0 B10R1.58 CC1=C(Br)SC(C(=O)O)=C1 SY133724 [0,0,0,0,0,0|1,2,0]=3 1 B10R1.58 CC1=C(C)SC(C(=O)O)=N1 SY022801 [0,0,0,0,0,0|3,1,0]=4 2 B10R1.58 CC1=CC(C(=O)O)=NN1C SY004171 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.58 CC1=NC(C(=O)O)=CN1C SY251500 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.58 CN1C=C(C(=O)O)N=C1Br SY252953 [0,0,0,0,0,0|3,1,0]=4 5 B10R1.58 NC1=C(Br)SC(C(=O)O)=C1 SY111495 [0,0,0,0,0,0|1,2,0]=3 6 B10R1.58 O=C(O)C1=CC(Br)=C(Br)S1 SY060376 [0,0,0,0,0,0|0,3,0]=3 7 B9R1.23 CC1=C(C)NC(C=O)=C1 SY284154 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.23 O=CC1=CC(Br)=C(Br)N1 SY157733 [1,0,0,0,0,0|1,2,0]=4 9 B9R1.35 CC(=O)C1=CC(Br)=CS1 SY031823 [1,0,0,0,0,0|1,2,0]=4 10 B9R1.35 CC(=O)C1=CC(Cl)=CS1 SY101316 [1,0,0,0,0,0|1,1,0]=3 11 B9R1.35 CC(=O)C1=CC=C(Br)S1 SY017856 [1,0,0,0,0,0|1,2,0]=4 12 B9R1.35 CC(=O)C1=CC=C(C)O1 SY013987 [1,0,0,0,0,0|2,0,0]=3 13 B9R1.35 CC(=O)C1=CC=C(C)S1 SY016983 [1,0,0,0,0,0|2,1,0]=4 14 B9R1.35 CC1=CC(C(=O)O)=CS1 SY014238 [1,0,0,0,0,0|3,0,0]=4 15 B9R1.35 CC1=CC(C(=O)O)=NO1 SY010127 [1,0,0,0,0,0|3,0,0]=4 16 B9R1.35 CC1=CC=C(B(O)O)O1 SY025273 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.35 CC1=CC=C(C(=O)O)O1 SY033736 [1,0,0,0,0,0|1,0,0]=2 18 B9R1.35 CC1=CC=C(C(=O)O)S1 SY001770 [1,0,0,0,0,0|1,1,0]=3 19 B9R1.35 CC1=CN=C(C(=O)O)S1 SY023408 [1,0,0,0,0,0|2,1,0]=4 20 B9R1.35 CC1=COC(C(=O)O)=N1 SY273851 [1,0,0,0,0,0|2,0,0]=3 21 B9R1.35 CC1=CSC(C(=O)O)=C1 SY012042 [1,0,0,0,0,0|1,1,0]=3 22 B9R1.35 CC1=CSC(C(=O)O)=N1 SY015483 [1,0,0,0,0,0|2,1,0]=4 23 B9R1.35 CC1=NC(C(=O)O)=CN1 SY015260 [1,0,0,0,0,0|3,0,0]=4 24 B9R1.35 CC1=NC(C(=O)O)=CO1 SY015418 [1,0,0,0,0,0|3,0,0]=4 25 B9R1.35 CC1=NC(C(=O)O)=CS1 SY005875 [1,0,0,0,0,0|3,0,0]=4 26 B9R1.35 CC1=NC=C(C(=O)O)O1 SY034537 [1,0,0,0,0,0|2,0,0]=3 27 B9R1.35 CC1=NC=C(C(=O)O)S1 SY019257 [1,0,0,0,0,0|2,1,0]=4 28 B9R1.35 CC1=NNC(C(=O)O)=C1 SY007408 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.35 CC1=NOC(C(=O)O)=C1 SY033484 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.35 CN1C=CC(C(=O)O)=C1 SY023300 [1,0,0,0,0,0|3,0,0]=4 31 B9R1.35 CN1C=CC(C(=O)O)=N1 SY005921 [1,0,0,0,0,0|3,0,0]=4 32 B9R1.35 CN1C=NC(C(=O)O)=C1 SY003723 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.35 NC1=CSC(C(=O)O)=C1 SY026146 [1,0,0,0,0,0|1,1,0]=3 34 B9R1.35 NC1=NC(C(=O)O)=CN1 SY027829 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.35 NC1=NC=C(C(=O)O)S1 SY003801 [1,0,0,0,0,0|2,1,0]=4 36 B9R1.35 O=C(O)C1=CC(Br)=CN1 SY110044 [1,0,0,0,0,0|1,1,0]=3 37 B9R1.35 O=C(O)C1=CC(Br)=CS1 SY002033 [1,0,0,0,0,0|0,2,0]=3 38 B9R1.35 O=C(O)C1=CC(Br)=NO1 SY018531 [1,0,0,0,0,0|1,1,0]=3 39 B9R1.35 O=C(O)C1=CC(Cl)=CS1 SY046793 [1,0,0,0,0,0|0,1,0]=2 40 B9R1.35 O=C(O)C1=CC=C(Br)O1 SY023401 [1,0,0,0,0,0|0,1,0]=2 41 B9R1.35 O=C(O)C1=CC=C(Br)S1 SY003028 [1,0,0,0,0,0|0,2,0]=3 42 B9R1.35 O=C(O)C1=CC=C(Cl)O1 SY104264 [1,0,0,0,0,0|0,0,0]=1 43 B9R1.35 O=C(O)C1=CC=C(Cl)S1 SY001039 [1,0,0,0,0,0|0,1,0]=2 44 B9R1.35 O=C(O)C1=CC=C(F)S1 SY042026 [1,0,0,0,0,0|0,2,0]=3 45 B9R1.35 O=C(O)C1=CN=C(Br)N1 SY035164 [1,0,0,0,0,0|2,1,0]=4 46 B9R1.35 O=C(O)C1=CN=C(Br)S1 SY006695 [1,0,0,0,0,0|1,2,0]=4 47 B9R1.35 O=C(O)C1=CN=C(Cl)S1 SY019267 [1,0,0,0,0,0|1,1,0]=3 48 B9R1.35 O=C(O)C1=CNC(Cl)=N1 SY264613 [1,0,0,0,0,0|2,0,0]=3 49 B9R1.35 O=C(O)C1=COC(Br)=C1 SY021737 [1,0,0,0,0,0|2,1,0]=4 50 B9R1.35 O=C(O)C1=COC(Cl)=N1 SY027681 [1,0,0,0,0,0|2,0,0]=3 51 B9R1.35 O=C(O)C1=CSC(Br)=C1 SY022842 [1,0,0,0,0,0|2,1,0]=4 52 B9R1.35 O=C(O)C1=CSC(Br)=N1 SY004497 [1,0,0,0,0,0|2,1,0]=4 53 B9R1.35 O=C(O)C1=CSC(Cl)=C1 SY019665 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.35 O=C(O)C1=CSC(Cl)=N1 SY065475 [1,0,0,0,0,0|2,0,0]=3 55 B9R1.35 O=C(O)C1=CSC(I)=N1 SY205366 [1,0,0,0,0,0|2,1,0]=4 56 B9R1.35 O=C(O)C1=NC(Br)=CS1 SY033628 [1,0,0,0,0,0|1,2,0]=4 57 B9R1.35 O=C(O)C1=NC=C(Br)S1 SY006142 [1,0,0,0,0,0|1,2,0]=4 58 B9R1.35 O=C(O)C1=NNC(Br)=C1 SY036625 [1,0,0,0,0,0|2,1,0]=4 59 B9R1.35 O=C(O)C1=NNC(Cl)=C1 SY029998 [1,0,0,0,0,0|2,0,0]=3 60 B9R1.35 O=C1NC=C(C(=O)O)N1 SY018249 [1,0,0,0,0,0|3,0,0]=4 61 B9R1.35 O=[N+]([O-])C1=CC=C(Br)O1 SY047887 [1,0,0,0,0,0|1,1,1]=4 62 B9R1.35 OB(O)C1=CC=C(Cl)S1 SY015575 [1,0,0,0,0,0|1,1,1]=4 63 B9R1.35 OB(O)C1=CC=C(F)O1 SY251035 [1,0,0,0,0,0|1,1,1]=4 64 B11R1.226 COC(=O)C1=CC(Br)=C(Br)O1 SY023311 [0,1,0,0,0,0|0,2,0]=3 65 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)N1 SY257781 [0,1,0,0,0,0|1,1,0]=3 66 B11R1.226 COC(=O)C1=CC(Br)=C(Cl)O1 SY023791 [0,1,0,0,0,0|0,1,0]=2 67 B11R1.226 COC(=O)C1=CC(I)=C(Cl)N1 SY257780 [0,1,0,0,0,0|1,1,0]=3 68 B11R1.226 COC(=O)C1=CC(N)=C(Cl)S1 SY064518 [0,1,0,0,0,0|1,1,0]=3 69 B11R1.226 COC(=O)C1=NC(C)=C(Br)O1 SY294372 [0,1,0,0,0,0|2,1,0]=4 70 B11R1.672 O=C(O)C1=C(Cl)C(Cl)=C(Cl)S1 SY247159 [0,1,0,0,0,0|0,1,0]=2 71 B11R1.21 CC(=O)C1=CC=C(Cl)C(C)=C1 SY062023 [0,0,0,0,0,1|3,0,0]=4 72 B11R1.21 CC(=O)C1=CC=C(Cl)C(Cl)=C1 SY003529 [0,0,0,0,0,1|2,0,0]=3 73 B11R1.21 CC(=O)C1=CC=C(F)C(Cl)=C1 SY023313 [0,0,0,0,0,1|2,1,0]=4 74 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 SY237270 [0,0,0,0,0,1|3,0,0]=4 75 B11R1.21 CC(O)C1=CC=C(Cl)C(Cl)=C1 SY005064 [0,0,0,0,0,1|2,0,1]=4 76 B11R1.21 CC1=C(Cl)C=CC(C(=O)O)=C1 SY014466 [0,0,0,0,0,1|2,0,0]=3 77 B11R1.21 CC1=CC(C(=O)O)=CC=C1Br SY005296 [0,0,0,0,0,1|2,1,0]=4 78 B11R1.21 CC1=CC(C(=O)O)=CC=C1F SY007282 [0,0,0,0,0,1|2,1,0]=4 79 B11R1.21 CC1=CC(C(=O)O)=CC=C1N SY005389 [0,0,0,0,0,1|3,0,0]=4 80 B11R1.21 CC1=CC(C(=O)O)=CC=C1O SY002872 [0,0,0,0,0,1|3,0,0]=4 81 B11R1.21 CC1=CC(C(=O)O)=CNC1=O SY034396 [0,0,0,0,0,1|3,0,0]=4 82 B11R1.21 CC1=CC(C(=O)O)=NC=C1Br SY031506 [0,0,0,0,0,1|2,1,0]=4 83 B11R1.21 