0 B9R1.35 CC(=O)C1=CC(Br)=CS1 P10187 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)C1=CC(C)=CS1 D71110 [0,0,0,0,0,0|3,0,0]=3 2 B9R1.35 CC(=O)C1=CC(Cl)=CS1 23254 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)C1=CC=C(Br)S1 75400 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.35 CC(=O)C1=CC=C(C)O1 28464 [0,0,0,0,0,0|3,0,0]=3 5 B9R1.35 CC(=O)C1=CC=C(C)S1 23304 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 CC(=O)C1=CC=C(Cl)S1 77914 [0,0,0,0,0,0|4,0,0]=4 7 B9R1.35 CC(=O)C1=CC=C(I)S1 D94642 [0,0,0,0,0,0|4,0,0]=4 8 B9R1.35 CC(=O)C1=CN(C)C=C1 D87533 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CC(=O)C1=CN(C)N=C1 Y10380 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 CC(=O)C1=CN=C(Br)S1 O10262 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.35 CC(=O)C1=CN=C(N)O1 C90558 [0,0,0,0,0,0|4,0,0]=4 12 B9R1.35 CC(=O)C1=CN=C(N)S1 50879 [0,0,0,0,0,0|4,0,0]=4 13 B9R1.35 CC(=O)C1=NC(C)=CS1 78610 [0,0,0,0,0,0|4,0,0]=4 14 B9R1.35 CC1=CC(C(=O)Cl)=NO1 29720 [0,0,0,0,0,0|2,1,0]=3 15 B9R1.35 CC1=CC(C(=O)O)=CN1 26248 [0,0,0,0,0,0|1,0,0]=1 16 B9R1.35 CC1=CC(C(=O)O)=NN1 CL3431 [0,0,0,0,0,0|2,0,0]=2 17 B9R1.35 CC1=CC(C(=O)O)=NO1 28331 [0,0,0,0,0,0|1,1,0]=2 18 B9R1.35 CC1=CC(C(N)=O)=NO1 24771 [0,0,0,0,0,0|2,1,0]=3 19 B9R1.35 CC1=CC([N+](=O)[O-])=NN1 85048 [0,0,0,0,0,0|3,0,1]=4 20 B9R1.35 CC1=CC=C(B(O)O)O1 33138 [0,0,0,0,0,0|3,0,1]=4 21 B9R1.35 CC1=CC=C(B(O)O)S1 33978 [0,0,0,0,0,0|3,0,1]=4 22 B9R1.35 CC1=CC=C(C(=O)O)N1 O11470 [0,0,0,0,0,0|2,0,0]=2 23 B9R1.35 CC1=CC=C(C(=O)O)O1 33208 [0,0,0,0,0,0|2,0,0]=2 24 B9R1.35 CC1=CC=C(C(=O)O)S1 F11216 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.35 CC1=CN=C(C(=O)O)S1 BL001513 [0,0,0,0,0,0|3,0,0]=3 26 B9R1.35 CC1=CNC(C(=O)O)=C1 59367 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.35 CC1=CSC(B(O)O)=C1 F11801 [0,0,0,0,0,0|3,0,1]=4 28 B9R1.35 CC1=CSC(C(=O)O)=C1 CL9298 [0,0,0,0,0,0|2,0,0]=2 29 B9R1.35 CC1=CSC(C(=O)O)=N1 69756 [0,0,0,0,0,0|3,0,0]=3 30 B9R1.35 CC1=NC(C(=O)O)=CN1 24690 [0,0,0,0,0,0|2,0,0]=2 31 B9R1.35 CC1=NC(C(=O)O)=CO1 69012 [0,0,0,0,0,0|1,1,0]=2 32 B9R1.35 CC1=NC(C(=O)O)=CS1 69867 [0,0,0,0,0,0|1,0,0]=1 33 B9R1.35 CC1=NC(C(=O)[O-])=NO1 80209 [0,0,0,0,0,0|2,1,1]=4 34 B9R1.35 CC1=NC([N+](=O)[O-])=CN1 44415 [0,0,0,0,0,0|3,0,1]=4 35 B9R1.35 CC1=NC=C(C(=O)O)S1 35338 [0,0,0,0,0,0|2,0,0]=2 36 B9R1.35 CC1=NN=C(C(=O)[O-])O1 65656 [0,0,0,0,0,0|3,0,1]=4 37 B9R1.35 CC1=NNC(C(=O)O)=C1 34014 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.35 CC1=NNC([N+](=O)[O-])=C1 23463 [0,0,0,0,0,0|3,0,1]=4 39 B9R1.35 CC1=NOC(C(=O)O)=C1 CL3463 [0,0,0,0,0,0|2,0,0]=2 40 B9R1.35 CN1C=C(B(O)O)C=N1 RB2072 [0,0,0,0,0,0|3,0,1]=4 41 B9R1.35 CN1C=C(C(=O)O)C=N1 82979 [0,0,0,0,0,0|2,0,0]=2 42 B9R1.35 CN1C=C(C(N)=O)C=N1 D97607 [0,0,0,0,0,0|3,0,0]=3 43 B9R1.35 CN1C=C([N+](=O)[O-])C=N1 24467 [0,0,0,0,0,0|3,0,1]=4 44 B9R1.35 CN1C=CC(C(=O)O)=N1 34655 [0,0,0,0,0,0|3,0,0]=3 45 B9R1.35 CN1C=NC(C(=O)O)=C1 35173 [0,0,0,0,0,0|3,0,0]=3 46 B9R1.35 NC(=O)C1=CC=C(Br)S1 A12832 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.35 NC(=O)C1=CC=C(Cl)S1 D81731 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.35 NC(=O)C1=CSC(Br)=C1 F52622 [0,0,0,0,0,0|2,0,0]=2 49 B9R1.35 NC(=O)C1=CSC(Br)=N1 S10143 [0,0,0,0,0,0|3,0,0]=3 50 B9R1.35 NC(=O)C1=CSC(N)=N1 37100 [0,0,0,0,0,0|3,0,0]=3 51 B9R1.35 NC(=O)C1=NNC(N)=C1 31823 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.35 NC1=CC(C(=O)O)=NN1 30226 [0,0,0,0,0,0|3,0,0]=3 53 B9R1.35 NC1=NC(C(=O)O)=CS1 AB1129 [0,0,0,0,0,0|2,0,0]=2 54 B9R1.35 NC1=NC(C(=O)O)=CS1 AB2631 [0,0,0,0,0,0|2,0,0]=2 55 B9R1.35 NC1=NC=C(C(=O)O)S1 34663 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.35 NC1=NNC(C(=O)O)=N1 F14876 [0,0,0,0,0,0|4,0,0]=4 57 B9R1.35 NN1C=C(C(=O)O)CS1 29247 [0,0,0,0,0,0|2,0,1]=3 58 B9R1.35 O=C(Cl)C1=CC=C(Cl)S1 25747 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.35 O=C(O)C1=CC(Br)=CN1 CL2806 [0,0,0,0,0,0|3,0,0]=3 60 B9R1.35 O=C(O)C1=CC(Br)=CS1 54466 [0,0,0,0,0,0|3,0,0]=3 61 B9R1.35 O=C(O)C1=CC(O)=NO1 11160 [0,0,0,0,0,0|3,0,0]=3 62 B9R1.35 O=C(O)C1=CC=C(Br)O1 FD17049 [0,0,0,0,0,0|3,0,0]=3 63 B9R1.35 O=C(O)C1=CC=C(Br)S1 76236 [0,0,0,0,0,0|3,0,0]=3 64 B9R1.35 O=C(O)C1=CC=C(Cl)O1 CL8867 [0,0,0,0,0,0|3,0,0]=3 65 B9R1.35 O=C(O)C1=CC=C(Cl)S1 37624 [0,0,0,0,0,0|3,0,0]=3 66 B9R1.35 O=C(O)C1=CN=C(Br)S1 CL2509 [0,0,0,0,0,0|3,0,0]=3 67 B9R1.35 O=C(O)C1=CN=C(Cl)S1 28365 [0,0,0,0,0,0|3,0,0]=3 68 B9R1.35 O=C(O)C1=CNC(O)=N1 F31133 [0,0,0,0,0,0|3,0,0]=3 69 B9R1.35 O=C(O)C1=COC(Br)=C1 31115 [0,0,0,0,0,0|1,1,0]=2 70 B9R1.35 O=C(O)C1=COC(Br)=N1 27561 [0,0,0,0,0,0|2,1,0]=3 71 B9R1.35 O=C(O)C1=CSC(Br)=C1 55810 [0,0,0,0,0,0|1,0,0]=1 72 B9R1.35 O=C(O)C1=CSC(Br)=N1 23823 [0,0,0,0,0,0|2,0,0]=2 73 B9R1.35 O=C(O)C1=CSC(Cl)=N1 VT1399 [0,0,0,0,0,0|2,0,0]=2 74 B9R1.35 O=C(O)C1=NC(Br)=CS1 51377 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.35 O=C(O)C1=NNC(Br)=C1 20417 [0,0,0,0,0,0|3,0,0]=3 76 B9R1.35 O=C(O)C1=NNC(Br)=N1 26332 [0,0,0,0,0,0|4,0,0]=4 77 B9R1.35 O=C(O)C1=NNC(Cl)=N1 26328 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.35 O=C1C=C(C(=O)O)CC1 D82157 [0,0,0,0,0,0|2,0,1]=3 79 B9R1.35 O=C1N[C@H](C(=O)O)CS1 D70531 [0,0,0,0,0,0|2,0,2]=4 80 B8R1.1 CC1=CC(C=O)=NO1 29715 [1,0,0,0,0,0|1,1,0]=3 81 B8R1.1 CC1=CC(CO)=NO1 TD8128 [1,0,0,0,0,0|1,1,1]=4 82 B8R1.1 CC1=CC=C(C=O)O1 AC7802 [1,0,0,0,0,0|2,0,0]=3 83 B8R1.1 CC1=CC=C(C=O)S1 F11208 [1,0,0,0,0,0|2,0,0]=3 84 B8R1.1 CC1=CC=C(CO)O1 55257 [1,0,0,0,0,0|2,0,1]=4 85 B8R1.1 CC1=CSC(C=O)=C1 F10375 [1,0,0,0,0,0|2,0,0]=3 86 B8R1.1 CC1=CSC(C=O)=N1 78529 [1,0,0,0,0,0|3,0,0]=4 87 B8R1.1 CC1=CSC(CO)=C1 30206 [1,0,0,0,0,0|2,0,1]=4 88 B8R1.1 CC1=NC(C=O)=CN1 79259 [1,0,0,0,0,0|2,0,0]=3 89 B8R1.1 CC1=NC(C=O)=CO1 64592 [1,0,0,0,0,0|1,1,0]=3 90 B8R1.1 CC1=NC(C=O)=CS1 24082 [1,0,0,0,0,0|1,0,0]=2 91 B8R1.1 CC1=NC(CCl)=CS1 71066 [1,0,0,0,0,0|2,0,1]=4 92 B8R1.1 CC1=NC(CCl)=CS1 71076 [1,0,0,0,0,0|2,0,1]=4 93 B8R1.1 CC1=NC(CO)=CO1 78705 [1,0,0,0,0,0|1,1,1]=4 94 B8R1.1 CC1=NC(CO)=CS1 F11140 [1,0,0,0,0,0|1,0,1]=3 95 B8R1.1 CC1=NC=C(C=O)S1 24244 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.1 CC1=NC=C(CO)S1 W10514 [1,0,0,0,0,0|2,0,1]=4 97 B8R1.1 CC1=NNC(C=O)=C1 71136 [1,0,0,0,0,0|2,0,0]=3 98 B8R1.1 CC1=NOC(C=O)=C1 52031 [1,0,0,0,0,0|2,0,0]=3 99 B8R1.1 CC1=NOC(CO)=C1 F52509 [1,0,0,0,0,0|2,0,1]=4 100 B8R1.1 CN1C=C(C=O)C=N1 81674 [1,0,0,0,0,0|2,0,0]=3 101 B8R1.1 CN1C=C(CO)C=N1 81396 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.1 CN1C=CC(C=O)=N1 83478 [1,0,0,0,0,0|3,0,0]=4 103 B8R1.1 CN1C=NC(C=O)=C1 38399 [1,0,0,0,0,0|3,0,0]=4 104 B8R1.1 NC1=NC(C=O)=CS1 D97493 [1,0,0,0,0,0|2,0,0]=3 105 B8R1.1 NC1=NC(CO)=CS1 20112 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.1 NC1=NC(CO)=CS1 AT14872 [1,0,0,0,0,0|2,0,1]=4 107 B8R1.1 NC1=NC=C(C=O)S1 51946 [1,0,0,0,0,0|3,0,0]=4 108 B8R1.1 NC1=NC=C(C=O)S1 83484 [1,0,0,0,0,0|3,0,0]=4 109 B8R1.1 NCC1=CSC(Cl)=C1 37529 [1,0,0,0,0,0|2,0,1]=4 110 B8R1.1 O=CC1=CC(Br)=CN1 24720 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.1 O=CC1=CC(Br)=CO1 54612 [1,0,0,0,0,0|3,0,0]=4 112 B8R1.1 O=CC1=CC(Br)=CS1 21502 [1,0,0,0,0,0|3,0,0]=4 113 B8R1.1 O=CC1=CC(I)=CN1 C74720 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.1 O=CC1=CC=C(Br)O1 FD17060 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.1 O=CC1=CC=C(Br)S1 37587 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.1 O=CC1=CC=C(Cl)O1 55259 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.1 O=CC1=CC=C(Cl)S1 CL1306 [1,0,0,0,0,0|3,0,0]=4 118 B8R1.1 O=CC1=CC=C(I)O1 F12254 [1,0,0,0,0,0|3,0,0]=4 119 B8R1.1 O=CC1=CN=C(Br)S1 24006 [1,0,0,0,0,0|3,0,0]=4 120 B8R1.1 O=CC1=CN=C(Cl)S1 24233 [1,0,0,0,0,0|3,0,0]=4 121 B8R1.1 O=CC1=CSC(Br)=N1 21710 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.1 OCC1=CSC(Br)=N1 60877 [1,0,0,0,0,0|2,0,1]=4 123 B8R1.7 CC(=O)C1=CC=CN1 F14878 [1,0,0,0,0,0|3,0,0]=4 124 B8R1.7 CC(=O)C1=CC=CO1 55774 [1,0,0,0,0,0|3,0,0]=4 125 B8R1.7 CC(=O)C1=CC=CS1 W18336 [1,0,0,0,0,0|3,0,0]=4 126 B8R1.7 CC(=O)C1=CCC=C1 TD8050 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.7 CC(=O)C1=CNC=C1 30137 [1,0,0,0,0,0|2,0,0]=3 128 B8R1.7 CC(=O)C1=CNC=N1 50330 [1,0,0,0,0,0|3,0,0]=4 129 B8R1.7 CC(=O)C1=COC=C1 N12485 [1,0,0,0,0,0|1,1,0]=3 130 B8R1.7 CC(=O)C1=CSC=C1 50448 [1,0,0,0,0,0|1,0,0]=2 131 B8R1.7 CC(=O)C1=CSC=N1 23438 [1,0,0,0,0,0|2,0,0]=3 132 B8R1.7 CC(=O)C1=NNC=C1 36103 [1,0,0,0,0,0|3,0,0]=4 133 B8R1.7 CC(=O)C1=NNC=C1 D94907 [1,0,0,0,0,0|3,0,0]=4 134 B8R1.7 CC(=O)N1C=CN=C1 44451 [1,0,0,0,0,0|3,0,0]=4 135 B8R1.7 CC(C)=C1C=CC=C1 A10651 [1,0,0,0,0,0|3,0,0]=4 136 B8R1.7 C[C@H](O)C1=CCC=C1 F13266 [1,0,0,0,0,0|2,0,1]=4 137 B8R1.7 NC(=O)C1=CC=CN1 D83540 [1,0,0,0,0,0|3,0,0]=4 138 B8R1.7 NC(=O)C1=CC=CO1 A51100 [1,0,0,0,0,0|3,0,0]=4 139 B8R1.7 NC(=O)C1=CC=CS1 D85795 [1,0,0,0,0,0|3,0,0]=4 140 B8R1.7 NC(=O)C1=CN=CN1 29927 [1,0,0,0,0,0|3,0,0]=4 141 B8R1.7 NC(=O)C1=CNC=N1 S10625 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.7 NC(=O)C1=CNN=C1 88190 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.7 NC(=O)C1=CSC=N1 W10298 [1,0,0,0,0,0|2,0,0]=3 144 B8R1.7 NC(=O)C1=NNC=C1 CL3448 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.7 NC(=S)C1=CSC=N1 24426 [1,0,0,0,0,0|2,1,0]=4 146 B8R1.7 O=C(Cl)C1=CC=CS1 D78154 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.7 O=C(Cl)C1=CC=NO1 D82349 [1,0,0,0,0,0|3,0,0]=4 148 B8R1.7 O=C(O)C1=CC=CN1 33105 [1,0,0,0,0,0|2,0,0]=3 149 B8R1.7 O=C(O)C1=CC=CS1 D70571 [1,0,0,0,0,0|2,0,0]=3 150 B8R1.7 O=C(O)C1=CC=NO1 28558 [1,0,0,0,0,0|2,0,0]=3 151 B8R1.7 O=C(O)C1=CC=NS1 62856 [1,0,0,0,0,0|2,0,0]=3 152 B8R1.7 O=C(O)C1=CCC=C1 36684 [1,0,0,0,0,0|1,0,0]=2 153 B8R1.7 O=C(O)C1=CCCC1 C10074 [1,0,0,0,0,0|1,0,2]=4 154 B8R1.7 O=C(O)C1=CN=CO1 80167 [1,0,0,0,0,0|2,0,0]=3 155 B8R1.7 O=C(O)C1=CN=CS1 69866 [1,0,0,0,0,0|2,0,0]=3 156 B8R1.7 O=C(O)C1=CNC=C1 65414 [1,0,0,0,0,0|1,0,0]=2 157 B8R1.7 O=C(O)C1=CNC=N1 69188 [1,0,0,0,0,0|2,0,0]=3 158 B8R1.7 O=C(O)C1=CNN=C1 65412 [1,0,0,0,0,0|2,0,0]=3 159 B8R1.7 O=C(O)C1=COC=C1 83420 [1,0,0,0,0,0|0,1,0]=2 160 B8R1.7 O=C(O)C1=COC=N1 64870 [1,0,0,0,0,0|1,1,0]=3 161 B8R1.7 O=C(O)C1=COCC1 60301 [1,0,0,0,0,0|0,1,2]=4 162 B8R1.7 O=C(O)C1=CON=C1 25393 [1,0,0,0,0,0|1,1,0]=3 163 B8R1.7 O=C(O)C1=CSC=C1 P17867 [1,0,0,0,0,0|0,0,0]=1 164 B8R1.7 O=C(O)C1=CSC=N1 83445 [1,0,0,0,0,0|1,0,0]=2 165 B8R1.7 O=C(O)C1=CSN=N1 71069 [1,0,0,0,0,0|2,0,0]=3 166 B8R1.7 O=C(O)C1=NC=CN1 CL2211 [1,0,0,0,0,0|3,0,0]=4 167 B8R1.7 O=C(O)C1=NC=CS1 29143 [1,0,0,0,0,0|3,0,0]=4 168 B8R1.7 O=C(O)C1=NNC=C1 CL3512 [1,0,0,0,0,0|2,0,0]=3 169 B8R1.7 O=C(O)C1=NNC=N1 F14915 [1,0,0,0,0,0|3,0,0]=4 170 B8R1.7 O=C(O)C1=NOC=C1 24572 [1,0,0,0,0,0|1,1,0]=3 171 B8R1.7 O=C(O)C1=NON=C1 23711 [1,0,0,0,0,0|2,1,0]=4 172 B8R1.7 O=C(O)[C-]1C=CC=C1 D77984 [1,0,0,0,0,0|1,0,1]=3 173 