1 HY-W016925 [0,1,0,0,0,0|2,0,0]=3 138 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-B1048 [0,1,0,0,0,0|2,0,0]=3 139 B11R1.166 NC1=CC=C(C(=O)O)C(O)=C1 HY-I0447 [0,1,0,0,0,0|2,0,0]=3 140 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 HY-W016769 [0,1,0,0,0,0|2,0,0]=3 141 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 HY-W002068 [0,1,0,0,0,0|2,0,0]=3 142 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 HY-W016867 [0,1,0,0,0,0|2,0,0]=3 143 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 HY-W008186 [0,1,0,0,0,0|2,0,0]=3 144 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 HY-W012575 [0,1,0,0,0,0|1,0,1]=3 145 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl HY-W002323 [0,1,0,0,0,0|1,0,1]=3 146 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl HY-W002553 [0,1,0,0,0,0|1,0,1]=3 147 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 HY-66047 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.166 O=C1NC=C([N+](=O)[O-])C(=O)N1 HY-W017265 [0,1,0,0,0,0|2,0,1]=4 149 B9R1.35 CC(=O)C1=CC=C(C)S1 HY-W002097 [0,0,0,0,1,0|3,0,0]=4 150 B9R1.35 CN1C=CC(C(=O)O)=N1 HY-34603 [0,0,0,0,1,0|2,0,1]=4 151 B9R1.35 O=C(O)C1=CC=C(Br)S1 HY-30133 [0,0,0,0,1,0|2,0,0]=3 152 B9R1.35 O=C(O)C1=CC=C(Cl)S1 HY-76835 [0,0,0,0,1,0|2,0,0]=3 153 B9R1.35 O=C(O)C1=CN=C(Br)S1 HY-33287 [0,0,0,0,1,0|2,0,1]=4 154 B9R1.35 O=C1CCC(C(=O)O)N1 HY-W012738 [0,0,0,0,1,0|0,0,3]=4 155 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082 [0,0,0,0,1,0|0,0,3]=4 156 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 HY-76082R [0,0,0,0,1,0|0,0,3]=4 157 B9R1.35 O=C1CC[C@H](C(=O)O)N1 HY-W002304 [0,0,0,0,1,0|0,0,3]=4 158 B9R1.35 O=C1N[C@H](C(=O)O)CS1 HY-133105 [0,0,0,0,1,0|1,0,2]=4 159 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005 [0,0,0,0,0,1|2,0,1]=4 160 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005R [0,0,0,0,0,1|2,0,1]=4 161 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 HY-30267 [0,0,0,0,0,1|2,0,1]=4 162 B11R1.20 NC(=O)NC1=CC=C(Cl)C=C1 HY-129973 [0,0,0,0,0,1|3,0,0]=4 163 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 HY-75476 [0,0,0,0,0,1|2,0,0]=3 164 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 HY-W010062 [0,0,0,0,0,1|2,0,0]=3 165 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 HY-N1902 [0,0,0,0,0,1|1,0,1]=3 166 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 HY-N1902R [0,0,0,0,0,1|1,0,1]=3 167 B8R0.28 O=C(O)\C=C\CC(=O)O HY-W073501 [1,0,1,0,0,0|1,0,1]=4 168 B8R0.28 O=C(O)\C=C\CC(=O)O HY-W073501A [1,0,1,0,0,0|1,0,1]=4 169 B8R1.2 O=NC1=CC=CC=C1 