CC1=CC=C(C(=O)O)C=C1C SY001153 [0,0,0,0,0,1|3,0,0]=4 84 B11R1.21 CC1=CC=C(C(=O)O)C=C1Cl SY003397 [0,0,0,0,0,1|2,0,0]=3 85 B11R1.21 CC1=CC=C(C(=O)O)C=C1F SY013052 [0,0,0,0,0,1|2,1,0]=4 86 B11R1.21 CC1=CC=C(C(=O)O)C=C1I SY002748 [0,0,0,0,0,1|2,1,0]=4 87 B11R1.21 CC1=CC=C(C(=O)O)C=C1N SY001489 [0,0,0,0,0,1|3,0,0]=4 88 B11R1.21 CC1=CC=C(C(=O)O)C=C1O SY003068 [0,0,0,0,0,1|3,0,0]=4 89 B11R1.21 CC1=NC(C(=O)O)=CC=C1Br SY108250 [0,0,0,0,0,1|2,1,0]=4 90 B11R1.21 NC(=O)C1=CC=C(Cl)C(N)=C1 SY020313 [0,0,0,0,0,1|3,0,0]=4 91 B11R1.21 NC1=C(Br)C=CC(C(=O)O)=C1 SY009233 [0,0,0,0,0,1|2,1,0]=4 92 B11R1.21 NC1=C(Cl)C=C(C(=O)O)C=C1 SY009077 [0,0,0,0,0,1|2,0,0]=3 93 B11R1.21 NC1=C(O)N=CC(C(=O)O)=C1 SY272001 [0,0,0,0,0,1|3,0,0]=4 94 B11R1.21 NC1=CC(C(=O)O)=CC=C1Cl SY001488 [0,0,0,0,0,1|2,0,0]=3 95 B11R1.21 NC1=CC(C(=O)O)=CC=C1F SY009032 [0,0,0,0,0,1|2,1,0]=4 96 B11R1.21 NC1=CC(C(=O)O)=CC=C1O SY002820 [0,0,0,0,0,1|3,0,0]=4 97 B11R1.21 NC1=CC(C(=O)O)=CC=C1O SY059883 [0,0,0,0,0,1|3,0,0]=4 98 B11R1.21 NC1=CC=C(C(=O)O)C=C1Br SY025536 [0,0,0,0,0,1|2,1,0]=4 99 B11R1.21 NC1=CC=C(C(=O)O)C=C1F SY007349 [0,0,0,0,0,1|2,1,0]=4 100 B11R1.21 NC1=CC=C(C(=O)O)C=C1N SY001595 [0,0,0,0,0,1|3,0,0]=4 101 B11R1.21 NC1=CC=C(C(=O)O)C=C1O SY018797 [0,0,0,0,0,1|3,0,0]=4 102 B11R1.21 O=C(O)C1=CC(Br)=C(O)N=C1 SY007563 [0,0,0,0,0,1|2,1,0]=4 103 B11R1.21 O=C(O)C1=CC(F)=C(I)C=C1 SY023172 [0,0,0,0,0,1|1,2,0]=4 104 B11R1.21 O=C(O)C1=CC(I)=C(O)N=C1 SY047818 [0,0,0,0,0,1|2,1,0]=4 105 B11R1.21 O=C(O)C1=CC(O)=C(Br)C=C1 SY012255 [0,0,0,0,0,1|2,1,0]=4 106 B11R1.21 O=C(O)C1=CC=C(Br)C(=O)N1 SY110772 [0,0,0,0,0,1|2,1,0]=4 107 B11R1.21 O=C(O)C1=CC=C(Br)C(Br)=C1 SY034395 [0,0,0,0,0,1|1,2,0]=4 108 B11R1.21 O=C(O)C1=CC=C(Br)C(F)=C1 SY008839 [0,0,0,0,0,1|1,2,0]=4 109 B11R1.21 O=C(O)C1=CC=C(Cl)C(Br)=C1 SY015480 [0,0,0,0,0,1|1,1,0]=3 110 B11R1.21 O=C(O)C1=CC=C(Cl)C(Cl)=C1 SY001131 [0,0,0,0,0,1|1,0,0]=2 111 B11R1.21 O=C(O)C1=CC=C(Cl)C(F)=C1 SY005008 [0,0,0,0,0,1|1,1,0]=3 112 B11R1.21 O=C(O)C1=CC=C(Cl)C(I)=C1 SY030183 [0,0,0,0,0,1|1,1,0]=3 113 B11R1.21 O=C(O)C1=CC=C(Cl)C(O)=C1 SY021851 [0,0,0,0,0,1|2,0,0]=3 114 B11R1.21 O=C(O)C1=CC=C(F)C(Br)=C1 SY002875 [0,0,0,0,0,1|1,2,0]=4 115 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 SY005155 [0,0,0,0,0,1|1,1,0]=3 116 B11R1.21 O=C(O)C1=CC=C(F)C(F)=C1 SY005367 [0,0,0,0,0,1|1,2,0]=4 117 B11R1.21 O=C(O)C1=CC=C(F)C(O)=C1 SY003002 [0,0,0,0,0,1|2,1,0]=4 118 B11R1.21 O=C(O)C1=CC=C(I)C(Br)=C1 SY034738 [0,0,0,0,0,1|1,2,0]=4 119 B11R1.21 O=C(O)C1=CC=C(I)C(O)=C1 SY041688 [0,0,0,0,0,1|2,1,0]=4 120 B11R1.21 O=C(O)C1=CC=C(O)C(F)=C1 SY017183 [0,0,0,0,0,1|2,1,0]=4 121 B11R1.21 O=C(O)C1=CC=C(O)C(O)=C1 SY014104 [0,0,0,0,0,1|3,0,0]=4 122 B11R1.21 O=C(O)C1=CN=C(Br)C(Br)=C1 SY031454 [0,0,0,0,0,1|1,2,0]=4 123 B11R1.21 O=C(O)C1=CN=C(Cl)C(Br)=C1 SY002596 [0,0,0,0,0,1|1,1,0]=3 