0 B10R1.58 CC1=C(C)C=C(N1)C(O)=O AC051119 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.58 OC(=O)C1=CC(Cl)=C(Cl)S1 AC511215 [0,0,0,0,0,0|0,1,0]=1 2 B9R1.35 C1=C(C(=O)O)SC(=C1)Br LN00009121 [1,0,0,0,0,0|0,2,0]=3 3 B9R1.35 CC(=O)C1=CC=C(C)S1 AC180308 [1,0,0,0,0,0|2,1,0]=4 4 B9R1.35 CC1=CC(=NO1)C(O)=O AC500307 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.35 CC1=CC=C(O1)B(O)O AC130312 [1,0,0,0,0,0|2,0,1]=4 6 B9R1.35 CC1=CC=C(O1)C(O)=O AC180680 [1,0,0,0,0,0|1,0,0]=2 7 B9R1.35 CC1=CC=C(S1)C(O)=O AC511071 [1,0,0,0,0,0|1,1,0]=3 8 B9R1.35 CC1=NC=C(C(=O)O)O1 LN00214770 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.35 CC1=NC=C(S1)C(O)=O AC181314 [1,0,0,0,0,0|2,1,0]=4 10 B9R1.35 CC1=NNC(=C1)C(O)=O AC190259 [1,0,0,0,0,0|3,0,0]=4 11 B9R1.35 CN1C=CC(=C1)C(O)=O AC182631 [1,0,0,0,0,0|3,0,0]=4 12 B9R1.35 CN1C=CC(=N1)C(O)=O AC181030 [1,0,0,0,0,0|3,0,0]=4 13 B9R1.35 CN1C=NC(=C1)C(O)=O AC181435 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.35 ClC(=O)C1=CC=C(Cl)S1 AC180470 [1,0,0,0,0,0|1,1,0]=3 15 B9R1.35 NC1=NC=C(S1)C(O)=O AC181939 [1,0,0,0,0,0|2,1,0]=4 16 B9R1.35 OC(=O)C1=CC(Br)=CS1 AC181641 [1,0,0,0,0,0|0,2,0]=3 17 B9R1.35 OC(=O)C1=CC=C(Br)O1 AC130080 [1,0,0,0,0,0|0,1,0]=2 18 B9R1.35 OC(=O)C1=CC=C(Br)S1 AC020591 [1,0,0,0,0,0|0,2,0]=3 19 B9R1.35 OC(=O)C1=CC=C(Cl)O1 AC511241 [1,0,0,0,0,0|0,0,0]=1 20 B9R1.35 OC(=O)C1=CC=C(Cl)S1 AC021211 [1,0,0,0,0,0|0,1,0]=2 21 B9R1.35 OC(=O)C1=CN=C(Br)S1 AC511727 [1,0,0,0,0,0|1,2,0]=4 22 B9R1.35 OC(=O)C1=CSC(Br)=C1 AC051032 [1,0,0,0,0,0|2,1,0]=4 23 B9R1.35 OC(=O)C1=CSC(Br)=N1 AC181839 [1,0,0,0,0,0|2,1,0]=4 24 B9R1.35 OC(=O)C1=NNC(Cl)=C1 AC182427 [1,0,0,0,0,0|2,0,0]=3 25 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)S1 AC020445 [0,1,0,0,0,0|0,2,0]=3 26 B11R1.21 C1=CC(=C(C=C1B(O)O)Cl)Cl LN00118281 [0,0,0,0,0,1|2,0,1]=4 27 B11R1.21 C1=CC(=C(C=C1C(=O)O)F)Br LN00009079 [0,0,0,0,0,1|1,2,0]=4 28 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 AC511644 [0,0,0,0,0,1|2,1,0]=4 29 B11R1.21 CC1=C(Br)C=CC(=C1)C(O)=O AC180420 [0,0,0,0,0,1|2,1,0]=4 30 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I LN00009376 [0,0,0,0,0,1|2,1,0]=4 31 B11R1.21 CC1=C(C=C(C=N1)C(=O)O)Br LN01322628 [0,0,0,0,0,1|2,1,0]=4 32 B11R1.21 CC1=C(F)C=C(C=C1)C(O)=O AC180041 [0,0,0,0,0,1|2,1,0]=4 33 B11R1.21 CC1=C(F)C=CC(=C1)C(O)=O