HY-121641 [2,0,0,0,0,0|2,0,0]=4 170 B8R1.2 O=[As]C1=CC=CC=C1 HY-131901 [2,0,0,0,0,0|2,0,0]=4 171 B8R1.2 OCC1=CC=CC=C1 HY-B0892 [2,0,0,0,0,0|1,0,1]=4 172 B8R1.2 OCC1=CC=CC=C1 HY-B0892R [2,0,0,0,0,0|1,0,1]=4 173 B8R1.2 OCC1=CC=CN=C1 HY-B0893 [2,0,0,0,0,0|0,0,2]=4 174 B8R1.3 CC1=CNC(=O)C=C1 HY-W010566 [2,0,0,0,0,0|0,0,1]=3 175 B8R1.3 O=C1C=CC(=O)NN1 HY-59354 [2,0,0,0,0,0|1,0,0]=3 176 B8R1.3 O=C1C=CC(Br)=CN1 HY-59165 [2,0,0,0,0,0|1,0,0]=3 177 B8R1.3 O=C1C=CC(Cl)=CN1 HY-W008822 [2,0,0,0,0,0|1,0,0]=3 178 B10R1.3 CCC1=CC=C(C=O)C=C1 HY-W012657 [1,1,0,0,0,0|2,0,0]=4 179 B10R1.3 COC1=CC=C(C=O)C=C1 HY-Y0740 [1,1,0,0,0,0|1,0,1]=4 180 B10R1.3 COC1=CC=C(C=O)C=N1 HY-32788 [1,1,0,0,0,0|0,0,2]=4 181 B10R1.3 O=CC1=CC=C(C=O)C=C1 HY-Y0425 [1,1,0,0,0,0|1,0,0]=3 182 B10R1.25 CC1=CC=C(C=O)C(O)=C1 HY-W007888 [1,1,0,0,0,0|2,0,0]=4 183 B10R1.25 NC1=C(C=O)C=NC(=O)N1 HY-126181 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.25 O=C1NC=C(CO)C(=O)N1 HY-W004924 [1,1,0,0,0,0|1,0,1]=4 185 B10R1.25 O=CC1=C(F)C=C(F)C=C1 HY-W007410 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.25 O=CC1=CC=C(Br)C=C1O HY-W001114 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.25 O=CC1=CC=C(O)C=C1O HY-W007539 [1,1,0,0,0,0|1,0,1]=4 188 B10R1.25 O=CC1=CNC(=O)NC1=O HY-W013644 [1,1,0,0,0,0|1,0,0]=3 189 B10R1.176 O=CC1=CC(F)=C(Br)C=C1 HY-W007518 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.176 O=CC1=CC=C(O)C(O)=C1 HY-N0295 [1,1,0,0,0,0|1,0,1]=4 191 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-135848 [1,1,0,0,0,0|2,0,0]=4 192 B10R1.15 CNC(=O)C1=CC=CC=C1 HY-KE7004 [1,1,0,0,0,0|2,0,0]=4 193 B10R1.15 CNC(=O)C1=CC=CN=C1 HY-124124 [1,1,0,0,0,0|1,0,1]=4 194 B10R1.15 COC(=O)C1=CC=CC=N1 HY-W005458 [1,1,0,0,0,0|2,0,0]=4 195 B10R1.15 N=C(NO)C1=CN=CC=C1 HY-W015805 [1,1,0,0,0,0|1,0,1]=4 196 B10R1.15 NNC(=O)C1=CC=CN=C1 HY-W012617 [1,1,0,0,0,0|1,0,1]=4 197 B10R1.15 O=C(NO)C1=CC=CC=C1 HY-Y1058 [1,1,0,0,0,0|1,0,0]=3 198 B10R1.15 O=C(O[K])C1=CC=CC=C1 HY-W103932 [1,1,0,0,0,0|1,0,0]=3 199 B10R1.15 O=C(O[Na])C1=CC=CC=C1 HY-Y1316 [1,1,0,0,0,0|1,0,0]=3 200 B10R1.15 O=S(O[Na])C1=CC=CC=C1 HY-W013598 [1,1,0,0,0,0|2,0,0]=4 201 B10R1.15 [Li]OC(=O)C1=CC=CC=C1 HY-N0216A [1,1,0,0,0,0|1,0,0]=3 202 B10R1.28 O=P(O)(O)C1=CC=CC=C1 HY-W087962 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.28 O=S(=O)(O)C1=CC=CN=C1 HY-W015467 [1,1,0,0,0,0|1,0,1]=4 204 B10R1.61 CC(=O)C1=CC=CC=C1Br HY-W007689 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.61 CC(=O)C1=CC=CC=C1F HY-Y1133 [1,1,0,0,0,0|2,0,0]=4 206 B10R1.61 CC(=O)C1=CC=CC=C1N HY-I0501R [1,1,0,0,0,0|2,0,0]=4 