0 B11R1.21 C1=CC(=C(C=C1B(O)O)Cl)Cl LN00118281 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Br LN00009079 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.21 C1=CC(=C(C=C1[N+](=O)[O-])I)N LN00009890 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O LN01360918 [0,0,0,0,0,0|2,0,0]=2 4 B11R1.21 CC(=O)C1=CC(F)=C(O)C=C1 AC180895 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 AC511644 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.21 CC(=O)C1=CC=C(F)C(F)=C1 AC511682 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.21 CC(=O)C1=CC=C(O)C(C)=C1 AC160576 [0,0,0,0,0,0|2,0,0]=2 8 B11R1.21 CC(C)C1=CC(C)=C(O)C=C1 AC060016 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.21 CC1=C(Br)C=C(C=C1)[N+]([O-])=O AC511797 [0,0,0,0,0,0|3,0,1]=4 10 B11R1.21 CC1=C(Br)C=CC(=C1)C(O)=O AC180420 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.21 CC1=C(C=C(C=C1)C(=O)Cl)I LN01356961 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I LN00009376 [0,0,0,0,0,0|2,0,0]=2 13 B11R1.21 CC1=C(C=C(C=N1)C(=O)O)Br LN01322628 [0,0,0,0,0,0|3,0,0]=3 14 B11R1.21 CC1=C(F)C=C(C=C1)C(O)=O AC180041 [0,0,0,0,0,0|2,0,0]=2 15 B11R1.21 CC1=C(F)C=CC(=C1)C(O)=O AC510753 [0,0,0,0,0,0|2,0,0]=2 16 B11R1.21 CC1=CC(=CC=C1F)B(O)O AC090059 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.21 CC1=CC(=CC=C1O)C(O)=O AC180983 [0,0,0,0,0,0|1,0,0]=1 18 B11R1.21 CC1=CC(=CN=C1O)C(=O)O LN00279505 [0,0,0,0,0,0|2,0,0]=2 19 B11R1.21 CC1=CC(=NC=C1Br)C(O)=O AC182131 [0,0,0,0,0,0|3,0,0]=3 20 B11R1.21 CC1=CC=C(C=C1Br)C(O)=O AC511792 [0,0,0,0,0,0|2,0,0]=2 21 B11R1.21 CC1=CC=C(C=C1C)B(O)O AC090180 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.21 CC1=CC=C(C=C1O)[N+]([O-])=O AC511728 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.21 CC1=NC=C(C=C1Br)C(O)=O AC050264 [0,0,0,0,0,0|3,0,0]=3 24 B11R1.21 CC1=[N+]([O-])C=C(N=C1)C(O)=O HY-B0283 [0,0,0,0,0,0|3,0,1]=4 25 B11R1.21 FC1=C(F)C=C(C=C1)C(Cl)=O AC021119 [0,0,0,0,0,0|3,0,0]=3 26 B11R1.21 NC1=C(Br)C=CC(=C1)[N+]([O-])=O AC180505 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.21 NC1=C(F)C=C(C=C1)[N+]([O-])=O AC180397 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.21 NC1=C(F)C=CC(=C1)[N+]([O-])=O AC511683 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.21 NC1=C(N)C=C(C=C1)C(O)=O AC200130 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.21 NC1=CC=C(C=C1F)C(O)=O AC511703 [0,0,0,0,0,0|2,0,0]=2 31 B11R1.21 NC1=CC=C(C=C1O)C(O)=O AC180334 [0,0,0,0,0,0|1,0,0]=1 32 B11R1.21 OB(O)C1=CC(Cl)=C(F)C=C1 AC511508 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.21 OB(O)C1=CC(Cl)=C(O)C=C1 AC511884 [0,0,0,0,0,0|2,0,1]=3 34 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 AC070113 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.21 OB(O)C1=CC(F)=C(F)C=C1 AC181124 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 AC500215 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.21 OC(=O)C1=CC(Br)=C(F)C=C1 AC511159 [0,0,0,0,0,0|2,0,0]=2 38 B11R1.21 OC(=O)C1=CC(Cl)=C(Cl)N=C1 AC510765 [0,0,0,0,0,0|3,0,0]=3 39 B11R1.21 OC(=O)C1=CC(Cl)=C(F)C=C1 AC511282 [0,0,0,0,0,0|2,0,0]=2 40 B11R1.21 OC(=O)C1=CC(F)=C(Cl)N=C1 AC010390 [0,0,0,0,0,0|3,0,0]=3 41 B11R1.21 OC(=O)C1=CC(F)=C(I)C=C1 AC182155 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.21 OC(=O)C1=CC=C(Br)C(F)=C1 AC181079 [0,0,0,0,0,0|2,0,0]=2 43 B11R1.21 OC(=O)C1=CC=C(Br)C(O)=C1 AC182195 [0,0,0,0,0,0|1,0,0]=1 44 B11R1.21 OC(=O)C1=CC=C(Cl)C(O)=C1 AC511937 [0,0,0,0,0,0|1,0,0]=1 45 B11R1.21 OC(=O)C1=CC=C(I)C(O)=C1 AC131761 [0,0,0,0,0,0|1,0,0]=1 46 B11R1.21 OC(=O)C1=CC=C(O)C(O)=C1 HY-N0294 [0,0,0,0,0,0|0,0,0]=0 47 B11R1.21 OC(=O)C1=CN=C(Cl)C(Br)=C1 AC181372 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.21 OC(=O)C1=CN=C(O)C(Cl)=C1 AC180523 [0,0,0,0,0,0|2,0,0]=2 49 B11R1.21 OC(=O)C1=CNC(=O)C(Br)=C1 AC182236 [0,0,0,0,0,0|2,0,1]=3 50 B11R1.21 OC(=O)C1=NC(Br)=C(F)C=C1 AC020158 [0,0,0,0,0,0|3,0,0]=3 51 B11R1.21 OC1=C(F)C=C(C=C1)[N+]([O-])=O AC511058 [0,0,0,0,0,0|2,0,1]=3 52 B11R1.21 OC1=CC=C(C=C1Br)[N+]([O-])=O AC511741 [0,0,0,0,0,0|2,0,1]=3 53 B11R1.21 OC1=NC=C(C=C1Br)[N+]([O-])=O AC181734 [0,0,0,0,0,0|3,0,1]=4 54 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(Br)=C1 AC511549 [0,0,0,0,0,0|3,0,1]=4 55 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(F)=C1 AC180892 [0,0,0,0,0,0|3,0,1]=4 56 B11R1.21 [O-][N+](=O)C1=CC=C(Cl)C(I)=C1 AC021173 [0,0,0,0,0,0|3,0,1]=4 57 B11R1.21 [O-][N+](=O)C1=CC=C(F)C(Br)=C1 AC130403 [0,0,0,0,0,0|3,0,1]=4 58 B10R1.13 C1=C(C=CC(=C1)Br)B(O)O LN00159009 [1,0,0,0,0,0|2,0,1]=4 59 B10R1.13 C1=C(C=CC(=C1)I)B(O)O LN00008579 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.13 C1=C(C=CC(=C1)O)B(O)O LN00138842 [1,0,0,0,0,0|1,0,1]=3 61 B10R1.13 C1=CC(=NC=C1Br)C(=O)O LN00009289 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 C1=NC(=CN=C1C(=O)O)Br LN00171312 [1,0,0,0,0,0|3,0,0]=4 63 B10R1.13 C1=NC(=CN=C1C(=O)O)N LN00159244 [1,0,0,0,0,0|3,0,0]=4 64 B10R1.13 CC(=O)C1=CC=C(Br)N=C1 AC511499 [1,0,0,0,0,0|3,0,0]=4 65 B10R1.13 CC(=O)C1=CC=C(C)C=C1 AC511479 [1,0,0,0,0,0|2,0,0]=3 66 B10R1.13 CC(=O)C1=CC=C(Cl)N=C1 AC181609 [1,0,0,0,0,0|3,0,0]=4 67 B10R1.13 CC(=O)C1=CC=C(F)N=C1 AC182130 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 CC(=O)C1=CC=C(N)C=C1 AC510510 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.13 CC(=O)C1=CC=C(O)C=C1 AC190210 [1,0,0,0,0,0|1,0,0]=2 70 B10R1.13 CC(=O)C1=CC=C(O)N=C1 AC182574 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.13 CC(=O)C1=CN=C(C=C1)Br LN00170457 [1,0,0,0,0,0|3,0,0]=4 72 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 AC181883 [1,0,0,0,0,0|3,0,0]=4 73 B10R1.13 CC1=CC=C(C=C1)B(O)O AC500015 [1,0,0,0,0,0|2,0,1]=4 74 B10R1.13 CC1=CC=C(C=C1)C(O)=O AC190159 [1,0,0,0,0,0|1,0,0]=2 75 B10R1.13 CC1=CC=C(C=C1)S([O-])=O AC510965 [1,0,0,0,0,0|2,0,1]=4 76 B10R1.13 CC1=CN=C(C=C1)C(O)=O AC181304 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.13 CC1=NC=C(C=N1)C(=O)O LN00156992 [1,0,0,0,0,0|3,0,0]=4 78 B10R1.13 CC1=NN=C(C=C1)C(O)=O AC182475 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.13 CN(C)C1=CC=C(C=C1)O LN00220688 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.13 NC(=N)C1=CC=C(Br)C=C1 AC181036 [1,0,0,0,0,0|3,0,0]=4 81 B10R1.13 NC(=N)C1=CC=C(Cl)C=C1 AC180714 [1,0,0,0,0,0|3,0,0]=4 82 B10R1.13 NC(=N)C1=CC=C(N)C=C1 AC511622 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 AC190321 