0 B11R1.266 C#CC1=CC=CC(=C1)C(=O)N Z1203640293 [0,0,0,0,0,0|1,0,1]=2 1 B11R1.266 C#CC1=CC=CC(=C1)C(=O)O Z1198169474 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.266 C#CC1=CN=CC(=C1)C(=O)N Z1255367990 [0,0,0,0,0,0|2,0,1]=3 3 B11R1.266 C#CC1=CN=CC(=C1)C(=O)O Z1205656977 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.266 CC(=O)C1=CC(=CC=C1)C#N Z381541056 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.266 CC(=O)C1=CC(=CC=C1)CN Z2182115422 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.266 CC(=O)C1=CC(=CC=C1)CO Z1255384632 [0,0,0,0,0,0|3,0,0]=3 7 B11R1.266 CC(=O)C1=NC=CC(=C1)C#N Z1198171805 [0,0,0,0,0,0|4,0,0]=4 8 B11R1.266 CCC1=CC(=CC=C1)B(O)O Z381540870 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.266 CCC1=CC(=CN=C1)C(=O)O Z1198306513 [0,0,0,0,0,0|3,0,0]=3 10 B11R1.266 CCC1=CC(=NC=C1)C(=O)O Z1198155041 [0,0,0,0,0,0|3,0,0]=3 11 B11R1.266 CCC1=NC(=CC=C1)C(=O)O Z1741980295 [0,0,0,0,0,0|3,0,0]=3 12 B11R1.266 CCC1=NC=CC(=C1)C(=O)O Z5485733526 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.266 CNC1=CC(=CC=C1)C(=O)N Z3714846457 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.266 CNC1=CC(=CC=C1)C(C)C Z362639302 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.266 CNC1=CC(=CC=C1)N(C)C Z2517097616 [0,0,0,0,0,0|4,0,0]=4 16 B11R1.266 CNC1=CC(=CC=C1)[N+](=O)[O-] Z425390850 [0,0,0,0,0,0|3,0,0]=3 17 B11R1.266 CNC1=CC(=CN=C1)C(=O)O Z1198165175 [0,0,0,0,0,0|3,0,0]=3 18 B11R1.266 CNC1=NC=CC(=C1)C(=O)O Z285782460 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.266 COC1=CC(=CC=C1)B(O)O Z381513356 [0,0,0,0,0,0|2,0,1]=3 20 B11R1.266 COC1=CC(=CC=C1)C(=N)N Z1263714060 [0,0,0,0,0,0|1,0,0]=1 21 B11R1.266 COC1=CC(=CC=C1)C(=O)C Z54179675 [0,0,0,0,0,0|1,0,0]=1 22 B11R1.266 COC1=CC(=CC=C1)C(=O)O Z57127526 [0,0,0,0,0,0|1,0,0]=1 23 B11R1.266 COC1=CC(=CC=C1)C(=S)N Z56950570 [0,0,0,0,0,0|0,1,0]=1 24 B11R1.266 COC1=CC(=CC=C1)C(C)O Z228586154 [0,0,0,0,0,0|1,0,2]=3 25 B11R1.266 COC1=CC(=CC=C1)[C@@H](C)O Z360055364 [0,0,0,0,0,0|1,0,2]=3 26 B11R1.266 COC1=CC(=CC=C1)[C@H](C)O Z360055368 [0,0,0,0,0,0|1,0,2]=3 27 B11R1.266 COC1=CC(=CN=C1)C(=O)C Z3446459961 [0,0,0,0,0,0|2,0,0]=2 28 B11R1.266 COC1=CC(=CN=C1)C(=O)O Z1160905076 [0,0,0,0,0,0|2,0,0]=2 29 B11R1.266 COC1=CC(=NC=C1)C(=N)N Z2760930341 [0,0,0,0,0,0|2,0,0]=2 30 B11R1.266 COC1=CC(=NC=C1)C(=O)N Z1201620706 [0,0,0,0,0,0|1,0,0]=1 31 B11R1.266 COC1=CC(=NC=C1)C(=O)O Z381411824 [0,0,0,0,0,0|2,0,0]=2 32 B11R1.266 COC1=CC(=NN=C1)C(=O)O Z3242712401 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.266 COC1=NC(=CC=C1)C(=N)N Z3234813118 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.266 COC1=NC(=CC=C1)C(=O)O Z969095262 [0,0,0,0,0,0|2,0,0]=2 35 B11R1.266 COC1=NC(=CC=C1)C(C)O Z1216820543 [0,0,0,0,0,0|2,0,2]=4 36 B11R1.266 COC1=NC(=CC=N1)C(=O)O Z1255500631 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.266 COC1=NC(=CN=C1)C(=O)O Z1198152489 [0,0,0,0,0,0|3,0,0]=3 38 B11R1.266 COC1=NC=CC(=C1)B(O)O Z1201624064 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.266 COC1=NC=CC(=C1)C(=N)N Z4920055179 [0,0,0,0,0,0|2,0,0]=2 40 B11R1.266 COC1=NC=CC(=C1)C(=O)C Z1198277852 [0,0,0,0,0,0|2,0,0]=2 41 B11R1.266 COC1=NC=CC(=C1)C(=O)O Z227823722 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.266 COC1=NC=CC(=C1)C(=S)N Z255149988 [0,0,0,0,0,0|1,1,0]=2 43 B11R1.266 COC1=NC=NC(=C1)C(=O)O Z1198153986 [0,0,0,0,0,0|3,0,0]=3 44 B11R1.266 CSC1=CC(=CC=C1)B(O)O Z381540936 [0,0,0,0,0,0|2,1,1]=4 45 B11R1.266 CSC1=CC(=CC=C1)C(=O)O Z1201631828 [0,0,0,0,0,0|1,1,0]=2 46 B11R1.266 CSC1=CC(=CN=C1)C(=O)O Z1198158905 [0,0,0,0,0,0|2,1,0]=3 47 B11R1.266 CSC1=NC(=CC=C1)C(=O)O Z24821871 [0,0,0,0,0,0|2,1,0]=3 48 B11R1.266 CSC1=NC(=CC=N1)C(=O)C Z1198218857 [0,0,0,0,0,0|3,1,0]=4 49 B11R1.266 CSC1=NC(=CC=N1)C(=O)O Z1198233185 [0,0,0,0,0,0|3,1,0]=4 50 B11R1.266 CSC1=NC(=CN=C1)C(=O)O Z1278639333 [0,0,0,0,0,0|3,1,0]=4 51 B11R1.266 CSC1=NC(=NC=C1)C(=O)O Z1255401962 [0,0,0,0,0,0|3,1,0]=4 52 B11R1.266 CSC1=NC=CC(=C1)C(=O)O Z732206876 [0,0,0,0,0,0|2,1,0]=3 53 B11R1.266 CSC1=NC=NC(=C1)C(=O)O Z1255487883 [0,0,0,0,0,0|3,1,0]=4 54 B11R1.266 N#CC1=CC(=NC=C1)C(=O)O Z1198184865 [0,0,0,0,0,0|4,0,0]=4 55 B11R1.266 N#CC1=CC=CC(=C1)C(=O)N Z33547157 [0,0,0,0,0,0|2,0,0]=2 56 B11R1.266 N#CC1=CC=CC(=C1)C(=O)O Z56921155 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.266 N#CC1=CC=CC(=C1)[N+](=O)[O-] Z57756579 [0,0,0,0,0,0|4,0,0]=4 58 B11R1.266 N#CC1=CC=CC(=N1)C(=O)O Z1170309368 [0,0,0,0,0,0|4,0,0]=4 59 B11R1.266 N#CC1=NC=CC(=C1)C(=O)O Z1198162090 [0,0,0,0,0,0|4,0,0]=4 60 B11R1.266 N=C(N)C1=CC=CC(=C1)CN Z1860991513 [0,0,0,0,0,0|3,0,0]=3 61 B11R1.266 NC(=O)C1=CC(=CC=C1)C=O Z1065725946 [0,0,0,0,0,0|2,0,0]=2 62 B11R1.266 NC(=O)C1=CC(=CC=C1)CCl Z363967382 [0,0,0,0,0,0|2,0,0]=2 63 B11R1.266 NC(=O)C1=CC(=CC=C1)CO Z431951860 [0,0,0,0,0,0|2,0,0]=2 64 B11R1.266 NC(=O)C1=NC(=CC=C1)CS Z1262674407 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.266 NCC1=CC(=CC=C1)C(=O)O Z1262691668 [0,0,0,0,0,0|3,0,0]=3 66 B11R1.266 NCC1=CC(=NC=C1)C(=O)N Z4760518872 [0,0,0,0,0,0|3,0,0]=3 67 B11R1.266 NCC1=CC(=NC=C1)C(=O)O Z3814744753 [0,0,0,0,0,0|4,0,0]=4 68 B11R1.266 NCC1=NC=CC(=C1)C(=O)O Z2685925257 [0,0,0,0,0,0|4,0,0]=4 69 B11R1.266 NNC1=CC(=CC=C1)C(=O)O Z815264094 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.266 O=C(O)C1=CC(=CC=C1)CBr Z57980664 [0,0,0,0,0,0|3,0,0]=3 71 B11R1.266 O=C(O)C1=CC(=CC=C1)CCl Z57834460 [0,0,0,0,0,0|3,0,0]=3 72 B11R1.266 O=C(O)C1=CC(=CC=C1)CS Z228024598 [0,0,0,0,0,0|3,0,0]=3 73 B11R1.266 O=C(O)C1=CC(=NC=C1)CO