B8R1.7 O=C(O)[C@@H]1C=CCN1 60104 [1,0,0,0,0,0|2,0,1]=4 174 B8R1.7 O=C(O)[C@@H]1C=CCN1 60105 [1,0,0,0,0,0|2,0,1]=4 175 B8R1.7 O=C([O-])C1=CC=CS1 F16481 [1,0,0,0,0,0|2,0,1]=4 176 B8R1.7 O=C([O-])C1=CC=CS1 H10133 [1,0,0,0,0,0|2,0,1]=4 177 B8R1.7 OB(O)C1=CCC=C1 F14115 [1,0,0,0,0,0|2,0,1]=4 178 B8R1.7 OB(O)C1=COC=C1 61454 [1,0,0,0,0,0|1,1,1]=4 179 B8R1.7 OB(O)C1=CSC=C1 33142 [1,0,0,0,0,0|1,0,1]=3 180 B10R1.14 CC1=CC(C(=O)NN)=CS1 D86469 [0,1,0,0,0,0|1,0,0]=2 181 B10R1.14 CC1=CC(C(=O)NN)=NN1 W15798 [0,1,0,0,0,0|3,0,0]=4 182 B10R1.14 CC1=CC(C(=O)NN)=NO1 20661 [0,1,0,0,0,0|2,1,0]=4 183 B10R1.14 CC1=NC(C(=O)NN)=CS1 20303 [0,1,0,0,0,0|2,0,0]=3 184 B10R1.14 CC1=NNC(C(=O)NN)=C1 AT10954 [0,1,0,0,0,0|3,0,0]=4 185 B10R1.14 CCC(=O)C1=CC=C(C)O1 N10391 [0,1,0,0,0,0|3,0,0]=4 186 B10R1.14 CNC(=O)C1=CSC(Br)=N1 D94836 [0,1,0,0,0,0|3,0,0]=4 187 B10R1.14 COC(=O)C1=CC(Br)=CN1 CL2807 [0,1,0,0,0,0|3,0,0]=4 188 B10R1.14 COC(=O)C1=CC(Br)=CO1 25677 [0,1,0,0,0,0|3,0,0]=4 189 B10R1.14 COC(=O)C1=CC(Br)=CS1 25584 [0,1,0,0,0,0|3,0,0]=4 190 B10R1.14 COC(=O)C1=CC(Br)=NN1 D70033 [0,1,0,0,0,0|3,0,0]=4 191 B10R1.14 COC(=O)C1=CC(N)=CS1 26318 [0,1,0,0,0,0|3,0,0]=4 192 B10R1.14 COC(=O)C1=CC(N)=NN1 38195 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.14 COC(=O)C1=CC(O)=NO1 11171 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.14 COC(=O)C1=CC=C(Br)N1 26294 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.14 COC(=O)C1=CC=C(Br)O1 33174 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.14 COC(=O)C1=CC=C(Br)S1 24044 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.14 COC(=O)C1=CC=C(C)N1 F19949 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.14 COC(=O)C1=CC=C(C)O1 Y10250 [0,1,0,0,0,0|2,0,0]=3 199 B10R1.14 COC(=O)C1=CC=C(C)S1 S10433 [0,1,0,0,0,0|2,0,0]=3 200 B10R1.14 COC(=O)C1=CC=C(N)O1 38243 [0,1,0,0,0,0|3,0,0]=4 201 B10R1.14 COC(=O)C1=CC=C(N)S1 26088 [0,1,0,0,0,0|3,0,0]=4 202 B10R1.14 COC(=O)C1=CN(C)C=N1 VT1447 [0,1,0,0,0,0|3,0,0]=4 203 B10R1.14 COC(=O)C1=CN=C(Br)S1 33092 [0,1,0,0,0,0|3,0,0]=4 204 B10R1.14 COC(=O)C1=CN=C(C)O1 64594 [0,1,0,0,0,0|2,0,0]=3 205 B10R1.14 COC(=O)C1=CN=C(C)S1 F12364 [0,1,0,0,0,0|2,0,0]=3 206 B10R1.14 COC(=O)C1=CN=C(Cl)S1 24982 [0,1,0,0,0,0|3,0,0]=4 207 B10R1.14 COC(=O)C1=CN=C(N)S1 82899 [0,1,0,0,0,0|3,0,0]=4 208 B10R1.14 COC(=O)C1=COC(C)=N1 49472 [0,1,0,0,0,0|1,1,0]=3 209 B10R1.14 COC(=O)C1=COC(Cl)=N1 35980 [0,1,0,0,0,0|2,1,0]=4 210 B10R1.14 COC(=O)C1=CSC(Br)=C1 P11679 [0,1,0,0,0,0|1,0,0]=2 211 B10R1.14 COC(=O)C1=CSC(Br)=N1 64123 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.14 COC(=O)C1=CSC(C)=N1 S10725 [0,1,0,0,0,0|1,0,0]=2 213 B10R1.14 COC(=O)C1=CSC(Cl)=C1 38490 [0,1,0,0,0,0|1,0,0]=2 214 B10R1.14 COC(=O)C1=CSC(Cl)=N1 CL2506 [0,1,0,0,0,0|2,0,0]=3 215 B10R1.14 COC(=O)C1=CSC(N)=N1 34082 [0,1,0,0,0,0|2,0,0]=3 216 B10R1.14 COC(=O)C1=NC(C)=CS1 35804 [0,1,0,0,0,0|3,0,0]=4 217 B10R1.14 COC(=O)C1=NC=C(C)O1 P10796 [0,1,0,0,0,0|3,0,0]=4 218 B10R1.14 COC(=O)C1=NN(C)C=C1 32285 [0,1,0,0,0,0|3,0,0]=4 219 B10R1.14 COC(=O)C1=NNC(Br)=C1 36428 [0,1,0,0,0,0|3,0,0]=4 220 B10R1.14 COC(=O)C1=NNC(C)=C1 F11978 [0,1,0,0,0,0|2,0,0]=3 221 B10R1.14 COC(=O)C1=NOC(C)=C1 76675 [0,1,0,0,0,0|1,1,0]=3 222 B10R1.31 CCC1=CC(C(=O)O)=CS1 54988 [0,1,0,0,0,0|0,0,0]=1 223 B10R1.31 CCC1=CC(C(=O)O)=NO1 F11842 [0,1,0,0,0,0|1,1,0]=3 224 B10R1.31 CCC1=NC(C(=O)O)=CO1 W18325 [0,1,0,0,0,0|1,1,0]=3 225 B10R1.31 CCN1C=C(C(C)=O)C=N1 D96811 [0,1,0,0,0,0|3,0,0]=4 226 B10R1.31 CCN1C=CC(C(=O)O)=N1 30867 [0,1,0,0,0,0|3,0,0]=4 227 B10R1.31 CSC1=CC=C(C(=O)O)S1 W17807 [0,1,0,0,0,0|2,0,0]=3 228 B10R1.31 CSC1=NC(C(=O)O)=CS1 D82192 [0,1,0,0,0,0|1,0,0]=2 229 B10R1.31 N#CC1=CC([N+](=O)[O-])=CS1 78064 [0,1,0,0,0,0|1,0,2]=4 230 B10R1.31 N#CC1=CNC(C(=O)O)=C1 59469 [0,1,0,0,0,0|2,0,1]=4 231 B10R1.31 O=C(O)C1=CC(CO)=CS1 D82538 [0,1,0,0,0,0|2,0,0]=3 232 B10R1.31 O=C(O)C1=CC=C(CO)O1 67726 [0,1,0,0,0,0|2,0,0]=3 233 B10R1.31 O=CC1=CC(B(O)O)=CS1 32742 [0,1,0,0,0,0|1,0,2]=4 234 B10R1.31 O=CC1=CC=C(C(=O)O)N1 F17110 [0,1,0,0,0,0|2,0,1]=4 235 B10R1.31 O=CC1=CC=C(C(=O)O)O1 O11442 [0,1,0,0,0,0|2,0,1]=4 236 B10R1.31 O=CC1=CC=C(C(=O)O)S1 76294 [0,1,0,0,0,0|2,0,1]=4 237 B10R1.31 OCC1=CC(B(O)O)=CS1 Y10141 [0,1,0,0,0,0|1,0,1]=3 238 B10R1.58 CC1=C(Br)SC(C(=O)O)=C1 F19706 [0,1,0,0,0,0|2,0,0]=3 239 B10R1.58 CC1=C(C)OC(C(=O)O)=C1 83430 [0,1,0,0,0,0|2,0,0]=3 240 B10R1.58 CC1=C(C)SC(C(=O)O)=N1 S10220 [0,1,0,0,0,0|3,0,0]=4 241 B10R1.58 CC1=CC(C(=O)O)=NN1C 68167 [0,1,0,0,0,0|2,0,0]=3 242 B10R1.58 CC1=CC(C(N)=O)=NN1C AC1278 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.58 CN1N=C(C(=O)O)C=C1O 78449 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.58 O=C(O)C1=CC(Br)=C(Br)O1 33084 [0,1,0,0,0,0|3,0,0]=4 245 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 91269 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.58 O=C(O)C1=CC(Cl)=C(Cl)S1 26271 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.59 CC(=O)C1=C(Br)SC(Br)=C1 AC1204 [0,1,0,0,0,0|2,0,0]=3 248 B10R1.59 CC(=O)C1=C(C)N=C(C)S1 F20383 [0,1,0,0,0,0|3,0,0]=4 249 B10R1.59 CC(=O)C1=C(C)OC(C)=C1 AT17488 [0,1,0,0,0,0|1,1,0]=3 250 B10R1.59 CC(=O)C1=C(C)SC(C)=C1 O10254 [0,1,0,0,0,0|1,0,0]=2 251 B10R1.59 CC(=O)C1=C(Cl)SC(Cl)=C1 P10027 [0,1,0,0,0,0|2,0,0]=3 252 B10R1.59 CC(=O)C1=CN(C)N=C1C D82148 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.59 CC1=C(C(=O)O)OC(Br)=C1 F19166 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.59 CC1=C(C(=O)O)SC(Br)=C1 73459 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.59 CC1=C(C(=O)O)SC(Br)=N1 73972 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 68704 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.59 CC1=C(C(=O)O)SC(O)=N1 25198 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.59 CC1=CC(B(O)O)=C(C)S1 71924 [0,1,0,0,0,0|1,0,1]=3 259 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 60580 [0,1,0,0,0,0|0,1,0]=2 260 B10R1.59 CC1=NC(C(=O)O)=C(C)O1 86688 [0,1,0,0,0,0|1,1,0]=3 261 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 36072 [0,1,0,0,0,0|2,0,0]=3 262 B10R1.59 CC1=NC(C)=C(C(=O)O)S1 23323 [0,1,0,0,0,0|2,0,0]=3 263 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 CL3405 [0,1,0,0,0,0|2,0,0]=3 264 B10R1.59 CC1=NN(C)C(C(N)=O)=C1 TD8060 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.59 CC1=NN(C)C=C1C(=O)O 36025 [0,1,0,0,0,0|2,0,0]=3 266 B10R1.59 CN1C=C(Br)C(C(=O)O)=N1 30250 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.59 NC1=NC(C(=O)O)=C(Br)S1 D86795 [0,1,0,0,0,0|2,0,0]=3 268 B10R1.59 O=C(O)C1=C(Br)SC(Br)=C1 F17134 [0,1,0,0,0,0|1,0,0]=2 269 B10R1.59 O=C(O)C1=C(Br)SC(Br)=N1 O10609 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.59 O=C(O)C1=C(Cl)N=C(Cl)S1 26774 [0,1,0,0,0,0|3,0,0]=4 271 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=C1 23446 [0,1,0,0,0,0|1,0,0]=2 272 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=N1 26518 [0,1,0,0,0,0|2,0,0]=3 273 B10R1.194 CC1=C(Br)C(C(=O)O)=NN1 K10046 [0,1,0,0,0,0|2,0,0]=3 274 B10R1.194 CC1=C(C(=O)O)C=CN1C C77030 [0,1,0,0,0,0|2,0,0]=3 275 B10R1.194 CC1=C(C(=O)O)SC=C1Br H10542 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.194 CC1=C(C)C(C(=O)O)=NO1 60346 [0,1,0,0,0,0|1,1,0]=3 277 B10R1.194 CC1=CNC(C(=O)O)=C1C 38037 [0,1,0,0,0,0|2,0,0]=3 278 B10R1.194 CC1=CSC(C(=O)O)=C1Cl W16284 [0,1,0,0,0,0|2,0,0]=3 279 B10R1.194 CC1=NC=C(C(=O)O)N1C W10998 [0,1,0,0,0,0|2,0,0]=3 280 B10R1.194 CN1C(C(=O)O)=CN=C1S W11425 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.194 CN1N=CC(C(=O)O)=C1Cl F17236 [0,1,0,0,0,0|2,0,0]=3 282 B10R1.194 CN1N=CC(C(=O)O)=C1N BL009259 [0,1,0,0,0,0|2,0,0]=3 283 B10R1.194 O=C(O)C1=C(Cl)C(Cl)=NS1 60658 [0,1,0,0,0,0|3,0,0]=4 284 B8R0.9 CNC(=O)\C=C/C(=O)O D91423 [0,0,1,0,0,0|2,0,1]=4 285 B8R0.9 COC(=O)\C=C\C(=O)O A11518 [0,0,1,0,0,0|1,1,1]=4 286 B8R0.23 C=C(NC(C)=O)C(=O)O F20437 [0,0,1,0,0,0|1,1,0]=3 287 B8R0.23 C\C(=C/C(C)C)C(=O)O D83819 [0,0,1,0,0,0|1,0,2]=4 288 B8R0.23 C\C(=C\C(=O)O)C(=O)O D95321 [0,0,1,0,0,0|1,1,1]=4 289 B8R0.28 CC(=O)SCCC(=O)O N12196 [0,0,1,0,0,0|1,0,2]=4 290 B8R0.28 CC(=O)\C=C\C=C(C)C 74345 [0,0,1,0,0,0|2,0,1]=4 291 B8R0.28 CN(C)C\C=C\C(=O)O 23615 [0,0,1,0,0,0|2,0,1]=4 292 B8R0.28 O=C(O)\C=C\CC(=O)O F21361 [0,0,1,0,0,0|3,0,0]=4 293 B10R1.13 C=C(C)C1=CC=C(C)C=C1 F17145 [0,0,0,0,0,1|3,0,0]=4 294 B10R1.13 CC(=O)C1=CC=C(C)C=C1 D70502 [0,0,0,0,0,1|2,0,0]=3 295 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 N10056 [0,0,0,0,0,1|3,0,0]=4 296 B10R1.13 CC(=O)C1=CC=C(F)C=C1 D70558 [0,0,0,0,0,1|3,0,0]=4 297 B10R1.13 CC(=O)C1=CC=C(I)C=C1 34152 [0,0,0,0,0,1|3,0,0]=4 298 B10R1.13 CC(=O)C1=CC=C(N)C=C1 D88235 [0,0,0,0,0,1|3,0,0]=4 299 B10R1.13 CC(=O)C1=CC=C(N)C=C1 F11286 [0,0,0,0,0,1|3,0,0]=4 300 B10R1.13 CC(=O)C1=CC=C(O)C=C1 44466 [0,0,0,0,0,1|3,0,0]=4 301 B10R1.13 CC(=O)C1=CN=C(Br)C=C1 34646 [0,0,0,0,0,1|3,0,0]=4 302 B10R1.13 CC(=O)C1=CN=C(C)C=C1 24573 [0,0,0,0,0,1|2,0,0]=3 303 B10R1.13 CC(=O)C1=CN=C(Cl)C=C1 57255 [0,0,0,0,0,1|3,0,0]=4 304 B10R1.13 CC(=O)C1=CN=C(Cl)C=N1 25655 [0,0,0,0,0,1|3,0,0]=4 305 B10R1.13 CC(=O)C1=CN=C(Cl)N=C1 C10484 [0,0,0,0,0,1|3,0,0]=4 306 B10R1.13 CC(=O)C1=CN=C(F)C=C1 26492 [0,0,0,0,0,1|3,0,0]=4 307 B10R1.13 CC(=O)C1=CN=C(N)C=C1 AB8078 [0,0,0,0,0,1|3,0,0]=4 308 B10R1.13 CC(=O)C1=CN=C(O)C=C1 36014 [0,0,0,0,0,1|3,0,0]=4 309 B10R1.13 CC(=O)C1=NC=C(Br)C=C1 56961 [0,0,0,0,0,1|3,0,0]=4 310 B10R1.13 CC(=O)C1=NC=C(C)C=C1 AB1019 [0,0,0,0,0,1|2,0,0]=3 311 B10R1.13 CC(=O)C1=NC=C(Cl)C=C1 80291 [0,0,0,0,0,1|3,0,0]=4 312 B10R1.13 CC(=O)C1=NC=C(F)C=C1 D82396 [0,0,0,0,0,1|3,0,0]=4 313 B10R1.13 CC1=CC=C(B(O)O)C=C1 26016 [0,0,0,0,0,1|2,0,1]=4 314 B10R1.13 CC1=CC=C(C(=N)N)C=C1 F11800 [0,0,0,0,0,1|3,0,0]=4 315 B10R1.13 CC1=CC=C(C(=O)O)C=C1 D70680 [0,0,0,0,0,1|1,0,0]=2 316 B10R1.13 CC1=CC=C(C(N)=O)C=C1 35410 [0,0,0,0,0,1|2,0,0]=3 317 B10R1.13 CC1=CC=C(C(N)=S)C=C1 H10917 [0,0,0,0,0,1|2,1,0]=4 318 B10R1.13 CC1=CC=C([C@H](C)O)C=C1 AC1243 [0,0,0,0,0,1|2,0,1]=4 319 B10R1.13 CC1=CC=C([S@@](N)=O)C=C1 97007 [0,0,0,0,0,1|3,0,0]=4 320 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 AC8095 [0,0,0,0,0,1|2,0,1]=4 321 B10R1.13 CC1=CC=C([S@](=O)[O-])C=C1 D80624 [0,0,0,0,0,1|2,0,1]=4 322 B10R1.13 CC1=CC=C([S@](C)=O)C=C1 95016 [0,0,0,0,0,1|3,0,0]=4 323 B10R1.13 CC1=CN=C(C(=O)O)C=C1 23515 [0,0,0,0,0,1|1,0,0]=2 324 B10R1.13 CC1=CN=C(C(=O)O)C=C1 C13862 [0,0,0,0,0,1|1,0,0]=2 325 B10R1.13 CC1=CN=C(C(=O)O)C=N1 89310 [0,0,0,0,0,1|1,0,0]=2 326 B10R1.13 CC1=CN=C(C(N)=O)C=N1 88782 [0,0,0,0,0,1|2,0,0]=3 327 B10R1.13 CC1=CN=C([N+](=O)[O-])C=C1 25566 [0,0,0,0,0,1|2,0,1]=4 328 B10R1.13 CC1=NC=C(B(O)O)C=C1 29651 [0,0,0,0,0,1|2,0,1]=4 329 B10R1.13 CC1=NC=C(B(O)O)C=C1 67891 [0,0,0,0,0,1|2,0,1]=4 330 B10R1.13 CC1=NC=C(B(O)O)C=N1 P10472 [0,0,0,0,0,1|2,0,1]=4 331 B10R1.13 CC1=NC=C(C(=O)O)C=C1 78731 [0,0,0,0,0,1|1,0,0]=2 332 