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.13 NC(=O)C1=CC=C(F)C=C1 AC511804 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.13 NC(=S)C1=CC=C(Cl)C=C1 AC180441 [1,0,0,0,0,0|2,1,0]=4 86 B10R1.13 NC1=CC=C(C=C1)B(O)O AC090205 [1,0,0,0,0,0|2,0,1]=4 87 B10R1.13 NC1=CC=C(C=C1)C(O)=O HY-B1008 [1,0,0,0,0,0|1,0,0]=2 88 B10R1.13 NC1=CC=C(N=C1)C(O)=O AC181509 [1,0,0,0,0,0|2,0,0]=3 89 B10R1.13 NC1=NC=C(C=N1)C(O)=O AC181924 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.13 NC1=NN=C(C=C1)C(O)=O AC181995 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.13 OB(O)C1=CC=C(Br)C=C1 AC500010 [1,0,0,0,0,0|2,0,1]=4 92 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 AC180418 [1,0,0,0,0,0|2,0,1]=4 93 B10R1.13 OB(O)C1=CC=C(F)C=C1 AC180417 [1,0,0,0,0,0|2,0,1]=4 94 B10R1.13 OB(O)C1=CC=C(I)C=C1 AC181226 [1,0,0,0,0,0|2,0,1]=4 95 B10R1.13 OB(O)C1=CC=C(O)C=C1 AC181172 [1,0,0,0,0,0|1,0,1]=3 96 B10R1.13 OB(O)C1=CC=C(O)N=C1 AC190026 [1,0,0,0,0,0|2,0,1]=4 97 B10R1.13 OC(=O)C1=CC=C(Br)C=N1 AC180939 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.13 OC(=O)C1=CC=C(Br)N=C1 AC181373 [1,0,0,0,0,0|2,0,0]=3 99 B10R1.13 OC(=O)C1=CC=C(Cl)N=C1 AC180144 [1,0,0,0,0,0|2,0,0]=3 100 B10R1.13 OC(=O)C1=CC=C(F)N=C1 AC512097 [1,0,0,0,0,0|2,0,0]=3 101 B10R1.13 OC(=O)C1=CC=C(I)C=C1 AC510881 [1,0,0,0,0,0|1,0,0]=2 102 B10R1.13 OC(=O)C1=CC=C(O)C=C1 AC190218 [1,0,0,0,0,0|0,0,0]=1 103 B10R1.13 OC(=O)C1=CC=C(O)C=N1 AC181066 [1,0,0,0,0,0|1,0,0]=2 104 B10R1.13 OC(=O)C1=CC=C(O)N=C1 AC180148 [1,0,0,0,0,0|1,0,0]=2 105 B10R1.13 OC(=O)C1=NC=C(Br)C=N1 AC511903 [1,0,0,0,0,0|3,0,0]=4 106 B10R1.13 OC(=O)C1=NC=C(Cl)C=C1 AC510981 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.13 OC(=O)C1=NC=C(F)C=C1 AC181804 [1,0,0,0,0,0|2,0,0]=3 108 B10R1.13 OC(=O)C1=NC=C(O)N=C1 HY-76210 [1,0,0,0,0,0|2,0,0]=3 109 B10R1.13 OC(=O)C1=NN=C(Cl)C=C1 AC511081 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.13 OC1=CC=C(C=C1)C(F)F AC512172 [1,0,0,0,0,0|2,0,1]=4 111 B10R1.13 [O-][N+](=O)C1=CC=C(F)C=C1 AC500316 [1,0,0,0,0,0|2,0,1]=4 112 B10R1.113 C1=C(C=NC=C1C(=O)O)Cl LN00003135 [1,0,0,0,0,0|2,0,0]=3 113 B10R1.113 C1=CC(=CC(=C1)F)B(O)O LN00116374 [1,0,0,0,0,0|2,0,1]=4 114 B10R1.113 C1=CC(=NC(=C1)Br)C(=O)O LN00009301 [1,0,0,0,0,0|2,0,0]=3 115 B10R1.113 C1=CC(=NC(=C1)F)C(=O)O LN00009991 [1,0,0,0,0,0|2,0,0]=3 116 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 AC020983 [1,0,0,0,0,0|3,0,0]=4 117 B10R1.113 CC(=O)C1=CC=CC(=N1)Br LN00004057 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 AC500258 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.113 CC(=O)C1=CC=CC(F)=C1 AC180005 [1,0,0,0,0,0|2,0,0]=3 120 B10R1.113 CC(=O)C1=CN=CC(Br)=C1 AC511684 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.113 CC(=O)C1=NC(Br)=CC=C1 AC180989 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.113 CC(=O)C1=NC(C)=CC=C1 AC181994 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.113 CC(N)C1=CC(O)=CC=C1 AC020799 [1,0,0,0,0,0|2,0,1]=4 124 B10R1.113 CC1=CC(=CC=C1)B(O)O AC500109 [1,0,0,0,0,0|2,0,1]=4 125 B10R1.113 CC1=CC(=CC=N1)C(=O)O LN00011005 [1,0,0,0,0,0|2,0,0]=3 126 B10R1.113 CC1=CC(=CN=C1)C(O)=O AC181129 [1,0,0,0,0,0|2,0,0]=3 127 B10R1.113 CC1=CC=CC(=N1)C(O)=O AC180370 [1,0,0,0,0,0|2,0,0]=3 128 B10R1.113 CC1=CN=CC(=N1)C(O)=O AC182346 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.113 CC1=NC(=CN=C1)C(=O)O LN00010207 [1,0,0,0,0,0|3,0,0]=4 130 B10R1.113 CC1=NC=CC(=C1)C(O)=O AC510752 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.113 CN(C)C1=CC=CC(O)=C1 AC190067 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.113 NC(=N)C1=CC=CC(Br)=C1 AC181813 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.113 NC(=O)C1=CC(N)=CN=C1 AC182383 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.113 NC(=O)C1=CC=CC(N)=C1 HY-12022 [1,0,0,0,0,0|2,0,0]=3 135 B10R1.113 NC(=O)C1=C[N+]([O-])=CC=C1 HY-101407 [1,0,0,0,0,0|2,0,1]=4 136 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 AC181190 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.113 NC1=CC(=CC=C1)B(O)O AC090217 [1,0,0,0,0,0|2,0,1]=4 138 B10R1.113 NC1=CC(=CC=N1)C(O)=O AC180915 [1,0,0,0,0,0|2,0,0]=3 139 B10R1.113 NC1=CC=CC(=C1)B(O)O AC090109 [1,0,0,0,0,0|2,0,1]=4 140 B10R1.113 NC1=CC=CC(=C1)B(O)O AC090193 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.113 NC1=CC=CC(=N1)C(O)=O AC180914 [1,0,0,0,0,0|2,0,0]=3 142 B10R1.113 NC1=CN=CC(=C1)C(O)=O AC180732 [1,0,0,0,0,0|2,0,0]=3 143 B10R1.113 NC1=CN=CC(=N1)C(O)=O AC182576 [1,0,0,0,0,0|3,0,0]=4 144 B10R1.113 OB(O)C1=CC(Br)=CC=C1 AC511068 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.113 OB(O)C1=CC(Cl)=CC=C1 AC180810 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.113 OB(O)C1=CC(F)=CC=C1 AC180959 [1,0,0,0,0,0|2,0,1]=4 147 B10R1.113 OB(O)C1=CC(O)=CC=C1 AC181171 [1,0,0,0,0,0|1,0,1]=3 148 B10R1.113 OC(=O)C1=CC(=O)NC=C1 AC181219 [1,0,0,0,0,0|1,0,1]=3 149 B10R1.113 OC(=O)C1=CC(Cl)=CC=N1 AC180860 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AC511765 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.113 OC(=O)C1=CC(F)=CN=C1 AC511690 [1,0,0,0,0,0|2,0,0]=3 152 B10R1.113 OC(=O)C1=CC(F)=NC=C1 AC181447 [1,0,0,0,0,0|2,0,0]=3 153 B10R1.113 OC(=O)C1=CC(I)=NC=C1 AC190088 [1,0,0,0,0,0|2,0,0]=3 154 B10R1.113 OC(=O)C1=CC(O)=CC=C1 AC190160 [1,0,0,0,0,0|0,0,0]=1 155 B10R1.113 OC(=O)C1=CC=CC(=O)N1 AC180866 [1,0,0,0,0,0|1,0,1]=3 156 B10R1.113 OC(=O)C1=CC=NC(Br)=C1 AC181281 [1,0,0,0,0,0|2,0,0]=3 157 B10R1.113 OC(=O)C1=CN(=O)=CC=C1 HY-B1061 [1,0,0,0,0,0|1,0,1]=3 158 B10R1.113 OC(=O)C1=CN=CC(Cl)=C1 AC180728 [1,0,0,0,0,0|2,0,0]=3 159 B10R1.113 OC(=O)C1=CN=CC(O)=C1 AC500286 [1,0,0,0,0,0|1,0,0]=2 160 B10R1.113 OC(=O)C1=NC(Br)=CC=C1 AC510356 [1,0,0,0,0,0|2,0,0]=3 161 B10R1.113 OC(=O)C1=NC(Cl)=CC=C1 AC180794 [1,0,0,0,0,0|2,0,0]=3 162 B10R1.113 OC(=O)C1=NC=CC(Br)=C1 AC511849 [1,0,0,0,0,0|2,0,0]=3 163 B10R1.113 OC(=O)C1=NC=CC(O)=C1 AC181051 [1,0,0,0,0,0|1,0,0]=2 164 B10R1.176 C1=CC(=C(C=C1C#N)O)Br LN00364300 [1,0,0,0,0,0|2,0,1]=4 165 B10R1.176 CC1=C(C=C(C=C1)C=O)O LN01279400 [1,0,0,0,0,0|1,0,0]=2 166 B10R1.176 CC1=C(Cl)N=CC(C=O)=C1 AC050908 [1,0,0,0,0,0|3,0,0]=4 167 B10R1.176 CC1=C(F)C=CC(C=O)=C1 AC510647 [1,0,0,0,0,0|2,0,0]=3 168 B10R1.176 CC1=C(O)C=CC(C=O)=C1 AC511525 [1,0,0,0,0,0|1,0,0]=2 169 B10R1.176 CC1=CC(C=O)=CC=C1Br AC512095 [1,0,0,0,0,0|2,0,0]=3 170 B10R1.176 COC1=CC(Br)=C(O)C=C1 AC010330 [1,0,0,0,0,0|3,0,0]=4 