207 B10R1.61 CC(=O)C1=CC=CC=C1O HY-Y1426 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.61 CC1=CC=CC=C1C(=O)O HY-41494 [1,1,0,0,0,0|1,0,0]=3 209 B10R1.61 NC(=O)C1=CC=CC=C1O HY-B0811 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.61 NC1=C(C(=O)O)C=CN=C1 HY-65257 [1,1,0,0,0,0|2,0,0]=4 211 B10R1.61 NC1=CC=NC=C1C(=O)O HY-W002555 [1,1,0,0,0,0|0,0,1]=3 212 B10R1.61 NC1=NC=CN=C1C(=O)O HY-Y1702 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.61 O=C(O)C1=C(Cl)N=CC=C1 HY-W017249 [1,1,0,0,0,0|0,0,1]=3 214 B10R1.61 O=C(O)C1=C(S)C=CC=C1 HY-Y0102 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.61 O=C(O)C1=CC=CC=C1F HY-Y1115 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.61 O=C(O)C1=CC=CC=C1I HY-77433 [1,1,0,0,0,0|1,0,0]=3 217 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167 [1,1,0,0,0,0|1,0,0]=3 218 B10R1.61 O=C(O)C1=CC=CC=C1O HY-B0167R [1,1,0,0,0,0|1,0,0]=3 219 B10R1.61 O=C(O)C1=NC=CC=C1O HY-Y0030 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.61 O=C(O)C1=NC=CC=C1O HY-Y0030A [1,1,0,0,0,0|2,0,0]=4 221 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 HY-W014915 [1,1,0,0,0,0|1,0,1]=4 222 B10R1.113 CC(=O)C1=CC(N)=CC=C1 HY-W012637 [1,1,0,0,0,0|2,0,0]=4 223 B10R1.113 CC(=O)C1=CC=CC(O)=C1 HY-Y0603 [1,1,0,0,0,0|2,0,0]=4 224 B10R1.113 CC1=CC(C(=O)O)=CC=C1 HY-78571 [1,1,0,0,0,0|1,0,0]=3 225 B10R1.113 CC1=CC=CC(C(=O)O)=N1 HY-W002139 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.113 C[N+]1=CC(C(=O)O)=CC=C1 HY-N0415 [1,1,0,0,0,0|0,0,1]=3 227 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 HY-113527 [1,1,0,0,0,0|1,0,1]=4 228 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 HY-113527R [1,1,0,0,0,0|1,0,1]=4 229 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 HY-W009418 [1,1,0,0,0,0|1,0,1]=4 230 B10R1.113 NC(=O)C1=CC=CC(N)=C1 HY-12022 [1,1,0,0,0,0|2,0,0]=4 231 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 HY-101407 [1,1,0,0,0,0|1,0,1]=4 232 B10R1.113 NC1=CC(C(=O)O)=CC=C1 HY-I0746 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.113 NC1=CC=CC(C(=O)O)=N1 HY-W002540 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.113 NC1C=CC=C(C(=O)O)C1 HY-15377 [1,1,0,0,0,0|1,0,1]=4 235 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 HY-Y1013 [1,1,0,0,0,0|0,0,1]=3 236 B10R1.113 O=C(O)C1=CC(F)=CC=C1 HY-W015753 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.113 O=C(O)C1=CC(O)=CC=C1 HY-W004049 [1,1,0,0,0,0|1,0,0]=3 238 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 HY-Y0403 [1,1,0,0,0,0|1,0,0]=3 239 B10R1.113 O=C(O)C1=CC=CC(I)=C1 