AC510753 [0,0,0,0,0,1|2,1,0]=4 34 B11R1.21 CC1=CC(=CC=C1O)C(O)=O AC180983 [0,0,0,0,0,1|3,0,0]=4 35 B11R1.21 CC1=CC(=CN=C1O)C(=O)O LN00279505 [0,0,0,0,0,1|3,0,0]=4 36 B11R1.21 CC1=CC(=NC=C1Br)C(O)=O AC182131 [0,0,0,0,0,1|2,1,0]=4 37 B11R1.21 CC1=CC=C(C=C1Br)C(O)=O AC511792 [0,0,0,0,0,1|2,1,0]=4 38 B11R1.21 CC1=NC=C(C=C1Br)C(O)=O AC050264 [0,0,0,0,0,1|2,1,0]=4 39 B11R1.21 NC1=C(N)C=C(C=C1)C(O)=O AC200130 [0,0,0,0,0,1|3,0,0]=4 40 B11R1.21 NC1=CC=C(C=C1F)C(O)=O AC511703 [0,0,0,0,0,1|2,1,0]=4 41 B11R1.21 NC1=CC=C(C=C1O)C(O)=O AC180334 [0,0,0,0,0,1|3,0,0]=4 42 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 AC500215 [0,0,0,0,0,1|2,0,1]=4 43 B11R1.21 OC(=O)C1=CC(Br)=C(F)C=C1 AC511159 [0,0,0,0,0,1|1,2,0]=4 44 B11R1.21 OC(=O)C1=CC(Cl)=C(Cl)N=C1 AC510765 [0,0,0,0,0,1|1,0,0]=2 45 B11R1.21 OC(=O)C1=CC(Cl)=C(F)C=C1 AC511282 [0,0,0,0,0,1|1,1,0]=3 46 B11R1.21 OC(=O)C1=CC(F)=C(Cl)N=C1 AC010390 [0,0,0,0,0,1|1,1,0]=3 47 B11R1.21 OC(=O)C1=CC(F)=C(I)C=C1 AC182155 [0,0,0,0,0,1|1,2,0]=4 48 B11R1.21 OC(=O)C1=CC=C(Br)C(F)=C1 AC181079 [0,0,0,0,0,1|1,2,0]=4 49 B11R1.21 OC(=O)C1=CC=C(Br)C(O)=C1 AC182195 [0,0,0,0,0,1|2,1,0]=4 50 B11R1.21 OC(=O)C1=CC=C(Cl)C(O)=C1 AC511937 [0,0,0,0,0,1|2,0,0]=3 51 B11R1.21 OC(=O)C1=CC=C(I)C(O)=C1 AC131761 [0,0,0,0,0,1|2,1,0]=4 52 B11R1.21 OC(=O)C1=CC=C(O)C(O)=C1 HY-N0294 [0,0,0,0,0,1|3,0,0]=4 53 B11R1.21 OC(=O)C1=CN=C(Cl)C(Br)=C1 AC181372 [0,0,0,0,0,1|1,1,0]=3 54 B11R1.21 OC(=O)C1=CN=C(O)C(Cl)=C1 AC180523 [0,0,0,0,0,1|2,0,0]=3 55 B11R1.21 OC(=O)C1=CNC(=O)C(Br)=C1 AC182236 [0,0,0,0,0,1|2,1,0]=4 56 B11R1.21 OC(=O)C1=NC(Br)=C(F)C=C1 AC020158 [0,0,0,0,0,1|1,2,0]=4 57 B11R1.21 [O-][N+](=O)C1=CN=C(Cl)C(Cl)=C1 AC181735 [0,0,0,0,0,1|2,0,1]=4 58 B11R1.74 C1=C(C=C(C=C1Cl)Cl)B(O)O LN00116565 [0,0,0,0,0,1|2,0,1]=4 59 B11R1.74 C1=C(C=C(C=C1F)F)C(=O)O LN00116557 [0,0,0,0,0,1|1,2,0]=4 60 B11R1.74 CC1=CC(=CC(Cl)=N1)C(O)=O AC180520 [0,0,0,0,0,1|2,0,0]=3 61 B11R1.74 CC1=CC(=NC(Cl)=C1)C(O)=O AC512065 [0,0,0,0,0,1|2,0,0]=3 62 B11R1.74 CC1=CC(Cl)=CC(=C1)C(O)=O AC182586 [0,0,0,0,0,1|2,0,0]=3 63 B11R1.74 CC1=CC(F)=CC(=C1)C(O)=O AC181548 [0,0,0,0,0,1|2,1,0]=4 64 B11R1.74 NC1=CC(=CC(O)=C1)C(O)=O AC180469 [0,0,0,0,0,1|3,0,0]=4 65 B11R1.74 NC1=CC(Br)=CC(=C1)C(O)=O AC180910 [0,0,0,0,0,1|2,1,0]=4 66 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 AC180511 [0,0,0,0,0,1|2,0,1]=4 67 B11R1.74 OC(=O)C1=CC(=O)NC(=O)N1 HY-N0157 [0,0,0,0,0,1|3,0,0]=4 68 B11R1.74 OC(=O)C1=CC(Br)=CC(Cl)=C1 AC511869 [0,0,0,0,0,1|1,1,0]=3 69 B11R1.74 OC(=O)C1=CC(Br)=CC(F)=C1 AC181255 [0,0,0,0,0,1|1,2,0]=4 70 B11R1.74 OC(=O)C1=CC(Br)=NC(Br)=C1 AC182443 [0,0,0,0,0,1|1,2,0]=4 71 B11R1.74 OC(=O)C1=CC(Cl)=CC(Cl)=C1 AC180042 [0,0,0,0,0,1|1,0,0]=2 72 B11R1.74 OC(=O)C1=CC(F)=CC(F)=C1 AC510561 [0,0,0,0,0,1|1,2,0]=4 73 B11R1.74 OC(=O)C1=NC(Cl)=CC(Cl)=C1 AC512109 [0,0,0,0,0,1|1,0,0]=2 74 B8R1.1 BrC1=CC=C(O1)C=O AC500242 [2,0,0,0,0,0|0,1,0]=3 75 B8R1.1 BrC1=COC(C=O)=C1 AC020788 [2,0,0,0,0,0|0,1,0]=3 76 B8R1.1 BrC1=CSC(C=O)=C1 AC511201 [2,0,0,0,0,0|0,2,0]=4 77 B8R1.1 C1=C(C=O)OC(=C1)Br LN00131779 [2,0,0,0,0,0|0,1,0]=3 78 B8R1.1 C1=C(C=O)SC(=C1)Br LN00009990 [2,0,0,0,0,0|0,2,0]=4 79 B8R1.1 CC1=CC=C(S1)C=O AC511283 [2,0,0,0,0,0|1,1,0]=4 80 B8R1.1 ClC1=CC=C(S1)C=O AC180483 [2,0,0,0,0,0|0,1,0]=3 81 B8R1.1 ClC1=NC=C(S1)C=O AC100127 [2,0,0,0,0,0|1,1,0]=4 82 B8R1.1 IC1=CNC(C=O)=C1 AC070002 [2,0,0,0,0,0|1,1,0]=4 83 B8R1.7 C1=C(C(=O)O)SN=C1 LN01368400 [2,0,0,0,0,0|1,1,0]=4 84 B8R1.7 C1=COC(=C1)B(O)O LN00004521 [2,0,0,0,0,0|1,0,1]=4 85 B8R1.7 C1=COC(=N1)C(=O)N LN02009510 [2,0,0,0,0,0|2,0,0]=4 86 B8R1.7 CC(=O)C1=CC=CS1 AC510514 [2,0,0,0,0,0|1,1,0]=4 87 B8R1.7 ClC(=O)C1=CC=CN1 AC180091 [2,0,0,0,0,0|2,0,0]=4 88 B8R1.7 OB(O)C1=CC=CO1 AC130268 [2,0,0,0,0,0|1,0,1]=4 89 B8R1.7 OC(=O)C1=CC=CO1 AC510992 [2,0,0,0,0,0|0,0,0]=2 90 B8R1.7 OC(=O)C1=CC=NO1 AC050948 [2,0,0,0,0,0|1,0,0]=3 91 B8R1.7 OC(=O)C1=CN=CO1 AC500181 [2,0,0,0,0,0|1,0,0]=3 92 B8R1.7 OC(=O)C1=CN=CS1 AC181678 [2,0,0,0,0,0|1,1,0]=4 93 B8R1.7 OC(=O)C1=CNC=C1 AC181119 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.7 OC(=O)C1=CNC=N1 AC511460 [2,0,0,0,0,0|2,0,0]=4 95 B8R1.7 OC(=O)C1=COC=N1 AC510698 [2,0,0,0,0,0|2,0,0]=4 96 B8R1.7 OC(=O)C1=CSC=C1 AC310080 [2,0,0,0,0,0|2,0,0]=4 97 B8R1.7 OC(=O)C1=CSC=N1 AC360006 [2,0,0,0,0,0|2,0,0]=4 98 B8R1.7 OC(=O)C1=NC=CN1 AC180986 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.7 OC(=O)C1=NC=CS1 AC510654 [2,0,0,0,0,0|1,1,0]=4 100 B8R1.7 OC(=O)C1=NNC=C1 AC180630 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.7 [O-]C(=O)C1=CC=CS1 AC030126 [2,0,0,0,0,0|0,1,1]=4 102 B10R1.14 COC(=O)C1=CC(Br)=CN1 AC511002 [1,1,0,0,0,0|1,1,0]=4 103 B10R1.14 COC(=O)C1=CC(Br)=CO1 