Z2856164825 [0,0,0,0,0,0|4,0,0]=4 74 B11R1.266 O=C(O)C1=CC=CC(=C1)CO Z385458084 [0,0,0,0,0,0|3,0,0]=3 75 B11R1.266 O=C(O)C1=CN=CC(=C1)CO Z4748876044 [0,0,0,0,0,0|4,0,0]=4 76 B11R1.266 O=CC1=CC(=NC=C1)C(=O)O Z4202384577 [0,0,0,0,0,0|4,0,0]=4 77 B11R1.266 O=CC1=CC=CC(=C1)C(=O)O Z1065768480 [0,0,0,0,0,0|3,0,0]=3 78 B11R1.266 O=CC1=CC=CC(=C1)[N+](=O)[O-] Z57127514 [0,0,0,0,0,0|4,0,0]=4 79 B11R1.266 O=CC1=CC=CC(=N1)C(=O)O Z1198307200 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.266 O=CC1=CN=CC(=C1)C(=O)O Z2902338030 [0,0,0,0,0,0|4,0,0]=4 81 B11R1.266 O=[N+]([O-])C1=CC=CC(=C1)CO Z425721958 [0,0,0,0,0,0|4,0,0]=4 82 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [1,0,0,0,0,0|3,0,0]=4 83 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,0,0,0,0,0|2,0,0]=3 84 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,0,0,0,0,0|1,0,0]=2 85 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.113 CC(=O)C1=CC(=CN=C1)C Z1198331406 [1,0,0,0,0,0|2,0,0]=3 88 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl Z1255491584 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.113 CC(=O)C1=CC(=NC=C1)Br Z3234972143 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.113 CC(=O)C1=CC(=NC=C1)Cl Z1201624144 [1,0,0,0,0,0|3,0,0]=4 91 B10R1.113 CC(=O)C1=CC(=NC=C1)F Z1198219263 [1,0,0,0,0,0|3,0,0]=4 92 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Z1216849381 [1,0,0,0,0,0|2,0,1]=4 93 B10R1.113 CC(=O)C1=NC(=CC=C1)Br Z1269164937 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl Z1198173097 [1,0,0,0,0,0|3,0,0]=4 95 B10R1.113 CC(=O)C1=NC(=CC=C1)F Z1198219245 [1,0,0,0,0,0|3,0,0]=4 96 B10R1.113 CC(=O)C1=NC(=NC=C1)C Z1198152051 [1,0,0,0,0,0|3,0,0]=4 97 B10R1.113 CC(=O)C1=NC=CC(=C1)Br Z1269133346 [1,0,0,0,0,0|3,0,0]=4 98 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [1,0,0,0,0,0|2,0,1]=4 100 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [1,0,0,0,0,0|2,0,1]=4 101 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [1,0,0,0,0,0|2,0,1]=4 102 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [1,0,0,0,0,0|1,0,1]=3 103 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [1,0,0,0,0,0|1,0,2]=4 104 B10R1.113 CC1=CC(=CC=C1)B(O)O Z336079540 [1,0,0,0,0,0|2,0,1]=4 105 B10R1.113 CC1=CC(=CC=C1)C(=N)N Z2471262589 [1,0,0,0,0,0|1,0,0]=2 106 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,0,0,0,0,0|0,0,0]=1 107 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,0,0,0,0,0|1,0,0]=2 108 B10R1.113 CC1=CC(=CC=C1)C(=S)N Z90122768 [1,0,0,0,0,0|0,1,0]=2 109 B10R1.113 CC1=CC(=CC=C1)[N+](=O)[O-] Z104508722 [1,0,0,0,0,0|2,0,0]=3 110 B10R1.113 CC1=CC(=CN=C1)C(=O)N Z1203579033 [1,0,0,0,0,0|1,0,0]=2 111 B10R1.113 CC1=CC(=CN=C1)C(=O)O Z825019000 [1,0,0,0,0,0|2,0,0]=3 112 B10R1.113 CC1=CC(=NC=C1)[N+](=O)[O-] Z1198164196 [1,0,0,0,0,0|3,0,0]=4 113 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [1,0,0,0,0,0|1,0,1]=3 114 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [1,0,0,0,0,0|1,0,2]=4 115 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [1,0,0,0,0,0|1,0,1]=3 116 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [1,0,0,0,0,0|1,0,2]=4 117 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [1,0,0,0,0,0|1,0,1]=3 118 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [1,0,0,0,0,0|1,0,2]=4 119 B10R1.113 CC1=CC=CC(=N1)[C@@H](C)N Z1492797078 [1,0,0,0,0,0|2,0,1]=4 120 B10R1.113 CC1=NC(=CC=C1)C(=O)N Z287485516 [1,0,0,0,0,0|1,0,0]=2 121 B10R1.113 CC1=NC(=CC=C1)C(=O)O Z278017928 [1,0,0,0,0,0|2,0,0]=3 122 B10R1.113 CC1=NC(=CC=N1)C(=O)O Z489806966 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.113 CC1=NC=CC(=C1)C(=O)N Z1203579723 [1,0,0,0,0,0|1,0,0]=2 124 B10R1.113 CC1=NC=CC(=C1)C(=O)O Z1205493663 [1,0,0,0,0,0|2,0,0]=3 125 B10R1.113 CC1=NN=CC(=C1)C(=O)O Z1205496420 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [1,0,0,0,0,0|1,0,2]=4 128 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [1,0,0,0,0,0|1,0,2]=4 129 B10R1.113 N=C(N)C1=CC(=CC=C1)Br Z1741973354 [1,0,0,0,0,0|2,0,0]=3 130 B10R1.113 N=C(N)C1=CC(=CC=C1)Cl Z1362754541 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.113 N=C(N)C1=CC(=CC=C1)F Z1263714076 [1,0,0,0,0,0|2,0,0]=3 132 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,0,0,0,0,0|1,0,0]=2 133 B10R1.113 N=C(N)C1=CC(=CN=C1)Br Z1741981976 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.113 N=C(N)C1=CC(=CN=C1)F Z2602277783 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.113 N=C(N)C1=CC(=NC=C1)Cl Z1696861498 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.113 N=C(N)C1=CC(=NC=C1)F Z3252328721 [1,0,0,0,0,0|3,0,0]=4 137 B10R1.113 N=C(N)C1=NC(=CC=C1)Br Z3688945008 [1,0,0,0,0,0|3,0,0]=4 138 B10R1.113 N=C(N)C1=NC(=CC=C1)Cl Z1255432409 [1,0,0,0,0,0|3,0,0]=4 139 B10R1.113 N=C(N)C1=NC(=CC=C1)N Z1592025387 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.113 N=C(N)C1=NC=CC(=C1)Br Z1269169965 [1,0,0,0,0,0|3,0,0]=4 141 B10R1.113 N=C(N)C1=NC=CC(=C1)Cl Z3234812767 [1,0,0,0,0,0|3,0,0]=4 142 B10R1.113 N=C(N)C1=NC=CC(=C1)N Z1642389653 [1,0,0,0,0,0|3,0,0]=4 143 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,0,0,0,0,0|1,0,0]=2 144 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,0,0,0,0,0|1,0,0]=2 145 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,0,0,0,0,0|1,0,0]=2 146 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,0,0,0,0,0|1,0,0]=2 147 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,0,0,0,0,0|0,0,0]=1 148 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,0,0,0,0,0|0,1,0]=2 