124 B11R1.21 O=C(O)C1=CN=C(Cl)C(Cl)=C1 SY007303 [0,0,0,0,0,1|1,0,0]=2 125 B11R1.21 O=C(O)C1=CN=C(Cl)C(F)=C1 SY042893 [0,0,0,0,0,1|1,1,0]=3 126 B11R1.21 O=C(O)C1=CN=C(Cl)C(I)=C1 SY041326 [0,0,0,0,0,1|1,1,0]=3 127 B11R1.21 O=C(O)C1=CN=C(O)C(Cl)=C1 SY007567 [0,0,0,0,0,1|2,0,0]=3 128 B11R1.21 O=C(O)C1=CNC(=O)C(O)=C1 SY028099 [0,0,0,0,0,1|3,0,0]=4 129 B11R1.21 O=C(O)C1=NC(Br)=C(F)C=C1 SY033452 [0,0,0,0,0,1|1,2,0]=4 130 B11R1.21 O=C(O)C1=NC(Cl)=C(Cl)C=C1 SY112665 [0,0,0,0,0,1|1,0,0]=2 131 B11R1.21 O=C(O)C1=NC(Cl)=C(F)C=C1 SY038170 [0,0,0,0,0,1|1,1,0]=3 132 B11R1.21 O=C(O)C1=NC(O)=C(O)C=C1 SY119665 [0,0,0,0,0,1|3,0,0]=4 133 B11R1.21 O=[N+]([O-])C1=CC(Cl)=C(Cl)N=C1 SY019256 [0,0,0,0,0,1|2,0,1]=4 134 B11R1.21 OB(O)C1=CC=C(Cl)C(Cl)=C1 SY019951 [0,0,0,0,0,1|2,0,1]=4 135 B11R1.21 OB(O)C1=CN=C(Cl)C(Cl)=C1 SY108375 [0,0,0,0,0,1|2,0,1]=4 136 B11R1.74 CC(=O)C1=CC(Cl)=CC(Br)=C1 SY108552 [0,0,0,0,0,1|2,1,0]=4 137 B11R1.74 CC(=O)C1=CC(Cl)=CC(Cl)=C1 SY029088 [0,0,0,0,0,1|2,0,0]=3 138 B11R1.74 CC1=CC(Br)=CC(C(=O)O)=C1 SY018398 [0,0,0,0,0,1|2,1,0]=4 139 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 SY009636 [0,0,0,0,0,1|3,0,0]=4 140 B11R1.74 CC1=CC(C(=O)O)=CC(C)=N1 SY013015 [0,0,0,0,0,1|3,0,0]=4 141 B11R1.74 CC1=CC(C(=O)O)=CC(Cl)=N1 SY006023 [0,0,0,0,0,1|2,0,0]=3 142 B11R1.74 CC1=CC(C(=O)O)=CC(F)=C1 SY019007 [0,0,0,0,0,1|2,1,0]=4 143 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 SY023413 [0,0,0,0,0,1|2,0,0]=3 144 B11R1.74 CC1=CC(C)=CC(C(=O)O)=C1 SY012192 [0,0,0,0,0,1|3,0,0]=4 145 B11R1.74 CC1=CC(Cl)=CC(C(=O)O)=C1 SY023243 [0,0,0,0,0,1|2,0,0]=3 146 B11R1.74 CC1=CC(O)=CC(C(=O)O)=C1 SY012261 [0,0,0,0,0,1|3,0,0]=4 147 B11R1.74 CC1=NC(C(=O)O)=CC(=O)N1 SY045137 [0,0,0,0,0,1|3,0,0]=4 148 B11R1.74 CC1=NC(O)=CC(C(=O)O)=C1 SY024888 [0,0,0,0,0,1|3,0,0]=4 149 B11R1.74 NC(=O)C1=NC(Cl)=NC(Cl)=C1 SY111600 [0,0,0,0,0,1|2,0,0]=3 150 B11R1.74 NC1=CC(C(=O)O)=CC(Br)=C1 SY025599 [0,0,0,0,0,1|2,1,0]=4 151 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 SY001026 [0,0,0,0,0,1|3,0,0]=4 152 B11R1.74 NC1=CC(C(=O)O)=CC(O)=C1 SY002353 [0,0,0,0,0,1|3,0,0]=4 153 B11R1.74 NC1=CC(Cl)=CC(C(=O)O)=C1 SY007084 [0,0,0,0,0,1|2,0,0]=3 154 B11R1.74 O=C(O)C1=CC(Br)=CC(Br)=C1 SY006266 [0,0,0,0,0,1|1,2,0]=4 155 B11R1.74 O=C(O)C1=CC(Br)=CC(I)=C1 SY008050 [0,0,0,0,0,1|1,2,0]=4 156 B11R1.74 O=C(O)C1=CC(Br)=NC(Br)=C1 SY023715 [0,0,0,0,0,1|1,2,0]=4 157 B11R1.74 O=C(O)C1=CC(Cl)=CC(Br)=C1 SY024815 [0,0,0,0,0,1|1,1,0]=3 158 B11R1.74 O=C(O)C1=CC(Cl)=CC(Cl)=C1 SY001678 [0,0,0,0,0,1|1,0,0]=2 159 B11R1.74 O=C(O)C1=CC(Cl)=NC(Cl)=C1 SY012339 [0,0,0,0,0,1|1,0,0]=2 160 B11R1.74 O=C(O)C1=CC(Cl)=NC(F)=C1 SY263366 [0,0,0,0,0,1|1,1,0]=3 161 B11R1.74 O=C(O)C1=CC(F)=CC(Br)=C1 SY016894 [0,0,0,0,0,1|1,2,0]=4 162 B11R1.74 O=C(O)C1=CC(F)=CC(Cl)=C1 SY019216 [0,0,0,0,0,1|1,1,0]=3 