HY-Y0931 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.113 O=C(O)C1=CC=NC(Br)=C1 HY-W002805 [1,1,0,0,0,0|2,0,0]=4 241 B10R1.113 O=C(O)C1=CC=NC(Cl)=C1 HY-65003 [1,1,0,0,0,0|2,0,0]=4 242 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=C1 HY-B1061 [1,1,0,0,0,0|0,0,1]=3 243 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 HY-W004860 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.113 O=C1C=C(C(=O)O)C=CN1 HY-W002765 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.31 O=C(O)C1=CC=C(CO)O1 HY-W005241 [0,1,0,0,1,0|1,0,1]=4 246 B10R1.58 CC1=CC(C(=O)O)=NN1C HY-W004978 [0,1,0,0,1,0|2,0,0]=4 247 B12R1.4 CC(=O)NC1=CC=C(C=O)C=C1 HY-W067445 [0,1,0,0,0,1|2,0,0]=4 248 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 HY-W004206 [0,1,0,0,0,1|1,0,1]=4 249 B12R1.4 O=C(O)CC1=CC=C(CO)C=C1 HY-W004128 [0,1,0,0,0,1|1,0,1]=4 250 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 HY-W001080 [0,1,0,0,0,1|1,0,1]=4 251 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 HY-W001080R [0,1,0,0,0,1|1,0,1]=4 252 B12R1.19 O=C(O)CC1=CC=C(O)C(Cl)=C1 HY-W001146 [0,1,0,0,0,1|1,0,1]=4 253 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 HY-W067425 [0,1,0,0,0,1|1,0,1]=4 254 B12R1.20 CC1=CC=C(C(N)C(=O)O)C=C1 HY-W006187 [0,1,0,0,0,1|2,0,0]=4 255 B12R1.20 NC(C(=O)O)C1=CC=C(Cl)C=C1 HY-W002237 [0,1,0,0,0,1|2,0,0]=4 256 B12R1.20 NC(C(=O)O)C1=CC=C(O)C=C1 HY-W005226 [0,1,0,0,0,1|1,0,1]=4 257 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(F)C=C1 HY-W051418 [0,1,0,0,0,1|2,0,0]=4 258 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 HY-34588 [0,1,0,0,0,1|1,0,1]=4 259 B12R1.20 N[C@H](C(=O)O)C1=CC=C(F)C=C1 HY-W002519 [0,1,0,0,0,1|2,0,0]=4 260 B12R1.20 N[C@H](C(=O)O)C1=CC=C(O)C=C1 HY-W018026 [0,1,0,0,0,1|1,0,1]=4 261 B12R1.20 [C@@H](N)(C(=O)O)C1=CC=C(Cl)C=C1 HY-W005720 [0,1,0,0,0,1|2,0,0]=4 262 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084 [0,1,0,0,0,1|1,0,1]=4 263 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 HY-W001084R [0,1,0,0,0,1|1,0,1]=4 264 B12R1.5 C(=O)C1=CC=C(C(=O)OC)C=C1 HY-78000 [0,2,0,0,0,0|1,0,0]=3 265 B12R1.5 C=CC1=CC=C(C(=O)OC)C=C1 HY-W008542 [0,2,0,0,0,0|2,0,0]=4 266 B12R1.5 CCC1=CC=C(C(=O)OC)C=C1 HY-W099871 [0,2,0,0,0,0|2,0,0]=4 267 B12R1.5 COC(=O)C1=CC=C(OC)C=C1 HY-W015342 [0,2,0,0,0,0|1,0,1]=4 268 B12R1.5 COC(=O)C1=CC=C(O[Na])C=C1 HY-W016806 [0,2,0,0,0,0|1,0,1]=4 269 B12R1.48 COC1=C(O)C=C(C(=O)O)C=C1 HY-N6864 [0,2,0,0,0,0|1,0,1]=4 270 B12R1.48 COC1=CC=C(C(=O)O)C=C1C HY-59384 [0,2,0,0,0,0|1,0,1]=4 271 B12R1.256 CC(=O)C1=CC=C(C(=O)O)C=C1 HY-W001939 [0,2,0,0,0,0|1,0,0]=3 