B10R1.13 CC1=NC=C(C(=O)O)C=N1 CL1902 [0,0,0,0,0,1|1,0,0]=2 333 B10R1.13 CC1=NC=C(C(N)=O)C=C1 AB2935 [0,0,0,0,0,1|2,0,0]=3 334 B10R1.13 CC1=NC=C([C@H](C)O)C=C1 N12208 [0,0,0,0,0,1|2,0,1]=4 335 B10R1.13 CC1=NC=C([N+](=O)[O-])C=C1 22533 [0,0,0,0,0,1|2,0,1]=4 336 B10R1.13 CC1=NN=C(C(=O)O)C=C1 51799 [0,0,0,0,0,1|2,0,0]=3 337 B10R1.13 NC(=O)C1=CC=C(Br)C=C1 F10314 [0,0,0,0,0,1|3,0,0]=4 338 B10R1.13 NC(=O)C1=CC=C(Cl)C=C1 78552 [0,0,0,0,0,1|3,0,0]=4 339 B10R1.13 NC(=O)C1=CC=C(F)C=C1 W18647 [0,0,0,0,0,1|3,0,0]=4 340 B10R1.13 NC(=O)C1=CC=C(I)C=C1 D94716 [0,0,0,0,0,1|3,0,0]=4 341 B10R1.13 NC(=O)C1=CC=C(N)C=C1 26019 [0,0,0,0,0,1|3,0,0]=4 342 B10R1.13 NC(=O)C1=CC=C(O)C=C1 D90813 [0,0,0,0,0,1|3,0,0]=4 343 B10R1.13 NC(=O)C1=CN=C(Br)C=C1 O11563 [0,0,0,0,0,1|3,0,0]=4 344 B10R1.13 NC(=O)C1=CN=C(Cl)C=C1 AB8937 [0,0,0,0,0,1|3,0,0]=4 345 B10R1.13 NC(=O)C1=CN=C(Cl)C=N1 35602 [0,0,0,0,0,1|3,0,0]=4 346 B10R1.13 NC(=O)C1=CN=C(N)C=C1 32965 [0,0,0,0,0,1|3,0,0]=4 347 B10R1.13 NC(=O)C1=NC=C(Br)C=C1 BL003043 [0,0,0,0,0,1|3,0,0]=4 348 B10R1.13 NC(=O)C1=NC=C(Cl)C=C1 F51214 [0,0,0,0,0,1|3,0,0]=4 349 B10R1.13 NC(=O)C1=NC=C(F)C=C1 H10045 [0,0,0,0,0,1|3,0,0]=4 350 B10R1.13 NC(=O)C1=NC=C(O)C=C1 P11310 [0,0,0,0,0,1|3,0,0]=4 351 B10R1.13 NC1=CC=C(C(=O)O)C=C1 20052 [0,0,0,0,0,1|2,0,0]=3 352 B10R1.13 NC1=CC=C(C(=O)[O-])C=C1 O12079 [0,0,0,0,0,1|2,0,1]=4 353 B10R1.13 NC1=CN=C(C(=O)O)C=C1 20196 [0,0,0,0,0,1|2,0,0]=3 354 B10R1.13 NC1=CN=C(C(=O)O)C=N1 RB3194 [0,0,0,0,0,1|2,0,0]=3 355 B10R1.13 NC1=NC=C(C(=O)O)C=C1 CL1029 [0,0,0,0,0,1|2,0,0]=3 356 B10R1.13 NC1=NC=C(C(=O)O)C=N1 20118 [0,0,0,0,0,1|2,0,0]=3 357 B10R1.13 NC1=NN=C(C(=O)O)C=C1 20191 [0,0,0,0,0,1|3,0,0]=4 358 B10R1.13 O=C(Cl)C1=CC=C(F)C=C1 CK1093 [0,0,0,0,0,1|3,0,0]=4 359 B10R1.13 O=C(Cl)C1=CC=C(I)C=C1 35169 [0,0,0,0,0,1|3,0,0]=4 360 B10R1.13 O=C(Cl)C1=CN=C(Cl)C=C1 D78310 [0,0,0,0,0,1|3,0,0]=4 361 B10R1.13 O=C(Cl)C1=CN=C(F)C=C1 78380 [0,0,0,0,0,1|3,0,0]=4 362 B10R1.13 O=C(O)C1=CC=C(Br)C=C1 AB10302 [0,0,0,0,0,1|2,0,0]=3 363 B10R1.13 O=C(O)C1=CC=C(Cl)C=C1 D77513 [0,0,0,0,0,1|2,0,0]=3 364 B10R1.13 O=C(O)C1=CC=C(F)C=C1 D70922 [0,0,0,0,0,1|2,0,0]=3 365 B10R1.13 O=C(O)C1=CC=C(I)C=C1 D70923 [0,0,0,0,0,1|2,0,0]=3 366 B10R1.13 O=C(O)C1=CC=C(O)C=C1 D86505 [0,0,0,0,0,1|2,0,0]=3 367 B10R1.13 O=C(O)C1=CC=C(S)C=C1 22131 [0,0,0,0,0,1|2,0,0]=3 368 B10R1.13 O=C(O)C1=CC=[N+]([O-])C=C1 AC9176 [0,0,0,0,0,1|3,0,0]=4 369 B10R1.13 O=C(O)C1=CN=C(Br)C=C1 56134 [0,0,0,0,0,1|2,0,0]=3 370 B10R1.13 O=C(O)C1=CN=C(Br)C=N1 RB3133 [0,0,0,0,0,1|2,0,0]=3 371 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 CX1097 [0,0,0,0,0,1|2,0,0]=3 372 B10R1.13 O=C(O)C1=CN=C(Cl)C=N1 RB3034 [0,0,0,0,0,1|2,0,0]=3 373 B10R1.13 O=C(O)C1=CN=C(Cl)N=C1 57263 [0,0,0,0,0,1|2,0,0]=3 374 B10R1.13 O=C(O)C1=CN=C(F)C=C1 11221 [0,0,0,0,0,1|2,0,0]=3 375 B10R1.13 O=C(O)C1=CN=C(O)C=C1 CX1100 [0,0,0,0,0,1|2,0,0]=3 376 B10R1.13 O=C(O)C1=NC=C(Br)C=C1 56132 [0,0,0,0,0,1|2,0,0]=3 377 B10R1.13 O=C(O)C1=NC=C(Br)C=N1 23833 [0,0,0,0,0,1|3,0,0]=4 378 B10R1.13 O=C(O)C1=NC=C(Cl)C=C1 FD17030 [0,0,0,0,0,1|2,0,0]=3 379 B10R1.13 O=C(O)C1=NC=C(Cl)C=N1 27137 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.13 O=C(O)C1=NC=C(F)C=C1 22539 [0,0,0,0,0,1|2,0,0]=3 381 B10R1.13 O=C(O)C1=NC=C(O)C=C1 32448 [0,0,0,0,0,1|2,0,0]=3 382 B10R1.13 O=C(O)C1=NC=C(O)C=C1 CX1286 [0,0,0,0,0,1|2,0,0]=3 383 B10R1.13 O=C(O)C1=NC=C(O)C=C1 W10240 [0,0,0,0,0,1|2,0,0]=3 384 B10R1.13 O=C(O)C1=NC=C(O)N=C1 62307 [0,0,0,0,0,1|2,0,0]=3 385 B10R1.13 O=C(O)C1=NN=C(Cl)C=C1 57277 [0,0,0,0,0,1|3,0,0]=4 386 B10R1.13 O=C(O)C1=NN=C(O)C=C1 20193 [0,0,0,0,0,1|3,0,0]=4 387 B10R1.13 O=C(O)C1=NN=C(O)C=C1 23421 [0,0,0,0,0,1|3,0,0]=4 388 B10R1.13 O=C([O-])C1=CC=C(F)C=C1 D83108 [0,0,0,0,0,1|2,0,1]=4 389 B10R1.13 O=C([O-])C1=CC=C(O)C=C1 D71249 [0,0,0,0,0,1|2,0,1]=4 390 B10R1.13 O=C1C=CC(C(=O)O)=CO1 38123 [0,0,0,0,0,1|1,1,0]=3 391 B10R1.54 CC(=O)NC1=NNC(C)=C1 W12887 [0,0,0,0,0,1|3,0,0]=4 392 B10R1.54 CC1=NC(CC(=O)O)=CS1 71392 [0,0,0,0,0,1|1,0,0]=2 393 B10R1.54 CC1=NOC(CC(=O)O)=C1 73992 [0,0,0,0,0,1|2,0,0]=3 394 B10R1.54 C[N+]1=CN(CC(=O)O)C=C1 D80537 [0,0,0,0,0,1|3,0,0]=4 395 B10R1.54 NC(=O)CC1=CSC(N)=N1 37114 [0,0,0,0,0,1|3,0,0]=4 396 B10R1.54 NC1=NC(CC(=O)O)=CS1 C10840 [0,0,0,0,0,1|2,0,0]=3 397 B10R1.54 NC1=NC(CC(=O)O)=CS1 D72492 [0,0,0,0,0,1|2,0,0]=3 398 B10R1.54 O=C(O)CC1=CC(Br)=CS1 D97326 [0,0,0,0,0,1|3,0,0]=4 399 B10R1.54 O=C(O)CC1=CC=C(Cl)S1 71335 [0,0,0,0,0,1|3,0,0]=4 400 B10R1.113 CC(=O)C1=CC(Br)=CN=C1 71412 [0,0,0,0,0,1|3,0,0]=4 401 B10R1.113 CC(=O)C1=CC(C)=CC=C1 28342 [0,0,0,0,0,1|2,0,0]=3 402 B10R1.113 CC(=O)C1=CC(Cl)=NC=C1 80227 [0,0,0,0,0,1|3,0,0]=4 403 B10R1.113 CC(=O)C1=CC(N)=CC=C1 D70852 [0,0,0,0,0,1|3,0,0]=4 404 B10R1.113 CC(=O)C1=CC(O)=CC=C1 44505 [0,0,0,0,0,1|3,0,0]=4 405 B10R1.113 CC(=O)C1=CC=CC(Br)=C1 D70815 [0,0,0,0,0,1|3,0,0]=4 406 B10R1.113 CC(=O)C1=CC=CC(F)=C1 34142 [0,0,0,0,0,1|3,0,0]=4 407 B10R1.113 CC(=O)C1=CC=CC(I)=C1 CK2572 [0,0,0,0,0,1|3,0,0]=4 408 B10R1.113 CC(=O)C1=CN=CC(C)=C1 I11175 [0,0,0,0,0,1|2,0,0]=3 409 B10R1.113 CC(=O)C1=NC(C)=CC=C1 34681 [0,0,0,0,0,1|3,0,0]=4 410 B10R1.113 CC(=O)C1=NC=CC(C)=C1 AB1018 [0,0,0,0,0,1|2,0,0]=3 411 B10R1.113 CC(=O)C1=NC=CC(Cl)=C1 72047 [0,0,0,0,0,1|3,0,0]=4 412 B10R1.113 CC(=O)C1=NC=NC(C)=C1 FD13029 [0,0,0,0,0,1|2,0,0]=3 413 B10R1.113 CC1=CC(B(O)O)=CN=C1 24597 [0,0,0,0,0,1|2,0,1]=4 414 B10R1.113 CC1=CC(C(=O)O)=CN=C1 63156 [0,0,0,0,0,1|1,0,0]=2 415 B10R1.113 CC1=CC(C(=O)O)=NC=C1 59430 [0,0,0,0,0,1|1,0,0]=2 416 B10R1.113 CC1=CC(C(=O)O)=NC=N1 P10833 [0,0,0,0,0,1|1,0,0]=2 417 B10R1.113 CC1=CC(C(N)=O)=CN=C1 AB11819 [0,0,0,0,0,1|2,0,0]=3 418 B10R1.113 CC1=CC([N+](=O)[O-])=NC=C1 S10244 [0,0,0,0,0,1|2,0,1]=4 419 B10R1.113 CC1=CC=CC(B(O)O)=C1 26035 [0,0,0,0,0,1|2,0,1]=4 420 B10R1.113 CC1=CC=CC(C(=N)N)=C1 F11748 [0,0,0,0,0,1|3,0,0]=4 421 B10R1.113 CC1=CC=CC(C(=O)Cl)=C1 D78225 [0,0,0,0,0,1|2,0,0]=3 422 B10R1.113 CC1=CC=CC(C(=O)O)=C1 D70873 [0,0,0,0,0,1|1,0,0]=2 423 B10R1.113 CC1=CC=CC(C(=O)O)=N1 CL0233 [0,0,0,0,0,1|2,0,0]=3 424 B10R1.113 CC1=CC=CC(C(N)=S)=C1 A10481 [0,0,0,0,0,1|2,1,0]=4 425 B10R1.113 CC1=CC=CC([C@H](C)O)=C1 73947 [0,0,0,0,0,1|2,0,1]=4 426 B10R1.113 CC1=CC=CC([N+](=O)[O-])=C1 F21441 [0,0,0,0,0,1|2,0,1]=4 427 B10R1.113 CC1=CC=NC(C(N)=O)=N1 D82541 [0,0,0,0,0,1|3,0,0]=4 428 B10R1.113 CC1=CN=CC(C(=O)O)=N1 25557 [0,0,0,0,0,1|2,0,0]=3 429 B10R1.113 CC1=CN=CC(C(N)=O)=N1 D80234 [0,0,0,0,0,1|3,0,0]=4 430 B10R1.113 CC1=NC=CC(B(O)O)=C1 32941 [0,0,0,0,0,1|2,0,1]=4 431 B10R1.113 CC1=NC=CC(B(O)O)=C1 A12896 [0,0,0,0,0,1|2,0,1]=4 432 B10R1.113 CC1=NC=CC(C(=O)O)=C1 63948 [0,0,0,0,0,1|1,0,0]=2 433 B10R1.113 CC1=NC=CC(C(=O)O)=N1 24979 [0,0,0,0,0,1|2,0,0]=3 434 B10R1.113 CC1=NC=CC([N+](=O)[O-])=C1 22423 [0,0,0,0,0,1|2,0,1]=4 435 B10R1.113 C[N+]1=CC=CC(C(=O)O)=C1 42967 [0,0,0,0,0,1|2,0,0]=3 436 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 D80780 [0,0,0,0,0,1|3,0,0]=4 437 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 D91325 [0,0,0,0,0,1|3,0,0]=4 438 B10R1.113 NC(=O)C1=CC(Br)=CN=C1 20585 [0,0,0,0,0,1|3,0,0]=4 439 B10R1.113 NC(=O)C1=CC(Br)=NC=C1 F19938 [0,0,0,0,0,1|3,0,0]=4 440 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 78772 [0,0,0,0,0,1|3,0,0]=4 441 B10R1.113 NC(=O)C1=CC(F)=CN=C1 29187 [0,0,0,0,0,1|3,0,0]=4 442 B10R1.113 NC(=O)C1=CC(N)=CC=C1 35377 [0,0,0,0,0,1|3,0,0]=4 443 B10R1.113 NC(=O)C1=CC(N)=NC=C1 29050 [0,0,0,0,0,1|3,0,0]=4 444 B10R1.113 NC(=O)C1=CC=CC(Br)=C1 26029 [0,0,0,0,0,1|3,0,0]=4 445 B10R1.113 NC(=O)C1=CC=CC(Cl)=C1 D70126 [0,0,0,0,0,1|3,0,0]=4 446 B10R1.113 NC(=O)C1=CC=CC(F)=C1 D71217 [0,0,0,0,0,1|3,0,0]=4 447 B10R1.113 NC(=O)C1=CC=CC(I)=C1 T71545 [0,0,0,0,0,1|3,0,0]=4 448 B10R1.113 NC(=O)C1=CN=CC(N)=C1 25964 [0,0,0,0,0,1|3,0,0]=4 449 B10R1.113 NC(=O)C1=NC=CC(Br)=C1 39241 [0,0,0,0,0,1|3,0,0]=4 450 B10R1.113 NC(=O)C1=NC=CC(Cl)=C1 CL0190 [0,0,0,0,0,1|3,0,0]=4 451 B10R1.113 NC(=O)C1=NC=CC(F)=C1 30416 [0,0,0,0,0,1|3,0,0]=4 452 B10R1.113 NC1=CC(C(=O)O)=CN=C1 23148 [0,0,0,0,0,1|2,0,0]=3 453 B10R1.113 NC1=CC(C(=O)O)=NC=C1 31876 [0,0,0,0,0,1|2,0,0]=3 454 B10R1.113 NC1=CC(C(=O)O)=NC=C1 36296 [0,0,0,0,0,1|2,0,0]=3 455 B10R1.113 NC1=CC(C(=O)O)=NC=C1 CL0353 [0,0,0,0,0,1|2,0,0]=3 456 B10R1.113 NC1=CC(C(=O)O)=NC=N1 D84123 [0,0,0,0,0,1|2,0,0]=3 457 B10R1.113 NC1=CC=CC(C(=O)O)=C1 D70484 [0,0,0,0,0,1|2,0,0]=3 458 B10R1.113 NC1=CC=CC(C(=O)O)=N1 CL0230 [0,0,0,0,0,1|3,0,0]=4 459 B10R1.113 NC1=NC=CC(C(=O)O)=C1 20144 [0,0,0,0,0,1|2,0,0]=3 460 B10R1.113 NC1=NC=CC(C(=O)O)=N1 BL000508 [0,0,0,0,0,1|3,0,0]=4 461 B10R1.113 O=C(Cl)C1=CC(Br)=CN=C1 A10427 [0,0,0,0,0,1|3,0,0]=4 462 B10R1.113 O=C(Cl)C1=CC(F)=CC=C1 75835 [0,0,0,0,0,1|3,0,0]=4 463 B10R1.113 O=C(Cl)C1=CC=CC(Br)=C1 67715 [0,0,0,0,0,1|3,0,0]=4 464 B10R1.113 O=C(Cl)C1=CC=CC(Cl)=C1 D77316 [0,0,0,0,0,1|3,0,0]=4 465 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 AB6459 [0,0,0,0,0,1|2,0,0]=3 466 B10R1.113 O=C(O)C1=CC(Br)=NC=C1 52660 [0,0,0,0,0,1|2,0,0]=3 467 B10R1.113 O=C(O)C1=CC(Cl)=CN=C1 33164 [0,0,0,0,0,1|2,0,0]=3 468 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 P16537 [0,0,0,0,0,1|2,0,0]=3 469 B10R1.113 O=C(O)C1=CC(Cl)=NC=N1 P10631 [0,0,0,0,0,1|2,0,0]=3 470 B10R1.113 O=C(O)C1=CC(Cl)=NN=C1 38772 [0,0,0,0,0,1|2,0,0]=3 471 B10R1.113 O=C(O)C1=CC(F)=CN=C1 82240 [0,0,0,0,0,1|2,0,0]=3 472 B10R1.113 O=C(O)C1=CC(F)=NC=C1 22391 [0,0,0,0,0,1|2,0,0]=3 473 B10R1.113 O=C(O)C1=CC(I)=CN=C1 26596 [0,0,0,0,0,1|2,0,0]=3 474 B10R1.113 O=C(O)C1=CC(I)=NC=C1 A10522 [0,0,0,0,0,1|2,0,0]=3 475 B10R1.113 O=C(O)C1=CC(O)=NC=C1 62227 [0,0,0,0,0,1|2,0,0]=3 476 B10R1.113 O=C(O)C1=CC=CC(Br)=C1 22039 [0,0,0,0,0,1|2,0,0]=3 477 B10R1.113 O=C(O)C1=CC=CC(Br)=N1 56092 [0,0,0,0,0,1|3,0,0]=4 478 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 AC7860 [0,0,0,0,0,1|2,0,0]=3 479 B10R1.113 O=C(O)C1=CC=CC(Cl)=N1 58082 [0,0,0,0,0,1|3,0,0]=4 480 B10R1.113 O=C(O)C1=CC=CC(F)=C1 AC7508 [0,0,0,0,0,1|2,0,0]=3 481 B10R1.113 O=C(O)C1=CC=CC(F)=N1 88349 [0,0,0,0,0,1|3,0,0]=4 482 B10R1.113 O=C(O)C1=CC=CC(I)=C1 36348 [0,0,0,0,0,1|2,0,0]=3 483 B10R1.113 O=C(O)C1=CC=CC(S)=C1 C10086 [0,0,0,0,0,1|2,0,0]=3 484 B10R1.113 O=C(O)C1=CC=NC(Cl)=N1 24532 [0,0,0,0,0,1|3,0,0]=4 485 B10R1.113 O=C(O)C1=CN=CC(Br)=N1 Y10050 [0,0,0,0,0,1|3,0,0]=4 486 B10R1.113 O=C(O)C1=CN=CC(Cl)=N1 RB3064 [0,0,0,0,0,1|3,0,0]=4 487 B10R1.113 O=C(O)C1=CN=CC(O)=C1 69574 [0,0,0,0,0,1|2,0,0]=3 488 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=C1 AC8656 [0,0,0,0,0,1|3,0,0]=4 489 B10R1.113 O=C(O)C1=NC(O)=CC=C1 22204 [0,0,0,0,0,1|3,0,0]=4 490 B10R1.113 O=C(O)C1=NC(O)=NC=C1 24239 [0,0,0,0,0,1|3,0,0]=4 491 B10R1.113 O=C(O)C1=NC=CC(Br)=C1 54504 [0,0,0,0,0,1|2,0,0]=3 492 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 57846 [0,0,0,0,0,1|2,0,0]=3 493 B10R1.113 O=C(O)C1=NC=CC(I)=C1 CL0291 [0,0,0,0,0,1|2,0,0]=3 494 B10R1.113 O=C(O)C1=NC=CC(O)=C1 