163 B11R1.74 O=C(O)C1=CC(F)=CC(F)=C1 SY013820 [0,0,0,0,0,1|1,2,0]=4 164 B11R1.74 O=C(O)C1=CC(F)=NC(F)=C1 SY039470 [0,0,0,0,0,1|1,2,0]=4 165 B11R1.74 O=C(O)C1=CC(I)=CC(Cl)=C1 SY041675 [0,0,0,0,0,1|1,1,0]=3 166 B11R1.74 O=C(O)C1=CC(O)=CC(Br)=C1 SY036587 [0,0,0,0,0,1|2,1,0]=4 167 B11R1.74 O=C(O)C1=CC(O)=CC(Cl)=C1 SY025109 [0,0,0,0,0,1|2,0,0]=3 168 B11R1.74 O=C(O)C1=CC(O)=CC(F)=C1 SY030488 [0,0,0,0,0,1|2,1,0]=4 169 B11R1.74 O=C(O)C1=CC(O)=CC(O)=C1 SY003472 [0,0,0,0,0,1|3,0,0]=4 170 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=C1 SY057644 [0,0,0,0,0,1|1,0,0]=2 171 B11R1.74 O=C(O)C1=NC(Cl)=CC(Cl)=N1 SY018399 [0,0,0,0,0,1|2,0,0]=3 172 B11R1.74 O=C1C=C(C(=O)O)NC(=O)N1 SY006030 [0,0,0,0,0,1|3,0,0]=4 173 B11R1.74 O=[N+]([O-])C1=CC(Cl)=CC(Cl)=C1 SY020726 [0,0,0,0,0,1|2,0,1]=4 174 B11R1.74 O=[N+]([O-])C1=CC(Cl)=NC(Cl)=C1 SY009256 [0,0,0,0,0,1|2,0,1]=4 175 B11R1.74 OB(O)C1=CC(Cl)=CC(Cl)=C1 SY015732 [0,0,0,0,0,1|2,0,1]=4 176 B11R1.74 OB(O)C1=CC(Cl)=NC(Cl)=C1 SY031099 [0,0,0,0,0,1|2,0,1]=4 177 B8R1.1 CC1=CC=C(C=O)N1 SY016074 [2,0,0,0,0,0|2,0,0]=4 178 B8R1.1 CC1=CC=C(C=O)O1 SY001535 [2,0,0,0,0,0|1,0,0]=3 179 B8R1.1 CC1=CC=C(C=O)S1 SY005122 [2,0,0,0,0,0|1,1,0]=4 180 B8R1.1 CC1=CC=C(CO)O1 SY046643 [2,0,0,0,0,0|1,0,1]=4 181 B8R1.1 CC1=CSC(C=O)=C1 SY035937 [2,0,0,0,0,0|1,1,0]=4 182 B8R1.1 O=CC1=CC(Br)=CN1 SY031830 [2,0,0,0,0,0|1,1,0]=4 183 B8R1.1 O=CC1=CC(Br)=CS1 SY002444 [2,0,0,0,0,0|0,2,0]=4 184 B8R1.1 O=CC1=CC(I)=CN1 SY102993 [2,0,0,0,0,0|1,1,0]=4 185 B8R1.1 O=CC1=CC=C(Br)N1 SY114423 [2,0,0,0,0,0|1,1,0]=4 186 B8R1.1 O=CC1=CC=C(Br)O1 SY008053 [2,0,0,0,0,0|0,1,0]=3 187 B8R1.1 O=CC1=CC=C(Br)S1 SY006056 [2,0,0,0,0,0|0,2,0]=4 188 B8R1.1 O=CC1=CC=C(Cl)N1 SY268296 [2,0,0,0,0,0|1,0,0]=3 189 B8R1.1 O=CC1=CC=C(Cl)O1 SY031372 [2,0,0,0,0,0|0,0,0]=2 190 B8R1.1 O=CC1=CC=C(Cl)S1 SY005588 [2,0,0,0,0,0|0,1,0]=3 191 B8R1.1 O=CC1=CN=C(Cl)S1 SY024025 [2,0,0,0,0,0|1,1,0]=4 192 B8R1.1 OCC1=CC=C(Cl)O1 SY251088 [2,0,0,0,0,0|0,0,1]=3 193 B8R1.1 OCC1=CC=C(I)O1 SY264013 [2,0,0,0,0,0|0,1,1]=4 194 B8R1.18 O=C1C=C(Br)C(=O)O1 SY009792 [2,0,0,0,0,0|1,1,0]=4 195 B8R1.7 C=C(C)C1=CC=CO1 SY225341 [2,0,0,0,0,0|2,0,0]=4 196 B8R1.7 CC(=O)C1=CC=CN1 SY011279 [2,0,0,0,0,0|2,0,0]=4 197 B8R1.7 CC(=O)C1=NC=CO1 SY148104 [2,0,0,0,0,0|2,0,0]=4 198 B8R1.7 O=C(O)C1=CC=CN1 SY014890 [2,0,0,0,0,0|1,0,0]=3 199 B8R1.7 O=C(O)C1=CC=CS1 SY001476 [2,0,0,0,0,0|0,1,0]=3 200 B8R1.7 O=C(O)C1=CC=NO1 SY018290 [2,0,0,0,0,0|1,0,0]=3 201 B8R1.7 O=C(O)C1=CC=NS1 SY029089 [2,0,0,0,0,0|1,1,0]=4 202 B8R1.7 O=C(O)C1=CN=CO1 SY026644 [2,0,0,0,0,0|1,0,0]=3 203 B8R1.7 O=C(O)C1=CN=CS1 SY006027 [2,0,0,0,0,0|1,1,0]=4 204 B8R1.7 O=C(O)C1=CNC=C1 SY004601 [2,0,0,0,0,0|2,0,0]=4 205 B8R1.7 O=C(O)C1=CNC=N1 SY001178 [2,0,0,0,0,0|2,0,0]=4 206 B8R1.7 O=C(O)C1=COC=C1 SY003999 [2,0,0,0,0,0|2,0,0]=4 