171 B10R1.176 COC1=CC(N)=C(O)C=C1 AC130278 [1,0,0,0,0,0|3,0,0]=4 172 B10R1.176 COC1=CC=C(Br)C(O)=C1 AC181675 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.176 ClC1=C(Br)C=C(C=O)C=C1 AC511882 [1,0,0,0,0,0|2,0,0]=3 174 B10R1.176 ClC1=CC=C(C=O)C=C1Cl AC510899 [1,0,0,0,0,0|2,0,0]=3 175 B10R1.176 FC1=C(Br)C=CC(C=O)=C1 AC500192 [1,0,0,0,0,0|2,0,0]=3 176 B10R1.176 FC1=C(Cl)C=CC(C=O)=C1 AC510834 [1,0,0,0,0,0|2,0,0]=3 177 B10R1.176 OC1=C(Cl)C=C(C=O)C=C1 AC500271 [1,0,0,0,0,0|1,0,0]=2 178 B10R1.176 OC1=C(O)C=C(C=O)C=C1 AC500052 [1,0,0,0,0,0|0,0,0]=1 179 B10R1.176 OC1=CC(C=O)=CC=C1Cl AC511121 [1,0,0,0,0,0|1,0,0]=2 180 B10R1.176 OC1=CC=C(C=C1Br)C#N AC500267 [1,0,0,0,0,0|2,0,1]=4 181 B10R1.176 OC1=CC=C(C=C1Cl)C#N AC181248 [1,0,0,0,0,0|2,0,1]=4 182 B10R1.176 OC1=CC=C(C=C1F)C#N AC180893 [1,0,0,0,0,0|2,0,1]=4 183 B12R1.48 C1=CC(=CC(=C1CO)F)[N+](=O)[O-] LN00167887 [0,1,0,0,0,0|2,0,1]=4 184 B12R1.48 CC1=CC(=CC=C1C#N)C(O)=O AC182737 [0,1,0,0,0,0|2,0,0]=3 185 B12R1.48 COC1=CC=C(C=C1Br)C(O)=O AC180347 [0,1,0,0,0,0|1,0,0]=2 186 B12R1.48 COC1=CC=C(C=C1Cl)B(O)O AC090091 [0,1,0,0,0,0|2,0,1]=4 187 B12R1.48 COC1=CC=C(C=C1O)C(C)=O AC180841 [0,1,0,0,0,0|1,0,0]=2 188 B12R1.48 OC1=CC(=CC=C1C=O)[N+]([O-])=O AC511260 [0,1,0,0,0,0|1,0,2]=4 189 B12R1.48 OCC1=CC=C(C=C1Cl)[N+]([O-])=O AC182551 [0,1,0,0,0,0|2,0,1]=4 190 B12R1.56 COC1=C(Br)C=CC(=C1)[N+]([O-])=O AC511795 [0,1,0,0,0,0|2,0,1]=4 191 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O LN00183464 [0,1,0,0,0,0|1,0,1]=3 192 B12R1.56 COC1=C(N)C=CC(=C1)C(O)=O AC020100 [0,1,0,0,0,0|1,0,0]=2 193 B12R1.56 COC1=CC(=CC=C1Br)C(O)=O AC182275 [0,1,0,0,0,0|1,0,0]=2 194 B12R1.56 COC1=CC(=CC=C1Cl)B(O)O AC181225 [0,1,0,0,0,0|2,0,1]=4 195 B12R1.56 COC1=CC(=CC=C1F)B(O)O AC182194 [0,1,0,0,0,0|2,0,1]=4 196 B12R1.56 COC1=CC(=CC=C1F)[N+]([O-])=O AC182181 [0,1,0,0,0,0|2,0,1]=4 197 B12R1.56 COC1=CC(=CC=C1O)C(C)=O HY-N0088 [0,1,0,0,0,0|1,0,0]=2 198 B12R1.56 OC1=C(C=O)C=C(C=C1)[N+]([O-])=O AC020981 [0,1,0,0,0,0|1,0,2]=4 199 B12R1.232 C1=C(C(=CC(=C1F)Br)N)C(=O)O LN01319400 [0,1,0,0,0,0|2,0,0]=3 200 B12R1.232 CC(=O)C1=CC(C)=C(C)C=C1O AC160404 [0,1,0,0,0,0|3,0,0]=4 201 B12R1.232 CC1=CC(C)=C(Br)C=C1C(O)=O AC010473 [0,1,0,0,0,0|2,0,0]=3 202 B12R1.232 CC1=CC(F)=C(C=C1F)C(O)=O AC182219 [0,1,0,0,0,0|2,0,0]=3 203 B12R1.232 NC1=C(C=C(F)C(F)=C1)C(O)=O AC180632 [0,1,0,0,0,0|2,0,0]=3 204 B12R1.232 OC(=O)C1=C(F)C=C(Br)C(Cl)=C1 AC512163 [0,1,0,0,0,0|2,0,0]=3 205 B12R1.232 OC(=O)C1=CC(Br)=C(F)C=C1Cl AC250023 [0,1,0,0,0,0|2,0,0]=3 206 B12R1.232 OC(=O)C1=CC(Cl)=C(F)C=C1F AC181990 [0,1,0,0,0,0|2,0,0]=3 207 B12R1.232 OC(=O)C1=CC(F)=C(Br)C=C1Cl AC180968 [0,1,0,0,0,0|2,0,0]=3 208 B12R1.232 OC(=O)C1=CC(F)=C(Cl)N=C1Cl AC181114 [0,1,0,0,0,0|3,0,0]=4 209 B12R1.232 OC1=C(Br)C=C(F)C(=C1)[N+]([O-])=O AC182304 [0,1,0,0,0,0|2,0,1]=4 210 B12R1.367 CC1=C(F)C=C(C=C1)C(/N)=N/O AC021046 [0,1,0,0,0,0|3,0,0]=4 211 B12R1.367 CC1=CC(=CC=C1Cl)C(=O)CBr AC190123 [0,1,0,0,0,0|3,0,0]=4 212 B12R1.367 COC(=O)C1=CC(Br)=C(C)C=C1 AC131056 [0,1,0,0,0,0|2,0,0]=3 213 B12R1.367 COC(=O)C1=CC(C)=C(Br)C=C1 AC500210 [0,1,0,0,0,0|2,0,0]=3 214 B12R1.367 COC(=O)C1=CC(F)=C(Br)C=C1 AC511927 [0,1,0,0,0,0|2,0,0]=3 215 B12R1.367 COC(=O)C1=CC(N)=C(N)C=C1 AC500123 [0,1,0,0,0,0|2,0,0]=3 216 B12R1.367 COC(=O)C1=CC(O)=C(N)C=C1 AC051061 [0,1,0,0,0,0|1,0,0]=2 217 B12R1.367 COC(=O)C1=CC=C(Br)C(N)=C1 AC511860 [0,1,0,0,0,0|2,0,0]=3 218 B12R1.367 COC(=O)C1=CC=C(Br)C(O)=C1 AC511455 [0,1,0,0,0,0|1,0,0]=2 219 B12R1.367 COC(=O)C1=CC=C(Cl)C(F)=C1 AC180878 [0,1,0,0,0,0|2,0,0]=3 220 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 AC182641 [0,1,0,0,0,0|1,0,0]=2 221 B12R1.367 COC(=O)C1=CC=C(F)C(C)=C1 AC181942 [0,1,0,0,0,0|2,0,0]=3 222 B12R1.367 COC(=O)C1=CC=C(N)C(C)=C1 AC180696 [0,1,0,0,0,0|2,0,0]=3 223 B12R1.367 COC(=O)C1=CC=C(O)C(Br)=N1 AC060012 [0,1,0,0,0,0|2,0,0]=3 224 B12R1.367 COC(=O)C1=CN=C(Cl)C(Br)=C1 AC181750 [0,1,0,0,0,0|3,0,0]=4 225 B12R1.367 COC(=O)C1=CN=C(N)C(Br)=C1 AC182016 [0,1,0,0,0,0|3,0,0]=4 226 B12R1.367 COC(=O)C1=NC(C)=C(N)C=C1 AC010206 [0,1,0,0,0,0|3,0,0]=4 227 B12R1.367 COC(=O)C1=NC(N)=C(Br)C=C1 AC050750 [0,1,0,0,0,0|3,0,0]=4 228 B12R1.367 ClC1=C(Cl)C=C(C=C1)C(=O)CBr AC190248 [0,1,0,0,0,0|3,0,0]=4 229 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 HY-13715A [0,1,0,0,0,0|1,0,1]=3 230 B12R1.367 NC[C@H](O)C1=CC=C(O)C(O)=C1 HY-13715B [0,1,0,0,0,0|1,0,1]=3 231 B12R1.367 OC1=CC=C(C=C1O)C(=O)CCl AC511820 [0,1,0,0,0,0|1,0,0]=2 232 B12R1.367 ONC(=O)C1=CC=C(O)C(O)=C1 HY-19387 [0,1,0,0,0,0|0,0,0]=1 233 B12R1.893 C1=CC(=C(C(=C1C(=O)O)F)Br)F LN00216149 [0,1,0,0,0,0|2,0,0]=3 234 B12R1.893 CC1=CC=C(C(O)=O)C(N)=C1C AC180737 [0,1,0,0,0,0|2,0,0]=3 235 B12R1.893 OC(=O)C1=C(Br)C(F)=C(F)C=C1 AC512145 [0,1,0,0,0,0|2,0,0]=3 236 B12R1.893 OC1=CC=C(C(F)=C1F)[N+]([O-])=O AC160120 [0,1,0,0,0,0|2,0,1]=4 237 B12R1.1005 C1=C(C=C(C(=C1F)Br)O)[N+](=O)[O-] LN02013768 [0,1,0,0,0,0|2,0,1]=4 238 B12R1.1005 C1=C(C=C(C(=C1F)F)F)C(=O)O LN00008657 [0,1,0,0,0,0|2,0,0]=3 239 B12R1.1005 C1=C(C=C(C(=C1F)O)F)C(=O)O LN01814976 [0,1,0,0,0,0|1,0,0]=2 240 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)F)F)F LN00116088 [0,1,0,0,0,0|3,0,0]=4 241 B12R1.1005 CC1=C(Br)C=C(C=C1Br)C(N)=O AC021179 [0,1,0,0,0,0|3,0,0]=4 242 B12R1.1005 CC1=C(C=C(C=C1N)C(=O)O)F LN01364337 [0,1,0,0,0,0|2,0,0]=3 243 B12R1.1005 OC(=O)C1=CC(Cl)=C(Br)C(Cl)=C1 AC512137 [0,1,0,0,0,0|2,0,0]=3 244 B12R1.1005 OC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1 AC180553 [0,1,0,0,0,0|2,0,0]=3 245 B12R1.1005 OC(=O)C1=CC(F)=C(F)C(F)=C1 AC160107 [0,1,0,0,0,0|2,0,0]=3 246 B12R1.1005 OC1=CC(=CC(F)=C1F)[N+]([O-])=O AC160039 [0,1,0,0,0,0|2,0,1]=4 247 B10R1.58 CC1=C(C)C=C(N1)C(O)=O AC051119 [0,0,0,0,1,0|3,0,0]=4 248 B10R1.58 OC(=O)C1=CC(Cl)=C(Cl)S1 AC511215 [0,0,0,0,1,0|3,0,0]=4 249 B12R1.19 CC(=O)NC1=CC(O)=C(O)C=C1 HY-G0004 [0,0,0,0,0,1|1,0,0]=2 250 B12R1.19 OC(=O)CC1=CC(Cl)=C(O)C=C1 AC130144 [0,0,0,0,0,1|1,0,0]=2 251 B12R1.19 OC(=O)CC1=CC(F)=C(O)C=C1 AC130145 [0,0,0,0,0,1|1,0,0]=2 252 B12R1.19 OC(=O)CC1=CC(O)=C(O)C=C1 AC130031 [0,0,0,0,0,1|0,0,0]=1 253 B12R1.19 OC(=O)CC1=CC=C(Br)C(F)=C1 AC182702 [0,0,0,0,0,1|2,0,0]=3 254 B12R1.19 OC(=O)CC1=CC=C(F)C(Br)=C1 AC510685 [0,0,0,0,0,1|2,0,0]=3 255 B12R1.19 OC(=O)CC1=CC=C(F)C(F)=C1 AC510919 [0,0,0,0,0,1|2,0,0]=3 256 B9R0.55 OC(=O)/C=C\C=C/C(O)=O AC070081 [1,0,1,0,0,0|1,0,0]=3 257 B9R1.1 BrC1=CC=C(C=C)C=C1 AC500252 [2,0,0,0,0,0|2,0,0]=4 258 B9R1.1 