52376 [0,0,0,0,0,1|2,0,0]=3 495 B10R1.113 O=C(O)C1=NC=NC(O)=C1 63339 [0,0,0,0,0,1|2,0,0]=3 496 B10R1.113 O=C1C=C(C(=O)O)C=NN1 25957 [0,0,0,0,0,1|2,0,0]=3 497 B10R1.113 O=C1C=COC(C(=O)O)=C1 78186 [0,0,0,0,0,1|2,0,0]=3 498 B10R1.113 O=C1C=NC=C(C(=O)O)N1 O11623 [0,0,0,0,0,1|3,0,0]=4 499 B10R1.113 O=C1CC(C(=O)O)=CC=N1 D72730 [0,0,0,0,0,1|2,0,1]=4 500 B10R1.113 O=C1N=CC=C(C(=O)O)N1 26790 [0,0,0,0,0,1|3,0,0]=4 501 B7R0.4 CCC\C=C\C(=O)O C10700 [1,0,1,0,0,0|1,0,1]=4 502 B7R0.4 CCO\C=C\C(=O)O 30211 [1,0,1,0,0,0|0,1,1]=4 503 B7R0.4 C\C=C\C=C\C(=O)[O-] D92224 [1,0,1,0,0,0|1,0,1]=4 504 B7R0.4 C\C=C\C=C\C(=O)[O-] D92225 [1,0,1,0,0,0|1,0,1]=4 505 B7R0.5 CC\C=C(/C)C(=O)O D78175 [1,0,1,0,0,0|0,0,2]=4 506 B7R0.6 C=C(C)CCC(=O)O 80208 [1,0,1,0,0,0|0,0,2]=4 507 B7R0.6 CC(=O)\C=C\C(=O)O D82816 [1,0,1,0,0,0|0,1,0]=3 508 B7R0.6 CC(C)\C=C\C(=O)O D91297 [1,0,1,0,0,0|0,0,2]=4 509 B7R0.6 NC(=O)\C=C/C(=O)O A11397 [1,0,1,0,0,0|1,1,0]=4 510 B7R0.6 O=C(O)\C=C\C(=O)O D85166 [1,0,1,0,0,0|1,1,0]=4 511 B7R0.6 O=C([O-])\C=C/C(=O)O D91269 [1,0,1,0,0,0|1,1,0]=4 512 B7R1.1 BrCC1=CSC=C1 54789 [2,0,0,0,0,0|1,0,1]=4 513 B7R1.1 C#CC1=CSC=C1 75818 [2,0,0,0,0,0|1,0,1]=4 514 B7R1.1 C=CC1=CSC=C1 D84207 [2,0,0,0,0,0|1,0,0]=3 515 B7R1.1 CCC1=CSC=C1 F14946 [2,0,0,0,0,0|1,0,1]=4 516 B7R1.1 COC1=CSC=C1 63554 [2,0,0,0,0,0|2,0,0]=4 517 B7R1.1 CSC1=CSC=C1 D97361 [2,0,0,0,0,0|2,0,0]=4 518 B7R1.1 N#CC1=CSC=C1 66666 [2,0,0,0,0,0|1,0,1]=4 519 B7R1.1 NCC1=CSC=C1 23759 [2,0,0,0,0,0|1,0,1]=4 520 B7R1.1 NCC1=CSC=C1 84938 [2,0,0,0,0,0|1,0,1]=4 521 B7R1.1 O=CC1=CC=CN1 61406 [2,0,0,0,0,0|2,0,0]=4 522 B7R1.1 O=CC1=CC=CS1 AC8106 [2,0,0,0,0,0|2,0,0]=4 523 B7R1.1 O=CC1=CCC=C1 F14116 [2,0,0,0,0,0|1,0,0]=3 524 B7R1.1 O=CC1=CN=CN1 30100 [2,0,0,0,0,0|2,0,0]=4 525 B7R1.1 O=CC1=CN=CS1 66596 [2,0,0,0,0,0|2,0,0]=4 526 B7R1.1 O=CC1=CNC=C1 65470 [2,0,0,0,0,0|1,0,0]=3 527 B7R1.1 O=CC1=CNC=N1 CL2201 [2,0,0,0,0,0|2,0,0]=4 528 B7R1.1 O=CC1=CNN=C1 24998 [2,0,0,0,0,0|2,0,0]=4 529 B7R1.1 O=CC1=CNN=C1 38080 [2,0,0,0,0,0|2,0,0]=4 530 B7R1.1 O=CC1=COC=C1 61504 [2,0,0,0,0,0|0,1,0]=3 531 B7R1.1 O=CC1=COC=N1 25504 [2,0,0,0,0,0|1,1,0]=4 532 B7R1.1 O=CC1=CSC=C1 24023 [2,0,0,0,0,0|0,0,0]=2 533 B7R1.1 O=CC1=CSC=N1 66630 [2,0,0,0,0,0|1,0,0]=3 534 B7R1.1 O=CC1=NNC=C1 BL001484 [2,0,0,0,0,0|2,0,0]=4 535 B7R1.1 OCC1=CCC=C1 F14117 [2,0,0,0,0,0|1,0,1]=4 536 B7R1.1 OCC1=COC=C1 35423 [2,0,0,0,0,0|0,1,1]=4 537 B7R1.1 OCC1=CSC=C1 33113 [2,0,0,0,0,0|0,0,1]=3 538 B7R1.1 OCC1=CSC=N1 24603 [2,0,0,0,0,0|1,0,1]=4 539 B7R1.2 BrC1=CSC(Br)=C1 75333 [2,0,0,0,0,0|2,0,0]=4 540 B7R1.2 CC1=CC(=O)CC1 H10654 [2,0,0,0,0,0|1,0,1]=4 541 B7R1.2 CC1=CC(Br)=CS1 33723 [2,0,0,0,0,0|1,0,0]=3 542 B7R1.2 CC1=CC(O)=NN1 A50988 [2,0,0,0,0,0|2,0,0]=4 543 B7R1.2 CC1=CC(O)=NO1 78261 [2,0,0,0,0,0|1,1,0]=4 544 B7R1.2 CC1=CNC(C)=C1 28362 [2,0,0,0,0,0|1,0,1]=4 545 B7R1.2 CC1=CSC(C)=N1 O10604 [2,0,0,0,0,0|1,0,1]=4 546 B7R1.2 CC1=NC(Br)=CS1 BL000165 [2,0,0,0,0,0|2,0,0]=4 547 B7R1.2 CC1=NNC(O)=C1 P10123 [2,0,0,0,0,0|2,0,0]=4 548 B7R1.2 NC1=CSC(Br)=C1 P17645 [2,0,0,0,0,0|2,0,0]=4 549 B7R1.2 NC1=NC(O)=CS1 VT1243 [2,0,0,0,0,0|2,0,0]=4 550 B9R1.21 CCC1=CC=C(C=O)S1 AT16722 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.21 CCN1C=C(C=O)C=N1 24164 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.21 COC1=NC=C(C=O)S1 27589 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.21 O=CC1=CC=C(CO)O1 23166 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.22 CC1=CC(Br)=C(C=O)S1 D94944 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.22 CC1=CC(C#N)=C(N)S1 74257 [1,1,0,0,0,0|1,0,1]=4 556 B9R1.22 CC1=CC(C)=C(C=O)N1 33870 [1,1,0,0,0,0|2,0,0]=4 557 B9R1.22 CC1=CC(C=O)=C(C)S1 D70135 [1,1,0,0,0,0|0,0,0]=2 558 B9R1.22 CC1=NC(C)=C(C=O)N1 A10564 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.22 CC1=NC(C)=C(C=O)O1 25043 [1,1,0,0,0,0|2,0,0]=4 560 B9R1.22 CC1=NC(C)=C(C=O)S1 30311 [1,1,0,0,0,0|2,0,0]=4 561 B9R1.22 CC1=NN(C)C(C=O)=C1 30125 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.22 CC1=NN(C)C=C1C=O 36098 [1,1,0,0,0,0|2,0,0]=4 563 B9R1.23 CC1=C(Br)C=C(C=O)S1 F17533 [1,1,0,0,0,0|2,0,0]=4 564 B9R1.23 CC1=CC(C=O)=NN1C H11470 [1,1,0,0,0,0|2,0,0]=4 565 B9R1.132 CC1=C(C=O)C=NN1C 71137 [1,1,0,0,0,0|2,0,0]=4 566 B9R1.132 CN1N=CC(C=O)=C1N AC2031 [1,1,0,0,0,0|2,0,0]=4 567 B9R1.11 COC(=O)C1=CC=CN1 CL2801 [1,1,0,0,0,0|2,0,0]=4 568 B9R1.11 COC(=O)C1=CC=CO1 D78223 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.11 COC(=O)C1=CC=CS1 20523 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.11 COC(=O)C1=CC=NN1 P10300 [1,1,0,0,0,0|2,0,0]=4 571 B9R1.11 COC(=O)C1=CN=CN1 36063 [1,1,0,0,0,0|2,0,0]=4 572 B9R1.11 COC(=O)C1=CN=CO1 78384 [1,1,0,0,0,0|2,0,0]=4 573 B9R1.11 COC(=O)C1=CN=CS1 24832 [1,1,0,0,0,0|2,0,0]=4 574 B9R1.11 COC(=O)C1=CNC=C1 CL2812 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.11 COC(=O)C1=CNC=N1 64348 [1,1,0,0,0,0|2,0,0]=4 576 B9R1.11 COC(=O)C1=CNN=C1 28997 [1,1,0,0,0,0|2,0,0]=4 577 B9R1.11 COC(=O)C1=CNN=C1 C90619 [1,1,0,0,0,0|2,0,0]=4 578 B9R1.11 COC(=O)C1=COC=C1 D90674 [1,1,0,0,0,0|0,1,0]=3 579 B9R1.11 COC(=O)C1=CSC=C1 74929 [1,1,0,0,0,0|0,0,0]=2 580 B9R1.11 COC(=O)C1=CSC=N1 CL2511 [1,1,0,0,0,0|1,0,0]=3 581 B9R1.11 COC(=O)C1=NNC=C1 24392 [1,1,0,0,0,0|2,0,0]=4 582 B9R1.11 NNC(=O)C1=CSC=N1 BL000540 [1,1,0,0,0,0|2,0,0]=4 583 B9R1.11 O=C(CBr)C1=CSC=C1 BL007628 [1,1,0,0,0,0|1,0,0]=3 584 B9R1.41 CC(=O)C1=C(N)SC=C1 D95065 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.41 CC1=C(B(O)O)C=CS1 F11322 [1,1,0,0,0,0|1,0,1]=4 586 B9R1.41 CC1=C(C(=O)O)C=CO1 33431 [1,1,0,0,0,0|0,1,0]=3 587 B9R1.41 CC1=C(C(=O)O)C=CS1 83433 [1,1,0,0,0,0|0,0,0]=2 588 B9R1.41 CC1=C(C(=O)O)C=NN1 F31191 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.41 CC1=C(C(=O)O)C=NO1 67851 [1,1,0,0,0,0|1,1,0]=4 590 B9R1.41 CC1=C(C(=O)O)N=CO1 68173 [1,1,0,0,0,0|1,1,0]=4 591 B9R1.41 CC1=C(C(=O)O)N=CS1 BL001514 [1,1,0,0,0,0|1,0,0]=3 592 B9R1.41 CC1=C(C(=O)O)NC=C1 59364 [1,1,0,0,0,0|2,0,0]=4 593 B9R1.41 CC1=C(C(=O)O)NC=N1 71178 [1,1,0,0,0,0|2,0,0]=4 594 B9R1.41 CC1=C(C(=O)O)OC=C1 33433 [1,1,0,0,0,0|2,0,0]=4 595 B9R1.41 CC1=C(C(=O)O)OC=N1 83356 [1,1,0,0,0,0|2,0,0]=4 596 B9R1.41 CC1=C(C(=O)O)ON=C1 29932 [1,1,0,0,0,0|2,0,0]=4 597 B9R1.41 CC1=C(C(=O)O)SC=C1 75872 [1,1,0,0,0,0|2,0,0]=4 598 B9R1.41 CC1=C(C(=O)O)SC=N1 33725 [1,1,0,0,0,0|2,0,0]=4 599 B9R1.41 CC1=CNN=C1C(=O)O 30694 [1,1,0,0,0,0|2,0,0]=4 600 B9R1.41 CC1=CSC=C1B(O)O 25285 [1,1,0,0,0,0|1,0,1]=4 601 B9R1.41 CC1=CSC=C1C(=O)O 83446 [1,1,0,0,0,0|0,0,0]=2 602 B9R1.41 CC1=NNC=C1C(=O)O 34665 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.41 CC1=NOC=C1C(=O)O 23452 [1,1,0,0,0,0|1,1,0]=4 604 B9R1.41 CC1=NSC=C1C(=O)O 75881 [1,1,0,0,0,0|1,0,0]=3 605 B9R1.41 CN1C=CC=C1C(=O)O TD8129 [1,1,0,0,0,0|2,0,0]=4 606 B9R1.41 CN1C=NC=C1C(=O)O CL2207 [1,1,0,0,0,0|2,0,0]=4 607 B9R1.41 CN1N=CC=C1C(=O)O 23375 [1,1,0,0,0,0|2,0,0]=4 608 B9R1.41 NC(=O)C1=C(N)SC=C1 81844 [1,1,0,0,0,0|1,0,0]=3 609 B9R1.41 NC(=O)C1=CSC=C1Br 88256 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.41 NC1=C(C(=O)O)C=CS1 83946 [1,1,0,0,0,0|0,0,0]=2 611 B9R1.41 NC1=C(C(=O)O)NN=C1 91421 [1,1,0,0,0,0|2,0,0]=4 612 B9R1.41 NC1=C(C(=O)O)SC=C1 29810 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.41 NC1=CNN=C1C(=O)O F13263 [1,1,0,0,0,0|2,0,0]=4 614 B9R1.41 NC1=NNC=C1C(=O)O 29075 [1,1,0,0,0,0|2,0,0]=4 615 B9R1.41 NC1=NSN=C1C(=O)O 24621 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.41 O=C(O)C1=C(Br)C=CS1 33500 [1,1,0,0,0,0|2,0,0]=4 617 B9R1.41 O=C(O)C1=C(Br)C=NN1 36114 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.41 O=C(O)C1=C(Br)SC=C1 30294 [1,1,0,0,0,0|0,0,0]=2 619 B9R1.41 O=C(O)C1=C(Br)SC=N1 68021 [1,1,0,0,0,0|1,0,0]=3 620 B9R1.41 O=C(O)C1=C(Cl)C=CS1 75807 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.41 O=C(O)C1=C(Cl)NN=C1 36321 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.41 O=C(O)C1=C(F)C=CS1 25680 [1,1,0,0,0,0|2,0,0]=4 623 B9R1.41 O=C(O)C1=C(I)C=NN1 26276 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.41 O=C(O)C1=C(I)OC=C1 W15727 [1,1,0,0,0,0|0,1,0]=3 625 B9R1.41 O=C(O)C1=CSC=C1Br 55568 [1,1,0,0,0,0|0,0,0]=2 626 B9R1.41 O=C(O)C1=NNC=C1Br 23224 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.41 O=[N+]([O-])C1=C(Br)SC=C1 26218 [1,1,0,0,0,0|1,0,1]=4 628 B9R1.41 O=[N+]([O-])C1=C(Cl)SC=C1 F14654 [1,1,0,0,0,0|1,0,1]=4 629 B9R1.41 OB(O)C1=C(Cl)SC=C1 F15514 [1,1,0,0,0,0|1,0,1]=4 630 B9R1.41 OB(O)C1=CSC=C1Br D71316 [1,1,0,0,0,0|1,0,1]=4 631 B11R1.3 C#CC1=CC=C(C(=O)O)C=C1 AB1444 [0,1,0,0,0,1|1,0,1]=4 632 B11R1.3 C=CC1=CC=C(C(=O)O)C=C1 67700 [0,1,0,0,0,1|1,0,1]=4 633 B11R1.3 CC(=O)C1=CC=C(CBr)C=C1 CL8917 [0,1,0,0,0,1|2,0,0]=4 634 B11R1.3 CCC1=CC=C(C(=O)Cl)C=C1 28595 [0,1,0,0,0,1|2,0,0]=4 635 B11R1.3 CCC1=CC=C(C(=O)O)C=C1 CK2173 [0,1,0,0,0,1|1,0,0]=3 636 B11R1.3 CCC1=CC=C(C(C)=O)C=C1 78945 [0,1,0,0,0,1|2,0,0]=4 637 B11R1.3 CNC1=CC=C(C(=O)O)C=C1 F16175 [0,1,0,0,0,1|1,0,0]=3 638 B11R1.3 CNC1=CC=C(C(C)=O)C=C1 N12151 [0,1,0,0,0,1|2,0,0]=4 639 B11R1.3 COC1=CC=C(C(=O)Cl)C=C1 73294 [0,1,0,0,0,1|2,0,0]=4 640 B11R1.3 COC1=CC=C(C(=O)O)C=C1 AB2885 [0,1,0,0,0,1|1,0,0]=3 641 B11R1.3 COC1=CC=C(C(C)=O)C=C1 D71251 [0,1,0,0,0,1|2,0,0]=4 642 B11R1.3 COC1=CC=C(C(N)=O)C=C1 F11797 [0,1,0,0,0,1|2,0,0]=4 643 B11R1.3 COC1=CN=C(C(=O)O)C=C1 24332 [0,1,0,0,0,1|1,0,0]=3 644 B11R1.3 COC1=CN=C(C(=O)O)C=N1 RB3245 [0,1,0,0,0,1|1,0,0]=3 645 B11R1.3 COC1=NC=C(C(=O)O)C=C1 76377 [0,1,0,0,0,1|1,0,0]=3 646 B11R1.3 COC1=NC=C(C(=O)O)C=N1 69184 [0,1,0,0,0,1|1,0,0]=3 647 B11R1.3 COC1=NC=C(C(C)=O)C=C1 29324 [0,1,0,0,0,1|2,0,0]=4 648 B11R1.3 COC1=NC=C(C(N)=O)C=C1 D95562 [0,1,0,0,0,1|2,0,0]=4 649 B11R1.3 CSC1=CC=C(C(=O)O)C=C1 FD7312 [0,1,0,0,0,1|1,0,0]=3 650 B11R1.3 CSC1=CC=C(C(C)=O)C=C1 F14884 [0,1,0,0,0,1|2,0,0]=4 651 B11R1.3 CSC1=NC=C(C(=O)O)C=C1 54707 [0,1,0,0,0,1|1,0,0]=3 652 B11R1.3 CSC1=NC=C(C(=O)O)C=N1 69186 [0,1,0,0,0,1|1,0,0]=3 653 B11R1.3 N#CC1=CC=C(C(=O)O)C=C1 CK2166 [0,1,0,0,0,1|1,0,1]=4 654 B11R1.3 N#CC1=CN=C(C(=O)O)C=C1 CK2603 [0,1,0,0,0,1|1,0,1]=4 655 B11R1.3 N#CC1=NC=C(C(=O)O)C=C1 CL0243 [0,1,0,0,0,1|1,0,1]=4 656 B11R1.3 NC(=O)C1=CC=C(CBr)C=C1 25783 [0,1,0,0,0,1|2,0,0]=4 657 B11R1.3 NC(=O)C1=NC=C(CO)C=C1 D84449 [0,1,0,0,0,1|2,0,0]=4 658 B11R1.3 NCC1=CC=C(C(=O)O)C=C1 D70590 [0,1,0,0,0,1|1,0,0]=3 659 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 73711 [0,1,0,0,0,1|2,0,0]=4 660 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 73712 [0,1,0,0,0,1|2,0,0]=4 661 B11R1.3 NNC1=NC=C(C(=O)O)C=C1 24830 [0,1,0,0,0,1|2,0,0]=4 662 B11R1.3 O=C(Cl)C1=CC=C(CCl)C=C1 D78183 [0,1,0,0,0,1|2,0,0]=4 663 B11R1.3 O=C(O)C1=CC=C(CBr)C=C1 CK2205 [0,1,0,0,0,1|1,0,0]=3 664 B11R1.3 O=C(O)C1=CC=C(CCl)C=C1 CK2167 [0,1,0,0,0,1|1,0,0]=3 665 B11R1.3 O=C(O)C1=CC=C(CO)C=C1 RB3326 [0,1,0,0,0,1|1,0,0]=3 666 B11R1.3 O=CC1=CC=C(C(=O)O)C=C1 