AC020441 [1,1,0,0,0,0|0,1,0]=3 104 B10R1.14 COC(=O)C1=CC(N)=CS1 AC182094 [1,1,0,0,0,0|1,1,0]=4 105 B10R1.14 COC(=O)C1=CC(O)=NO1 AC070072 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.14 COC(=O)C1=CC=C(Br)O1 AC180679 [1,1,0,0,0,0|0,1,0]=3 107 B10R1.14 COC(=O)C1=CC=C(Br)S1 AC020592 [1,1,0,0,0,0|0,2,0]=4 108 B10R1.14 COC(=O)C1=CC=C(Cl)S1 AC020444 [1,1,0,0,0,0|0,1,0]=3 109 B10R1.14 COC(=O)C1=CC=C(N)S1 AC511981 [1,1,0,0,0,0|1,1,0]=4 110 B10R1.31 OC(=O)C1=CC=C(O1)C=O AC511250 [1,1,0,0,0,0|1,0,0]=3 111 B10R1.31 OCC1=CC=C(O1)C(O)=O AC511228 [1,1,0,0,0,0|1,0,0]=3 112 B10R1.59 CN1C=C(Br)C=C1C(O)=O AC182193 [1,1,0,0,0,0|1,1,0]=4 113 B12R1.232 OC(=O)C1=C(F)C=C(Br)C(Cl)=C1 AC512163 [0,1,0,0,0,1|1,1,0]=4 114 B12R1.232 OC(=O)C1=CC(Cl)=C(F)C=C1F AC181990 [0,1,0,0,0,1|1,1,0]=4 115 B12R1.232 OC(=O)C1=CC(F)=C(Cl)N=C1Cl AC181114 [0,1,0,0,0,1|1,1,0]=4 116 B12R1.367 COC(=O)C1=CC=C(Cl)C(F)=C1 AC180878 [0,1,0,0,0,1|1,1,0]=4 117 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 AC182641 [0,1,0,0,0,1|2,0,0]=4 118 B12R1.367 COC(=O)C1=CN=C(Cl)C(Br)=C1 AC181750 [0,1,0,0,0,1|1,1,0]=4 119 B12R1.367 ClC1=C(Cl)C=C(C=C1)C(=O)CBr AC190248 [0,1,0,0,0,1|2,0,0]=4 120 B12R1.1005 OC(=O)C1=CC(Cl)=C(Br)C(Cl)=C1 AC512137 [0,1,0,0,0,1|1,1,0]=4 121 B12R1.1005 OC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1 AC180553 [0,1,0,0,0,1|1,0,0]=3 122 B12R1.11 COC1=NC(Cl)=CC(=C1)C(O)=O AC040091 [0,1,0,0,0,1|2,0,0]=4 123 B12R1.358 CCC(=O)C1=CC(=CC(=C1)Cl)Cl LN02043379 [0,1,0,0,0,1|2,0,0]=4 124 B12R1.358 COC(=O)C1=CC(C)=NC(Cl)=C1 AC181763 [0,1,0,0,0,1|2,0,0]=4 125 B12R1.358 COC(=O)C1=CC(Cl)=CC(N)=C1 AC182614 [0,1,0,0,0,1|2,0,0]=4 126 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=C1 AC180473 [0,1,0,0,0,1|1,0,0]=3 127 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=N1 AC511837 [0,1,0,0,0,1|1,0,0]=3 128 B12R1.511 CC(=O)C1=C(C(=CC(=C1)Cl)Cl)F LN00222784 [0,1,0,0,0,1|2,0,0]=4 129 B12R1.511 CC1=CC(Cl)=CC(C(O)=O)=C1N AC181468 [0,1,0,0,0,1|2,0,0]=4 130 B10R1.113 OC(=O)C1=CC(Cl)=CC=N1 AC180860 [0,0,1,1,0,0|2,0,0]=4 131 B10R1.113 OC(=O)C1=CC(Cl)=NC=C1 AC511765 [0,0,1,1,0,0|2,0,0]=4 132 B10R1.113 OC(=O)C1=NC(Cl)=CC=C1 AC180794 [0,0,1,1,0,0|2,0,0]=4 133 B10R1.54 OC(=O)CN1C=C(Cl)C=N1 AC100069 [1,0,0,0,0,1|2,0,0]=4 134 B12R1.19 OC(=O)CC1=CC(Cl)=C(O)C=C1 AC130144 [0,0,0,0,0,2|2,0,0]=4