BrC1=CC=C(C=O)C=C1 AC130129 [2,0,0,0,0,0|1,0,0]=3 259 B9R1.1 BrC1=CC=C(C=O)C=N1 AC181833 [2,0,0,0,0,0|2,0,0]=4 260 B9R1.1 BrC1=CC=C(C=O)N=C1 AC181786 [2,0,0,0,0,0|2,0,0]=4 261 B9R1.1 C1=C(C=CC(=C1)I)CO LN00140802 [2,0,0,0,0,0|1,0,1]=4 262 B9R1.1 CC1=CC=C(C=O)C=C1 AC131766 [2,0,0,0,0,0|1,0,0]=3 263 B9R1.1 CC1=CC=C(C=O)C=N1 AC100063 [2,0,0,0,0,0|2,0,0]=4 264 B9R1.1 CC1=CC=C(C=O)N=C1 AC511100 [2,0,0,0,0,0|2,0,0]=4 265 B9R1.1 COC1=CC=C(O)C=C1 AC130677 [2,0,0,0,0,0|2,0,0]=4 266 B9R1.1 CSC1=CC=C(O)C=C1 AC130022 [2,0,0,0,0,0|2,0,0]=4 267 B9R1.1 ClC1=CC=C(C=O)C=N1 AC020051 [2,0,0,0,0,0|2,0,0]=4 268 B9R1.1 ClC1=CN=C(C=O)C=C1 AC182265 [2,0,0,0,0,0|2,0,0]=4 269 B9R1.1 FC1=CC=C(C=O)C=C1 AC131767 [2,0,0,0,0,0|1,0,0]=3 270 B9R1.1 FC1=CN=C(C=O)C=C1 AC511176 [2,0,0,0,0,0|2,0,0]=4 271 B9R1.1 FC1=NC=C(C=O)C=C1 AC511039 [2,0,0,0,0,0|2,0,0]=4 272 B9R1.1 IC1=CC=C(C=O)C=C1 AC180421 [2,0,0,0,0,0|1,0,0]=3 273 B9R1.1 NC1=CC=C(CO)C=C1 AC510886 [2,0,0,0,0,0|1,0,1]=4 274 B9R1.1 NCC1=CC=C(O)C=C1 AC190229 [2,0,0,0,0,0|1,0,1]=4 275 B9R1.1 OC1=CC=C(C=C1)C#N AC190204 [2,0,0,0,0,0|1,0,1]=4 276 B9R1.1 OC1=CC=C(C=O)C=C1 AC130039 [2,0,0,0,0,0|0,0,0]=2 277 B9R1.1 OC1=CC=C(C=O)C=N1 AC511193 [2,0,0,0,0,0|1,0,0]=3 278 B9R1.1 OC1=CN=C(C=O)C=C1 AC511243 [2,0,0,0,0,0|1,0,0]=3 279 B9R1.1 OCC1=CC=C(Br)C=C1 AC190199 [2,0,0,0,0,0|1,0,1]=4 280 B9R1.1 OCC1=CC=C(Cl)C=C1 AC190200 [2,0,0,0,0,0|1,0,1]=4 281 B9R1.1 OCC1=CC=C(I)C=C1 AC511569 [2,0,0,0,0,0|1,0,1]=4 282 B9R1.1 OCC1=NC=C(O)C=C1 AC512020 [2,0,0,0,0,0|1,0,1]=4 283 B9R1.6 CC(=C)C1=CC=CC=C1 AC190225 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.6 CC(=O)C1=CC=CN=C1 AC510735 [2,0,0,0,0,0|2,0,0]=4 285 B9R1.6 CC(=O)C1=NC=CC=C1 AC131564 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AC021442 [2,0,0,0,0,0|1,0,1]=4 287 B9R1.6 NC(=N)C1=CC=CC=C1 AC511551 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.6 NC(=O)C1=CC=CN=C1 HY-B0150 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.6 OB(O)C1=CC=CC=C1 AC130043 [2,0,0,0,0,0|1,0,1]=4 290 B9R1.6 OC(=O)C1=CC=CN=C1 AC510862 [2,0,0,0,0,0|1,0,0]=3 291 B9R1.6 OC(=O)C1=CC=CN=C1 HY-B0143 [2,0,0,0,0,0|1,0,0]=3 292 B9R1.6 OC(=O)C1=CC=NN=C1 AC180268 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.6 OC(=O)C1=CN=CN=C1 AC020529 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.6 OC(=O)C1=NC=CC=C1 AC190264 [2,0,0,0,0,0|1,0,0]=3 295 B9R1.6 OC(=O)C1=NC=CC=N1 AC181135 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.6 OC(=O)C1=NC=CN=C1 AC021096 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.6 OC(=O)C1=NC=NC=C1 AC180734 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.6 OC(=O)C1=NN=CC=C1 AC511154 [2,0,0,0,0,0|2,0,0]=4 299 B9R1.2 BrC1=CC(C=O)=NC=C1 AC511173 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.2 BrC1=CC=CC(C=O)=C1 AC500300 [2,0,0,0,0,0|1,0,0]=3 301 B9R1.2 BrC1=CC=CC(C=O)=N1 AC181501 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.2 BrC1=CN=CC(C=O)=C1 AC181606 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.2 C1=CC(=NC(=C1)Br)C=O LN00008017 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.2 C1=CNC(=O)C=C1C=O LN00003854 [2,0,0,0,0,0|1,0,1]=4 305 B9R1.2 CC1=CC(C=O)=NC=C1 AC510820 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.2 CC1=CC=CC(C=O)=N1 AC510632 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.2 CC1=NC=CC(C=O)=C1 AC181964 [2,0,0,0,0,0|2,0,0]=4 308 B9R1.2 COC1=CC=CC(O)=C1 AC130088 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.2 ClC1=CC(C=O)=CC=C1 AC511323 [2,0,0,0,0,0|1,0,0]=3 310 B9R1.2 ClC1=CC(C=O)=NC=C1 AC182139 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.2 ClC1=NC=CC(C=O)=C1 AC511448 [2,0,0,0,0,0|2,0,0]=4 312 B9R1.2 FC1=CC(C=O)=CC=C1 AC511704 [2,0,0,0,0,0|1,0,0]=3 313 B9R1.2 FC1=CC(C=O)=CN=C1 AC512032 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.2 FC1=NC(C=O)=CC=C1 AC181585 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.2 IC1=CC(C=O)=CC=C1 AC511778 [2,0,0,0,0,0|1,0,0]=3 316 B9R1.2 OC1=CC(=CC=C1)C#N AC190275 [2,0,0,0,0,0|1,0,1]=4 317 B9R1.2 OC1=CC=CC(C=O)=C1 AC130074 [2,0,0,0,0,0|0,0,0]=2 318 B9R1.2 OCC1=CC=CC(Br)=C1 AC511533 [2,0,0,0,0,0|1,0,1]=4 319 B9R1.69 C1=CC(=C(C=C1Br)O)Br LN00009796 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.69 C1=CC(=C(C=C1F)N)O LN00121786 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.69 C1=CC(=C(C=C1O)F)N LN00010756 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.69 CC1=C(N)C=C(O)C=C1 AC511958 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.69 CC1=CC(N)=C(O)C=C1 AC190176 [2,0,0,0,0,0|1,0,1]=4 324 B9R1.69 CC1=CC(O)=CC=C1Br AC130242 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.69 CC1=CC(O)=CC=C1Cl HY-B1284 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.69 CC1=CC(O)=CC=C1F AC180456 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.69 CC1=CC=C(Br)C(O)=C1 AC182616 [2,0,0,0,0,0|1,0,1]=4 328 B9R1.69 CC1=CC=C(O)C(Cl)=C1 AC190242 [2,0,0,0,0,0|1,0,1]=4 329 B9R1.69 CC1=CC=C(O)C(F)=C1 AC181549 [2,0,0,0,0,0|1,0,1]=4 330 B9R1.69 CC1=CC=C(O)C=C1Br AC182244 [2,0,0,0,0,0|2,0,0]=4 331 B9R1.69 CC1=CC=C(O)C=C1Cl AC180550 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.69 CC1=CC=C(O)C=C1O AC511938 [2,0,0,0,0,0|1,0,0]=3 333 B9R1.69 NC1=C(F)C=C(O)C=C1 AC021410 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.69 NC1=C(O)C=C(Br)C=C1 AC181566 [2,0,0,0,0,0|2,0,0]=4 335 B9R1.69 NC1=CC(Br)=CC=C1O AC510761 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.69 NC1=CC(F)=CC=C1O AC511688 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.69 NC1=CC(O)=CC=C1Cl AC511537 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.69 NC1=CC(O)=CC=C1F AC510884 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.69 NC1=CC=C(F)C=C1O AC500070 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.69 NC1=CC=C(O)C=C1F AC021411 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.69 NC1=CC=C(O)C=C1O AC511671 [2,0,0,0,0,0|1,0,0]=3 342 B9R1.69 OC1=C(Br)C=C(F)C=C1 AC190059 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.69 OC1=C(Cl)C=C(Br)C=C1 AC131131 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.69 OC1=C(Cl)C=C(F)C=C1 AC511589 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.69 OC1=C(Cl)C=CC(F)=C1 AC511127 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.69 OC1=C(F)C=C(Br)C=C1 AC190214 [2,0,0,0,0,0|2,0,0]=4 347 B9R1.69 OC1=C(F)C=C(Cl)C=C1 AC510734 [2,0,0,0,0,0|2,0,0]=4 348 B9R1.69 OC1=C(I)C=CC(Br)=C1 AC511179 [2,0,0,0,0,0|2,0,0]=4 349 B9R1.69 OC1=CC(=O)NC=C1Cl HY-17469 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.69 OC1=CC(Br)=CC=C1Cl AC500081 [2,0,0,0,0,0|2,0,0]=4 351 B9R1.69 OC1=CC(Cl)=CC=C1Br AC180754 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.69 OC1=CC(Cl)=CC=C1Cl AC190212 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.69 OC1=CC(F)=CC=C1Br AC190300 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.69 OC1=CC(F)=CC=C1F AC130349 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.69 OC1=CC=C(Br)C(O)=C1 AC511775 [2,0,0,0,0,0|1,0,0]=3 356 B9R1.69 OC1=CC=C(Br)C=C1O AC510420 [2,0,0,0,0,0|1,0,0]=3 357 B9R1.69 OC1=CC=C(Cl)C(F)=C1 AC510733 [2,0,0,0,0,0|2,0,0]=4 358 B9R1.69 OC1=CC=C(F)C(O)=C1 AC181717 [2,0,0,0,0,0|1,0,0]=3 359 B11R1.3 C=CC1=CC=C(C=C1)C(=O)O LN00115884 [1,1,0,0,0,0|1,0,0]=3 360 B11R1.3 CC(=O)C1=CC=C(C=C1)C#N AC180027 [1,1,0,0,0,0|2,0,0]=4 361 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 AC511182 [1,1,0,0,0,0|2,0,0]=4 362 B11R1.3 CC(=O)C1=CN=C(C=C1)OC LN00220760 [1,1,0,0,0,0|2,0,0]=4 363 B11R1.3 COC1=CC=C(C=C1)B(O)O AC180419 [1,1,0,0,0,0|1,0,1]=4 364 B11R1.3 COC1=CC=C(C=N1)C(N)=O AC040095 [1,1,0,0,0,0|2,0,0]=4 365 B11R1.3 COC1=CN=C(C=C1)C(O)=O AC500082 [1,1,0,0,0,0|1,0,0]=3 366 B11R1.3 COC1=CN=C(C=N1)C(=O)O LN00011206 [1,1,0,0,0,0|2,0,0]=4 367 B11R1.3 COC1=NC=C(C=C1)C(C)=O AC510693 [1,1,0,0,0,0|2,0,0]=4 368 B11R1.3 COC1=NC=C(C=C1)C(O)=O AC511139 [1,1,0,0,0,0|1,0,0]=3 369 B11R1.3 NCC1=CC=C(C=C1)C(O)=O HY-B1258 [1,1,0,0,0,0|1,0,0]=3 370 B11R1.3 NNC1=NC=C(C=C1)C(O)=O AC181712 [1,1,0,0,0,0|2,0,0]=4 371 B11R1.3 OC(=O)C1=CC=C(C=C)C=C1 AC510627 [1,1,0,0,0,0|1,0,0]=3 372 B11R1.3 OC(=O)C1=CC=C(C=C1)C#C AC500166 [1,1,0,0,0,0|1,0,0]=3 373 B11R1.3 OC(=O)C1=CC=C(C=O)C=C1 AC510882 [1,1,0,0,0,0|0,0,1]=3 374 B11R1.3 OC(=O)C1=CC=C(N=C1)C#N AC181213 [1,1,0,0,0,0|2,0,0]=4 375 B11R1.3 OCC1=CC=C(C=C1)B(O)O AC090183 [1,1,0,0,0,0|1,0,1]=4 376 B11R1.3 OCC1=CC=C(C=C1)C(O)=O AC511649 [1,1,0,0,0,0|0,0,0]=2 377 B11R1.3 OCC1=CC=C(C=C1)[N+]([O-])=O AC511761 [1,1,0,0,0,0|1,0,1]=4 378 B11R1.19 CC1=CC=C(C=C1)S(=O)(=O)O LN00194072 [1,1,0,0,0,0|2,0,0]=4 379 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC021526 [1,1,0,0,0,0|2,0,0]=4 380 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC050314 [1,1,0,0,0,0|2,0,0]=4 381 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC051052 [1,1,0,0,0,0|2,0,0]=4 382 B11R1.19 CC1=CC=C(C=C1)S(O)(=O)=O AC130238 [1,1,0,0,0,0|2,0,0]=4 383 B11R1.22 C1=C(C=CC(=C1)Br)C(=O)CN LN00146620 [1,1,0,0,0,0|2,0,0]=4 384 B11R1.22 C1=C(C=CC(=C1)F)C(=O)NN LN00116928 [1,1,0,0,0,0|2,0,0]=4 385 B11R1.22 CC1=CC=C(C=C1)C(=O)CBr AC500028 [1,1,0,0,0,0|2,0,0]=4 386 B11R1.22 CCC(=O)C1=CC=C(C=C1)Br LN00225179 [1,1,0,0,0,0|2,0,0]=4 387 B11R1.22 COC(=O)C1=CC=C(Br)C=N1 AC181779 [1,1,0,0,0,0|2,0,0]=4 388 B11R1.22 COC(=O)C1=CC=C(Br)N=C1 AC181863 [1,1,0,0,0,0|2,0,0]=4 389 B11R1.22 COC(=O)C1=CC=C(C)C=C1 AC021180 [1,1,0,0,0,0|1,0,0]=3 390 B11R1.22 COC(=O)C1=CC=C(Cl)N=C1 AC190192 [1,1,0,0,0,0|2,0,0]=4 391 B11R1.22 COC(=O)C1=CC=C(F)N=C1 AC510655 [1,1,0,0,0,0|2,0,0]=4 392 B11R1.22 COC(=O)C1=CC=C(I)C=C1 AC130758 [1,1,0,0,0,0|1,0,0]=3 393 B11R1.22 COC(=O)C1=CC=C(N)C=C1 AC500030 [1,1,0,0,0,0|1,0,0]=3 394 B11R1.22 COC(=O)C1=CC=C(O)C=C1 AC190171 [1,1,0,0,0,0|0,0,0]=2 395 B11R1.22 COC(=O)C1=CN=C(C)C=C1 AC021708 [1,1,0,0,0,0|2,0,0]=4 396 B11R1.22 COC(=O)C1=CN=C(N)C=C1 AC181104 [1,1,0,0,0,0|2,0,0]=4 397 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 AC512123 [1,1,0,0,0,0|2,0,0]=4 398 B11R1.22 COC(=O)C1=NC=C(N)C=C1 AC160157 [1,1,0,0,0,0|2,0,0]=4 399 B11R1.22 FC1=CC=C(C=C1)C(=O)CBr AC510754 [1,1,0,0,0,0|2,0,0]=4 400 B11R1.22 NCC(=O)C1=CC=C(F)C=C1 AC512178 [1,1,0,0,0,0|2,0,0]=4 401 B11R1.22 NCC(O)C1=CC=C(O)C=C1 HY-B0528A [1,1,0,0,0,0|1,0,1]=4 402 B11R1.22 O/N=C(\Cl)C1=CC=C(Br)C=C1 AC050902 [1,1,0,0,0,0|2,0,0]=4 403 B11R1.166 C1=CC(=C(C=C1Br)F)C(=O)O LN00008566 [1,1,0,0,0,0|1,0,0]=3 404 B11R1.166 C1=CC(=C(C=C1O)Br)C(=O)O LN01038895 [1,1,0,0,0,0|0,0,0]=2 405 B11R1.166 C1=CC(=C(C=C1O)F)[N+](=O)[O-] LN00116278 [1,1,0,0,0,0|1,0,1]=4 406 B11R1.166 CC(=O)C1=C(C=C(C=C1)N)Cl LN01796470 [1,1,0,0,0,0|2,0,0]=4 407 B11R1.166 CC(=O)C1=C(F)C=C(Br)C=C1 AC220119 [1,1,0,0,0,0|2,0,0]=4 408 B11R1.166 CC(=O)C1=CC=C(Br)C=C1O AC181677 [1,1,0,0,0,0|2,0,0]=4 409 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Br AC511164 [1,1,0,0,0,0|2,0,0]=4 410 B11R1.166 CC(=O)C1=CC=C(Cl)C=C1Cl AC500263 [1,1,0,0,0,0|2,0,0]=4 411 B11R1.166 CC(=O)C1=CC=C(N)C=C1O AC511889 [1,1,0,0,0,0|2,0,0]=4 412 B11R1.166 CC(=O)C1=CC=C(O)C=C1F AC021126 [1,1,0,0,0,0|1,0,0]=3 413 B11R1.166 CC1=C(N=CC(Br)=C1)C(O)=O AC182133 [1,1,0,0,0,0|2,0,0]=4 414 B11R1.166 CC1=CC(Br)=CC=C1C(O)=O AC250047 [1,1,0,0,0,0|1,0,0]=3 415 B11R1.166 CC1=CC(Cl)=CN=C1C(O)=O AC182134 [1,1,0,0,0,0|2,0,0]=4 416 B11R1.166 CC1=CC(F)=C(C=C1)C(O)=O AC181531 [1,1,0,0,0,0|1,0,0]=3 417 B11R1.166 CC1=CC(N)=CC=C1C(O)=O AC181976 [1,1,0,0,0,0|1,0,0]=3 418 B11R1.166 CC1=CC(O)=C(C=N1)C(O)=O AC181761 [1,1,0,0,0,0|2,0,0]=4 419 B11R1.166 CC1=CC(O)=CC=C1B(O)O AC090175 [1,1,0,0,0,0|1,0,1]=4 420 B11R1.166 CC1=CC=C(C(O)=O)C(Br)=C1 AC511793 [1,1,0,0,0,0|1,0,0]=3 421 B11R1.166 CC1=CC=C(C(O)=O)C(Cl)=N1 AC020050 [1,1,0,0,0,0|2,0,0]=4 422 B11R1.166 CC1=CC=C(C(O)=O)C(N)=C1 AC511862 [1,1,0,0,0,0|1,0,0]=3 423 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)C LN00181449 [1,1,0,0,0,0|2,0,0]=4 424 B11R1.166 CC1=NC(=C(C=C1)C(=O)O)Cl LN00131032 [1,1,0,0,0,0|2,0,0]=4 425 B11R1.166 NC(=O)C1=CC=C(Cl)C=C1N AC182388 [1,1,0,0,0,0|2,0,0]=4 426 B11R1.166 NC1=C(C=CC(Cl)=C1)C(O)=O AC180214 [1,1,0,0,0,0|1,0,0]=3 427 B11R1.166 NC1=C(C=CC(Cl)=N1)C(O)=O AC020633 [1,1,0,0,0,0|2,0,0]=4 428 B11R1.166 NC1=CC(Br)=CC=C1C(O)=O AC181692 [1,1,0,0,0,0|1,0,0]=3 429 B11R1.166 NC1=CC(Cl)=C(C=C1)C(O)=O AC511619 [1,1,0,0,0,0|1,0,0]=3 430 B11R1.166 NC1=CC(I)=CC=C1C(O)=O AC182459 [1,1,0,0,0,0|1,0,0]=3 431 B11R1.166 NC1=CC=C(C(O)=O)C(F)=C1 AC511347 [1,1,0,0,0,0|1,0,0]=3 432 B11R1.166 NC1=CC=C(C(O)=O)C(O)=C1 HY-B1048 [1,1,0,0,0,0|1,0,0]=3 433 B11R1.166 OC(=O)C1=C(Br)C=C(Cl)C=C1 AC181078 [1,1,0,0,0,0|1,0,0]=3 434 B11R1.166 OC(=O)C1=C(Br)C=C(F)C=C1 AC180537 [1,1,0,0,0,0|1,0,0]=3 435 B11R1.166 OC(=O)C1=C(Br)N=C(F)C=C1 AC050995 [1,1,0,0,0,0|2,0,0]=4 436 B11R1.166 OC(=O)C1=C(Cl)C=C(Cl)C=C1 AC510802 [1,1,0,0,0,0|1,0,0]=3 437 B11R1.166 