D71017 [0,1,0,0,0,1|1,0,1]=4 667 B11R1.19 CC1=CC=C(P(=O)(O)O)C=C1 76750 [0,1,0,0,0,1|2,0,0]=4 668 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 23404 [0,1,0,0,0,1|2,0,0]=4 669 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 26112 [0,1,0,0,0,1|2,0,0]=4 670 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 32870 [0,1,0,0,0,1|2,0,0]=4 671 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 55387 [0,1,0,0,0,1|2,0,0]=4 672 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 66728 [0,1,0,0,0,1|2,0,0]=4 673 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 76576 [0,1,0,0,0,1|2,0,0]=4 674 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D77781 [0,1,0,0,0,1|2,0,0]=4 675 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 D82829 [0,1,0,0,0,1|2,0,0]=4 676 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 F19870 [0,1,0,0,0,1|2,0,0]=4 677 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 RB4029 [0,1,0,0,0,1|2,0,0]=4 678 B11R1.19 CC1=CC=C(S(=O)(=O)O)C=C1 W10105 [0,1,0,0,0,1|2,0,0]=4 679 B11R1.19 CC1=NC=C(S(=O)(=O)O)C=C1 26755 [0,1,0,0,0,1|2,0,0]=4 680 B11R1.21 CC(=O)C1=CC(Br)=C(C)C=C1 75764 [0,1,0,0,0,1|2,0,0]=4 681 B11R1.21 CC(=O)C1=CC(C)=C(C)C=C1 C13333 [0,1,0,0,0,1|2,0,0]=4 682 B11R1.21 CC(=O)C1=CC(O)=C(C)C=C1 CL8658 [0,1,0,0,0,1|2,0,0]=4 683 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=C1 CK2240 [0,1,0,0,0,1|1,0,0]=3 684 B11R1.21 CC1=C(Br)C=C(C(=O)O)C=N1 CL0343 [0,1,0,0,0,1|1,0,0]=3 685 B11R1.21 CC1=C(Br)C=C(C(N)=O)C=C1 W17426 [0,1,0,0,0,1|2,0,0]=4 686 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=C1 21550 [0,1,0,0,0,1|2,0,0]=4 687 B11R1.21 CC1=C(Br)C=CC(C(=O)O)=N1 C72509 [0,1,0,0,0,1|2,0,0]=4 688 B11R1.21 CC1=C(Br)C=NC(C(=O)O)=C1 26746 [0,1,0,0,0,1|2,0,0]=4 689 B11R1.21 CC1=C(C)C=C(C(=O)O)C=C1 28850 [0,1,0,0,0,1|1,0,0]=3 690 B11R1.21 CC1=C(C)N=C(C(=O)O)C=N1 O11328 [0,1,0,0,0,1|1,0,0]=3 691 B11R1.21 CC1=C(Cl)C=C(C(=O)O)C=C1 CK2203 [0,1,0,0,0,1|1,0,0]=3 692 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 CK2202 [0,1,0,0,0,1|2,0,0]=4 693 B11R1.21 CC1=C(F)C=C(C(=O)O)C=C1 22107 [0,1,0,0,0,1|1,0,0]=3 694 B11R1.21 CC1=C(F)C=CC(C(=O)O)=C1 CK2241 [0,1,0,0,0,1|2,0,0]=4 695 B11R1.21 CC1=C(F)C=CC(C(=O)O)=N1 O11440 [0,1,0,0,0,1|2,0,0]=4 696 B11R1.21 CC1=C(I)C=C(C(=O)Cl)C=C1 35179 [0,1,0,0,0,1|2,0,0]=4 697 B11R1.21 CC1=C(I)C=C(C(=O)O)C=C1 O11020 [0,1,0,0,0,1|1,0,0]=3 698 B11R1.21 CC1=C(I)C=CC(C(=O)O)=C1 C10846 [0,1,0,0,0,1|2,0,0]=4 699 B11R1.21 CC1=C(N)C=C(C(=O)O)C=C1 22035 [0,1,0,0,0,1|1,0,0]=3 700 B11R1.21 CC1=C(N)C=C(C(N)=O)C=C1 D88518 [0,1,0,0,0,1|2,0,0]=4 701 B11R1.21 CC1=C(N)C=CC(C(=O)O)=C1 28777 [0,1,0,0,0,1|2,0,0]=4 702 B11R1.21 CC1=C(O)C=C(C(=O)O)C=C1 CL9294 [0,1,0,0,0,1|1,0,0]=3 703 B11R1.21 CC1=C(O)C=CC(C(=O)O)=C1 TD1029 [0,1,0,0,0,1|2,0,0]=4 704 B11R1.21 CC1=CC(C(=O)O)=CN=C1C A12825 [0,1,0,0,0,1|1,0,0]=3 705 B11R1.21 CC1=CC(C(=O)O)=CN=C1Cl 70947 [0,1,0,0,0,1|2,0,0]=4 706 B11R1.21 CC1=CC(C(=O)O)=CN=C1F AT21540 [0,1,0,0,0,1|2,0,0]=4 707 B11R1.21 CC1=CC=C(C(=O)O)N=C1Cl 25764 [0,1,0,0,0,1|1,0,0]=3 708 B11R1.21 CC1=CN=C(C(=O)O)C=[N+]1[O-] 23387 [0,1,0,0,0,1|1,0,0]=3 709 B11R1.21 CN1C=C(C(=O)O)C=CC1=O 63164 [0,1,0,0,0,1|2,0,0]=4 710 B11R1.21 CN1C=CC(C(=O)O)=CC1=O 63162 [0,1,0,0,0,1|2,0,0]=4 711 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=C1 CK2231 [0,1,0,0,0,1|2,0,0]=4 712 B11R1.21 NC1=C(Br)C=C(C(=O)O)C=N1 24870 [0,1,0,0,0,1|2,0,0]=4 713 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 CK1077 [0,1,0,0,0,1|2,0,0]=4 714 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 51934 [0,1,0,0,0,1|2,0,0]=4 715 B11R1.21 NC1=C(Cl)C=CC(C(=O)O)=C1 CK2207 [0,1,0,0,0,1|2,0,0]=4 716 B11R1.21 NC1=C(F)C=C(C(=O)O)C=C1 CL8101 [0,1,0,0,0,1|2,0,0]=4 717 B11R1.21 NC1=C(F)C=CC(C(=O)O)=C1 CK1082 [0,1,0,0,0,1|2,0,0]=4 718 B11R1.21 NC1=C(I)C=C(C(=O)O)C=C1 CL8102 [0,1,0,0,0,1|2,0,0]=4 719 B11R1.21 NC1=C(N)C=C(C(=O)O)C=C1 CL4162 [0,1,0,0,0,1|2,0,0]=4 720 B11R1.21 NC1=C(O)C=C(C(=O)O)C=C1 86988 [0,1,0,0,0,1|2,0,0]=4 721 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 88874 [0,1,0,0,0,1|2,0,0]=4 722 B11R1.21 NC1=C(O)C=CC(C(=O)O)=C1 AC1735 [0,1,0,0,0,1|2,0,0]=4 723 B11R1.21 O=C(O)C1=CC(Br)=C(Br)C=C1 35046 [0,1,0,0,0,1|2,0,0]=4 724 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)C=C1 67812 [0,1,0,0,0,1|2,0,0]=4 725 B11R1.21 O=C(O)C1=CC(Br)=C(Cl)N=C1 21544 [0,1,0,0,0,1|2,0,0]=4 726 B11R1.21 O=C(O)C1=CC(Br)=C(F)C=C1 67713 [0,1,0,0,0,1|2,0,0]=4 727 B11R1.21 O=C(O)C1=CC(Br)=C(F)N=C1 26913 [0,1,0,0,0,1|2,0,0]=4 728 B11R1.21 O=C(O)C1=CC(Br)=C(I)C=C1 36436 [0,1,0,0,0,1|2,0,0]=4 729 B11R1.21 O=C(O)C1=CC(Br)=C(O)C=C1 H11843 [0,1,0,0,0,1|2,0,0]=4 730 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 CL0229 [0,1,0,0,0,1|2,0,0]=4 731 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=C1 34967 [0,1,0,0,0,1|2,0,0]=4 732 B11R1.21 O=C(O)C1=CC(Cl)=C(Br)C=N1 O11376 [0,1,0,0,0,1|2,0,0]=4 733 B11R1.21 O=C(O)C1=CC(Cl)=C(Cl)C=C1 AC7846 [0,1,0,0,0,1|2,0,0]=4 734 B11R1.21 O=C(O)C1=CC(Cl)=C(F)C=C1 67645 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.21 O=C(O)C1=CC(Cl)=C(F)N=C1 C10119 [0,1,0,0,0,1|2,0,0]=4 736 B11R1.21 O=C(O)C1=CC(Cl)=C(I)C=C1 TD1023 [0,1,0,0,0,1|2,0,0]=4 737 B11R1.21 O=C(O)C1=CC(Cl)=C(O)C=C1 O10980 [0,1,0,0,0,1|2,0,0]=4 738 B11R1.21 O=C(O)C1=CC(Cl)=C(O)N=C1 CL0217 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.21 O=C(O)C1=CC(F)=C(Br)C=C1 22303 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.21 O=C(O)C1=CC(F)=C(Cl)C=C1 22075 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.21 O=C(O)C1=CC(F)=C(F)C=C1 CK2210 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 22625 [0,1,0,0,0,1|2,0,0]=4 743 B11R1.21 O=C(O)C1=CC(F)=C(O)C=C1 24116 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.21 O=C(O)C1=CC(I)=C(Br)C=C1 AB10180 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.21 O=C(O)C1=CC(I)=C(Cl)C=C1 20563 [0,1,0,0,0,1|2,0,0]=4 746 B11R1.21 O=C(O)C1=CC(I)=C(Cl)N=C1 82350 [0,1,0,0,0,1|2,0,0]=4 747 B11R1.21 O=C(O)C1=CC(I)=C(F)C=C1 24580 [0,1,0,0,0,1|2,0,0]=4 748 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 62246 [0,1,0,0,0,1|2,0,0]=4 749 B11R1.21 O=C(O)C1=CC(O)=C(Cl)C=C1 CL8114 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.21 O=C(O)C1=CC(O)=C(F)C=C1 CL8119 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.21 O=C(O)C1=CC(O)=C(I)C=C1 62578 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.21 O=C(O)C1=CC(O)=C(O)C=C1 F11285 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=N1 22758 [0,1,0,0,0,1|2,0,0]=4 754 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=N1 84491 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=N1 22763 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.21 O=C(O)C1=CN=C(Br)C(Br)=C1 CL0207 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 CL0206 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.21 O=C(O)C1=CNC(=O)C(Br)=C1 83313 [0,1,0,0,0,1|2,0,0]=4 759 B11R1.21 O=C(O)C1=NC(Cl)=C(Br)C=C1 22711 [0,1,0,0,0,1|2,0,0]=4 760 B11R1.21 O=C(O)C1=NC(O)=C(Br)C=C1 26416 [0,1,0,0,0,1|2,0,0]=4 761 B11R1.22 CC1=CC=C(C(=N)NO)C=C1 D72885 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.22 CC1=CC=C(C(=O)C#N)C=C1 AB1509 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.22 CC1=CC=C(C(=O)C=O)C=C1 23345 [0,1,0,0,0,1|1,0,1]=4 764 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 36290 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.22 CC1=CC=C(C(=O)NN)C=C1 AC8686 [0,1,0,0,0,1|2,0,0]=4 766 B11R1.22 CC1=CC=C(\C(N)=N\O)C=C1 60212 [0,1,0,0,0,1|2,0,0]=4 767 B11R1.22 CC1=NC=C(C(=O)NN)C=C1 20651 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.22 CCC(=O)C1=CC=C(C)C=C1 D71258 [0,1,0,0,0,1|2,0,0]=4 769 B11R1.22 COC(=O)C1=CC=C(Br)C=C1 76648 [0,1,0,0,0,1|2,0,0]=4 770 B11R1.22 COC(=O)C1=CC=C(C)C=C1 D72468 [0,1,0,0,0,1|1,0,0]=3 771 B11R1.22 COC(=O)C1=CC=C(Cl)C=C1 D71020 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.22 COC(=O)C1=CC=C(F)C=C1 AB9709 [0,1,0,0,0,1|2,0,0]=4 773 B11R1.22 COC(=O)C1=CC=C(I)C=C1 H10030 [0,1,0,0,0,1|2,0,0]=4 774 B11R1.22 COC(=O)C1=CC=C(N)C=C1 24405 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.22 COC(=O)C1=CC=C(N)C=C1 AB11598 [0,1,0,0,0,1|2,0,0]=4 776 B11R1.22 COC(=O)C1=CC=C(O)C=C1 CK1194 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.22 COC(=O)C1=CC=C([O-])C=C1 A11551 [0,1,0,0,0,1|2,0,0]=4 778 B11R1.22 COC(=O)C1=CN=C(Br)C=C1 63852 [0,1,0,0,0,1|2,0,0]=4 779 B11R1.22 COC(=O)C1=CN=C(Br)C=N1 64287 [0,1,0,0,0,1|2,0,0]=4 780 B11R1.22 COC(=O)C1=CN=C(C)C=C1 71007 [0,1,0,0,0,1|1,0,0]=3 781 B11R1.22 COC(=O)C1=CN=C(Cl)C=C1 RB1062 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.22 COC(=O)C1=CN=C(Cl)C=N1 64288 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.22 COC(=O)C1=CN=C(Cl)N=C1 35788 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.22 COC(=O)C1=CN=C(F)C=C1 82677 [0,1,0,0,0,1|2,0,0]=4 785 B11R1.22 COC(=O)C1=CN=C(I)C=C1 C15087 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.22 COC(=O)C1=CN=C(N)C=C1 CL0231 [0,1,0,0,0,1|2,0,0]=4 787 B11R1.22 COC(=O)C1=CN=C(N)N=C1 CL1920 [0,1,0,0,0,1|2,0,0]=4 788 B11R1.22 COC(=O)C1=CN=C(O)C=C1 62440 [0,1,0,0,0,1|2,0,0]=4 789 B11R1.22 COC(=O)C1=COC(=O)C=C1 34855 [0,1,0,0,0,1|1,1,0]=4 790 B11R1.22 COC(=O)C1=NC=C(Br)C=C1 64386 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.22 COC(=O)C1=NC=C(C)C=C1 36315 [0,1,0,0,0,1|1,0,0]=3 792 B11R1.22 COC(=O)C1=NC=C(C)N=C1 89311 [0,1,0,0,0,1|1,0,0]=3 793 B11R1.22 COC(=O)C1=NC=C(Cl)C=C1 52894 [0,1,0,0,0,1|2,0,0]=4 794 B11R1.22 COC(=O)C1=NC=C(F)C=C1 36417 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.22 COC(=O)C1=NC=C(I)C=C1 C75123 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.22 COC(=O)C1=NC=C(N)C=C1 52592 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.22 COC(=O)C1=NC=C(N)C=C1 S11696 [0,1,0,0,0,1|2,0,0]=4 798 B11R1.22 COC(=O)C1=NC=C(N)N=C1 26296 [0,1,0,0,0,1|2,0,0]=4 799 B11R1.22 COC(=O)C1=NC=C(N)N=C1 37236 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.22 COC(=O)C1=NC=C(O)C=C1 TD8012 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.22 COC(=O)C1=NC=C(O)N=C1 63306 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.22 NOC(=O)C1=CC=C(Cl)C=C1 S10395 [0,1,0,0,0,1|2,0,0]=4 803 B11R1.22 O=C(CO)C1=CC=C(Br)C=C1 AC1227 [0,1,0,0,0,1|2,0,0]=4 804 B11R1.22 O=C(CO)C1=CC=C(Cl)C=C1 AC5796 [0,1,0,0,0,1|2,0,0]=4 805 B11R1.166 CC(=O)C1=C(C)C=C(C)C=C1 CK2555 [0,1,0,0,0,1|2,0,0]=4 806 B11R1.166 CC(=O)C1=C(O)C=C(C)C=C1 83684 [0,1,0,0,0,1|2,0,0]=4 807 B11R1.166 CC(=O)C1=NC=C(C)N=C1C D81742 [0,1,0,0,0,1|2,0,0]=4 808 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=C1 CK2239 [0,1,0,0,0,1|2,0,0]=4 809 B11R1.166 CC1=C(C(=O)O)C=CC(Br)=N1 C71244 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=C1 CL8113 [0,1,0,0,0,1|2,0,0]=4 811 B11R1.166 CC1=C(C(=O)O)C=CC(Cl)=N1 68232 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.166 CC1=C(C(=O)O)C=CC(F)=C1 CK2191 [0,1,0,0,0,1|2,0,0]=4 813 B11R1.166 CC1=C(C(=O)O)C=CC(F)=N1 25318 [0,1,0,0,0,1|2,0,0]=4 814 B11R1.166 CC1=C(C(=O)O)C=CC(N)=C1 51994 [0,1,0,0,0,1|2,0,0]=4 815 B11R1.166 CC1=C(C(=O)O)C=CC(O)=C1 23596 [0,1,0,0,0,1|2,0,0]=4 816 B11R1.166 CC1=C(C(=O)O)C=NC(O)=N1 TD8091 [0,1,0,0,0,1|2,0,0]=4 817 B11R1.166 CC1=CC(Br)=C(C(=O)O)C=C1 CL8026 [0,1,0,0,0,1|1,0,0]=3 818 B11R1.166 CC1=CC(Br)=C(C(=O)O)N=C1 24267 [0,1,0,0,0,1|1,0,0]=3 819 B11R1.166 CC1=CC(Br)=CN=C1C(=O)O 56973 [0,1,0,0,0,1|2,0,0]=4 820 B11R1.166 CC1=CC(C)=C(C(=O)Cl)C=C1 75351 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.166 CC1=CC(C)=C(C(=O)O)C=C1 H10034 [0,1,0,0,0,1|1,0,0]=3 822 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 O11142 [0,1,0,0,0,1|1,0,0]=3 823 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=C1 CL8038 [0,1,0,0,0,1|1,0,0]=3 824 B11R1.166 CC1=CC(Cl)=C(C(=O)O)C=N1 26455 [0,1,0,0,0,1|1,0,0]=3 825 B11R1.166 CC1=CC(Cl)=CN=C1C(=O)O 34639 [0,1,0,0,0,1|2,0,0]=4 826 B11R1.166 CC1=CC(Cl)=NC=C1C(=O)O CS1635 [0,1,0,0,0,1|2,0,0]=4 827 B11R1.166 CC1=CC(F)=C(C(=O)O)C=C1 22401 [0,1,0,0,0,1|1,0,0]=3 828 B11R1.166 CC1=CC(F)=NC=C1C(=O)O BL007486 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.166 CC1=CC(I)=C(C(=O)O)C=C1 SC5074 [0,1,0,0,0,1|1,0,0]=3 830 B11R1.166 CC1=CC(N)=C(C(=O)O)C=C1 64149 [0,1,0,0,0,1|1,0,0]=3 831 B11R1.166 CC1=CC(N)=C(C(N)=O)C=C1 23474 [0,1,0,0,0,1|2,0,0]=4 832 B11R1.166 CC1=CC(O)=C(C(=O)O)C=C1 AC7810 [0,1,0,0,0,1|1,0,0]=3 833 B11R1.166 CC1=CC(O)=C(C(=O)O)C=N1 38239 [0,1,0,0,0,1|1,0,0]=3 834 B11R1.166 CC1=CC(O)=C(C(N)=O)C=C1 D74580 [0,1,0,0,0,1|2,0,0]=4 835 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 CL0085 [0,1,0,0,0,1|1,0,0]=3 836 B11R1.166 CC1=CN=C(C(=O)O)C(C)=C1 52068 [0,1,0,0,0,1|1,0,0]=3 837 B11R1.166 CC1=CN=C(C(N)=O)C(N)=C1 BL006487 [0,1,0,0,0,1|2,0,0]=4 838 B11R1.166 CC1=NC(C)=C(C(=O)O)C=C1 F11654 [0,1,0,0,0,1|1,0,0]=3 839 B11R1.166 CC1=NC(N)=C(C(=O)O)C=C1 80799 [0,1,0,0,0,1|1,0,0]=3 840 B11R1.166 CC1=NC(O)=C(C(=O)O)C=C1 A51035 [0,1,0,0,0,1|1,0,0]=3 841 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=C1 51550 [0,1,0,0,0,1|2,0,0]=4 842 B11R1.166 NC1=C(C(=O)O)C=CC(Br)=N1 26646 [0,1,0,0,0,1|2,0,0]=4 843 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=C1 26021 [0,1,0,0,0,1|2,0,0]=4 844 B11R1.166 NC1=C(C(=O)O)C=CC(Cl)=N1 81840 [0,1,0,0,0,1|2,0,0]=4 845 B11R1.166 NC1=C(C(=O)O)C=CC(F)=C1 51554 [0,1,0,0,0,1|2,0,0]=4 846 B11R1.166 NC1=C(C(=O)O)C=CC(I)=C1 51552 [0,1,0,0,0,1|2,0,0]=4 847 B11R1.166 NC1=C(C(=O)O)C=CC(O)=C1 85907 [0,1,0,0,0,1|2,0,0]=4 848 B11R1.166 NC1=C(C(=O)O)C=NC(O)=N1 D94964 [0,1,0,0,0,1|2,0,0]=4 849 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 D84490 [0,1,0,0,0,1|2,0,0]=4 850 B11R1.166 NC1=CC(Br)=CN=C1C(=O)O 30402 [0,1,0,0,0,1|2,0,0]=4 851 B11R1.166 NC1=CC(Cl)=C(C(=O)O)C=C1 CL8100 [0,1,0,0,0,1|2,0,0]=4 852 B11R1.166 NC1=CC(Cl)=CN=C1C(=O)O P10899 [0,1,0,0,0,1|2,0,0]=4 853 B11R1.166 NC1=CC(Cl)=NC=C1C(=O)O 70951 [0,1,0,0,0,1|2,0,0]=4 854 B11R1.166 NC1=CC(F)=C(C(=O)O)C=C1 AB2615 [0,1,0,0,0,1|2,0,0]=4 855 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 D70306 [0,1,0,0,0,1|2,0,0]=4 856 B11R1.166 NC1=CC(O)=C(C(=O)O)C=C1 P17508 [0,1,0,0,0,1|2,0,0]=4 857 B11R1.166 NC1=NC(N)=C(C(=O)O)C=N1 77901 [0,1,0,0,0,1|2,0,0]=4 858 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=C1 CL8011 [0,1,0,0,0,1|2,0,0]=4 859 B11R1.166 O=C(O)C1=C(Br)C=C(Br)C=N1 W16708 [0,1,0,0,0,1|2,0,0]=4 860 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=C1 66889 [0,1,0,0,0,1|2,0,0]=4 861 B11R1.166 O=C(O)C1=C(Br)C=C(Cl)C=N1 87901 [0,1,0,0,0,1|2,0,0]=4 862 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=C1 TD1032 [0,1,0,0,0,1|2,0,0]=4 863 B11R1.166 O=C(O)C1=C(Br)C=C(F)C=N1 22750 [0,1,0,0,0,1|2,0,0]=4 864 B11R1.166 O=C(O)C1=C(Br)C=C(I)C=C1 36275 [0,1,0,0,0,1|2,0,0]=4 865 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 22144 [0,1,0,0,0,1|2,0,0]=4 866 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 D77744 [0,1,0,0,0,1|2,0,0]=4 867 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=N1 33598 [0,1,0,0,0,1|2,0,0]=4 868 B11R1.166 O=C(O)C1=C(Cl)C=C(F)C=C1 P16531 [0,1,0,0,0,1|2,0,0]=4 869 B11R1.166 O=C(O)C1=C(Cl)C=C(I)C=C1 C90851 [0,1,0,0,0,1|2,0,0]=4 870 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 31789 [0,1,0,0,0,1|2,0,0]=4 871 B11R1.166 O=C(O)C1=C(Cl)C=C(O)C=C1 CL8036 [0,1,0,0,0,1|2,0,0]=4 872 B11R1.166 O=C(O)C1=C(Cl)C=C(O)N=C1 25857 [0,1,0,0,0,1|2,0,0]=4 873 B11R1.166 O=C(O)C1=C(Cl)N=C(Cl)N=C1 24097 [0,1,0,0,0,1|2,0,0]=4 874 B11R1.166 O=C(O)C1=C(F)C=C(Br)C=C1 22236 [0,1,0,0,0,1|2,0,0]=4 875 B11R1.166 O=C(O)C1=C(F)C=C(Cl)C=C1 CK2227 [0,1,0,0,0,1|2,0,0]=4 876 B11R1.166 O=C(O)C1=C(F)C=C(F)C=C1 86687 [0,1,0,0,0,1|2,0,0]=4 877 B11R1.166 O=C(O)C1=C(F)C=C(F)C=N1 80026 [0,1,0,0,0,1|2,0,0]=4 878 B11R1.166 O=C(O)C1=C(F)C=C(I)C=C1 23257 [0,1,0,0,0,1|2,0,0]=4 879 B11R1.166 O=C(O)C1=C(F)C=C(O)C=C1 24114 [0,1,0,0,0,1|2,0,0]=4 880 B11R1.166 O=C(O)C1=C(F)N=C(Br)C=C1 F30821 [0,1,0,0,0,1|2,0,0]=4 881 B11R1.166 O=C(O)C1=C(I)C=C(Br)C=C1 CK1064 [0,1,0,0,0,1|2,0,0]=4 882 B11R1.166 O=C(O)C1=C(I)C=C(Cl)C=C1 CL8112 [0,1,0,0,0,1|2,0,0]=4 883 B11R1.166 O=C(O)C1=C(I)C=C(F)C=C1 CK1080 [0,1,0,0,0,1|2,0,0]=4 884 B11R1.166 O=C(O)C1=C(O)C=C(Br)C=C1 CK2193 [0,1,0,0,0,1|2,0,0]=4 885 B11R1.166 O=C(O)C1=C(O)C=C(Cl)C=C1 CL8111 [0,1,0,0,0,1|2,0,0]=4 886 B11R1.166 O=C(O)C1=C(O)C=C(F)C=C1 CL8118 [0,1,0,0,0,1|2,0,0]=4 887 B11R1.166 O=C(O)C1=C(O)C=C(I)C=C1 60163 [0,1,0,0,0,1|2,0,0]=4 888 B11R1.166 O=C(O)C1=C(O)C=C(O)C=C1 D78167 [0,1,0,0,0,1|2,0,0]=4 889 B11R1.166 O=C(O)C1=C(O)C=C(O)N=C1 30324 [0,1,0,0,0,1|2,0,0]=4 890 B11R1.166 O=C(O)C1=C(O)N=C(Cl)C=C1 36280 [0,1,0,0,0,1|2,0,0]=4 891 B11R1.166 O=C(O)C1=C(O)N=C(O)N=C1 60558 [0,1,0,0,0,1|2,0,0]=4 892 B11R1.166 O=C(O)C1=CC=C(Br)N=C1Br 36089 [0,1,0,0,0,1|2,0,0]=4 893 B11R1.166 O=C(O)C1=CC=C(Cl)N=C1Cl 68405 [0,1,0,0,0,1|2,0,0]=4 894 B11R1.166 O=C(O)C1=CC=C(F)N=C1F S11311 [0,1,0,0,0,1|2,0,0]=4 895 B11R1.166 O=C(O)C1=CC=C(O)N=C1Cl 23822 [0,1,0,0,0,1|2,0,0]=4 896 B11R1.166 O=C(O)C1=CN=C(Cl)C=C1Cl 52360 [0,1,0,0,0,1|2,0,0]=4 897 B11R1.166 O=C(O)C1=CNC(=S)NC1=O H10119 [0,1,0,0,0,1|2,0,0]=4 898 B11R1.166 O=C(O)C1=NC=C(Br)C=C1Cl 22749 [0,1,0,0,0,1|2,0,0]=4 899 B11R1.166 O=C(O)C1=NC=C(Br)C=C1F 22621 [0,1,0,0,0,1|2,0,0]=4 900 B11R1.166 O=C(O)C1=NC=C(Cl)C=C1F BL001904 [0,1,0,0,0,1|2,0,0]=4 901 B11R1.166 O=C(O)C1=NC=C(Cl)N=C1Cl 90112 [0,1,0,0,0,1|2,0,0]=4 902 B11R1.39 COC(=O)CC1=CSC(N)=N1 74848 [0,1,0,0,0,1|2,0,0]=4 903 B11R1.39 COC(=O)CC1=NOC(C)=C1 W10286 [0,1,0,0,0,1|1,1,0]=4 904 B11R1.80 CC1=CC(CC(=O)O)=NN1C 77878 [0,1,0,0,0,1|2,0,0]=4 905 B11R1.314 CC1=CC=C([C@@H](N)C(=O)O)S1 A50309 [0,1,0,0,0,1|2,0,0]=4 906 B11R1.645 CC1=NC(CC(=O)O)=C(C)S1 F16768 [0,1,0,0,0,1|1,0,0]=3 907 B11R1.23 CC1=CC=CC(C(=O)C#N)=C1 AB1508 [0,1,0,0,0,1|2,0,0]=4 908 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 W12696 [0,1,0,0,0,1|2,0,0]=4 909 B11R1.23 CCC(=O)C1=CC(C)=CC=C1 29743 [0,1,0,0,0,1|2,0,0]=4 910 B11R1.23 COC(=O)C1=CC(=O)NC=C1 24655 [0,1,0,0,0,1|2,0,0]=4 911 B11R1.23 COC(=O)C1=CC(Br)=CN=C1 RB1030 [0,1,0,0,0,1|2,0,0]=4 912 B11R1.23 COC(=O)C1=CC(Br)=NC=C1 74878 [0,1,0,0,0,1|2,0,0]=4 913 B11R1.23 COC(=O)C1=CC(C)=CC=C1 F20909 [0,1,0,0,0,1|1,0,0]=3 914 B11R1.23 COC(=O)C1=CC(C)=NC=C1 64229 [0,1,0,0,0,1|1,0,0]=3 915 B11R1.23 COC(=O)C1=CC(Cl)=CN=C1 W11186 [0,1,0,0,0,1|2,0,0]=4 916 B11R1.23 COC(=O)C1=CC(Cl)=NC=C1 AB3941 [0,1,0,0,0,1|2,0,0]=4 917 B11R1.23 COC(=O)C1=CC(Cl)=NC=N1 63342 [0,1,0,0,0,1|2,0,0]=4 918 B11R1.23 COC(=O)C1=CC(Cl)=NN=C1 26516 [0,1,0,0,0,1|2,0,0]=4 919 B11R1.23 COC(=O)C1=CC(F)=CN=C1 82671 [0,1,0,0,0,1|2,0,0]=4 920 B11R1.23 COC(=O)C1=CC(I)=NC=C1 C14615 [0,1,0,0,0,1|2,0,0]=4 921 B11R1.23 COC(=O)C1=CC(N)=CC=C1 34901 [0,1,0,0,0,1|2,0,0]=4 922 B11R1.23 COC(=O)C1=CC(N)=NC=C1 34933 [0,1,0,0,0,1|2,0,0]=4 923 B11R1.23 COC(=O)C1=CC(O)=CC=C1 AB7533 [0,1,0,0,0,1|2,0,0]=4 924 B11R1.23 COC(=O)C1=CC=CC(Br)=C1 76630 [0,1,0,0,0,1|2,0,0]=4 925 B11R1.23 COC(=O)C1=CC=CC(Cl)=C1 F14862 [0,1,0,0,0,1|2,0,0]=4 926 B11R1.23 COC(=O)C1=CC=CC(F)=C1 AB9708 [0,1,0,0,0,1|2,0,0]=4 927 B11R1.23 COC(=O)C1=CC=CC(I)=C1 35166 [0,1,0,0,0,1|2,0,0]=4 928 B11R1.23 COC(=O)C1=CN(C)C=CC1 D93544 [0,1,0,0,0,1|2,0,0]=4 929 B11R1.23 COC(=O)C1=CN=CC(C)=C1 29043 [0,1,0,0,0,1|1,0,0]=3 930 B11R1.23 COC(=O)C1=CN=CC(N)=C1 AB3918 [0,1,0,0,0,1|2,0,0]=4 931 B11R1.23 COC(=O)C1=CN=CC(O)=C1 30523 [0,1,0,0,0,1|2,0,0]=4 932 B11R1.23 COC(=O)C1=CN=CC(O)=C1 69583 [0,1,0,0,0,1|2,0,0]=4 933 B11R1.23 COC(=O)C1=CN=NC(O)=C1 W17463 [0,1,0,0,0,1|2,0,0]=4 934 B11R1.23 COC(=O)C1=NC(C)=CC=C1 CL0234 [0,1,0,0,0,1|2,0,0]=4 935 B11R1.23 COC(=O)C1=NC(C)=CC=N1 26604 [0,1,0,0,0,1|2,0,0]=4 936 B11R1.23 COC(=O)C1=NC(C)=CN=C1 51129 [0,1,0,0,0,1|2,0,0]=4 937 B11R1.23 COC(=O)C1=NC=CC(Br)=C1 22618 [0,1,0,0,0,1|2,0,0]=4 938 B11R1.23 COC(=O)C1=NC=CC(C)=C1 W17537 [0,1,0,0,0,1|1,0,0]=3 939 B11R1.23 COC(=O)C1=NC=CC(Cl)=C1 CL0195 [0,1,0,0,0,1|2,0,0]=4 940 B11R1.23 COC(=O)C1=NC=CC(F)=C1 H11035 [0,1,0,0,0,1|2,0,0]=4 941 B11R1.23 COC(=O)C1=NC=CC(I)=C1 CL0182 [0,1,0,0,0,1|2,0,0]=4 942 B11R1.23 COC(=O)C1=NC=CC(N)=C1 63176 [0,1,0,0,0,1|2,0,0]=4 943 B11R1.23 COC(=O)C1=NC=CC(O)=C1 F30283 [0,1,0,0,0,1|2,0,0]=4 944 B11R1.23 COC(=O)C1=NC=NC(O)=C1 50199 [0,1,0,0,0,1|2,0,0]=4 945 B11R1.74 CC(=O)C1=CC(C)=CC(C)=C1 CK1150 [0,1,0,0,0,1|2,0,0]=4 946 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 CL8076 [0,1,0,0,0,1|1,0,0]=3 947 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 CL0087 [0,1,0,0,0,1|1,0,0]=3 948 B11R1.74 CC1=CC(C(=O)O)=CC(O)=C1 CL8088 [0,1,0,0,0,1|1,0,0]=3 949 B11R1.74 CC1=CC(C(=O)O)=CC(O)=N1 CL0100 [0,1,0,0,0,1|1,0,0]=3 950 B11R1.74 CC1=CC(C(=O)O)=NC(C)=C1 72877 [0,1,0,0,0,1|1,0,0]=3 951 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 D71201 [0,1,0,0,0,1|1,0,0]=3 952 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 36312 [0,1,0,0,0,1|1,0,0]=3 953 B11R1.74 CC1=CC(Cl)=NC(C(=O)O)=C1 24356 [0,1,0,0,0,1|1,0,0]=3 954 B11R1.74 CC1=CC(F)=CC(C(=O)O)=C1 22409 [0,1,0,0,0,1|1,0,0]=3 955 B11R1.74 NC1=CC(C(=O)O)=CC(Br)=C1 TD1097 [0,1,0,0,0,1|2,0,0]=4 956 B11R1.74 NC1=CC(C(=O)O)=CC(Cl)=C1 CL8065 [0,1,0,0,0,1|2,0,0]=4 957 B11R1.74 NC1=CC(C(=O)O)=CC(F)=C1 CL8066 [0,1,0,0,0,1|2,0,0]=4 958 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 23873 [0,1,0,0,0,1|2,0,0]=4 959 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 29538 [0,1,0,0,0,1|2,0,0]=4 960 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 D85890 [0,1,0,0,0,1|2,0,0]=4 961 B11R1.74 NC1=CC(N)=CC(C(=O)O)=C1 D89590 [0,1,0,0,0,1|2,0,0]=4 962 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 CK2212 [0,1,0,0,0,1|2,0,0]=4 