149 B10R1.113 NC(=O)C1=CC(=CN=C1)Br Z33546660 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.113 NC(=O)C1=CC(=CN=C1)N Z1198184520 [1,0,0,0,0,0|2,0,0]=3 151 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [1,0,0,0,0,0|1,0,0]=2 152 B10R1.113 NC(=O)C1=CC(=NC=C1)Br Z1269224952 [1,0,0,0,0,0|2,0,0]=3 153 B10R1.113 NC(=O)C1=CC(=NC=C1)Cl Z147129672 [1,0,0,0,0,0|2,0,0]=3 154 B10R1.113 NC(=O)C1=CC(=NC=C1)F Z802658956 [1,0,0,0,0,0|2,0,0]=3 155 B10R1.113 NC(=O)C1=CC(=NC=C1)N Z733874990 [1,0,0,0,0,0|2,0,0]=3 156 B10R1.113 NC(=O)C1=NC(=CC=C1)Br Z1116315117 [1,0,0,0,0,0|2,0,0]=3 157 B10R1.113 NC(=O)C1=NC(=CC=C1)Cl Z969100498 [1,0,0,0,0,0|2,0,0]=3 158 B10R1.113 NC(=O)C1=NC(=CC=C1)N Z969101552 [1,0,0,0,0,0|2,0,0]=3 159 B10R1.113 NC(=O)C1=NC(=CC=N1)Cl Z4338695231 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.113 NC(=O)C1=NC(=CN=C1)Cl Z1079442100 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.113 NC(=O)C1=NC(=NC=C1)Cl Z1198152556 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.113 NC(=O)C1=NC=CC(=C1)N Z425851730 [1,0,0,0,0,0|2,0,0]=3 163 B10R1.113 NC(=O)C1=NC=NC(=C1)Cl Z1255448549 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.113 NC(=S)C1=CC(=CC=C1)Br Z56985752 [1,0,0,0,0,0|1,1,0]=3 165 B10R1.113 NC(=S)C1=CC(=CC=C1)Cl Z56979368 [1,0,0,0,0,0|1,1,0]=3 166 B10R1.113 NC(=S)C1=CC(=CC=C1)F Z56979300 [1,0,0,0,0,0|1,1,0]=3 167 B10R1.113 NC(=S)C1=CC(=NC=C1)Cl Z368561286 [1,0,0,0,0,0|2,1,0]=4 168 B10R1.113 NC(=S)C1=CC(=NC=C1)F Z3272631388 [1,0,0,0,0,0|2,1,0]=4 169 B10R1.113 NC(=S)C1=NC(=CC=C1)N Z1238673112 [1,0,0,0,0,0|2,1,0]=4 170 B10R1.113 NC(=S)C1=NC=CC(=C1)N Z1041133428 [1,0,0,0,0,0|2,1,0]=4 171 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,0,0,0,0,0|2,0,0]=3 172 B10R1.113 NC1=CC(=CC=C1)[N+](=O)[O-] Z56924547 [1,0,0,0,0,0|3,0,0]=4 173 B10R1.113 NC1=CC(=CN=C1)C(=O)O Z1095353978 [1,0,0,0,0,0|3,0,0]=4 174 B10R1.113 NC1=CC(=NC=C1)C(=O)O Z381413014 [1,0,0,0,0,0|3,0,0]=4 175 B10R1.113 NC1=NC(=CC=C1)C(=O)O Z220336222 [1,0,0,0,0,0|3,0,0]=4 176 B10R1.113 O=C(Cl)C1=CC(=NC=C1)Cl Z1255450413 [1,0,0,0,0,0|3,0,0]=4 177 B10R1.113 O=C(Cl)C1=CC(=NC=C1)F Z1198320906 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,0,0,0,0,0|2,0,0]=3 179 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,0,0,0,0,0|2,0,0]=3 180 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,0,0,0,0,0|2,0,0]=3 181 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,0,0,0,0,0|2,0,0]=3 182 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,0,0,0,0,0|1,0,0]=2 183 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,0,0,0,0,0|1,1,0]=3 184 B10R1.113 O=C(O)C1=CC(=CN=C1)Br Z104476582 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.113 O=C(O)C1=CC(=CN=C1)Cl Z972756276 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.113 O=C(O)C1=CC(=CN=C1)F Z1192357288 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [1,0,0,0,0,0|2,0,0]=3 188 B10R1.113 O=C(O)C1=CC(=CN=C1)S Z2238935068 [1,0,0,0,0,0|2,1,0]=4 189 B10R1.113 O=C(O)C1=CC(=NC=C1)Br Z1259086653 [1,0,0,0,0,0|3,0,0]=4 190 B10R1.113 O=C(O)C1=CC(=NC=C1)Cl Z135302154 [1,0,0,0,0,0|3,0,0]=4 191 B10R1.113 O=C(O)C1=CC(=NC=C1)F Z234896331 [1,0,0,0,0,0|3,0,0]=4 192 B10R1.113 O=C(O)C1=CC(=NC=C1)S Z800150220 [1,0,0,0,0,0|2,1,0]=4 193 B10R1.113 O=C(O)C1=C[N+](=CC=C1)[O-] Z104477974 [1,0,0,0,0,0|2,0,1]=4 194 B10R1.113 O=C(O)C1=NC(=CC=C1)Br Z415628156 [1,0,0,0,0,0|3,0,0]=4 195 B10R1.113 O=C(O)C1=NC(=CC=C1)Cl Z56771183 [1,0,0,0,0,0|3,0,0]=4 196 B10R1.113 O=C(O)C1=NC(=CC=C1)F Z1203162000 [1,0,0,0,0,0|3,0,0]=4 197 B10R1.113 O=C(O)C1=NC=CC(=C1)Br Z802558860 [1,0,0,0,0,0|3,0,0]=4 198 B10R1.113 O=C(O)C1=NC=CC(=C1)Cl Z57990012 [1,0,0,0,0,0|3,0,0]=4 199 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [1,0,0,0,0,0|2,0,0]=3 200 B10R1.113 O=C1C=C(C=CN1)C(=O)O Z1416200909 [1,0,0,0,0,0|2,0,1]=4 201 B10R1.113 O=C1C=CC=C(N1)C(=O)O Z359371306 [1,0,0,0,0,0|2,0,1]=4 202 B10R1.113 O=C1C=CC=C(O1)C(=O)O Z1198151696 [1,0,0,0,0,0|2,0,1]=4 203 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,0,0,0,0,0|2,0,0]=3 204 B10R1.113 OB(O)C1=CC(=CC=C1)O Z336080002 [1,0,0,0,0,0|2,0,1]=4 205 B10R1.172 C#CC1=CC=CC(=C1)C=O Z1201623414 [1,0,0,0,0,0|1,0,1]=3 206 B10R1.172 C#CC1=CC=CC(=C1)NC Z335248874 [1,0,0,0,0,0|2,0,1]=4 207 B10R1.172 C#CC1=CC=CC(=N1)C=O Z1198314570 [1,0,0,0,0,0|2,0,1]=4 208 B10R1.172 C#CC1=CC=CC(=N1)OC Z1198312689 [1,0,0,0,0,0|2,0,1]=4 209 B10R1.172 C#CC1=CN=CC(=C1)C=O Z1198312684 [1,0,0,0,0,0|2,0,1]=4 210 B10R1.172 C#CC1=NC=CC(=C1)C=O Z1255464581 [1,0,0,0,0,0|2,0,1]=4 211 B10R1.172 C=CC1=CC(=CN=C1)C=O Z4958191467 [1,0,0,0,0,0|2,0,1]=4 212 B10R1.172 C=CC1=NC=CC(=C1)C=O Z1618142690 [1,0,0,0,0,0|2,0,1]=4 213 B10R1.172 CCC1=CC(=CC=C1)C#N Z1201618078 [1,0,0,0,0,0|1,0,2]=4 214 B10R1.172 CCC1=CC(=CC=C1)C=O Z1198218859 [1,0,0,0,0,0|1,0,0]=2 215 B10R1.172 CCC1=CC(=CC=C1)NC Z335280692 [1,0,0,0,0,0|2,0,1]=4 216 B10R1.172 CCC1=CC(=CN=C1)C=O Z1255382321 [1,0,0,0,0,0|2,0,0]=3 217 B10R1.172 CCC1=CC(=CN=C1)CN Z2310718462 [1,0,0,0,0,0|2,0,1]=4 218 B10R1.172 CCC1=CC(=NC=C1)C=O Z1255380583 [1,0,0,0,0,0|2,0,0]=3 219 B10R1.172 CCC1=NC(=CC=C1)C=O Z1255375781 [1,0,0,0,0,0|2,0,0]=3 220 B10R1.172 CCC1=NC=CC(=C1)C=O Z1255362037 [1,0,0,0,0,0|2,0,0]=3 221 B10R1.172 CNC1=CC(=CC=C1)C#N Z335274890 [1,0,0,0,0,0|1,0,2]=4 222 B10R1.172 CNC1=CC(=CC=C1)C=O Z1203829743 [1,0,0,0,0,0|1,0,0]=2 223 B10R1.172 CNC1=CC(=CC=C1)CO Z1082871942 [1,0,0,0,0,0|1,0,2]=4 224 B10R1.172 CNC1=CC(=CC=C1)OC Z3013892520 [1,0,0,0,0,0|2,0,0]=3 225 B10R1.172 