207 B8R1.7 O=C(O)C1=COC=N1 SY003724 [2,0,0,0,0,0|2,0,0]=4 208 B8R1.7 O=C(O)C1=CSC=C1 SY001582 [2,0,0,0,0,0|2,0,0]=4 209 B8R1.7 O=C(O)C1=CSC=N1 SY015498 [2,0,0,0,0,0|2,0,0]=4 210 B8R1.7 O=C(O)C1=NC=CN1 SY007870 [2,0,0,0,0,0|2,0,0]=4 211 B8R1.7 O=C(O)C1=NNC=C1 SY002921 [2,0,0,0,0,0|2,0,0]=4 212 B8R1.7 O=C(O)C1=NOC=C1 SY031545 [2,0,0,0,0,0|2,0,0]=4 213 B8R1.7 O=C(O)C1=NSC=C1 SY059468 [2,0,0,0,0,0|2,0,0]=4 214 B8R1.7 OB(O)C1=CC=CO1 SY013494 [2,0,0,0,0,0|1,0,1]=4 215 B10R1.14 CC1=CC=C(C(=O)CO)O1 SY131039 [1,1,0,0,0,0|1,0,0]=3 216 B10R1.14 CC1=CC=C(C(=O)CO)S1 SY131041 [1,1,0,0,0,0|1,1,0]=4 217 B10R1.14 COC(=O)C1=CC(Br)=CN1 SY007031 [1,1,0,0,0,0|1,1,0]=4 218 B10R1.14 COC(=O)C1=CC(Br)=CO1 SY023052 [1,1,0,0,0,0|0,1,0]=3 219 B10R1.14 COC(=O)C1=CC(Br)=CS1 SY096947 [1,1,0,0,0,0|0,2,0]=4 220 B10R1.14 COC(=O)C1=CC(F)=CN1 SY016341 [1,1,0,0,0,0|1,1,0]=4 221 B10R1.14 COC(=O)C1=CC(F)=CS1 SY273933 [1,1,0,0,0,0|0,2,0]=4 222 B10R1.14 COC(=O)C1=CC(I)=CN1 SY029016 [1,1,0,0,0,0|1,1,0]=4 223 B10R1.14 COC(=O)C1=CC(N)=CO1 SY269578 [1,1,0,0,0,0|1,0,0]=3 224 B10R1.14 COC(=O)C1=CC(N)=CS1 SY026160 [1,1,0,0,0,0|1,1,0]=4 225 B10R1.14 COC(=O)C1=CC(O)=NO1 SY032405 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.14 COC(=O)C1=CC=C(Br)N1 SY037210 [1,1,0,0,0,0|1,1,0]=4 227 B10R1.14 COC(=O)C1=CC=C(Br)O1 SY022677 [1,1,0,0,0,0|0,1,0]=3 228 B10R1.14 COC(=O)C1=CC=C(Br)S1 SY020860 [1,1,0,0,0,0|0,2,0]=4 229 B10R1.14 COC(=O)C1=CC=C(Cl)O1 SY030840 [1,1,0,0,0,0|0,0,0]=2 230 B10R1.14 COC(=O)C1=CC=C(N)O1 SY036521 [1,1,0,0,0,0|1,0,0]=3 231 B10R1.14 COC(=O)C1=CC=C(N)S1 SY104197 [1,1,0,0,0,0|1,1,0]=4 232 B10R1.14 COC(=O)C1=CN=C(Cl)O1 SY107008 [1,1,0,0,0,0|1,0,0]=3 233 B10R1.14 COC(=O)C1=CNC(Cl)=C1 SY249600 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.14 COC(=O)C1=COC(Cl)=N1 SY104314 [1,1,0,0,0,0|2,0,0]=4 235 B10R1.14 COC(=O)C1=NC=C(Cl)S1 SY272283 [1,1,0,0,0,0|1,1,0]=4 236 B10R1.14 O=C(CBr)C1=CC=C(Cl)S1 SY079930 [1,1,0,0,0,0|1,1,0]=4 237 B10R1.31 COC1=CC=C(C(=O)O)S1 SY022425 [1,1,0,0,0,0|1,1,0]=4 238 B10R1.31 COC1=CNC(C(=O)O)=C1 SY247648 [1,1,0,0,0,0|2,0,0]=4 239 B10R1.31 N#CC1=CC=C(C(=O)O)O1 SY022127 [1,1,0,0,0,0|1,0,0]=3 240 B10R1.31 N#CC1=CC=C(C(=O)O)S1 SY194482 [1,1,0,0,0,0|1,1,0]=4 241 B10R1.31 O=C(O)C1=CC=C(CO)O1 SY062854 [1,1,0,0,0,0|1,0,0]=3 242 B10R1.31 O=CC1=CC=C(C(=O)O)O1 SY050542 [1,1,0,0,0,0|1,0,0]=3 243 B10R1.59 CC1=C(C(=O)O)N=C(Cl)S1 SY102206 [1,1,0,0,0,0|2,0,0]=4 244 B10R1.59 CC1=CC(C)=C(C(=O)O)N1 SY139192 [1,1,0,0,0,0|2,0,0]=4 245 B10R1.59 CC1=NC(C)=C(C(=O)O)O1 SY192463 [1,1,0,0,0,0|2,0,0]=4 246 B10R1.59 CN1C=C(Br)C=C1C(=O)O SY021734 [1,1,0,0,0,0|1,1,0]=4 247 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=C1 SY020987 [1,1,0,0,0,0|2,0,0]=4 248 B10R1.59 O=C(O)C1=C(Cl)SC(Cl)=N1 SY107533 [1,1,0,0,0,0|2,0,0]=4 249 B10R1.194 