OC(=O)C1=C(Cl)C=C(F)C=C1 AC200135 [1,1,0,0,0,0|1,0,0]=3 438 B11R1.166 OC(=O)C1=C(F)C=C(Br)C=C1 AC511019 [1,1,0,0,0,0|1,0,0]=3 439 B11R1.166 OC(=O)C1=C(F)C=C(Cl)C=C1 AC510774 [1,1,0,0,0,0|1,0,0]=3 440 B11R1.166 OC(=O)C1=C(F)C=C(F)C=C1 AC180271 [1,1,0,0,0,0|1,0,0]=3 441 B11R1.166 OC(=O)C1=C(F)C=C(I)C=C1 AC181546 [1,1,0,0,0,0|1,0,0]=3 442 B11R1.166 OC(=O)C1=C(F)N=C(Br)C=C1 AC050280 [1,1,0,0,0,0|2,0,0]=4 443 B11R1.166 OC(=O)C1=C(O)C=C(Br)C=C1 AC500228 [1,1,0,0,0,0|1,0,0]=3 444 B11R1.166 OC(=O)C1=CC=C(Br)C=C1Cl AC180439 [1,1,0,0,0,0|1,0,0]=3 445 B11R1.166 OC(=O)C1=CC=C(Cl)C=C1I AC511491 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.166 OC(=O)C1=CC=C(Cl)N=C1Cl AC180623 [1,1,0,0,0,0|2,0,0]=4 447 B11R1.166 OC(=O)C1=CC=C(F)C=C1O AC511669 [1,1,0,0,0,0|1,0,0]=3 448 B11R1.166 OC(=O)C1=CC=C(O)C=C1F AC181201 [1,1,0,0,0,0|0,0,0]=2 449 B11R1.166 OC(=O)C1=CN=C(Br)C=C1Cl AC050221 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.166 OC(=O)C1=CN=C(Cl)C=C1Cl AC180938 [1,1,0,0,0,0|2,0,0]=4 451 B11R1.166 OC(=O)C1=CN=C(O)N=C1O AC180624 [1,1,0,0,0,0|2,0,0]=4 452 B11R1.166 OC(=O)C1=NC=C(Br)C=C1Cl AC182704 [1,1,0,0,0,0|2,0,0]=4 453 B11R1.166 OC(=O)C1=NC=C(Cl)C=C1Cl AC181600 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.166 OC(=O)C1=NC=C(F)C=C1F AC510952 [1,1,0,0,0,0|2,0,0]=4 455 B11R1.166 OC1=CC=C(C(Br)=C1)[N+]([O-])=O AC182511 [1,1,0,0,0,0|1,0,1]=4 456 B11R1.166 OC1=CC=C(C(I)=C1)[N+]([O-])=O AC512128 [1,1,0,0,0,0|1,0,1]=4 457 B11R1.23 C1=CC(=CC(=C1)Cl)C(=O)CBr LN00145927 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.23 CC1=CC(=CC=N1)C(=O)OC LN00222103 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.23 COC(=O)C1=CC(=O)NC=C1 AC182395 [1,1,0,0,0,0|1,0,1]=4 460 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 AC500293 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 AC130905 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.23 COC(=O)C1=CC(C)=NC=C1 AC030128 [1,1,0,0,0,0|2,0,0]=4 463 B11R1.23 COC(=O)C1=CC(Cl)=CC=N1 AC500112 [1,1,0,0,0,0|2,0,0]=4 464 B11R1.23 COC(=O)C1=CC(N)=NC=C1 AC181772 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.23 COC(=O)C1=CC=CC(Br)=N1 AC021134 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.23 COC(=O)C1=CC=CC(Cl)=N1 AC180795 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.23 COC(=O)C1=CC=CC(I)=C1 AC130759 [1,1,0,0,0,0|1,0,0]=3 468 B11R1.23 COC(=O)C1=CC=CC(O)=C1 AC021635 [1,1,0,0,0,0|0,0,0]=2 469 B11R1.23 COC(=O)C1=CN=CC(O)=C1 AC160383 [1,1,0,0,0,0|1,0,0]=3 470 B11R1.23 COC(=O)C1=NC(C)=CC=C1 AC181940 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.23 COC(=O)C1=NC(N)=CC=C1 AC131427 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 AC511026 [1,1,0,0,0,0|2,0,0]=4 473 B11R1.23 COC(=O)C1=NC=CC(N)=C1 AC160525 [1,1,0,0,0,0|2,0,0]=4 474 B11R1.23 ClC1=CC(=CC=C1)C(=O)CBr AC181101 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)O LN00116557 [1,1,0,0,0,0|1,0,0]=3 476 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)F LN00117061 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.74 CC(=O)C1=CC(Br)=CC(Br)=C1 AC180640 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 AC310106 [1,1,0,0,0,0|2,0,0]=4 479 B11R1.74 CC1=CC(=CC(Cl)=N1)C(O)=O AC180520 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.74 CC1=CC(=NC(Cl)=C1)C(O)=O AC512065 [1,1,0,0,0,0|2,0,0]=4 481 B11R1.74 CC1=CC(Cl)=CC(=C1)C(O)=O AC182586 [1,1,0,0,0,0|1,0,0]=3 482 B11R1.74 CC1=CC(F)=CC(=C1)C(O)=O AC181548 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.74 NC1=CC(=CC(O)=C1)C(O)=O AC180469 [1,1,0,0,0,0|0,0,0]=2 484 B11R1.74 NC1=CC(Br)=CC(=C1)C(O)=O AC180910 [1,1,0,0,0,0|1,0,0]=3 485 B11R1.74 OB(O)C1=CC(O)=CC(F)=C1 AC090230 [1,1,0,0,0,0|1,0,1]=4 486 B11R1.74 OC(=O)C1=CC(Br)=CC(Cl)=C1 AC511869 [1,1,0,0,0,0|1,0,0]=3 487 B11R1.74 OC(=O)C1=CC(Br)=CC(F)=C1 AC181255 [1,1,0,0,0,0|1,0,0]=3 488 B11R1.74 OC(=O)C1=CC(Br)=NC(Br)=C1 AC182443 [1,1,0,0,0,0|2,0,0]=4 489 B11R1.74 OC(=O)C1=CC(Cl)=CC(Cl)=C1 AC180042 [1,1,0,0,0,0|1,0,0]=3 490 B11R1.74 OC(=O)C1=CC(F)=CC(F)=C1 AC510561 [1,1,0,0,0,0|1,0,0]=3 491 B11R1.74 OC(=O)C1=NC(Cl)=CC(Cl)=C1 AC512109 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.74 OC1=CC(Br)=CC(=C1)[N+]([O-])=O AC512002 [1,1,0,0,0,0|1,0,1]=4 493 B11R1.159 C1=CC(=C(C(=C1)Cl)Br)C(=O)O LN00204324 [1,1,0,0,0,0|1,0,0]=3 494 B11R1.159 C1=CC(=C(C(=C1)F)Br)C(=O)O LN01316525 [1,1,0,0,0,0|1,0,0]=3 495 B11R1.159 CC(=O)C1=C(O)C(Br)=CC=C1 AC182239 [1,1,0,0,0,0|2,0,0]=4 496 B11R1.159 CC1=C(Br)C=CC=C1C(O)=O AC130042 [1,1,0,0,0,0|1,0,0]=3 497 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)I LN00116621 [1,1,0,0,0,0|1,0,0]=3 498 B11R1.159 CC1=C(C=CC=C1Cl)C(O)=O AC180528 [1,1,0,0,0,0|1,0,0]=3 499 B11R1.159 CC1=C(C=CC=C1F)C(O)=O AC510933 [1,1,0,0,0,0|1,0,0]=3 500 B11R1.159 CC1=C(I)C(=CC=C1)C(O)=O AC510630 [1,1,0,0,0,0|1,0,0]=3 501 B11R1.159 CC1=C(O)C(=CC=C1)C(O)=O HY-B1399 [1,1,0,0,0,0|1,0,0]=3 502 B11R1.159 CC1=CC=CC(C(O)=O)=C1Br AC510821 [1,1,0,0,0,0|1,0,0]=3 503 B11R1.159 CC1=CC=CC(C(O)=O)=C1C AC021104 [1,1,0,0,0,0|1,0,0]=3 504 B11R1.159 CC1=CC=CC(C(O)=O)=C1N AC511696 [1,1,0,0,0,0|1,0,0]=3 505 B11R1.159 NC1=C(Br)C=CC=C1C(O)=O AC181691 [1,1,0,0,0,0|1,0,0]=3 506 B11R1.159 NC1=C(C=CC=C1Cl)C(O)=O AC180742 [1,1,0,0,0,0|1,0,0]=3 507 B11R1.159 NC1=C(F)C=CC=C1C(O)=O AC181251 [1,1,0,0,0,0|1,0,0]=3 508 B11R1.159 NC1=C(O)C=CC=C1C(O)=O AC130201 [1,1,0,0,0,0|0,0,0]=2 509 B11R1.159 NC1=C(O)C=CC=C1[N+]([O-])=O AC510866 [1,1,0,0,0,0|1,0,1]=4 510 B11R1.159 OB(O)C1=C(F)C(O)=CC=C1 AC090010 [1,1,0,0,0,0|1,0,1]=4 511 B11R1.159 OC(=O)C1=C(Br)C(F)=CC=C1 AC130173 [1,1,0,0,0,0|1,0,0]=3 512 B11R1.159 OC(=O)C1=C(Cl)C(Cl)=NC=C1 AC181344 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.159 OC(=O)C1=C(F)C(Cl)=NC=C1 AC181762 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.159 OC(=O)C1=CC=CC(Br)=C1O AC511188 [1,1,0,0,0,0|1,0,0]=3 515 B11R1.159 OC(=O)C1=CC=NC(Br)=C1F AC182721 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.159 OC1=CC=CC(=C1Cl)[N+]([O-])=O AC020526 [1,1,0,0,0,0|1,0,1]=4 517 B11R1.167 C1=C(C=NC(=C1C(=O)O)N)Br LN00008839 [1,1,0,0,0,0|2,0,0]=4 518 B11R1.167 C1=CC(=C(C=C1F)C(=O)O)Br LN00008719 [1,1,0,0,0,0|1,0,0]=3 519 B11R1.167 C1=CC(=C(C=C1I)C(=O)O)Cl LN00007888 [1,1,0,0,0,0|1,0,0]=3 520 B11R1.167 CC(=O)C1=C(Cl)C=CC(F)=C1 AC180460 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.167 CC(=O)C1=C(O)C=CC(O)=C1 AC130204 [1,1,0,0,0,0|1,0,0]=3 522 