CNC1=CC(=CC=C1)SC Z335253758 [1,0,0,0,0,0|2,1,0]=4 226 B10R1.172 CNC1=NC(=CC=C1)OC Z104494274 [1,0,0,0,0,0|3,0,0]=4 227 B10R1.172 COC1=CC(=CC=C1)C=O Z53836050 [1,0,0,0,0,0|0,0,0]=1 228 B10R1.172 COC1=CC(=CC=C1)CCl Z104486106 [1,0,0,0,0,0|1,0,1]=3 229 B10R1.172 COC1=CC(=CC=C1)CO Z90121251 [1,0,0,0,0,0|0,0,2]=3 230 B10R1.172 COC1=CC(=CC=C1)NN Z94599902 [1,0,0,0,0,0|1,0,0]=2 231 B10R1.172 COC1=CC(=CN=C1)C=O Z1255365477 [1,0,0,0,0,0|1,0,0]=2 232 B10R1.172 COC1=CC(=NC=C1)C#N Z1041141324 [1,0,0,0,0,0|1,0,2]=4 233 B10R1.172 COC1=CC(=NC=C1)C=O Z1198176555 [1,0,0,0,0,0|1,0,0]=2 234 B10R1.172 COC1=CC(=NC=C1)CO Z800297980 [1,0,0,0,0,0|1,0,2]=4 235 B10R1.172 COC1=CN=CC(=C1)OC Z1198157277 [1,0,0,0,0,0|3,0,0]=4 236 B10R1.172 COC1=NC(=CC=C1)C=O Z1160906077 [1,0,0,0,0,0|1,0,0]=2 237 B10R1.172 COC1=NC(=CC=C1)CCl Z969097374 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.172 COC1=NC(=CC=C1)CN Z875024662 [1,0,0,0,0,0|1,0,1]=3 239 B10R1.172 COC1=NC(=CC=C1)CO Z969097688 [1,0,0,0,0,0|1,0,2]=4 240 B10R1.172 COC1=NC(=CN=C1)CN Z2944291893 [1,0,0,0,0,0|2,0,1]=4 241 B10R1.172 COC1=NC(=NC=C1)C=O Z1198330110 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.172 COC1=NC=CC(=C1)C#N Z235344767 [1,0,0,0,0,0|1,0,2]=4 243 B10R1.172 COC1=NC=NC(=C1)C=O Z2178582106 [1,0,0,0,0,0|2,0,0]=3 244 B10R1.172 COC1=NC=NC(=C1)CN Z3675381988 [1,0,0,0,0,0|2,0,1]=4 245 B10R1.172 CSC1=CC(=CC=C1)C=O Z1198235179 [1,0,0,0,0,0|0,1,0]=2 246 B10R1.172 CSC1=NC=CC(=C1)CN Z732208356 [1,0,0,0,0,0|1,1,1]=4 247 B10R1.172 N#CC1=CC=CC(=C1)C=O Z210802450 [1,0,0,0,0,0|2,0,0]=3 248 B10R1.172 N#CC1=CC=CC(=C1)CN Z1267773821 [1,0,0,0,0,0|2,0,1]=4 249 B10R1.172 NCC1=CC(=CC=C1)C=O Z3481427925 [1,0,0,0,0,0|2,0,0]=3 250 B10R1.172 NCC1=CC(=CC=C1)CO Z385458332 [1,0,0,0,0,0|2,0,1]=4 251 B10R1.172 O=CC1=CC=CC(=C1)CBr Z1201623840 [1,0,0,0,0,0|2,0,0]=3 252 B10R1.172 O=CC1=CC=CC(=C1)CCl Z1205658947 [1,0,0,0,0,0|2,0,0]=3 253 B10R1.172 O=CC1=CC=CC(=C1)CF Z1511848007 [1,0,0,0,0,0|2,0,0]=3 254 B10R1.172 O=CC1=CC=CC(=N1)CO Z1255379968 [1,0,0,0,0,0|3,0,0]=4 255 B12R1.11 C#CC1=CC(=CC(=C1)C(=O)O)Br Z1813097898 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.11 C#CC1=CC(=CC(=C1)C(=O)O)F Z2049562225 [0,1,0,0,0,0|2,0,1]=4 257 B12R1.11 C#CC1=CC(=CC(=C1)C(=O)O)N Z4801985035 [0,1,0,0,0,0|2,0,1]=4 258 B12R1.11 CC1=CC(=CC(=C1)C=O)C(=O)O Z1262528438 [0,1,0,0,0,0|3,0,0]=4 259 B12R1.11 CCC1=CC(=CC(=C1)N)C(=O)O Z1255430776 [0,1,0,0,0,0|2,0,0]=3 260 B12R1.11 CCC1=CC(=CC(=O)N1)C(=O)O Z1198320047 [0,1,0,0,0,0|3,0,0]=4 261 B12R1.11 CCC1=NC(=CC(=C1)C(=O)O)Cl Z1255421058 [0,1,0,0,0,0|3,0,0]=4 262 B12R1.11 CNC1=NC(=CC(=C1)C(=O)O)Cl Z385470286 [0,1,0,0,0,0|3,0,0]=4 263 B12R1.11 COC1=CC(=CC(=C1)Br)C(=O)O Z1269197290 [0,1,0,0,0,0|1,0,0]=2 264 B12R1.11 COC1=CC(=CC(=C1)Br)[N+](=O)[O-] Z1065885488 [0,1,0,0,0,0|2,0,0]=3 265 B12R1.11 COC1=CC(=CC(=C1)Cl)C(=O)C Z1551958187 [0,1,0,0,0,0|1,0,0]=2 266 B12R1.11 COC1=CC(=CC(=C1)Cl)C(=O)O Z1255488484 [0,1,0,0,0,0|1,0,0]=2 267 B12R1.11 COC1=CC(=CC(=C1)F)B(O)O Z1201623979 [0,1,0,0,0,0|2,0,1]=4 268 B12R1.11 COC1=CC(=CC(=C1)N)C(C)C Z6020170572 [0,1,0,0,0,0|2,0,1]=4 269 B12R1.11 COC1=CC(=CC(=C1)O)C(=O)O Z1198169196 [0,1,0,0,0,0|1,0,0]=2 270 B12R1.11 COC1=CC(=NC(=C1)C)C(=O)O Z4990375320 [0,1,0,0,0,0|2,0,0]=3 271 B12R1.11 COC1=NC(=CC(=O)N1)C(=O)O Z1708089997 [0,1,0,0,0,0|3,0,0]=4 272 B12R1.11 CSC1=CC(=CC(=C1)Cl)C(=O)O Z1508925199 [0,1,0,0,0,0|1,1,0]=3 273 B12R1.11 CSC1=NC(=CC(=C1)C(=O)O)Cl Z732206900 [0,1,0,0,0,0|2,1,0]=4 274 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)Br Z1551960208 [0,1,0,0,0,0|3,0,0]=4 275 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)Cl Z1262556297 [0,1,0,0,0,0|3,0,0]=4 276 B12R1.11 O=CC1=CC(=CC(=C1)C(=O)O)O Z1255441210 [0,1,0,0,0,0|3,0,0]=4 277 B12R1.56 C#CC1=C(C=CC(=C1)C(=O)O)C Z1262529010 [0,1,0,0,0,0|2,0,1]=4 278 B12R1.56 CC(=O)C1=CC(=C(C=C1)Br)C=O Z3325945410 [0,1,0,0,0,0|3,0,0]=4 279 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)C#N Z1198160291 [0,1,0,0,0,0|3,0,0]=4 280 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)CCl Z56896221 [0,1,0,0,0,0|3,0,0]=4 281 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)C#N Z1255360522 [0,1,0,0,0,0|3,0,0]=4 282 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)C=O Z1262560013 [0,1,0,0,0,0|3,0,0]=4 283 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)CN Z2417557044 [0,1,0,0,0,0|3,0,0]=4 284 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)CO Z1262538882 [0,1,0,0,0,0|3,0,0]=4 285 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)Br Z1269205442 [0,1,0,0,0,0|2,0,0]=3 286 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)Cl Z1198314407 [0,1,0,0,0,0|2,0,0]=3 287 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)F Z1255492920 [0,1,0,0,0,0|2,0,0]=3 288 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)O Z1255420244 [0,1,0,0,0,0|2,0,0]=3 289 B12R1.56 CNC1=C(C=CC(=C1)[N+](=O)[O-])N Z1198234411 [0,1,0,0,0,0|3,0,0]=4 290 B12R1.56 COC1=C(C=CC(=C1)B(O)O)Cl Z360059556 [0,1,0,0,0,0|2,0,1]=4 291 B12R1.56 COC1=C(C=CC(=C1)B(O)O)F Z1741976235 [0,1,0,0,0,0|2,0,1]=4 292 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)Cl Z1198331246 [0,1,0,0,0,0|1,0,0]=2 293 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)F Z1201620068 [0,1,0,0,0,0|1,0,0]=2 294 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [0,1,0,0,0,0|1,0,0]=2 295 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)F Z1198168690 [0,1,0,0,0,0|0,0,0]=1 296 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)N Z1126160967 [0,1,0,0,0,0|0,0,0]=1 