272 B12R1.256 CC(=O)C1=CC=C([N+](=O)[O-])C=C1 HY-Y0185 [0,2,0,0,0,0|2,0,0]=4 273 B12R1.256 CC(C)C1=CC=C(C(=O)O)C=C1 HY-W013571 [0,2,0,0,0,0|2,0,0]=4 274 B12R1.256 O=C(O)C1=CC=C(B(O)O)C=C1 HY-75102 [0,2,0,0,0,0|1,0,1]=4 275 B12R1.256 O=C(O)C1=CC=C(C(=O)O)C=C1 HY-W010098 [0,2,0,0,0,0|1,0,0]=3 276 B12R1.256 O=C(O)C1=CC=C(C(=O)O)C=C1 HY-W010098R [0,2,0,0,0,0|1,0,0]=3 277 B12R1.256 O=C(O)C1=CC=C([N+](=O)[O-])C=C1 HY-Y0607 [0,2,0,0,0,0|1,0,0]=3 278 B12R1.256 O=C(O)C1=CN=C(C(=O)O)C=C1 HY-W012523 [0,2,0,0,0,0|0,0,1]=3 279 B12R1.256 O=[13C](O)C1=CC=C([13C](=O)O)C=C1 HY-W010098S1 [0,2,0,0,0,0|1,0,0]=3 280 B12R1.452 COC1=CC(O)=C(C(=O)O)C=C1 HY-75625 [0,2,0,0,0,0|1,0,1]=4 281 B12R1.56 COC1=CC(C(=O)O)=CC=C1N HY-75577 [0,2,0,0,0,0|2,0,0]=4 282 B12R1.56 COC1=CC(C(=O)O)=CC=C1O HY-N0708 [0,2,0,0,0,0|1,0,1]=4 283 B12R1.56 COC1=CC(C(=O)O)=CC=C1O HY-N0708R [0,2,0,0,0,0|1,0,1]=4 284 B12R1.232 O=C(O)C1=C(Cl)N=C(Cl)C(F)=C1 HY-W002688 [0,2,0,0,0,0|1,0,1]=4 285 B12R1.232 O=C(O)C1=CC(F)=C(F)C=C1Br HY-W012149 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.367 COC(=O)C1=CC(N)=C(O)C=C1 HY-W005637 [0,2,0,0,0,0|1,0,1]=4 287 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 HY-W002375 [0,2,0,0,0,0|2,0,0]=4 288 B12R1.367 COC(=O)C1=CC=C(O)C(O)=C1 HY-Z0548 [0,2,0,0,0,0|1,0,1]=4 289 B12R1.367 O=C(NO)C1=CC=C(O)C(O)=C1 HY-19387 [0,2,0,0,0,0|1,0,1]=4 290 B12R1.893 O=C(O)C1=C(O)C(O)=C(O)C=C1 HY-W016993 [0,2,0,0,0,0|1,0,1]=4 291 B12R1.1005 O=C(O)C1=CC(I)=C(O)C(I)=C1 HY-W011013 [0,2,0,0,0,0|1,0,1]=4 292 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 HY-N0523 [0,2,0,0,0,0|1,0,1]=4 293 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 HY-N0523A [0,2,0,0,0,0|1,0,1]=4 294 B12R1.1005 O=C(O)C1=CC(O)=C(O)C(O)=C1 HY-N0523AR [0,2,0,0,0,0|1,0,1]=4 295 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258 [0,2,0,0,0,0|2,0,0]=4 296 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258A [0,2,0,0,0,0|2,0,0]=4 297 B12R1.16 CCOC(=O)C1=CC=C(N)C=C1 HY-Y0258R [0,2,0,0,0,0|2,0,0]=4 298 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HY-B0934 [0,2,0,0,0,0|1,0,1]=4 299 B12R1.16 CCOC(=O)C1=CC=C(O)C=C1 HY-B0934R [0,2,0,0,0,0|1,0,1]=4 300 B12R1.1703 COC(=O)C1=C(Br)C=C(Cl)N=C1 HY-W022073 [0,2,0,0,0,0|1,0,1]=4 301 B12R1.1703 COC(=O)C1=C(O)C=C(O)C=C1 HY-W010076 [0,2,0,0,0,0|1,0,1]=4 302 B12R1.1703 NC1=CC(O)=C(C(=O)O[Na])C=C1 HY-I0447A [0,2,0,0,0,0|2,0,0]=4 303 B12R1.1000 CC1=C(C(=O)O)C(O)=CC(O)=C1 HY-N3126 [0,2,0,0,0,0|1,0,1]=4 304 B12R1.1000 O=C(O)C1=C(O)C=C(O)C=C1O HY-W077292 [0,2,0,0,0,0|1,0,1]=4 305 B12R2.606 O=C1OC2=CC(O)=CC=C2S1 