963 B11R1.74 O=C(O)C1=CC(Br)=CC(Cl)=C1 CL8073 [0,1,0,0,0,1|2,0,0]=4 964 B11R1.74 O=C(O)C1=CC(Br)=CC(F)=C1 21546 [0,1,0,0,0,1|2,0,0]=4 965 B11R1.74 O=C(O)C1=CC(Br)=CC(O)=C1 75773 [0,1,0,0,0,1|2,0,0]=4 966 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 CL0267 [0,1,0,0,0,1|2,0,0]=4 967 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 36720 [0,1,0,0,0,1|2,0,0]=4 968 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=N1 60068 [0,1,0,0,0,1|2,0,0]=4 969 B11R1.74 O=C(O)C1=CC(Cl)=CC(F)=C1 CL8904 [0,1,0,0,0,1|2,0,0]=4 970 B11R1.74 O=C(O)C1=CC(Cl)=CC(O)=C1 CL8082 [0,1,0,0,0,1|2,0,0]=4 971 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 28397 [0,1,0,0,0,1|2,0,0]=4 972 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 67643 [0,1,0,0,0,1|2,0,0]=4 973 B11R1.74 O=C(O)C1=CC(F)=CC(O)=C1 CL8086 [0,1,0,0,0,1|2,0,0]=4 974 B11R1.74 O=C(O)C1=CC(F)=NC(F)=C1 60536 [0,1,0,0,0,1|2,0,0]=4 975 B11R1.74 O=C(O)C1=CC(I)=CC(Br)=C1 28895 [0,1,0,0,0,1|2,0,0]=4 976 B11R1.74 O=C(O)C1=CC(I)=CC(Cl)=C1 24434 [0,1,0,0,0,1|2,0,0]=4 977 B11R1.74 O=C(O)C1=CC(I)=CC(F)=C1 35137 [0,1,0,0,0,1|2,0,0]=4 978 B11R1.74 O=C(O)C1=CC(I)=CC(I)=C1 58422 [0,1,0,0,0,1|2,0,0]=4 979 B11R1.74 O=C(O)C1=CC(I)=CC(O)=C1 63573 [0,1,0,0,0,1|2,0,0]=4 980 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 P16552 [0,1,0,0,0,1|2,0,0]=4 981 B11R1.74 O=C(O)C1=CC(O)=NC(O)=C1 40020 [0,1,0,0,0,1|2,0,0]=4 982 B11R1.74 O=C(O)C1=NC(Cl)=NC(Cl)=C1 F11650 [0,1,0,0,0,1|2,0,0]=4 983 B11R1.74 O=C(O)C1=NC(O)=NC(O)=C1 D86757 [0,1,0,0,0,1|2,0,0]=4 984 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 D70614 [0,1,0,0,0,1|2,0,0]=4 985 B11R1.155 CC1=CC=CC(S(=O)(=O)O)=C1 D94761 [0,1,0,0,0,1|2,0,0]=4 986 B11R1.159 CC(=O)C1=C(C)C(C)=CC=C1 CK2574 [0,1,0,0,0,1|2,0,0]=4 987 B11R1.159 CC(=O)C1=C(F)C(C)=CC=C1 CL9502 [0,1,0,0,0,1|2,0,0]=4 988 B11R1.159 CC(=O)C1=C(O)C(C)=CC=C1 I11047 [0,1,0,0,0,1|2,0,0]=4 989 B11R1.159 CC1=C(Br)C=CC=C1C(=O)O CK2194 [0,1,0,0,0,1|2,0,0]=4 990 B11R1.159 CC1=C(C(=O)O)C=CC=C1N CK2223 [0,1,0,0,0,1|2,0,0]=4 991 B11R1.159 CC1=C(C(=O)O)C=CC=C1O 36367 [0,1,0,0,0,1|2,0,0]=4 992 B11R1.159 CC1=C(C(=O)O)C=CN=C1Cl 31958 [0,1,0,0,0,1|2,0,0]=4 993 B11R1.159 CC1=C(Cl)C=CC=C1C(=O)O 58188 [0,1,0,0,0,1|2,0,0]=4 994 B11R1.159 CC1=C(F)C=CC=C1C(=O)O CL8085 [0,1,0,0,0,1|2,0,0]=4 995 B11R1.159 CC1=C(I)C=CC=C1C(=O)O CK2215 [0,1,0,0,0,1|2,0,0]=4 996 B11R1.159 CC1=CC=CC(C(=O)O)=C1Br 34987 [0,1,0,0,0,1|1,0,0]=3 997 B11R1.159 CC1=CC=CC(C(=O)O)=C1C 23143 [0,1,0,0,0,1|1,0,0]=3 998 B11R1.159 CC1=CC=CC(C(=O)O)=C1Cl CK2171 [0,1,0,0,0,1|1,0,0]=3 999 B11R1.159 CC1=CC=CC(C(=O)O)=C1F CL8044 [0,1,0,0,0,1|1,0,0]=3 1000 B11R1.159 CC1=CC=CC(C(=O)O)=C1I 35322 [0,1,0,0,0,1|1,0,0]=3 1001 B11R1.159 CC1=CC=CC(C(=O)O)=C1N 26058 [0,1,0,0,0,1|1,0,0]=3 1002 B11R1.159 CC1=CC=CC(C(=O)O)=C1O D70635 [0,1,0,0,0,1|1,0,0]=3 1003 B11R1.159 CC1=CC=CC(C(=O)[O-])=C1O D89244 [0,1,0,0,0,1|1,0,1]=4 1004 B11R1.159 CC1=CC=CC(C(N)=O)=C1N C73608 [0,1,0,0,0,1|2,0,0]=4 1005 B11R1.159 CN1C=CC=C(C(=O)O)C1=O 37245 [0,1,0,0,0,1|2,0,0]=4 1006 B11R1.159 NC1=C(Br)C(C(=O)O)=CC=C1 CL8062 [0,1,0,0,0,1|2,0,0]=4 1007 B11R1.159 NC1=C(Br)C=CC=C1C(=O)O 55040 [0,1,0,0,0,1|2,0,0]=4 1008 B11R1.159 NC1=C(Br)C=NC=C1C(=O)O 35475 [0,1,0,0,0,1|2,0,0]=4 1009 B11R1.159 NC1=C(C(=O)O)C=CC=C1O 23716 [0,1,0,0,0,1|2,0,0]=4 1010 B11R1.159 NC1=C(Cl)C(C(=O)O)=CC=C1 CL8063 [0,1,0,0,0,1|2,0,0]=4 1011 B11R1.159 NC1=C(Cl)C(C(=O)O)=NC=N1 31566 [0,1,0,0,0,1|2,0,0]=4 1012 B11R1.159 NC1=C(Cl)C=CC=C1C(=O)O 23023 [0,1,0,0,0,1|2,0,0]=4 1013 B11R1.159 NC1=C(F)C(C(=O)O)=CC=C1 22611 [0,1,0,0,0,1|2,0,0]=4 1014 B11R1.159 NC1=C(F)C=CC=C1C(=O)O 46017 [0,1,0,0,0,1|2,0,0]=4 1015 B11R1.159 NC1=C(I)C=CC=C1C(=O)O BL008555 [0,1,0,0,0,1|2,0,0]=4 1016 B11R1.159 NC1=CC=CC(C(=O)O)=C1N 54186 [0,1,0,0,0,1|2,0,0]=4 1017 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=CC=N1 58502 [0,1,0,0,0,1|2,0,0]=4 1018 B11R1.159 O=C(O)C1=C(Cl)C(Cl)=NC=C1 60396 [0,1,0,0,0,1|2,0,0]=4 1019 B11R1.159 O=C(O)C1=C(F)C(Br)=NC=C1 22762 [0,1,0,0,0,1|2,0,0]=4 1020 B11R1.159 O=C(O)C1=C(F)C(Cl)=NC=C1 22485 [0,1,0,0,0,1|2,0,0]=4 1021 B11R1.159 O=C(O)C1=C(F)C(F)=NC=C1 22668 [0,1,0,0,0,1|2,0,0]=4 1022 B11R1.159 O=C(O)C1=C(O)C(Cl)=NC=C1 O10717 [0,1,0,0,0,1|2,0,0]=4 1023 B11R1.159 O=C(O)C1=C(O)C(O)=CC=C1 88222 [0,1,0,0,0,1|2,0,0]=4 1024 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Br CL8966 [0,1,0,0,0,1|2,0,0]=4 1025 B11R1.159 O=C(O)C1=CC=CC(Br)=C1Cl CL8067 [0,1,0,0,0,1|2,0,0]=4 1026 B11R1.159 O=C(O)C1=CC=CC(Br)=C1F CL8068 [0,1,0,0,0,1|2,0,0]=4 1027 B11R1.159 O=C(O)C1=CC=CC(Br)=C1I N10630 [0,1,0,0,0,1|2,0,0]=4 1028 B11R1.159 O=C(O)C1=CC=CC(Br)=C1O CL8069 [0,1,0,0,0,1|2,0,0]=4 1029 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Br CL8022 [0,1,0,0,0,1|2,0,0]=4 1030 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1Cl CK2179 [0,1,0,0,0,1|2,0,0]=4 1031 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1F 67925 [0,1,0,0,0,1|2,0,0]=4 1032 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1I 36285 [0,1,0,0,0,1|2,0,0]=4 1033 B11R1.159 O=C(O)C1=CC=CC(Cl)=C1O CL8078 [0,1,0,0,0,1|2,0,0]=4 1034 B11R1.159 O=C(O)C1=CC=CC(F)=C1Br 22325 [0,1,0,0,0,1|2,0,0]=4 1035 B11R1.159 O=C(O)C1=CC=CC(F)=C1Cl CL8034 [0,1,0,0,0,1|2,0,0]=4 1036 B11R1.159 O=C(O)C1=CC=CC(F)=C1F 25037 [0,1,0,0,0,1|2,0,0]=4 1037 B11R1.159 O=C(O)C1=CC=CC(F)=C1I CL8084 [0,1,0,0,0,1|2,0,0]=4 1038 B11R1.159 O=C(O)C1=CC=CC(F)=C1O TD1041 [0,1,0,0,0,1|2,0,0]=4 1039 B11R1.159 O=C(O)C1=CC=CC(I)=C1Br CL8023 [0,1,0,0,0,1|2,0,0]=4 1040 B11R1.159 O=C(O)C1=CC=CC(I)=C1Cl CL9584 [0,1,0,0,0,1|2,0,0]=4 1041 B11R1.159 O=C(O)C1=CC=CC(I)=C1F CL8043 [0,1,0,0,0,1|2,0,0]=4 1042 B11R1.159 O=C(O)C1=CC=CC(O)=C1Br 98173 [0,1,0,0,0,1|2,0,0]=4 1043 B11R1.159 O=C(O)C1=CC=CC(O)=C1F TD1358 [0,1,0,0,0,1|2,0,0]=4 1044 B11R1.159 O=C(O)C1=CC=NC(F)=C1Cl S12149 [0,1,0,0,0,1|2,0,0]=4 1045 B11R1.167 CC(=O)C1=C(C)C=CC(C)=C1 C13915 [0,1,0,0,0,1|2,0,0]=4 1046 B11R1.167 CC(=O)C1=C(F)C=CC(C)=C1 CK1152 [0,1,0,0,0,1|2,0,0]=4 1047 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 62590 [0,1,0,0,0,1|2,0,0]=4 1048 B11R1.167 CC1=C(C(=O)O)C=C(Br)C=C1 34988 [0,1,0,0,0,1|2,0,0]=4 1049 B11R1.167 CC1=C(C(=O)O)C=C(Cl)C=C1 89331 [0,1,0,0,0,1|2,0,0]=4 1050 B11R1.167 CC1=C(C(=O)O)C=C(F)C=C1 67849 [0,1,0,0,0,1|2,0,0]=4 1051 B11R1.167 CC1=C(C(=O)O)C=C(I)C=C1 51755 [0,1,0,0,0,1|2,0,0]=4 1052 B11R1.167 CC1=C(C(=O)O)C=C(N)C=C1 35343 [0,1,0,0,0,1|2,0,0]=4 1053 B11R1.167 CC1=C(C(=O)O)C=C(O)C=C1 35575 [0,1,0,0,0,1|2,0,0]=4 1054 B11R1.167 CC1=CC(C(=O)O)=C(Br)C=C1 CL8030 [0,1,0,0,0,1|1,0,0]=3 1055 B11R1.167 CC1=CC(C(=O)O)=C(C)C=C1 CK2188 [0,1,0,0,0,1|1,0,0]=3 1056 B11R1.167 CC1=CC(C(=O)O)=C(Cl)C=C1 CL8041 [0,1,0,0,0,1|1,0,0]=3 1057 B11R1.167 CC1=CC(C(=O)O)=C(F)C=C1 67638 [0,1,0,0,0,1|1,0,0]=3 1058 B11R1.167 CC1=CC(C(=O)O)=C(I)C=C1 CL8050 [0,1,0,0,0,1|1,0,0]=3 1059 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 26054 [0,1,0,0,0,1|1,0,0]=3 1060 B11R1.167 CC1=CC(C(=O)O)=C(O)C=C1 23035 [0,1,0,0,0,1|1,0,0]=3 1061 B11R1.167 CC1=CC(C(N)=O)=C(N)C=C1 23745 [0,1,0,0,0,1|2,0,0]=4 1062 B11R1.167 CC1=CC(C(N)=O)=C(N)N=C1 D82536 [0,1,0,0,0,1|2,0,0]=4 1063 B11R1.167 CC1=NC(C(=O)O)=C(Cl)C=N1 80160 [0,1,0,0,0,1|2,0,0]=4 1064 B11R1.167 CC1=NC=C(Br)C=C1C(=O)O CL0346 [0,1,0,0,0,1|2,0,0]=4 1065 B11R1.167 CC1=NN=C(Cl)C(C(=O)O)=C1 57275 [0,1,0,0,0,1|1,0,0]=3 1066 B11R1.167 NC1=C(C(=O)O)C=C(Br)C=C1 D77697 [0,1,0,0,0,1|2,0,0]=4 1067 B11R1.167 NC1=C(C(=O)O)C=C(Cl)C=C1 26023 [0,1,0,0,0,1|2,0,0]=4 1068 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 CK2229 [0,1,0,0,0,1|2,0,0]=4 1069 B11R1.167 NC1=C(C(=O)O)C=C(I)C=C1 86695 [0,1,0,0,0,1|2,0,0]=4 1070 B11R1.167 NC1=C(C(=O)O)C=C(O)C=C1 28786 [0,1,0,0,0,1|2,0,0]=4 1071 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=C1 CL8124 [0,1,0,0,0,1|2,0,0]=4 1072 B11R1.167 NC1=CC(C(=O)O)=C(Br)C=N1 CL0043 [0,1,0,0,0,1|2,0,0]=4 1073 B11R1.167 NC1=CC(C(=O)O)=C(Cl)C=C1 AC8218 [0,1,0,0,0,1|2,0,0]=4 1074 B11R1.167 NC1=CC(C(=O)O)=C(F)C=C1 CK2230 [0,1,0,0,0,1|2,0,0]=4 1075 B11R1.167 NC1=CC(C(=O)O)=C(O)C=C1 AC8101 [0,1,0,0,0,1|2,0,0]=4 1076 B11R1.167 NC1=CN=C(Br)C=C1C(=O)O 88073 [0,1,0,0,0,1|2,0,0]=4 1077 B11R1.167 NC1=CN=C(Cl)C=C1C(=O)O BL003048 [0,1,0,0,0,1|2,0,0]=4 1078 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O AC1527 [0,1,0,0,0,1|2,0,0]=4 1079 B11R1.167 NC1=NC=C(Br)C=C1C(=O)O CX1229 [0,1,0,0,0,1|2,0,0]=4 1080 B11R1.167 NC1=NC=C(Cl)C=C1C(=O)O 24782 [0,1,0,0,0,1|2,0,0]=4 1081 B11R1.167 NC1=NC=C(I)C=C1C(=O)O I10186 [0,1,0,0,0,1|2,0,0]=4 1082 B11R1.167 O=C(O)C1=C(Br)C=CC(Br)=C1 25031 [0,1,0,0,0,1|2,0,0]=4 1083 B11R1.167 O=C(O)C1=C(Br)C=CC(Cl)=C1 TD1170 [0,1,0,0,0,1|2,0,0]=4 1084 B11R1.167 O=C(O)C1=C(Br)C=CC(F)=C1 CK2228 [0,1,0,0,0,1|2,0,0]=4 1085 B11R1.167 O=C(O)C1=C(Br)C=CC(I)=C1 TD1018 [0,1,0,0,0,1|2,0,0]=4 1086 B11R1.167 O=C(O)C1=C(Br)C=CC(O)=C1 CL8028 [0,1,0,0,0,1|2,0,0]=4 1087 B11R1.167 O=C(O)C1=C(Br)C=NC(Cl)=C1 CL0356 [0,1,0,0,0,1|2,0,0]=4 1088 B11R1.167 O=C(O)C1=C(Cl)C=CC(Br)=C1 67841 [0,1,0,0,0,1|2,0,0]=4 1089 B11R1.167 O=C(O)C1=C(Cl)C=CC(Cl)=C1 CK2192 [0,1,0,0,0,1|2,0,0]=4 1090 B11R1.167 O=C(O)C1=C(Cl)C=CC(F)=C1 22247 [0,1,0,0,0,1|2,0,0]=4 1091 B11R1.167 O=C(O)C1=C(Cl)C=CC(I)=C1 57452 [0,1,0,0,0,1|2,0,0]=4 1092 B11R1.167 O=C(O)C1=C(Cl)C=CC(O)=C1 CL8039 [0,1,0,0,0,1|2,0,0]=4 1093 B11R1.167 O=C(O)C1=C(F)C=CC(Br)=C1 22061 [0,1,0,0,0,1|2,0,0]=4 1094 B11R1.167 O=C(O)C1=C(F)C=CC(Cl)=C1 22297 [0,1,0,0,0,1|2,0,0]=4 1095 B11R1.167 O=C(O)C1=C(F)C=CC(F)=C1 67691 [0,1,0,0,0,1|2,0,0]=4 1096 B11R1.167 O=C(O)C1=C(F)C=CC(I)=C1 28096 [0,1,0,0,0,1|2,0,0]=4 1097 B11R1.167 O=C(O)C1=C(F)C=CC(O)=C1 CL8046 [0,1,0,0,0,1|2,0,0]=4 1098 B11R1.167 O=C(O)C1=C(I)C=CC(Br)=C1 TD1130 [0,1,0,0,0,1|2,0,0]=4 1099 B11R1.167 O=C(O)C1=C(I)C=CC(Cl)=C1 CK1078 [0,1,0,0,0,1|2,0,0]=4 1100 B11R1.167 O=C(O)C1=C(I)C=CC(F)=C1 34439 [0,1,0,0,0,1|2,0,0]=4 1101 B11R1.167 O=C(O)C1=C(I)C=CC(I)=C1 35078 [0,1,0,0,0,1|2,0,0]=4 1102 B11R1.167 O=C(O)C1=C(O)C=CC(Br)=C1 S12289 [0,1,0,0,0,1|2,0,0]=4 1103 B11R1.167 O=C(O)C1=C(O)C=CC(F)=C1 CK2251 [0,1,0,0,0,1|2,0,0]=4 1104 B11R1.167 O=C(O)C1=C(O)C=CC(I)=C1 D73875 [0,1,0,0,0,1|2,0,0]=4 1105 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 CK2181 [0,1,0,0,0,1|2,0,0]=4 1106 B11R1.167 O=C(O)C1=C(O)C=CC(O)=C1 T71195 [0,1,0,0,0,1|2,0,0]=4 1107 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Br 23548 [0,1,0,0,0,1|2,0,0]=4 1108 B11R1.167 O=C(O)C1=CC(Br)=CN=C1Cl 53610 [0,1,0,0,0,1|2,0,0]=4 1109 B11R1.167 O=C(O)C1=CC(Br)=CN=C1F 23893 [0,1,0,0,0,1|2,0,0]=4 1110 B11R1.167 O=C(O)C1=CC(Br)=CN=C1O CL0224 [0,1,0,0,0,1|2,0,0]=4 1111 B11R1.167 O=C(O)C1=CC(Br)=NC=C1Br 33597 [0,1,0,0,0,1|2,0,0]=4 1112 B11R1.167 O=C(O)C1=CC(Br)=NC=C1F 22678 [0,1,0,0,0,1|2,0,0]=4 1113 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Br 34517 [0,1,0,0,0,1|2,0,0]=4 