297 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)C Z104511172 [0,1,0,0,0,0|1,0,0]=2 298 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)Cl Z1741972864 [0,1,0,0,0,0|1,0,0]=2 299 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F Z1201620067 [0,1,0,0,0,0|1,0,0]=2 300 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)I Z1269139629 [0,1,0,0,0,0|1,0,0]=2 301 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O Z381356666 [0,1,0,0,0,0|1,0,0]=2 302 B12R1.56 COC1=C(C=CC(=C1)C(C)C)C Z54854001 [0,1,0,0,0,0|2,0,1]=4 303 B12R1.56 COC1=C(C=CC(=C1)C(C)N)F Z1198747325 [0,1,0,0,0,0|1,0,1]=3 304 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])I Z406674790 [0,1,0,0,0,0|2,0,0]=3 305 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])N Z104477890 [0,1,0,0,0,0|2,0,0]=3 306 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740558 [0,1,0,0,0,0|2,0,0]=3 307 B12R1.56 COC1=C(C=NC(=C1)C(=O)O)Br Z1269180517 [0,1,0,0,0,0|2,0,0]=3 308 B12R1.56 COC1=C(C=NC(=C1)C(=O)O)C Z1362754524 [0,1,0,0,0,0|2,0,0]=3 309 B12R1.56 COC1=C(N=CC(=C1)C(=O)O)Br Z1269150433 [0,1,0,0,0,0|2,0,0]=3 310 B12R1.56 COC1=C(N=CC(=C1)C(=O)O)O Z1201626480 [0,1,0,0,0,0|2,0,0]=3 311 B12R1.56 COC1=CC(=CNC1=O)[N+](=O)[O-] Z2678251421 [0,1,0,0,0,0|3,0,0]=4 312 B12R1.56 CSC1=C(C=CC(=C1)C(=O)O)Br Z1551925183 [0,1,0,0,0,0|1,1,0]=3 313 B12R1.56 CSC1=C(C=CC(=C1)C(=O)O)F Z1262553189 [0,1,0,0,0,0|1,1,0]=3 314 B12R1.56 CSC1=C(C=CC(=C1)C(=O)O)N Z185587022 [0,1,0,0,0,0|1,1,0]=3 315 B12R1.56 N#CC1=C(C=CC(=C1)C(=O)O)Cl Z1255446950 [0,1,0,0,0,0|3,0,0]=4 316 B12R1.56 N#CC1=C(C=CC(=C1)C(=O)O)F Z1255365356 [0,1,0,0,0,0|3,0,0]=4 317 B12R1.56 NCC1=C(C=CC(=C1)C(=O)O)F Z1649893240 [0,1,0,0,0,0|3,0,0]=4 318 B12R1.56 NNC1=C(C=CC(=C1)C(=O)O)Cl Z56951160 [0,1,0,0,0,0|3,0,0]=4 319 B12R1.56 O=C(O)C1=CC(=C(C=C1)O)CO Z1262519174 [0,1,0,0,0,0|3,0,0]=4 320 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)Br Z1486034958 [0,1,0,0,0,0|3,0,0]=4 321 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)Cl Z1649775095 [0,1,0,0,0,0|3,0,0]=4 322 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)F Z1198168885 [0,1,0,0,0,0|3,0,0]=4 323 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)O Z1255434815 [0,1,0,0,0,0|3,0,0]=4 324 B12R1.258 CC(=O)C1=CC(=CC=C1)B(O)O Z1162448672 [0,1,0,0,0,0|3,0,0]=4 325 B12R1.258 CC(=O)C1=CC(=CC=C1)C(=O)O Z1203161684 [0,1,0,0,0,0|2,0,0]=3 326 B12R1.258 CC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z57127467 [0,1,0,0,0,0|3,0,0]=4 327 B12R1.258 CC(=O)C1=CC(=CN=C1)C(=O)O Z1255382323 [0,1,0,0,0,0|3,0,0]=4 328 B12R1.258 CC(C)C1=CC(=CC=C1)C(=O)O Z1171158000 [0,1,0,0,0,0|2,0,0]=3 329 B12R1.258 CC(C)C1=CC(=CN=C1)C(=O)O Z3854252237 [0,1,0,0,0,0|3,0,0]=4 330 B12R1.258 CC(C)C1=NC(=CC=C1)C(=O)O Z1255449261 [0,1,0,0,0,0|3,0,0]=4 331 B12R1.258 CC(Cl)C1=CC(=CC=C1)[N+](=O)[O-] Z104341244 [0,1,0,0,0,0|3,0,0]=4 332 B12R1.258 CC(N)C1=CC(=CC=C1)[N+](=O)[O-] Z594038376 [0,1,0,0,0,0|3,0,0]=4 333 B12R1.258 CN(C)C1=CC(=CC=C1)C(=O)O Z104476962 [0,1,0,0,0,0|2,0,0]=3 334 B12R1.258 CN(C)C1=CC(=CN=C1)C(=O)O Z1198165176 [0,1,0,0,0,0|3,0,0]=4 335 B12R1.258 CN(C)C1=CC(=NC=C1)C(=O)O Z234895477 [0,1,0,0,0,0|3,0,0]=4 336 B12R1.258 CN(C)C1=NC=CC(=C1)C(=O)O Z285782398 [0,1,0,0,0,0|3,0,0]=4 337 B12R1.258 CS(=O)C1=CC(=CC=C1)C(=O)O Z1198340914 [0,1,0,0,0,0|1,1,0]=3 338 B12R1.258 N=C(N)C1=CC(=CC=C1)[N+](=O)[O-] Z444349582 [0,1,0,0,0,0|3,0,0]=4 339 B12R1.258 NC(=O)C1=CC(=CC=C1)B(O)O Z1255365365 [0,1,0,0,0,0|2,0,0]=3 340 B12R1.258 NC(=O)C1=CC(=CC=C1)C(=O)O Z295886826 [0,1,0,0,0,0|2,0,0]=3 341 B12R1.258 NC(=O)C1=CC(=CC=C1)C(=S)N Z295387652 [0,1,0,0,0,0|2,0,0]=3 342 B12R1.258 NC(=O)C1=CC(=CN=C1)C(=O)O Z451348038 [0,1,0,0,0,0|3,0,0]=4 343 B12R1.258 NC(=O)C1=CC=CC(=C1)C(=O)N Z275156916 [0,1,0,0,0,0|2,0,0]=3 344 B12R1.258 NC(=O)C1=NC(=CC=C1)C(=O)O Z431949148 [0,1,0,0,0,0|3,0,0]=4 345 B12R1.258 NC(=O)C1=NC(=CC=C1)C(F)F Z1726038396 [0,1,0,0,0,0|3,0,0]=4 346 B12R1.258 NC(=O)C1=NC=CC(=C1)C(=O)O Z1255448641 [0,1,0,0,0,0|3,0,0]=4 347 B12R1.258 NC(=S)C1=CC(=CC=C1)C(=O)O Z404889430 [0,1,0,0,0,0|2,1,0]=4 348 B12R1.258 O=C(O)C1=CC(=CC=C1)C(F)F Z1117882789 [0,1,0,0,0,0|3,0,0]=4 349 B12R1.258 O=C(O)C1=CC(=CC=C1)[N+](=O)[O-] Z57127479 [0,1,0,0,0,0|3,0,0]=4 350 B12R1.258 O=C(O)C1=CC=CC(=C1)B(O)O Z1203161777 [0,1,0,0,0,0|3,0,0]=4 351 B12R1.258 O=C(O)C1=CC=CC(=C1)C(=O)O Z104475158 [0,1,0,0,0,0|3,0,0]=4 352 B12R1.279 CCCC1=NC=CC(=C1)C(=O)O Z1198175147 [0,1,0,0,0,0|3,0,0]=4 353 B12R1.279 CCNC1=CC(=CC=C1)C(=O)O Z3875496023 [0,1,0,0,0,0|2,0,0]=3 354 B12R1.279 CCNC1=CC(=CN=C1)C(=O)O Z1509050724 [0,1,0,0,0,0|3,0,0]=4 355 B12R1.279 CCNC1=NC=CC(=C1)C(=O)O Z227823010 [0,1,0,0,0,0|3,0,0]=4 356 B12R1.279 CCOC1=CC(=CC=C1)B(O)O Z336079740 [0,1,0,0,0,0|2,0,1]=4 357 B12R1.279 CCOC1=CC(=CC=C1)C(=N)N Z1268152274 [0,1,0,0,0,0|1,0,0]=2 358 B12R1.279 CCOC1=CC(=CC=C1)C(=O)C Z54179676 [0,1,0,0,0,0|1,0,0]=2 359 B12R1.279 CCOC1=CC(=CC=C1)C(=O)N Z274459672 [0,1,0,0,0,0|0,0,0]=1 360 B12R1.279 CCOC1=CC(=CC=C1)C(=O)O Z111782446 [0,1,0,0,0,0|1,0,0]=2 361 B12R1.279 CCOC1=CC(=CC=C1)C(=S)N Z56979299 [0,1,0,0,0,0|0,1,0]=2 362 B12R1.279 CCOC1=CC(=CC=C1)C(C)N Z278080564 [0,1,0,0,0,0|1,0,1]=3 363 B12R1.279 CCOC1=NC=CC(=C1)C(=O)O Z319446996 [0,1,0,0,0,0|2,0,0]=3 364 B12R1.279 CCSC1=CC(=CC=C1)C(=O)O Z1201631366 [0,1,0,0,0,0|1,1,0]=3 365 B12R1.279 CCSC1=NC=CC(=C1)C(=O)O Z332377496 [0,1,0,0,0,0|2,1,0]=4 366 B12R1.279 CNCC1=CC(=CC=C1)C(=O)N Z752989064 [0,1,0,0,0,0|1,0,0]=2 367 B12R1.279 CNCC1=CC(=CC=C1)[N+](=O)[O-] Z367678590 [0,1,0,0,0,0|3,0,0]=4 368 