B11R1.167 CC(=O)C1=CC(Br)=CC=C1F AC182638 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.167 CC(=O)C1=CC(Br)=CC=C1N AC511145 [1,1,0,0,0,0|2,0,0]=4 524 B11R1.167 CC(=O)C1=CC(Br)=CC=C1O AC510656 [1,1,0,0,0,0|2,0,0]=4 525 B11R1.167 CC(=O)C1=CC(Cl)=CC=C1Cl AC020882 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.167 CC(=O)C1=CC(F)=CC=C1O AC510745 [1,1,0,0,0,0|2,0,0]=4 527 B11R1.167 CC1=C(C=C(I)C=C1)C(O)=O AC181258 [1,1,0,0,0,0|1,0,0]=3 528 B11R1.167 CC1=C(C=C(N)C=C1)C(O)=O AC181945 [1,1,0,0,0,0|1,0,0]=3 529 B11R1.167 CC1=C(C=C(O)C=C1)[N+]([O-])=O AC180200 [1,1,0,0,0,0|1,0,1]=4 530 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O LN00117409 [1,1,0,0,0,0|1,0,0]=3 531 B11R1.167 CC1=CC=C(Br)C=C1C(O)=O AC511799 [1,1,0,0,0,0|1,0,0]=3 532 B11R1.167 CC1=CC=C(Cl)C(=C1)C(O)=O AC511767 [1,1,0,0,0,0|1,0,0]=3 533 B11R1.167 CC1=CC=C(Cl)N=C1C(O)=O AC050269 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.167 CC1=CC=C(N)C(=C1)C(O)=O AC180220 [1,1,0,0,0,0|1,0,0]=3 535 B11R1.167 NC1=C(C=C(Br)C=C1)C(O)=O AC510850 [1,1,0,0,0,0|1,0,0]=3 536 B11R1.167 NC1=C(C=C(Br)C=N1)C(O)=O AC181326 [1,1,0,0,0,0|2,0,0]=4 537 B11R1.167 NC1=C(C=C(F)C=C1)C(O)=O AC512093 [1,1,0,0,0,0|1,0,0]=3 538 B11R1.167 NC1=C(C=C(I)C=C1)C(O)=O AC180218 [1,1,0,0,0,0|1,0,0]=3 539 B11R1.167 NC1=C(C=C(O)C=C1)C(O)=O AC180219 [1,1,0,0,0,0|0,0,0]=2 540 B11R1.167 NC1=CC(C(O)=O)=C(O)C=C1 HY-15027 [1,1,0,0,0,0|1,0,0]=3 541 B11R1.167 NC1=CC=C(Cl)N=C1C(O)=O AC182417 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.167 NC1=CC=C(O)C=C1[N+]([O-])=O AC130220 [1,1,0,0,0,0|1,0,1]=4 543 B11R1.167 NC1=CN=C(Cl)C=C1C(O)=O AC511065 [1,1,0,0,0,0|2,0,0]=4 544 B11R1.167 NC1=NC=C(Br)C(=C1)C(O)=O AC182498 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.167 OC(=O)C1=C(Br)C=CC(O)=C1 AC512094 [1,1,0,0,0,0|0,0,0]=2 546 B11R1.167 OC(=O)C1=C(Br)N=CC(Cl)=C1 AC182442 [1,1,0,0,0,0|2,0,0]=4 547 B11R1.167 OC(=O)C1=C(Cl)C=CC(F)=C1 AC180797 [1,1,0,0,0,0|1,0,0]=3 548 B11R1.167 OC(=O)C1=C(Cl)C=NC(Br)=C1 AC050570 [1,1,0,0,0,0|2,0,0]=4 549 B11R1.167 OC(=O)C1=C(Cl)N=CC(F)=C1 AC500330 [1,1,0,0,0,0|2,0,0]=4 550 B11R1.167 OC(=O)C1=C(F)N=CC(Br)=C1 AC182057 [1,1,0,0,0,0|2,0,0]=4 551 B11R1.167 OC(=O)C1=C(O)C=CC(O)=C1 AC130216 [1,1,0,0,0,0|0,0,0]=2 552 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Br AC180318 [1,1,0,0,0,0|1,0,0]=3 553 B11R1.167 OC(=O)C1=CC(Br)=CC=C1Cl AC511599 [1,1,0,0,0,0|1,0,0]=3 554 B11R1.167 OC(=O)C1=CC(Br)=CC=C1I AC180644 [1,1,0,0,0,0|1,0,0]=3 555 B11R1.167 OC(=O)C1=CC(Br)=CN=C1Cl AC181748 [1,1,0,0,0,0|2,0,0]=4 556 B11R1.167 OC(=O)C1=CC(Br)=CN=C1O AC020330 [1,1,0,0,0,0|2,0,0]=4 557 B11R1.167 OC(=O)C1=CC(Br)=NC=C1F AC040200 [1,1,0,0,0,0|2,0,0]=4 558 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1F AC181071 [1,1,0,0,0,0|1,0,0]=3 559 B11R1.167 OC(=O)C1=CC(Cl)=CC=C1O AC500101 [1,1,0,0,0,0|1,0,0]=3 560 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1Cl AC181345 [1,1,0,0,0,0|2,0,0]=4 561 B11R1.167 OC(=O)C1=CC(Cl)=CN=C1O AC180874 [1,1,0,0,0,0|2,0,0]=4 562 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1Cl AC181039 [1,1,0,0,0,0|2,0,0]=4 563 B11R1.167 OC(=O)C1=CC(Cl)=NC=C1F AC181864 [1,1,0,0,0,0|2,0,0]=4 564 B11R1.167 OC(=O)C1=CC(I)=CC=C1Br AC180643 [1,1,0,0,0,0|1,0,0]=3 565 B11R1.167 OC(=O)C1=CC(I)=CC=C1Cl AC180645 [1,1,0,0,0,0|1,0,0]=3 566 B11R1.167 OC(=O)C1=CC(I)=CC=C1F AC500186 [1,1,0,0,0,0|1,0,0]=3 567 B11R1.167 OC(=O)C1=NC(Cl)=CC=C1F AC512028 [1,1,0,0,0,0|2,0,0]=4 568 B11R1.167 OC1=CC=C(Br)C(=C1)[N+]([O-])=O AC511874 [1,1,0,0,0,0|1,0,1]=4 569 B11R1.167 OC1=CC=C(F)C(=C1)[N+]([O-])=O AC511186 [1,1,0,0,0,0|1,0,1]=4 570 B11R1.266 C1=CC(=CC(=C1)C(=O)O)C#N LN00180819 [1,1,0,0,0,0|1,0,0]=3 571 B11R1.266 CC(=O)C1=CC(=CC=C1)C#N AC250032 [1,1,0,0,0,0|2,0,0]=4 572 B11R1.266 COC1=CC(=CC=C1)C(N)=N AC181812 [1,1,0,0,0,0|2,0,0]=4 573 B11R1.266 COC1=CC(=CN=C1)C(O)=O AC160339 [1,1,0,0,0,0|1,0,0]=3 574 B11R1.266 COC1=CC(=NC=C1)C(O)=O AC511198 [1,1,0,0,0,0|1,0,0]=3 575 B11R1.266 COC1=CC=CC(=C1)B(O)O AC090036 [1,1,0,0,0,0|1,0,1]=4 576 B11R1.266 COC1=CC=CC(=C1)C(O)=O AC180043 [1,1,0,0,0,0|0,0,0]=2 577 B11R1.266 COC1=CC=CC(=N1)C(=O)O LN00222703 [1,1,0,0,0,0|1,0,0]=3 578 B11R1.266 COC1=CC=CC(=N1)C(O)=O AC182063 [1,1,0,0,0,0|1,0,0]=3 579 B11R1.266 NC(=O)C1=NC(CO)=CC=C1 AC200020 [1,1,0,0,0,0|2,0,0]=4 580 B11R1.266 NCC1=CC(=CC=C1)C(O)=O AC170057 [1,1,0,0,0,0|1,0,0]=3 581 B11R1.266 OC(=O)C1=CC(=CC=C1)C#N AC180040 [1,1,0,0,0,0|1,0,0]=3 582 B11R1.266 OC(=O)C1=CC(C=O)=CC=C1 AC160494 [1,1,0,0,0,0|0,0,1]=3 583 B11R1.266 OC(=O)C1=CC=CC(CBr)=C1 AC511772 [1,1,0,0,0,0|1,0,0]=3 584 B11R1.266 OCC1=CC=CC(=C1)B(O)O AC500088 [1,1,0,0,0,0|1,0,1]=4 585 B11R1.14 C1=C(C=C(C(=C1F)F)F)C=O LN00008828 [1,1,0,0,0,0|2,0,0]=4 586 B11R1.14 FC1=C(I)C=C(C=O)C=C1I AC060030 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.14 OC1=CC(C=O)=CC(O)=C1O AC280074 [1,1,0,0,0,0|0,0,0]=2 588 B11R1.192 NCCC1=CC(O)=C(O)C=C1 AC510887 [1,1,0,0,0,0|1,0,1]=4 589 B11R1.192 NCCC1=CC=C(O)C(O)=C1 HY-B0451A [1,1,0,0,0,0|1,0,1]=4 590 B11R1.277 C1=C(C=O)C(=CC(=C1F)F)Br LN00201112 [1,1,0,0,0,0|2,0,0]=4 591 B11R1.277 FC1=CC(Br)=C(F)C=C1C=O AC182665 [1,1,0,0,0,0|2,0,0]=4 592 B11R1.278 CC1=C(O)C=CC(C=O)=C1O AC511960 [1,1,0,0,0,0|1,0,0]=3 593 B11R1.278 FC1=C(Br)C=CC(C=O)=C1F AC512006 [1,1,0,0,0,0|2,0,0]=4 594 B11R1.279 CC1=C(C=CC(C=O)=C1)C#N AC010159 [1,1,0,0,0,0|2,0,0]=4 595 B11R1.279 COC1=C(Br)C=C(C=O)C=C1 AC180321 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.279 COC1=CC=C(C=C1O)C#N AC181461 [1,1,0,0,0,0|1,0,1]=4 597 B11R1.279 COC1=CC=C(C=O)C=C1Cl AC511088 [1,1,0,0,0,0|1,0,0]=3 598 B11R1.280 C1=CC(=C(C=C1C=O)C#N)F LN00010054 [1,1,0,0,0,0|2,0,0]=4 599 B11R1.280 COC1=C(Cl)C=CC(C=O)=C1 AC182189 [1,1,0,0,0,0|1,0,0]=3 600 B11R1.280 COC1=CC(C=O)=CC=C1Br AC511904 [1,1,0,0,0,0|1,0,0]=3 601 B11R1.280 FC1=C(C=C(C=O)C=C1)C#N AC020008 [1,1,0,0,0,0|2,0,0]=4 602 B13R1.35 COC1=C(C)C=C(CC(O)=O)C=C1 AC130196 [0,1,0,0,0,1|1,0,0]=3 603 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Br LN00117216 [0,1,0,0,0,1|1,0,0]=3 604 B13R1.35 COC1=CC=C(CC(O)=O)C=C1O AC180326 [0,1,0,0,0,1|0,0,0]=2 605 B13R1.52 C1=CC(=C(C=C1CC(=O)O)C#N)F LN01815347 [0,1,0,0,0,1|2,0,0]=4 606 B13R1.2879 COC(=O)CC1=CC(N)=C(O)C=C1 AC051066 [0,1,0,0,0,1|1,0,0]=3 607 B13R1.120 C1=CC(=C(C=C1C(=O)O)Cl)[N+](=O)[O-] LN00010492 [0,2,0,0,0,0|1,0,1]=4 608 B13R1.120 C1=CC(=C(C=C1C(=O)O)F)[N+](=O)[O-] LN00009427 [0,2,0,0,0,0|1,0,1]=4 