CC1=C(C(=O)O)SC=C1Br SY063565 [1,1,0,0,0,0|0,2,0]=4 250 B12R1.48 COC1=CC=C(C(=O)O)C=C1Cl SY018640 [0,1,0,0,0,1|2,0,0]=4 251 B12R1.48 COC1=NC=C(C(=O)O)C=C1Cl SY198047 [0,1,0,0,0,1|2,0,0]=4 252 B12R1.48 N#CC1=NC=C(C(=O)O)C=C1Cl SY253248 [0,1,0,0,0,1|2,0,0]=4 253 B12R1.56 N#CC1=CC(C(=O)O)=CN=C1Cl SY029138 [0,1,0,0,0,1|2,0,0]=4 254 B12R1.232 CC1=C(Cl)C=C(N)C(C(=O)O)=C1 SY238206 [0,1,0,0,0,1|2,0,0]=4 255 B12R1.232 CC1=C(Cl)C=C(O)C(C(=O)O)=C1 SY238212 [0,1,0,0,0,1|2,0,0]=4 256 B12R1.232 NC1=C(Cl)C=C(C(=O)O)C(O)=C1 SY246822 [0,1,0,0,0,1|2,0,0]=4 257 B12R1.232 NC1=CC(Br)=C(Cl)C=C1C(=O)O SY030560 [0,1,0,0,0,1|1,1,0]=4 258 B12R1.232 O=C(O)C1=C(Cl)N=C(Cl)C(Cl)=C1 SY034400 [0,1,0,0,0,1|1,0,0]=3 259 B12R1.232 O=C(O)C1=CC(Cl)=C(Br)C=C1F SY035139 [0,1,0,0,0,1|1,1,0]=4 260 B12R1.232 O=C(O)C1=CC(Cl)=C(Cl)C=C1F SY030903 [0,1,0,0,0,1|1,0,0]=3 261 B12R1.232 O=C(O)C1=CC(Cl)=C(F)C=C1F SY021997 [0,1,0,0,0,1|1,1,0]=4 262 B12R1.232 O=C(O)C1=CC(F)=C(Cl)N=C1Cl SY013440 [0,1,0,0,0,1|1,1,0]=4 263 B12R1.232 O=C(O)C1=CC(I)=C(Cl)C=C1Cl SY164724 [0,1,0,0,0,1|1,1,0]=4 264 B12R1.367 COC(=O)C1=CC(Br)=C(Cl)N=C1 SY007495 [0,1,0,0,0,1|1,1,0]=4 265 B12R1.367 COC(=O)C1=CC=C(Br)C(Cl)=C1 SY056387 [0,1,0,0,0,1|1,1,0]=4 266 B12R1.367 COC(=O)C1=CC=C(C)C(Cl)=C1 SY003376 [0,1,0,0,0,1|2,0,0]=4 267 B12R1.367 COC(=O)C1=CC=C(Cl)C(Br)=C1 SY038668 [0,1,0,0,0,1|1,1,0]=4 268 B12R1.367 COC(=O)C1=CC=C(Cl)C(Cl)=C1 SY007298 [0,1,0,0,0,1|1,0,0]=3 269 B12R1.367 COC(=O)C1=CC=C(Cl)C(F)=C1 SY023704 [0,1,0,0,0,1|1,1,0]=4 270 B12R1.367 COC(=O)C1=CC=C(Cl)C(O)=C1 SY023753 [0,1,0,0,0,1|2,0,0]=4 271 B12R1.367 COC(=O)C1=CC=C(F)C(Cl)=C1 SY011950 [0,1,0,0,0,1|1,1,0]=4 272 B12R1.367 COC(=O)C1=CC=C(O)C(Cl)=C1 SY004575 [0,1,0,0,0,1|2,0,0]=4 273 B12R1.367 COC(=O)C1=CN=C(Cl)C(Cl)=C1 SY104172 [0,1,0,0,0,1|1,0,0]=3 274 B12R1.367 COC(=O)C1=NC(Br)=C(Cl)C=C1 SY070853 [0,1,0,0,0,1|1,1,0]=4 275 B12R1.367 COC(=O)C1=NC(Cl)=C(Br)C=C1 SY068273 [0,1,0,0,0,1|1,1,0]=4 276 B12R1.367 COC(=O)C1=NC(N)=C(Cl)C=C1 SY310367 [0,1,0,0,0,1|2,0,0]=4 277 B12R1.367 O=C(CO)C1=CC=C(Cl)C(Cl)=C1 SY130956 [0,1,0,0,0,1|1,0,0]=3 278 B12R1.367 O=C(CO)C1=CC=C(F)C(Cl)=C1 SY131027 [0,1,0,0,0,1|1,1,0]=4 279 B12R1.893 O=C(O)C1=C(Cl)C(F)=C(Cl)N=C1 SY273407 [0,1,0,0,0,1|1,1,0]=4 280 B12R1.893 O=C(O)C1=CC=C(Cl)C(Cl)=C1F SY273422 [0,1,0,0,0,1|1,0,0]=3 281 B12R1.893 O=C(O)C1=CC=C(Cl)C(F)=C1Cl SY273423 [0,1,0,0,0,1|1,1,0]=4 282 B12R1.893 O=C(O)C1=CC=C(F)C(Cl)=C1F SY032141 [0,1,0,0,0,1|1,1,0]=4 283 B12R1.1005 O=C(O)C1=CC(Cl)=C(Cl)C(Cl)=C1 SY023214 [0,1,0,0,0,1|1,0,0]=3 284 B12R1.1005 O=C(O)C1=CC(Cl)=C(F)C(Cl)=C1 SY064679 [0,1,0,0,0,1|1,1,0]=4 285 B12R1.1005 O=C(O)C1=CC(Cl)=C(O)C(Cl)=C1 SY002505 [0,1,0,0,0,1|2,0,0]=4 286 B12R1.11 COC1=NC(Cl)=CC(C(=O)O)=C1 SY014924 [0,1,0,0,0,1|2,0,0]=4 287 B12R1.11 O=C(O)C1=CC(CO)=CC(Cl)=C1 SY026330 [0,1,0,0,0,1|2,0,0]=4 288 B12R1.11 O=CC1=CC(Cl)=CC(C(=O)O)=C1 SY026329 [0,1,0,0,0,1|2,0,0]=4 289 B12R1.358 COC(=O)C1=CC(Cl)=CC(Br)=C1 SY033693 [0,1,0,0,0,1|1,1,0]=4 290 B12R1.358 COC(=O)C1=CC(Cl)=CC(N)=C1 SY009128 [0,1,0,0,0,1|2,0,0]=4 291 B12R1.358 COC(=O)C1=CC(Cl)=NC(C)=C1 SY006033 [0,1,0,0,0,1|2,0,0]=4 292 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=C1 SY028005 [0,1,0,0,0,1|1,0,0]=3 293 B12R1.358 COC(=O)C1=CC(Cl)=NC(Cl)=N1 SY013414 [0,1,0,0,0,1|1,0,0]=3 294 B12R1.358 COC(=O)C1=CC(O)=CC(Cl)=C1 SY275106 [0,1,0,0,0,1|2,0,0]=4 295 B12R1.358 COC(=O)C1=NC(Cl)=CC(Cl)=C1 SY065716 [0,1,0,0,0,1|1,0,0]=3 296 B12R1.358 COC(=O)C1=NC(Cl)=CC(Cl)=N1 SY205004 [0,1,0,0,0,1|2,0,0]=4 297 B12R1.358 COC(=O)C1=NC(Cl)=CC(N)=C1 SY234064 [0,1,0,0,0,1|2,0,0]=4 298 B12R1.358 COC(=O)C1=NC(Cl)=NC(C)=C1 SY162695 [0,1,0,0,0,1|2,0,0]=4 299 B12R1.511 CC(=O)C1=CC(Cl)=CC(Cl)=C1F SY101416 [0,1,0,0,0,1|2,0,0]=4 300 B12R1.511 CC(=O)C1=CC(Cl)=CC(Cl)=C1O SY049948 [0,1,0,0,0,1|2,0,0]=4 301 B12R1.511 CC1=C(N)C(C(=O)O)=CC(Cl)=C1 SY011484 [0,1,0,0,0,1|2,0,0]=4 302 B12R1.511 NC(=O)C1=C(N)C(Cl)=NC(Cl)=C1 SY263518 [0,1,0,0,0,1|2,0,0]=4 303 B12R1.511 NC(=O)C1=NC(Cl)=NC(Cl)=C1F SY039419 [0,1,0,0,0,1|2,0,0]=4 304 B12R1.511 NC1=C(C(=O)O)C=C(Cl)N=C1I SY277103 [0,1,0,0,0,1|1,1,0]=4 305 B12R1.511 NC1=C(C(=O)O)C=C(F)C=C1Cl SY038415 [0,1,0,0,0,1|1,1,0]=4 306 B12R1.511 NC1=C(Cl)C(C(=O)O)=NC(Cl)=C1 SY105500 [0,1,0,0,0,1|2,0,0]=4 307 B12R1.511 NC1=C(Cl)C=C(Cl)N=C1C(=O)O SY121172 [0,1,0,0,0,1|1,0,0]=3 308 B12R1.511 O=C(O)C1=CC(Cl)=CC(Br)=C1Cl SY252958 [0,1,0,0,0,1|1,1,0]=4 309 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 SY003272 [0,0,1,1,0,0|2,0,0]=4 310 B10R1.113 O=C(O)C1=CC=CC(Cl)=C1 SY001122 [0,0,1,1,0,0|2,0,0]=4 311 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 SY007552 [0,0,1,1,0,0|2,0,0]=4 312 B10R1.113 O=C(O)C1=NC(Cl)=NC=C1 SY009367 [0,0,1,1,0,0|2,0,0]=4 313 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 SY003269 [0,0,1,1,0,0|2,0,0]=4 314 B10R1.8 CC1=CC(Cl)=CC(C=O)=C1 SY127953 [1,0,0,0,0,1|2,0,0]=4 315 B10R1.8 O=CC1=CC(Cl)=CC(Br)=C1 SY051388 [1,0,0,0,0,1|1,1,0]=4 316 B10R1.8 OCC1=CC(Cl)=CC(Cl)=C1 SY017960 [1,0,0,0,0,1|1,0,1]=4 317 B10R1.8 OCC1=CC(Cl)=NC(Cl)=C1 SY032402 [1,0,0,0,0,1|1,0,1]=4 318 B10R1.54 CC1=NOC(CC(=O)O)=C1 SY128203 [1,0,0,0,0,1|2,0,0]=4 319 B10R1.54 O=C(O)CC1=CC=C(Br)S1 SY077014 [1,0,0,0,0,1|0,2,0]=4 320 B10R1.54 O=C(O)CN1C=C(Cl)C=N1 SY045842 [1,0,0,0,0,1|2,0,0]=4 321 B12R1.19 O=C(O)CC1=CC=C(Cl)C(Cl)=C1 SY003305 [0,0,0,0,0,2|1,0,0]=3 322 B12R1.19 O=C(O)CC1=CC=C(Cl)C(F)=C1 SY041310 [0,0,0,0,0,2|1,1,0]=4 323 B12R1.19 O=C(O)CC1=CC=C(F)C(Cl)=C1 SY019212 [0,0,0,0,0,2|1,1,0]=4 324 B12R1.101 O=C(Cl)OC1=CC(Cl)=CC(Cl)=C1 SY296855 [0,0,0,0,0,2|2,0,0]=4 325 B12R1.101 O=C(O)CC1=CC(Cl)=CC(Cl)=C1 SY021382 [0,0,0,0,0,2|1,0,0]=3