B12R1.279 COCC1=CC(=CC=C1)C(=O)N Z101185906 [0,1,0,0,0,0|0,0,0]=1 369 B12R1.279 COCC1=CC(=CC=C1)C(=O)O Z90122375 [0,1,0,0,0,0|1,0,0]=2 370 B12R1.279 COCC1=CC(=CN=C1)C(=O)O Z1255438067 [0,1,0,0,0,0|2,0,0]=3 371 B12R1.279 COCC1=CC(=NC=C1)C(=O)O Z5027778944 [0,1,0,0,0,0|2,0,0]=3 372 B12R1.279 CSCC1=CC(=CC=C1)C(=O)O Z90122372 [0,1,0,0,0,0|1,1,0]=3 373 B12R1.279 N#CCC1=CC=CC(=C1)C(=O)N Z444840556 [0,1,0,0,0,0|1,0,1]=3 374 B12R1.279 N#CCC1=CC=CC(=C1)C(=O)O Z274531452 [0,1,0,0,0,0|2,0,1]=4 375 B12R1.279 NCCC1=CC(=CC=C1)C(=O)N Z1262327414 [0,1,0,0,0,0|1,0,0]=2 376 B12R1.279 NCCC1=CC(=CC=C1)C(=O)O Z1245633941 [0,1,0,0,0,0|2,0,0]=3 377 B12R1.279 NCCC1=CC(=CC=C1)[N+](=O)[O-] Z1536936187 [0,1,0,0,0,0|3,0,0]=4 378 B12R1.279 NCCC1=NC(=CC=C1)C(=O)O Z1813090259 [0,1,0,0,0,0|3,0,0]=4 379 B12R1.279 O=[N+]([O-])C1=CC=CC(=C1)CCO Z1250886952 [0,1,0,0,0,0|3,0,0]=4 380 B12R1.435 CCC(=O)C1=CC(=CC=C1)C#N Z1255396281 [0,1,0,0,0,0|3,0,0]=4 381 B12R1.435 CCC(=O)C1=CC(=CC=C1)OC Z513732528 [0,1,0,0,0,0|1,0,0]=2 382 B12R1.435 CCC(O)C1=CC(=CC=C1)OC Z513748112 [0,1,0,0,0,0|1,0,2]=4 383 B12R1.435 CNC(=O)C1=CC(=CC=C1)C#N Z32017061 [0,1,0,0,0,0|2,0,0]=3 384 B12R1.435 CNC(=O)C1=CC(=CC=C1)C=O Z1068186274 [0,1,0,0,0,0|2,0,0]=3 385 B12R1.435 CNC(=O)C1=CC(=CC=C1)CN Z336481558 [0,1,0,0,0,0|2,0,0]=3 386 B12R1.435 CNC(=O)C1=CC(=CC=C1)NC Z2831446214 [0,1,0,0,0,0|1,0,0]=2 387 B12R1.435 CNC(=O)C1=CC(=CC=C1)OC Z32016549 [0,1,0,0,0,0|0,0,0]=1 388 B12R1.435 CNC(=O)C1=NC(=CC=C1)CN Z2063791547 [0,1,0,0,0,0|3,0,0]=4 389 B12R1.435 CNC(=O)C1=NC(=CC=C1)NC Z969100808 [0,1,0,0,0,0|2,0,0]=3 390 B12R1.435 CNC(=O)C1=NC(=CN=C1)NC Z1262583647 [0,1,0,0,0,0|3,0,0]=4 391 B12R1.435 CNC(=O)C1=NC=CC(=C1)NC Z425852262 [0,1,0,0,0,0|2,0,0]=3 392 B12R1.435 CNC1=CC(=CC=C1)C(=O)OC Z1082871350 [0,1,0,0,0,0|2,0,0]=3 393 B12R1.435 COC(=O)C1=CC(=CC=C1)C#N Z24765807 [0,1,0,0,0,0|3,0,0]=4 394 B12R1.435 COC(=O)C1=CC(=CC=C1)C=O Z1255415803 [0,1,0,0,0,0|3,0,0]=4 395 B12R1.435 COC(=O)C1=CC(=CC=C1)CBr Z56989676 [0,1,0,0,0,0|3,0,0]=4 396 B12R1.435 COC(=O)C1=CC(=CC=C1)CN Z1421530097 [0,1,0,0,0,0|3,0,0]=4 397 B12R1.435 COC(=O)C1=CC(=CC=C1)CO Z431953134 [0,1,0,0,0,0|3,0,0]=4 398 B12R1.435 COC(=O)C1=CC(=CC=C1)OC Z18352701 [0,1,0,0,0,0|1,0,0]=2 399 B12R1.435 COC(=O)C1=CC(=CN=C1)OC Z1255443133 [0,1,0,0,0,0|2,0,0]=3 400 B12R1.435 COC(=O)C1=NC(=CC=C1)OC Z1255489919 [0,1,0,0,0,0|2,0,0]=3 401 B12R1.435 COC(=O)C1=NC(=CC=C1)SC Z1618110328 [0,1,0,0,0,0|2,1,0]=4 402 B12R1.435 COC1=CC(=CC=C1)C(=O)CBr Z104482198 [0,1,0,0,0,0|1,0,0]=2 403 B12R1.435 COC1=CC(=CC=C1)C(=O)CCl Z440619268 [0,1,0,0,0,0|1,0,0]=2 404 B12R1.435 COC1=CC(=CC=C1)C(=O)CN Z2242140910 [0,1,0,0,0,0|0,0,0]=1 405 B12R1.435 COC1=CC(=CC=C1)C(=O)NN Z58981865 [0,1,0,0,0,0|0,0,0]=1 406 B12R1.435 COC1=CC(=CC=C1)C(C)C#N Z415654698 [0,1,0,0,0,0|1,0,2]=4 407 B12R1.435 COC1=CC(=CC=C1)C(C)C=O Z1255385344 [0,1,0,0,0,0|1,0,1]=3 408 B12R1.435 COC1=CC(=CC=C1)C(N)CO Z385458538 [0,1,0,0,0,0|0,0,2]=3 409 B12R1.435 COC1=CC(=CC=C1)C(O)CO Z1416170023 [0,1,0,0,0,0|1,0,2]=4 410 B12R1.435 N#CC1=CC=CC(=C1)C(=O)CBr Z1095336216 [0,1,0,0,0,0|3,0,0]=4 411 B12R1.435 N#CC1=CC=CC(=C1)C(=O)CO Z1469782360 [0,1,0,0,0,0|3,0,0]=4 412 B12R1.436 CCC1=CC(=CC=C1)S(=O)(=O)N Z401602538 [0,1,0,0,0,0|2,0,0]=3 413 B12R1.436 CNC1=CC(=CC=C1)S(=O)(=O)C Z1082871540 [0,1,0,0,0,0|3,0,0]=4 414 B12R1.436 CNC1=CC(=CC=C1)S(=O)(=O)F Z5089127637 [0,1,0,0,0,0|3,0,0]=4 415 B12R1.436 COC1=CC(=CC=C1)C(C)(C)N Z3023980681 [0,1,0,0,0,0|1,0,1]=3 416 B12R1.436 COC1=CC(=CC=C1)S(=O)(=O)N Z234895027 [0,1,0,0,0,0|1,0,0]=2 417 B12R1.436 COC1=CC(=CN=C1)S(=O)(=O)N Z1522555825 [0,1,0,0,0,0|2,0,0]=3 418 B12R1.436 COC1=CC(=NC=C1)S(=O)(=O)F Z3271510271 [0,1,0,0,0,0|3,0,0]=4 419 B12R1.436 COC1=NC(=CC=C1)S(=O)(=O)F Z2933949736 [0,1,0,0,0,0|3,0,0]=4 420 B12R1.436 COC1=NC=CC(=C1)S(=O)(=O)F Z3015839126 [0,1,0,0,0,0|3,0,0]=4 421 B12R1.436 N#CC1=CC=CC(=C1)S(=O)(=O)N Z45415628 [0,1,0,0,0,0|3,0,0]=4 422 B12R1.436 NCC1=CC(=CC=C1)S(=O)(=O)N Z367450906 [0,1,0,0,0,0|3,0,0]=4 423 B12R1.436 NS(=O)(=O)C1=CC(=CC=C1)CO Z1216845276 [0,1,0,0,0,0|3,0,0]=4 424 B12R1.440 CC(=O)C1=C(C(=CC=C1)C#N)O Z1216845818 [0,1,0,0,0,0|3,0,0]=4 425 B12R1.440 CC1=C(C=CC=C1C#N)C(=O)O Z1255453572 [0,1,0,0,0,0|3,0,0]=4 426 B12R1.440 CC1=C(C=CC=C1CO)C(=O)O Z1486035448 [0,1,0,0,0,0|3,0,0]=4 427 B12R1.440 CCC1=C(C(=CC=C1)C(=O)O)F Z1255430783 [0,1,0,0,0,0|2,0,0]=3 428 B12R1.440 CCC1=C(C(=CC=C1)C(=O)O)N Z2327039978 [0,1,0,0,0,0|2,0,0]=3 429 B12R1.440 CCC1=C(C(=CC=C1)C(=O)O)O Z367679250 [0,1,0,0,0,0|2,0,0]=3 430 B12R1.440 CNC1=C(C(=CC=N1)C(=O)O)N Z1267840556 [0,1,0,0,0,0|3,0,0]=4 431 B12R1.440 COC1=C(C(=CC=C1)B(O)O)Cl Z1201626818 [0,1,0,0,0,0|2,0,1]=4 432 B12R1.440 COC1=C(C(=CC=C1)B(O)O)F Z1203162315 [0,1,0,0,0,0|2,0,1]=4 433 B12R1.440 COC1=C(C(=CC=C1)C(=O)C)O Z1255428654 [0,1,0,0,0,0|1,0,0]=2 434 B12R1.440 COC1=C(C(=CC=C1)C(=O)N)N Z1198223462 [0,1,0,0,0,0|0,0,0]=1 435 B12R1.440 COC1=C(C(=CC=C1)C(=O)N)O Z57032585 [0,1,0,0,0,0|0,0,0]=1 436 B12R1.440 COC1=C(C(=CC=C1)C(=O)O)Cl Z1255461970 [0,1,0,0,0,0|1,0,0]=2 437 B12R1.440 COC1=C(C(=CC=C1)C(=O)O)F Z1201621660 [0,1,0,0,0,0|1,0,0]=2 438 B12R1.440 COC1=C(C(=CC=C1)C(=O)O)O Z104500498 [0,1,0,0,0,0|1,0,0]=2 439 B12R1.440 COC1=C(C(=CC=C1)[N+](=O)[O-])N Z57160133 [0,1,0,0,0,0|2,0,0]=3 440 B12R1.440 COC1=C(C(=CC=N1)C(=O)O)Br Z1269160980 [0,1,0,0,0,0|2,0,0]=3 441 B12R1.440 COC1=C(C(=CN=C1)C(=O)O)C Z2686261046 [0,1,0,0,0,0|2,0,0]=3 442 B12R1.440 COC1=C(C(=NC=C1)C(=O)O)Br Z1269237683 [0,1,0,0,0,0|2,0,0]=3 443 B12R1.440 COC1=C(C(=NC=C1)C(=O)O)F Z3210760418 [0,1,0,0,0,0|2,0,0]=3 444 B12R1.440 COC1=C(C(=NC=C1)C(=O)O)N Z4966043219 [0,1,0,0,0,0|2,0,0]=3 445 B12R1.440 COC1=C(C(=NC=N1)C(=O)O)F Z2313525714 [0,1,0,0,0,0|3,0,0]=4 446 B12R1.440 N#CC1=CC=CC(=C1Br)C(=O)O Z1269144734 [0,1,0,0,0,0|3,0,0]=4 447 B12R1.440 N#CC1=CC=CC(=C1I)C(=O)O Z1551960102 [0,1,0,0,0,0|3,0,0]=4 448 B12R1.440 NC(=O)C1=C(C(=CC=C1)C=O)F Z2511824780 [0,1,0,0,0,0|2,0,0]=3 449 B12R1.440 O=CC1=CC=CC(=C1Cl)C(=O)O Z1649775097 [0,1,0,0,0,0|3,0,0]=4 450 B12R1.440 O=CC1=CC=CC(=C1F)C(=O)O Z1322795747 [0,1,0,0,0,0|3,0,0]=4 451 B12R1.440 O=CC1=CC=CC(=C1O)C(=O)O Z56756601 [0,1,0,0,0,0|3,0,0]=4 452 B12R1.453 CC(=O)C1=C(C=CC(=C1)C#N)N Z1216845820 [0,1,0,0,0,0|3,0,0]=4 453 B12R1.453 CC1=C(C=C(C=C1)C#N)C(=O)O Z1255495726 [0,1,0,0,0,0|3,0,0]=4 454 B12R1.453 CC1=C(C=C(C=C1)C=O)C(=O)O Z1813092023 [0,1,0,0,0,0|3,0,0]=4 455 B12R1.453 CCC1=CC(=C(C=C1)C)C(=O)O Z1262538890 [0,1,0,0,0,0|2,0,0]=3 456 B12R1.453 CCC1=CC(=C(C=C1)Cl)C(=O)O Z1201628894 [0,1,0,0,0,0|2,0,0]=3 457 B12R1.453 CCC1=CC(=C(C=C1)F)C(=O)O Z1255442013 [0,1,0,0,0,0|2,0,0]=3 458 B12R1.453 CCC1=CC(=C(C=C1)N)C(=O)O Z362758706 [0,1,0,0,0,0|2,0,0]=3 459 B12R1.453 CCC1=CC(=C(C=C1)O)C(=O)O Z367679272 [0,1,0,0,0,0|2,0,0]=3 460 B12R1.453 CCC1=CC(=C(C=C1)O)[N+](=O)[O-] Z979482328 [0,1,0,0,0,0|3,0,0]=4 461 B12R1.453 CCC1=CNC(=O)C(=C1)C(=O)O Z994289166 [0,1,0,0,0,0|3,0,0]=4 462 B12R1.453 CNC1=CC(=C(C=C1)Cl)C(=O)O Z2130643804 [0,1,0,0,0,0|2,0,0]=3 463 B12R1.453 CNC1=NC=C(C(=C1)C(=O)O)Br Z2153894596 [0,1,0,0,0,0|3,0,0]=4 464 B12R1.453 COC1=CC(=C(C=C1)Br)C(=O)N Z33545388 [0,1,0,0,0,0|0,0,0]=1 465 B12R1.453 COC1=CC(=C(C=C1)Br)C(=O)O Z104487486 [0,1,0,0,0,0|1,0,0]=2 466 B12R1.453 COC1=CC(=C(C=C1)Cl)B(O)O Z838915080 [0,1,0,0,0,0|2,0,1]=4 467 B12R1.453 COC1=CC(=C(C=C1)Cl)C(=O)O Z1201620273 [0,1,0,0,0,0|1,0,0]=2 468 B12R1.453 COC1=CC(=C(C=C1)F)B(O)O Z1255391319 [0,1,0,0,0,0|2,0,1]=4 469 B12R1.453 COC1=CC(=C(C=C1)I)[N+](=O)[O-] Z397593294 [0,1,0,0,0,0|2,0,0]=3 470 B12R1.453 COC1=CC(=C(C=C1)N)C(=O)O Z594219052 [0,1,0,0,0,0|1,0,0]=2 471 B12R1.453 COC1=CC(=C(C=C1)N)[N+](=O)[O-] Z104495160 [0,1,0,0,0,0|2,0,0]=3 472 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)C Z104483744 [0,1,0,0,0,0|1,0,0]=2 473 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)N Z394696298 [0,1,0,0,0,0|0,0,0]=1 474 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)O Z104495362 [0,1,0,0,0,0|1,0,0]=2 475 B12R1.453 COC1=CC(=C(C=C1)O)C(C)N Z239627178 [0,1,0,0,0,0|1,0,1]=3 476 B12R1.453 COC1=NC(=C(C=C1)C)C(=O)O Z1255390077 [0,1,0,0,0,0|2,0,0]=3 477 B12R1.453 COC1=NC(=C(C=C1)Cl)C(=O)O Z221432352 [0,1,0,0,0,0|2,0,0]=3 478 B12R1.453 COC1=NC(=C(C=C1)F)C(=O)O Z1255447688 [0,1,0,0,0,0|2,0,0]=3 479 B12R1.453 COC1=NC(=C(C=N1)Cl)C(=O)O Z1198170113 [0,1,0,0,0,0|3,0,0]=4 480 B12R1.453 CSC1=CC(=C(C=C1)C)C(=O)N Z278515262 [0,1,0,0,0,0|0,1,0]=2 481 B12R1.453 CSC1=CC(=C(C=C1)C)C(=O)O Z255150402 [0,1,0,0,0,0|1,1,0]=3 482 B12R1.453 CSC1=CC(=C(C=C1)Cl)C(=O)N Z33546773 [0,1,0,0,0,0|0,1,0]=2 483 B12R1.453 CSC1=CC(=C(C=C1)Cl)C(=O)O Z104495540 [0,1,0,0,0,0|1,1,0]=3 484 B12R1.453 CSC1=CC(=C(C=C1)O)C(=O)O Z1255431342 [0,1,0,0,0,0|1,1,0]=3 485 B12R1.453 CSC1=NC(=C(C=C1)Cl)C(=O)O Z732206892 [0,1,0,0,0,0|2,1,0]=4 486 B12R1.453 CSC1=NC(=C(C=N1)Cl)C(=O)N Z296759552 [0,1,0,0,0,0|2,1,0]=4 487 B12R1.453 N#CC1=CC(=C(C=C1)Br)C(=O)O Z1269112120 [0,1,0,0,0,0|3,0,0]=4 488 B12R1.453 N#CC1=CC(=C(C=C1)Cl)C(=O)O Z1198304567 [0,1,0,0,0,0|3,0,0]=4 489 B12R1.453 N#CC1=CC(=C(C=C1)F)C(=O)O Z1255461823 [0,1,0,0,0,0|3,0,0]=4 490 B12R1.453 N#CC1=CC(=C(C=C1)N)C(=O)O Z1262514273 [0,1,0,0,0,0|3,0,0]=4 491 B12R1.453 N#CC1=CC(=C(C=C1)O)C(=O)O Z1255393347 [0,1,0,0,0,0|3,0,0]=4 492 B12R1.453 NNC1=CC(=C(C=C1)Cl)C(=O)O Z56792408 [0,1,0,0,0,0|3,0,0]=4 493 B12R1.453 O=C(O)C1=C(C=CC(=C1)CO)Cl Z1262523857 [0,1,0,0,0,0|3,0,0]=4 494 B12R1.453 O=CC1=CC(=C(C=C1)F)C(=O)O Z1201623086 [0,1,0,0,0,0|3,0,0]=4 495 B12R1.453 O=CC1=CC(=C(C=C1)O)C(=O)O Z1255430994 [0,1,0,0,0,0|3,0,0]=4 496 B12R2.43 COC1=CC(=CC=C1)C2CO2 Z278165228 [0,0,0,1,0,0|1,0,2]=4 497 B12R2.1384 O=C(O)C1=CC2=C(C=C1)CC2 Z1205494871 [0,0,0,1,0,0|2,0,0]=3 498 B10R1.31 CCC1=CC=C(N1)C(=O)O Z1416166268 [0,0,0,0,1,0|3,0,0]=4 499 B10R1.31 CCC1=CC=C(O1)C(=O)O Z57564911 [0,0,0,0,1,0|3,0,0]=4 500 B10R1.31 CCC1=CC=C(S1)C(=O)C Z89267050 [0,0,0,0,1,0|3,0,0]=4 501 B10R1.31 CCC1=CNC(=C1)C(=O)O Z3243445142 [0,0,0,0,1,0|3,0,0]=4 502 B10R1.31 COC1=CC=C(S1)C(=O)O Z1198160366 [0,0,0,0,1,0|2,0,0]=3 503 B10R1.31 COC1=CSC(=C1)C(=O)O Z335442452 [0,0,0,0,1,0|2,0,0]=3 504 B10R1.31 COC1=NC(=CO1)C(=O)O Z1646049290 [0,0,0,0,1,0|3,0,0]=4 505 B10R1.31 COC1=NOC(=C1)C(=O)C Z1416183410 [0,0,0,0,1,0|3,0,0]=4 506 B10R1.31 COC1=NSC(=C1)C(=O)O Z2301475282 [0,0,0,0,1,0|3,0,0]=4 507 B10R1.31 CSC1=CC(=CO1)C(=O)O Z2408373903 [0,0,0,0,1,0|2,1,0]=4 508 B10R1.31 CSC1=CC=C(O1)C(=O)O Z963425062 [0,0,0,0,1,0|2,1,0]=4 509 B10R1.31 CSC1=CC=C(S1)C(=O)O Z1201619509 [0,0,0,0,1,0|2,1,0]=4 510 B10R1.31 N#CC1=CC(=CN1)C(=O)N Z1541586953 [0,0,0,0,1,0|3,0,0]=4 511 B10R1.31 NC(=O)C1=CC=C(S1)C=O Z1255366081 [0,0,0,0,1,0|3,0,0]=4 512 B10R1.31 NC(=O)C1=CSC(=C1)C=O Z1335014589 [0,0,0,0,1,0|3,0,0]=4 513 B10R1.31 NCC1=CC=C(O1)C(=O)N Z1324054900 [0,0,0,0,1,0|3,0,0]=4 514 B10R1.39 CCC1=C(C=CN1)C(=O)O Z1416192080 [0,0,0,0,1,0|3,0,0]=4 515 B10R1.39 CCC1=C(C=CO1)C(=O)O Z1205494709 [0,0,0,0,1,0|3,0,0]=4 516 B10R1.39 CCC1=C(OC=C1)C(=O)O Z1205495479 [0,0,0,0,1,0|3,0,0]=4 517 B10R1.39 CCC1=C(SC=C1)C(=O)N Z803943296 [0,0,0,0,1,0|2,0,0]=3 518 B10R1.39 CCC1=C(SC=C1)C(=O)O Z608482636 [0,0,0,0,1,0|3,0,0]=4 519 B10R1.39 