609 B13R1.120 CC1=C(C=CC(=C1)C(O)=O)C(O)=O AC310159 [0,2,0,0,0,0|1,0,0]=3 610 B13R1.120 CC1=CC(=CC=C1[N+](=O)[O-])C(=O)O LN00175290 [0,2,0,0,0,0|1,0,1]=4 611 B13R1.120 NC1=CC(=CC=C1C(O)=O)C(O)=O AC511034 [0,2,0,0,0,0|1,0,0]=3 612 B13R1.120 OC(=O)C1=CC(O)=C(C=C1)[N+]([O-])=O AC180192 [0,2,0,0,0,0|0,0,1]=3 613 B13R1.120 OC(=O)C1=CC=C(C(Br)=C1)[N+]([O-])=O AC511929 [0,2,0,0,0,0|1,0,1]=4 614 B13R1.120 OC(=O)C1=CC=C(C(F)=C1)[N+]([O-])=O AC181350 [0,2,0,0,0,0|1,0,1]=4 615 B13R1.120 OC(=O)C1=CC=C(C=C1O)[N+]([O-])=O AC510880 [0,2,0,0,0,0|1,0,1]=4 616 B13R1.652 COC1=C(C=C(C(=C1)Br)C(=O)O)O LN00201601 [0,2,0,0,0,0|0,0,0]=2 617 B13R1.3088 COC(=O)C1=CC=C(C#N)C(F)=C1 AC051130 [0,2,0,0,0,0|2,0,0]=4 618 B13R1.3088 COC(=O)C1=CC=C(CBr)C(Cl)=C1 AC512155 [0,2,0,0,0,0|2,0,0]=4 619 B13R1.3088 COC(=O)C1=CC=C(CBr)C(F)=C1 AC180992 [0,2,0,0,0,0|2,0,0]=4 620 B13R1.3088 COC(=O)C1=CC=C(OC)C(O)=C1 AC181230 [0,2,0,0,0,0|0,0,0]=2 621 B13R1.3091 COC1=C(OC)C=C(C=C1)B(O)O AC181169 [0,2,0,0,0,0|1,0,1]=4 622 B13R1.3091 COC1=CC(=CN=C1OC)C(O)=O AC060032 [0,2,0,0,0,0|1,0,0]=3 623 B13R1.3096 COC1=CC=C(C(C)=O)C(N)=C1C AC020505 [0,2,0,0,0,0|2,0,0]=4 624 B13R1.13 OB(O)C1=CC(=CC=C1Cl)C(O)=O AC182326 [0,2,0,0,0,0|1,0,0]=3 625 B13R1.13 OC(=O)C1=CC(=C(F)C=C1)[N+]([O-])=O AC510777 [0,2,0,0,0,0|1,0,1]=4 626 B13R1.13 OC(=O)C1=CC(=CC=C1F)S(O)=O AC021430 [0,2,0,0,0,0|2,0,0]=4 627 B13R1.13 OC(=O)C1=CC=C(I)C(=C1)[N+]([O-])=O AC181044 [0,2,0,0,0,0|1,0,1]=4 628 B13R1.13 OC(=O)C1=CN=C(O)C(=C1)[N+]([O-])=O AC181440 [0,2,0,0,0,0|1,0,1]=4 629 B13R1.49 COC(=O)C1=CC(OC)=C(N)C=C1 AC180338 [0,2,0,0,0,0|1,0,0]=3 630 B13R1.49 COC(=O)C1=CC(OC)=C(O)C=C1 AC180229 [0,2,0,0,0,0|0,0,0]=2 631 B13R1.49 COC(=O)C1=CC=C(Br)C(CBr)=C1 AC051041 [0,2,0,0,0,0|2,0,0]=4 632 B13R1.49 COC(=O)C1=CC=C(Br)C(OC)=C1 AC182276 [0,2,0,0,0,0|1,0,0]=3 633 B13R1.49 COC(=O)C1=CC=C(C)C(=C1)C#C AC050295 [0,2,0,0,0,0|2,0,0]=4 634 B13R1.49 COC(=O)C1=NC=C(Br)C(OC)=C1 AC511238 [0,2,0,0,0,0|2,0,0]=4 635 B13R1.3230 COC1=C(F)C=CC(C(O)=O)=C1N AC182742 [0,2,0,0,0,0|1,0,0]=3 636 B13R1.1807 COC(=O)C1=CC(=C(C=C1F)F)Br LN01328090 [0,2,0,0,0,0|2,0,0]=4 637 B13R1.1807 COC(=O)C1=CC(F)=C(F)C=C1N AC182420 [0,2,0,0,0,0|2,0,0]=4 638 B13R1.2398 COC1=CC(C)=C(N)C=C1C(O)=O AC021149 [0,2,0,0,0,0|2,0,0]=4 639 B13R1.2398 COC1=CC(Cl)=C(Br)C=C1C(O)=O AC010091 [0,2,0,0,0,0|2,0,0]=4 640 B13R1.2812 OC(=O)C1=C(Br)C=C(Br)C(O)=C1Br HY-15929 [0,2,0,0,0,0|1,0,0]=3 641 B13R1.2812 OC(=O)C1=C(I)C=C(I)C(O)=C1I HY-15919 [0,2,0,0,0,0|1,0,0]=3 642 B13R1.466 CCOC(=O)C1=CC(O)=C(O)C=C1 AC511412 [0,2,0,0,0,0|0,0,0]=2 643 B13R1.466 CCOC(=O)C1=CC=C(N)C(Br)=C1 AC200117 [0,2,0,0,0,0|2,0,0]=4 644 B13R1.466 CNCC(=O)C1=CC=C(O)C(O)=C1 HY-B1308 [0,2,0,0,0,0|1,0,0]=3 645 B13R1.466 CNCC(O)C1=CC(O)=C(O)C=C1 HY-B0447 [0,2,0,0,0,0|1,0,1]=4 646 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 HY-B0447A [0,2,0,0,0,0|1,0,1]=4 647 B13R1.466 CNC[C@H](O)C1=CC(O)=C(O)C=C1 HY-B0447B [0,2,0,0,0,0|1,0,1]=4 648 B13R1.1808 COC(=O)C1=C(C(=C(C=C1)N)F)F LN01997392 [0,2,0,0,0,0|2,0,0]=4 649 B13R1.2678 COC(=O)C1=CC(C)=C(N)C(C)=C1 AC511914 [0,2,0,0,0,0|2,0,0]=4 650 B11R1.53 OC(=O)C1=C(C=O)C=CC=C1 AC180060 [0,0,1,1,0,0|1,0,1]=4 651 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCC2 LN00200630 [0,1,0,1,0,0|2,0,0]=4 652 B13R2.430 CC(=O)C1=CC=C2OCCC2=C1 AC020851 [0,1,0,1,0,0|2,0,0]=4 653 B13R2.430 OB(O)C1=CC=C2OCOC2=C1 AC190076 [0,1,0,1,0,0|1,0,1]=4 654 B13R2.430 OC(=O)C1=CC2=C(NC=C2)C=C1 AC180108 [0,1,0,1,0,0|2,0,0]=4 655 B13R2.430 OC(=O)C1=CC2=C(OCO2)C=C1 AC170087 [0,1,0,1,0,0|0,0,0]=2 656 B13R2.430 OC(=O)C1=CC=C2C=COC2=C1 AC051160 [0,1,0,1,0,0|1,0,0]=3 657 B13R2.430 OC(=O)C1=CC=C2N=CNC2=C1 AC180265 [0,1,0,1,0,0|2,0,0]=4 658 B13R2.430 OC(=O)C1=CC=C2N=COC2=C1 AC050384 [0,1,0,1,0,0|1,0,0]=3 659 B13R2.430 OC(=O)C1=CC=C2SC=CC2=C1 AC050451 [0,1,0,1,0,0|1,1,0]=4 660 B13R2.430 OC(=O)C1=CC=C2SC=NC2=C1 AC182044 [0,1,0,1,0,0|1,1,0]=4 661 B13R2.11634 OC1=C(O)C=C2C(=O)CCC2=C1 AC060046 [0,1,0,1,0,0|1,0,0]=3 662 B9R1.35 C1=C(C(=O)O)SC(=C1)Br LN00009121 [1,0,0,0,1,0|2,0,0]=4 663 B9R1.35 CC1=CC=C(O1)C(O)=O AC180680 [1,0,0,0,1,0|2,0,0]=4 664 B9R1.35 CC1=CC=C(S1)C(O)=O AC511071 [1,0,0,0,1,0|2,0,0]=4 665 B9R1.35 CN1C=CC(=C1)C(O)=O AC182631 [1,0,0,0,1,0|2,0,0]=4 666 B9R1.35 OC(=O)C1=CC(Br)=CS1 AC181641 [1,0,0,0,1,0|2,0,0]=4 667 B9R1.35 OC(=O)C1=CC=C(Br)O1 AC130080 [1,0,0,0,1,0|2,0,0]=4 668 B9R1.35 OC(=O)C1=CC=C(Br)S1 AC020591 [1,0,0,0,1,0|2,0,0]=4 669 B9R1.35 OC(=O)C1=CC=C(Cl)O1 AC511241 [1,0,0,0,1,0|2,0,0]=4 670 B9R1.35 OC(=O)C1=CC=C(Cl)S1 AC021211 [1,0,0,0,1,0|2,0,0]=4 671 B9R1.35 OC(=O)C1=CSC(Br)=C1 AC051032 [1,0,0,0,1,0|2,0,0]=4 672 B9R1.41 CC1=C(C(=O)O)NC=C1 LN01237182 [1,0,0,0,1,0|2,0,0]=4 673 B9R1.41 CN1C=CC=C1C(=O)O LN00149766 [1,0,0,0,1,0|2,0,0]=4 674 B9R1.41 OC(=O)C1=C(Br)SC=C1 AC100025 [1,0,0,0,1,0|2,0,0]=4 675 B9R1.41 OC(=O)C1=C(F)C=CS1 AC181662 [1,0,0,0,1,0|2,0,0]=4 676 B9R1.41 OC(=O)C1=CSC=C1Br AC050399 [1,0,0,0,1,0|2,0,0]=4 677 B11R1.20 CC(=NC1=CC=C(C=C1)I)O LN01092551 [1,0,0,0,0,1|2,0,0]=4 678 B11R1.20 CC(=O)CC1=CC=C(F)C=C1 AC180006 [1,0,0,0,0,1|2,0,0]=4 679 B11R1.20 CC(=O)NC1=CC=C(I)C=C1 AC190309 [1,0,0,0,0,1|2,0,0]=4 680 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 HY-66005 [1,0,0,0,0,1|1,0,0]=3 681 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 AC021568 [1,0,0,0,0,1|2,0,0]=4 682 B11R1.20 CC(=O)OC1=CC=C(O)C=C1 AC020469 [1,0,0,0,0,1|1,0,0]=3 683 B11R1.20 NC1=CC=C(CC(O)=O)C=C1 AC500183 [1,0,0,0,0,1|1,0,0]=3 684 B11R1.20 OC(=O)CC1=CC=C(Br)C=C1 AC130091 [1,0,0,0,0,1|1,0,0]=3 685 B11R1.20 OC(=O)CC1=CC=C(F)C=C1 AC180075 [1,0,0,0,0,1|1,0,0]=3 686 B11R1.20 OC(=O)CC1=CC=C(I)C=C1 AC180656 [1,0,0,0,0,1|1,0,0]=3 687 B11R1.20 OC(=O)CC1=CC=C(O)C=C1 AC130027 [1,0,0,0,0,1|0,0,0]=2 688 B11R1.20 OC(=O)CC1=CC=C(S)C=C1 AC130028 [1,0,0,0,0,1|0,1,0]=3 689 B11R1.20 OC(=O)CC1=CN=C(Cl)C=C1 AC130212 [1,0,0,0,0,1|2,0,0]=4 690 B11R1.157 CC(=O)CC1=CC=CC(Br)=C1 AC020586 [1,0,0,0,0,1|2,0,0]=4 691 B11R1.157 CC(=O)OC1=CC=CC(C)=C1 HY-B0948 [1,0,0,0,0,1|2,0,0]=4 692 B11R1.157 CC(=O)OC1=CC=CC(O)=C1 HY-B0894 [1,0,0,0,0,1|1,0,0]=3 693 B11R1.157 OC(=O)CC1=CC(O)=CC=C1 AC130034 [1,0,0,0,0,1|0,0,0]=2 694 B11R1.157 OC(=O)CC1=CC=CC(Br)=C1 AC511114 [1,0,0,0,0,1|1,0,0]=3 695 B11R1.157 OC(=O)CC1=CC=CC(Cl)=C1 AC500241 [1,0,0,0,0,1|1,0,0]=3 696 B11R1.157 OC(=O)CC1=CC=CC(F)=C1 AC511141 [1,0,0,0,0,1|1,0,0]=3 697 B11R1.157 OC(=O)CC1=CC=CC(I)=C1 AC511575 [1,0,0,0,0,1|1,0,0]=3