HY-B0483 [0,0,0,1,0,1|1,0,1]=4 306 B12R2.612 O=C1OCC2=CC(Br)=CC=C12 HY-W007667 [0,1,0,1,0,0|2,0,0]=4 307 B8R0.23 C=C(CC(=O)O)C(=O)O HY-Y0520 [0,0,1,0,1,0|1,0,1]=4 308 B8R0.23 C=C(CC(=O)O)C(=O)O HY-Y0520R [0,0,1,0,1,0|1,0,1]=4 309 B8R0.23 C\C(=C/C(=O)O)C(=O)O HY-78036 [0,0,1,0,1,0|1,0,1]=4 310 B8R0.23 C\C(=C\C(=O)O)C(=O)O HY-113298 [0,0,1,0,1,0|1,0,1]=4 311 B8R1.1 CC1=CC=C(C=O)O1 HY-Y0543 [1,0,0,0,1,0|2,0,0]=4 312 B8R1.1 CC1=CC=C(C=O)S1 HY-34465 [1,0,0,0,1,0|2,0,0]=4 313 B8R1.1 O=CC1=CC=C(Br)S1 HY-59174 [1,0,0,0,1,0|2,0,0]=4 314 B8R1.1 O=CC1=CC=C(Cl)S1 HY-W002227 [1,0,0,0,1,0|2,0,0]=4 315 B8R1.7 CC(=O)C1=CC=CO1 HY-W015912 [1,0,0,0,1,0|2,0,0]=4 316 B8R1.7 CC(=O)C1=CC=CS1 HY-20585 [1,0,0,0,1,0|2,0,0]=4 317 B8R1.7 CC(=O)C1=CSC=C1 HY-W007361 [1,0,0,0,1,0|2,0,0]=4 318 B8R1.7 O=C(O)C1=CC=CO1 HY-W012946 [1,0,0,0,1,0|1,0,0]=3 319 B8R1.7 O=C(O)C1=CC=NS1 HY-W042027 [1,0,0,0,1,0|1,0,1]=4 320 B8R1.7 O=C(O)C1=CN=CN1 HY-W007695 [1,0,0,0,1,0|1,0,0]=3 321 B8R1.7 O=C(O)C1=COC=C1 HY-21075 [1,0,0,0,1,0|1,0,0]=3 322 B8R1.7 O=C(O)C1=CSC=C1 HY-W004615 [1,0,0,0,1,0|1,0,0]=3 323 B8R1.7 O=C(O)C1=CSC=N1 HY-59320 [1,0,0,0,1,0|1,0,1]=4 324 B8R1.7 O=C(O)C1=NNC=C1 HY-W002328 [1,0,0,0,1,0|1,0,0]=3 325 B8R1.7 O=C(O)[C@@H]1C=CCN1 HY-W015897 [1,0,0,0,1,0|0,0,2]=4 326 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733 [1,0,0,0,0,1|2,0,0]=4 327 B10R1.18 CC(=O)OC1=CC=CC=C1 HY-128733R [1,0,0,0,0,1|2,0,0]=4 328 B10R1.18 NC(=O)CC1=CC=CC=C1 HY-W018197 [1,0,0,0,0,1|2,0,0]=4 329 B10R1.18 NC(=O)NC1=CC=CC=C1 HY-W017044 [1,0,0,0,0,1|2,0,0]=4 330 B10R1.18 O=C(O)CC1=CC=CC=N1 HY-W016825 [1,0,0,0,0,1|2,0,0]=4 331 B10R1.18 O=C(O)CC1=CC=CN=C1 HY-W004515 [1,0,0,0,0,1|0,0,1]=3 332 B10R1.18 O=C(O)CC1=CN=CC=C1 HY-W015806 [1,0,0,0,0,1|0,0,1]=3 333 B12R1.21 C(C(=O)O)=CC1=CC=C(C)C=C1 HY-W015399 [0,0,0,0,0,2|2,0,0]=4 334 B12R1.21 O=C(O)CCC1=CC=C(F)C=C1 HY-W028185 [0,0,0,0,0,2|2,0,0]=4 335 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 HY-W015346 [0,0,0,0,0,2|1,0,1]=4 336 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 HY-W141885 [0,0,0,0,0,2|1,0,1]=4 337 B12R1.21 O=C(O)COC1=CC=C(Cl)C=C1 HY-19698 [0,0,0,0,0,2|2,0,0]=4 338 B12R1.21 O=C(O)COC1=CC=C(F)C=C1 HY-W052234 [0,0,0,0,0,2|2,0,0]=4 339 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 HY-Y0729 [0,0,0,0,0,2|2,0,0]=4 340 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 HY-N0351 [0,0,0,0,0,2|1,0,1]=4 341 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 HY-N0351R [0,0,0,0,0,2|1,0,1]=4 342 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 HY-N2391 [0,0,0,0,0,2|1,0,1]=4