1114 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1Cl CL0015 [0,1,0,0,0,1|2,0,0]=4 1115 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1F 29088 [0,1,0,0,0,1|2,0,0]=4 1116 B11R1.167 O=C(O)C1=CC(Cl)=CN=C1O CL0214 [0,1,0,0,0,1|2,0,0]=4 1117 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1Cl 60656 [0,1,0,0,0,1|2,0,0]=4 1118 B11R1.167 O=C(O)C1=CC(Cl)=NC=C1F 22561 [0,1,0,0,0,1|2,0,0]=4 1119 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1Cl 35390 [0,1,0,0,0,1|2,0,0]=4 1120 B11R1.167 O=C(O)C1=CC(Cl)=NN=C1O 24719 [0,1,0,0,0,1|2,0,0]=4 1121 B11R1.167 O=C(O)C1=CC(F)=CN=C1Cl 52503 [0,1,0,0,0,1|2,0,0]=4 1122 B11R1.167 O=C(O)C1=CC(F)=NC=C1F W11444 [0,1,0,0,0,1|2,0,0]=4 1123 B11R1.167 O=C(O)C1=CC(I)=CN=C1Cl I11277 [0,1,0,0,0,1|2,0,0]=4 1124 B11R1.167 O=C(O)C1=CC(I)=CN=C1O C74987 [0,1,0,0,0,1|2,0,0]=4 1125 B11R1.266 C#CC1=CC=CC(C(=O)O)=C1 AB1443 [0,1,0,0,0,1|1,0,1]=4 1126 B11R1.266 CCC1=CC=CC(C(=O)O)=N1 26713 [0,1,0,0,0,1|2,0,0]=4 1127 B11R1.266 CCC1=CC=CC(C(C)=O)=C1 30121 [0,1,0,0,0,1|2,0,0]=4 1128 B11R1.266 CCC1=CC=CC(C(C)=O)=C1 CL9636 [0,1,0,0,0,1|2,0,0]=4 1129 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 C71644 [0,1,0,0,0,1|1,0,0]=3 1130 B11R1.266 CNC1=CC=CC(C(=O)O)=C1 F16160 [0,1,0,0,0,1|1,0,0]=3 1131 B11R1.266 COC1=CC(C(=O)O)=CN=C1 23872 [0,1,0,0,0,1|1,0,0]=3 1132 B11R1.266 COC1=CC(C(=O)O)=NC=C1 CL0185 [0,1,0,0,0,1|1,0,0]=3 1133 B11R1.266 COC1=CC(C(C)=O)=CN=C1 D95054 [0,1,0,0,0,1|2,0,0]=4 1134 B11R1.266 COC1=CC(C(N)=O)=NC=C1 D74452 [0,1,0,0,0,1|2,0,0]=4 1135 B11R1.266 COC1=CC=CC(C(=O)Cl)=C1 75865 [0,1,0,0,0,1|2,0,0]=4 1136 B11R1.266 COC1=CC=CC(C(=O)O)=C1 AB2884 [0,1,0,0,0,1|1,0,0]=3 1137 B11R1.266 COC1=CC=CC(C(=O)O)=N1 CL0063 [0,1,0,0,0,1|2,0,0]=4 1138 B11R1.266 COC1=CC=CC(C(C)=O)=C1 L10020 [0,1,0,0,0,1|2,0,0]=4 1139 B11R1.266 COC1=CC=CC(C(N)=O)=C1 F20929 [0,1,0,0,0,1|2,0,0]=4 1140 B11R1.266 COC1=NC=CC(C(=O)O)=C1 64204 [0,1,0,0,0,1|1,0,0]=3 1141 B11R1.266 CSC1=CC(C(=O)O)=CC=C1 FD7334 [0,1,0,0,0,1|1,0,0]=3 1142 B11R1.266 N#CC1=CC(C(=O)O)=CN=C1 F13830 [0,1,0,0,0,1|1,0,1]=4 1143 B11R1.266 N#CC1=CC=CC(C(=O)O)=C1 22318 [0,1,0,0,0,1|1,0,1]=4 1144 B11R1.266 N#CC1=NC=CC(C(=O)O)=C1 82971 [0,1,0,0,0,1|1,0,1]=4 1145 B11R1.266 NC(=O)C1=CC=CC(CBr)=C1 27100 [0,1,0,0,0,1|2,0,0]=4 1146 B11R1.266 NC(=O)C1=CC=CC(CCl)=C1 D84155 [0,1,0,0,0,1|2,0,0]=4 1147 B11R1.266 NCC1=CC=CC(C(=O)O)=C1 83004 [0,1,0,0,0,1|1,0,0]=3 1148 B11R1.266 NCC1=CC=CC(C(N)=O)=C1 Y10174 [0,1,0,0,0,1|2,0,0]=4 1149 B11R1.266 NNC1=CC=CC(C(=O)O)=C1 AB7307 [0,1,0,0,0,1|2,0,0]=4 1150 B11R1.266 NNC1=CC=CC(C(=O)O)=C1 I10221 [0,1,0,0,0,1|2,0,0]=4 1151 B11R1.266 O=C(Cl)C1=CC(CCl)=CC=C1 75637 [0,1,0,0,0,1|2,0,0]=4 1152 B11R1.266 O=C(O)C1=CC=CC(CBr)=C1 I11347 [0,1,0,0,0,1|1,0,0]=3 1153 B11R1.266 O=C(O)C1=CC=CC(CCl)=C1 28340 [0,1,0,0,0,1|1,0,0]=3 1154 B11R1.266 O=C(O)C1=NC(CO)=CC=C1 24753 [0,1,0,0,0,1|2,0,0]=4 1155 B11R1.266 O=C(O)C1=NC=CC(CO)=C1 D76132 [0,1,0,0,0,1|1,0,0]=3 1156 B11R1.266 O=CC1=CC=CC(C(=O)O)=C1 33600 [0,1,0,0,0,1|1,0,1]=4 1157 B11R1.15 CCOC(=O)C1=CC(C)=NN1 29262 [0,2,0,0,0,0|2,0,0]=4 1158 B11R1.15 CCOC(=O)C1=CC=C(C)N1 60155 [0,2,0,0,0,0|2,0,0]=4 1159 B11R1.15 CCOC(=O)C1=CC=C(C)S1 O11807 [0,2,0,0,0,0|2,0,0]=4 1160 B11R1.15 CCOC(=O)C1=CN(C)N=C1 38787 [0,2,0,0,0,0|2,0,0]=4 1161 B11R1.15 CCOC(=O)C1=CN=C(C)S1 87845 [0,2,0,0,0,0|2,0,0]=4 1162 B11R1.15 CCOC(=O)C1=COC(C)=N1 90299 [0,2,0,0,0,0|1,1,0]=4 1163 B11R1.15 CCOC(=O)C1=CSC(Br)=C1 36218 [0,2,0,0,0,0|1,0,0]=3 1164 B11R1.15 CCOC(=O)C1=CSC(Br)=N1 60876 [0,2,0,0,0,0|2,0,0]=4 1165 B11R1.15 CCOC(=O)C1=CSC(C)=N1 CL2518 [0,2,0,0,0,0|1,0,0]=3 1166 B11R1.15 CCOC(=O)C1=CSC(Cl)=N1 36007 [0,2,0,0,0,0|2,0,0]=4 1167 B11R1.15 CCOC(=O)C1=CSC(N)=N1 51704 [0,2,0,0,0,0|2,0,0]=4 1168 B11R1.15 CCOC(=O)C1=NOC(C)=C1 F14097 [0,2,0,0,0,0|1,1,0]=4 1169 B11R1.44 CCC1=NNC(C(=O)OC)=C1 25067 [0,2,0,0,0,0|2,0,0]=4 1170 B11R1.44 COC(=O)C1=CC=C(CCl)O1 67736 [0,2,0,0,0,0|2,0,0]=4 1171 B11R1.44 COC(=O)C1=COC(CCl)=N1 50698 [0,2,0,0,0,0|1,1,0]=4 1172 B11R1.44 COC(=O)C1=CSC(C=O)=C1 33669 [0,2,0,0,0,0|0,0,1]=3 1173 B11R1.44 COC(=O)C1=CSC(CCl)=N1 26750 [0,2,0,0,0,0|1,0,0]=3 1174 B11R1.225 COC(=O)C1=C(Br)SC(Br)=C1 Y11400 [0,2,0,0,0,0|1,0,0]=3 1175 B11R1.225 COC(=O)C1=C(Br)SC(Br)=N1 23695 [0,2,0,0,0,0|2,0,0]=4 1176 B11R1.225 COC(=O)C1=C(Br)SC(C)=N1 D79746 [0,2,0,0,0,0|1,0,0]=3 1177 B11R1.225 COC(=O)C1=C(Br)SC(N)=N1 76606 [0,2,0,0,0,0|2,0,0]=4 1178 B11R1.225 COC(=O)C1=C(C)NC(C)=C1 78268 [0,2,0,0,0,0|1,0,0]=3 1179 B11R1.225 COC(=O)C1=C(C)SC(Br)=N1 F12362 [0,2,0,0,0,0|2,0,0]=4 1180 B11R1.225 COC(=O)C1=C(C)SC(N)=N1 24395 [0,2,0,0,0,0|2,0,0]=4 1181 B11R1.225 COC(=O)C1=C(Cl)SC(N)=N1 23443 [0,2,0,0,0,0|2,0,0]=4 1182 B11R1.225 COC(=O)C1=C(N)C=C(C)S1 50005 [0,2,0,0,0,0|2,0,0]=4 1183 B11R1.225 COC(=O)C1=C(N)SC(C)=C1 71347 [0,2,0,0,0,0|0,0,0]=2 1184 B11R1.225 COC(=O)C1=CC(C)=NN1C W11019 [0,2,0,0,0,0|2,0,0]=4 1185 B11R1.225 COC(=O)C1=CN(C)N=C1N C16148 [0,2,0,0,0,0|2,0,0]=4 1186 B11R1.226 COC(=O)C1=CC(Br)=C(C)S1 D84466 [0,2,0,0,0,0|2,0,0]=4 1187 B11R1.226 COC(=O)C1=CC(C)=C(Br)S1 F10362 [0,2,0,0,0,0|2,0,0]=4 1188 B11R1.865 COC(=O)C1=C(Cl)C(C)=CS1 I11777 [0,2,0,0,0,0|2,0,0]=4 1189 B11R1.865 COC(=O)C1=C(N)C(C)=CS1 67882 [0,2,0,0,0,0|2,0,0]=4 1190 B11R1.865 COC(=O)C1=CSC(C)=C1N 76644 [0,2,0,0,0,0|0,0,0]=2 1191 B11R1.865 COC(=O)C1=NOC(C)=C1Br W18195 [0,2,0,0,0,0|1,1,0]=4 1192 B11R1.50 CCC1=NN(C)C(C(=O)O)=C1 W18574 [0,2,0,0,0,0|2,0,0]=4 1193 B11R1.50 COC1=NC(C)=C(C(=O)O)S1 D82121 [0,2,0,0,0,0|2,0,0]=4 1194 B11R1.124 CCCC1=NNC(C(=O)O)=C1 F16166 [0,2,0,0,0,0|2,0,0]=4 1195 B11R1.175 CC(=O)C1=CC=C(C(=O)O)S1 FD7379 [0,2,0,0,0,0|2,0,0]=4 1196 B11R1.175 CC(=O)C1=CNC(C(=O)O)=C1 CL2818 [0,2,0,0,0,0|2,0,0]=4 1197 B11R1.175 CC(=O)C1=NC=C(C(=O)O)S1 FD7385 [0,2,0,0,0,0|2,0,0]=4 1198 B11R1.175 CC(C)C1=NNC(C(=O)O)=C1 54607 [0,2,0,0,0,0|2,0,0]=4 1199 B11R1.175 CC(C)N1C=C(C(=O)O)C=N1 P10272 [0,2,0,0,0,0|2,0,0]=4 1200 B11R1.175 O=C(O)C1=CSC([N+](=O)[O-])=C1 30092 [0,2,0,0,0,0|1,0,0]=3 1201 B11R1.672 CC1=C(Br)C(C(=O)O)=NN1C W15922 [0,2,0,0,0,0|2,0,0]=4 1202 B11R1.672 CC1=CC(C(=O)O)=C(C)N1C 30163 [0,2,0,0,0,0|1,0,0]=3 1203 B11R1.49 CCN1N=C(C)C=C1C(=O)O P15301 [0,2,0,0,0,0|2,0,0]=4 1204 B11R1.673 CC1=NN(C)C(C(=O)O)=C1Br C16018 [0,2,0,0,0,0|2,0,0]=4 1205 B11R1.673 CC1=NN(C)C(C)=C1C(=O)O 71138 [0,2,0,0,0,0|2,0,0]=4 1206 B11R1.64 COC1=C(Cl)SC=C1C(=O)O 30105 [0,2,0,0,0,0|1,0,0]=3 1207 B9R1.6 O=C(O)C1=CC=CC=C1 D85168 [0,0,1,1,0,0|1,0,1]=4 1208 B9R1.6 O=C(O)C1=CC=CC=C1 P19750 [0,0,1,1,0,0|1,0,1]=4 1209 B9R1.6 O=C(O)C1=CN=CC=C1 AC8691 [0,0,1,1,0,0|1,0,1]=4 1210 B9R1.6 O=C(O)C1=CN=CN=C1 CL1919 [0,0,1,1,0,0|2,0,0]=4 1211 B9R1.2 CC1=CC(C=O)=CN=C1 25175 [1,0,0,0,0,1|1,0,0]=3 1212 B9R1.2 CC1=CC(C=O)=NC=C1 24308 [1,0,0,0,0,1|1,0,0]=3 1213 B9R1.2 CC1=CC(CO)=CN=C1 SC5056 [1,0,0,0,0,1|1,0,1]=4 1214 B9R1.2 CC1=CC(CO)=NC=C1 35673 [1,0,0,0,0,1|1,0,1]=4 1215 B9R1.2 CC1=CC=CC(C=O)=C1 AC8308 [1,0,0,0,0,1|1,0,0]=3 1216 B9R1.2 CC1=CC=CC(C=O)=N1 76383 [1,0,0,0,0,1|2,0,0]=4 1217 B9R1.2 CC1=CC=CC(CO)=C1 H10820 [1,0,0,0,0,1|1,0,1]=4 1218 B9R1.2 CC1=NC=CC(C=O)=C1 63428 [1,0,0,0,0,1|1,0,0]=3 1219 B9R1.2 CC1=NC=CC(C=O)=N1 27815 [1,0,0,0,0,1|2,0,0]=4 1220 B9R1.2 CC1=NC=CC(CO)=C1 25745 [1,0,0,0,0,1|1,0,1]=4 1221 B9R1.2 O=CC1=CC(=O)NC=C1 S10165 [1,0,0,0,0,1|2,0,0]=4 1222 B9R1.2 O=CC1=CC(Br)=CN=C1 54538 [1,0,0,0,0,1|2,0,0]=4 1223 B9R1.2 O=CC1=CC(Br)=NC=C1 CL8873 [1,0,0,0,0,1|2,0,0]=4 1224 B9R1.2 O=CC1=CC(Cl)=CN=C1 BL006745 [1,0,0,0,0,1|2,0,0]=4 1225 B9R1.2 O=CC1=CC(Cl)=NC=C1 37324 [1,0,0,0,0,1|2,0,0]=4 1226 B9R1.2 O=CC1=CC(F)=CN=C1 34808 [1,0,0,0,0,1|2,0,0]=4 1227 B9R1.2 O=CC1=CC(F)=NC=C1 25422 [1,0,0,0,0,1|2,0,0]=4 1228 B9R1.2 O=CC1=CC(O)=CC=C1 P17108 [1,0,0,0,0,1|2,0,0]=4 1229 B9R1.2 O=CC1=CC(O)=NC=C1 62936 [1,0,0,0,0,1|2,0,0]=4 1230 B9R1.2 O=CC1=CC=CC(Br)=C1 FD9079 [1,0,0,0,0,1|2,0,0]=4 1231 B9R1.2 O=CC1=CC=CC(Cl)=C1 D70835 [1,0,0,0,0,1|2,0,0]=4 1232 B9R1.2 O=CC1=CC=CC(F)=C1 36766 [1,0,0,0,0,1|2,0,0]=4 1233 B9R1.2 O=CC1=CC=CC(I)=C1 52671 [1,0,0,0,0,1|2,0,0]=4 1234 B9R1.2 O=CC1=CN=CC(O)=C1 36323 [1,0,0,0,0,1|2,0,0]=4 1235 B9R1.2 O=CC1=NC=CC(Br)=C1 57009 [1,0,0,0,0,1|2,0,0]=4 1236 B9R1.2 O=CC1=NC=CC(Cl)=C1 24640 [1,0,0,0,0,1|2,0,0]=4 1237 B9R1.13 CC(=O)NC1=CSC=C1 30787 [1,0,0,0,0,1|1,0,0]=3 1238 B9R1.13 O=C(O)CC1=CC=CS1 P10011 [1,0,0,0,0,1|2,0,0]=4 1239 B9R1.13 O=C(O)CC1=CN=CN1 76838 [1,0,0,0,0,1|2,0,0]=4 1240 B9R1.13 O=C(O)CC1=CNC=N1 62600 [1,0,0,0,0,1|2,0,0]=4 1241 B9R1.13 O=C(O)CC1=CSC=C1 23025 [1,0,0,0,0,1|0,0,0]=2 1242 B9R1.13 O=C(O)CC1=CSC=N1 30725 [1,0,0,0,0,1|1,0,0]=3 1243 B9R1.13 O=C(O)CC1=NNC=C1 82858 [1,0,0,0,0,1|2,0,0]=4 1244 B9R1.13 O=C(O)CN1C=CN=C1 39400 [1,0,0,0,0,1|2,0,0]=4 1245 B11R1.20 CC(=O)CC1=CC=C(C)C=C1 N11980 [0,0,0,0,0,2|2,0,0]=4 1246 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 11780 [0,0,0,0,0,2|2,0,0]=4 1247 B11R1.20 CC(=O)OC1=CC=C(C)C=C1 F19619 [0,0,0,0,0,2|2,0,0]=4 1248 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 73716 [0,0,0,0,0,2|1,0,0]=3 1249 B11R1.20 CC1=CC=C(NC(N)=O)C=C1 D92325 [0,0,0,0,0,2|2,0,0]=4 1250 B11R1.20 CC1=CN=C(CC(=O)O)C=C1 RB3375 [0,0,0,0,0,2|1,0,0]=3 1251 B11R1.20 CC1=NC=C(CC(=O)O)C=C1 76381 [0,0,0,0,0,2|1,0,0]=3 1252 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 AC7503 [0,0,0,0,0,2|2,0,0]=4 1253 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 P16509 [0,0,0,0,0,2|2,0,0]=4 1254 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 D70527 [0,0,0,0,0,2|2,0,0]=4 1255 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 25500 [0,0,0,0,0,2|2,0,0]=4 1256 B11R1.20 O=C(O)CC1=CC=C(I)C=C1 33451 [0,0,0,0,0,2|2,0,0]=4 1257 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 AC7824 [0,0,0,0,0,2|2,0,0]=4 1258 B11R1.20 O=C(O)CC1=CN=C(Cl)C=C1 57816 [0,0,0,0,0,2|2,0,0]=4 1259 B11R1.20 O=C(O)CC1=NC=C(Br)C=C1 36095 [0,0,0,0,0,2|2,0,0]=4 1260 B11R1.75 CC1=CC=C(\C=C\C(=O)O)S1 D72574 [0,0,0,0,0,2|2,0,0]=4 1261 B11R1.75 CC1=CC=C(\C=C\C(=O)O)S1 W17624 [0,0,0,0,0,2|2,0,0]=4 1262 B11R1.157 CC(=O)NC1=CC(C)=CC=C1 D88205 [0,0,0,0,0,2|2,0,0]=4 1263 B11R1.157 CC(=O)NC1=NC=CC(C)=C1 F16668 [0,0,0,0,0,2|2,0,0]=4 1264 B11R1.157 CC(=O)OC1=CC(C)=CC=C1 I10260 [0,0,0,0,0,2|2,0,0]=4 1265 B11R1.157 CC1=CC=CC(CC(=O)O)=C1 A10247 [0,0,0,0,0,2|1,0,0]=3 1266 B11R1.157 NC1=CC=CC(CC(=O)O)=C1 CL8768 [0,0,0,0,0,2|2,0,0]=4 1267 B11R1.157 O=C(O)CC1=CC(Br)=NC=C1 F53120 [0,0,0,0,0,2|2,0,0]=4 1268 B11R1.157 O=C(O)CC1=CC(Cl)=NC=C1 F17279 [0,0,0,0,0,2|2,0,0]=4 1269 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 AB3840 [0,0,0,0,0,2|2,0,0]=4 1270 B11R1.157 O=C(O)CC1=CC=CC(Br)=C1 67683 [0,0,0,0,0,2|2,0,0]=4 1271 B11R1.157 O=C(O)CC1=CC=CC(Cl)=C1 67684 [0,0,0,0,0,2|2,0,0]=4 1272 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 22029 [0,0,0,0,0,2|2,0,0]=4 1273 B11R1.157 O=C(O)CC1=CC=CC(I)=C1 CK2077 [0,0,0,0,0,2|2,0,0]=4