CCC1=CNC=C1C(=O)O Z1813204808 [0,0,0,0,1,0|3,0,0]=4 520 B10R1.39 CCC1=CSC=C1C(=O)O Z1198727066 [0,0,0,0,1,0|3,0,0]=4 521 B10R1.39 CCN1C=CC=C1C(=O)O Z425487628 [0,0,0,0,1,0|3,0,0]=4 522 B10R1.39 COC1=C(C=CS1)C(=O)O Z1262517788 [0,0,0,0,1,0|2,0,0]=3 523 B10R1.39 COC1=C(SC=C1)C(=O)C Z1255500699 [0,0,0,0,1,0|2,0,0]=3 524 B10R1.39 COC1=C(SC=C1)C(=O)O Z1124707084 [0,0,0,0,1,0|2,0,0]=3 525 B10R1.39 COC1=CNN=C1C(=O)O Z3825664386 [0,0,0,0,1,0|3,0,0]=4 526 B10R1.39 COC1=CSC=C1C(=O)O Z1201618692 [0,0,0,0,1,0|2,0,0]=3 527 B10R1.39 COC1=NNC=C1C(=O)O Z1205655926 [0,0,0,0,1,0|3,0,0]=4 528 B10R1.39 COC1=NSC=C1C(=O)C Z3024184412 [0,0,0,0,1,0|3,0,0]=4 529 B10R1.39 COC1=NSC=C1C(=O)O Z1262521358 [0,0,0,0,1,0|3,0,0]=4 530 B10R1.39 CSC1=C(C=CS1)C(=O)O Z1198158844 [0,0,0,0,1,0|2,1,0]=4 531 B10R1.39 CSC1=C(SC=C1)C(=O)O Z1142701510 [0,0,0,0,1,0|2,1,0]=4 532 B10R1.39 CSC1=CSC=C1C(=O)O Z1262517772 [0,0,0,0,1,0|2,1,0]=4 533 B12R1.438 C#CC1=CC=CC(=C1)NC(=O)N Z316107698 [0,0,0,0,0,1|1,0,1]=3 534 B12R1.438 CC(=O)NC1=CC(=CC=C1)C#N Z26548069 [0,0,0,0,0,1|3,0,0]=4 535 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O Z1238570824 [0,0,0,0,0,1|3,0,0]=4 536 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN Z239097364 [0,0,0,0,0,1|3,0,0]=4 537 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [0,0,0,0,0,1|3,0,0]=4 538 B12R1.438 CCC1=CC(=CC=C1)CC(=O)O Z1198264513 [0,0,0,0,0,1|2,0,0]=3 539 B12R1.438 CCC1=CC(=CC=C1)NC(=N)N Z2518173555 [0,0,0,0,0,1|2,0,0]=3 540 B12R1.438 CCC1=CC(=CC=C1)NC(=S)N Z271134332 [0,0,0,0,0,1|1,1,0]=3 541 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [0,0,0,0,0,1|1,0,0]=2 542 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [0,0,0,0,0,1|0,0,0]=1 543 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [0,0,0,0,0,1|1,0,0]=2 544 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [0,0,0,0,0,1|1,0,0]=2 545 B12R1.438 COC1=CC(=CC=C1)NC(=S)N Z56913186 [0,0,0,0,0,1|0,1,0]=2 546 B12R1.438 COC1=NC=CC(=C1)CC(=O)O Z2186882871 [0,0,0,0,0,1|2,0,0]=3 547 B12R1.438 N#CC1=CC=CC(=C1)CC(=O)O Z982130150 [0,0,0,0,0,1|3,0,0]=4 548 B12R1.438 NCC1=CC(=CC=C1)NC(=O)N Z228589074 [0,0,0,0,0,1|2,0,0]=3 549 B12R1.438 O=CC1=CC=CC(=C1)CC(=O)O Z1262512246 [0,0,0,0,0,1|3,0,0]=4 550 B9R0.42 COC(=O)/C=C(\N)/C(=O)N Z87002018 [1,0,1,0,0,0|2,0,0]=4 551 B9R1.2 C#CC1=CC=CC(=C1)N Z235485474 [2,0,0,0,0,0|1,0,1]=4 552 B9R1.2 CC1=CC(=CC=C1)C=O Z104478208 [2,0,0,0,0,0|0,0,0]=2 553 B9R1.2 CC1=CC(=CC=C1)NN Z56943685 [2,0,0,0,0,0|1,0,0]=3 554 B9R1.2 CC1=CC(=CN=C1)C=O Z1198176743 [2,0,0,0,0,0|1,0,0]=3 555 B9R1.2 CC1=CC(=CN=C1)CN Z1198167984 [2,0,0,0,0,0|1,0,1]=4 556 B9R1.2 CC1=CC(=NC=C1)C=O Z1201624018 [2,0,0,0,0,0|1,0,0]=3 557 B9R1.2 CC1=NC(=CC=C1)C=O Z1079442396 [2,0,0,0,0,0|1,0,0]=3 558 B9R1.2 CC1=NC(=CC=C1)CN Z291234028 [2,0,0,0,0,0|1,0,1]=4 559 B9R1.2 CC1=NC=CC(=C1)C=O Z1198168755 [2,0,0,0,0,0|1,0,0]=3 560 B9R1.2 CC1=NC=NC(=C1)C=O Z1013697120 [2,0,0,0,0,0|2,0,0]=4 561 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [2,0,0,0,0,0|2,0,0]=4 562 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [2,0,0,0,0,0|1,0,0]=3 563 B9R1.2 CNC1=CC(=CC=C1)F Z335274194 [2,0,0,0,0,0|2,0,0]=4 564 B9R1.2 CNC1=CC(=CC=C1)I Z4085232023 [2,0,0,0,0,0|2,0,0]=4 565 B9R1.2 CNC1=CC(=CC=C1)N Z376447548 [2,0,0,0,0,0|1,0,0]=3 566 B9R1.2 CNC1=CC(=CC=C1)O Z1082872246 [2,0,0,0,0,0|1,0,1]=4 567 B9R1.2 COC1=CC(=CC=C1)C Z53834440 [2,0,0,0,0,0|0,0,1]=3 568 B9R1.2 COC1=CC(=CC=C1)N Z104472536 [2,0,0,0,0,0|0,0,0]=2 569 B9R1.2 COC1=CC(=CC=C1)O Z104478798 [2,0,0,0,0,0|0,0,1]=3 570 B9R1.2 COC1=CC(=NC=C1)N Z1201624123 [2,0,0,0,0,0|1,0,0]=3 571 B9R1.2 COC1=CC(=O)NC=C1 Z1741975851 [2,0,0,0,0,0|1,0,0]=3 572 B9R1.2 COC1=NC(=CC=C1)O Z1198172138 [2,0,0,0,0,0|1,0,1]=4 573 B9R1.2 COC1=NC(=CC=N1)N Z56773387 [2,0,0,0,0,0|2,0,0]=4 574 B9R1.2 COC1=NC(=CN=C1)N Z1198261569 [2,0,0,0,0,0|2,0,0]=4 575 B9R1.2 COC1=NC(=NC=C1)N Z1198154284 [2,0,0,0,0,0|2,0,0]=4 576 B9R1.2 COC1=NC=CC(=C1)Cl Z1201623697 [2,0,0,0,0,0|2,0,0]=4 577 B9R1.2 COC1=NC=NC(=C1)N Z1203578175 [2,0,0,0,0,0|2,0,0]=4 578 B9R1.2 CSC1=CC(=CC=C1)N Z104472758 [2,0,0,0,0,0|0,1,0]=3 579 B9R1.2 CSC1=CC(=CN=C1)N Z2239020735 [2,0,0,0,0,0|1,1,0]=4 580 B9R1.2 CSC1=CC(=NC=C1)N Z1203581667 [2,0,0,0,0,0|1,1,0]=4 581 B9R1.2 CSC1=NC=CC(=C1)N Z851811592 [2,0,0,0,0,0|1,1,0]=4 582 B9R1.2 N#CC1=CC=CC(=C1)N Z104477194 [2,0,0,0,0,0|2,0,0]=4 583 B9R1.2 N#CC1=CC=CC(=C1)O Z56969327 [2,0,0,0,0,0|0,0,2]=4 584 B9R1.2 NCC1=CC(=CC=C1)Br Z1262246228 [2,0,0,0,0,0|1,0,1]=4 585 B9R1.2 NCC1=CC(=CC=C1)I Z1269220799 [2,0,0,0,0,0|1,0,1]=4 586 B9R1.2 NCC1=CC(=CC=C1)O Z744729056 [2,0,0,0,0,0|0,0,1]=3 587 B9R1.2 NCC1=CC(=CN=C1)O Z2310701794 [2,0,0,0,0,0|1,0,1]=4 588 B9R1.2 NNC1=CC(=CC=C1)Br Z118530090 [2,0,0,0,0,0|2,0,0]=4 589 B9R1.2 NNC1=CC(=CC=C1)Cl Z56940998 [2,0,0,0,0,0|2,0,0]=4 590 B9R1.2 O=CC1=CC(=NC=C1)O Z1198163187 [2,0,0,0,0,0|1,0,0]=3 591 B9R1.2 O=CC1=CC=CC(=C1)Br Z104472918 [2,0,0,0,0,0|1,0,0]=3 592 B9R1.2 O=CC1=CC=CC(=C1)Cl Z104476504 [2,0,0,0,0,0|1,0,0]=3 593 B9R1.2 O=CC1=CC=CC(=C1)F Z104476574 [2,0,0,0,0,0|1,0,0]=3 594 B9R1.2 O=CC1=CC=CC(=C1)I Z57887683 [2,0,0,0,0,0|1,0,0]=3 595 B9R1.2 O=CC1=CC=CC(=C1)O Z57772446 [2,0,0,0,0,0|0,0,0]=2 596 B9R1.2 O=CC1=CC=CC(=C1)S Z969587160 [2,0,0,0,0,0|0,1,0]=3 597 B9R1.2 O=CC1=CN=CC(=C1)Br Z1079442626 [2,0,0,0,0,0|2,0,0]=4 598 B9R1.2 O=CC1=CN=CC(=C1)Cl Z1198179591 [2,0,0,0,0,0|2,0,0]=4 599 B9R1.2 O=CC1=CN=CC(=C1)F Z1183458945 [2,0,0,0,0,0|2,0,0]=4 600 B9R1.2 O=CC1=NC=CC(=C1)Br Z1198180938 [2,0,0,0,0,0|2,0,0]=4 601 B9R1.2 O=CC1=NC=CC(=C1)Cl Z1198173296 [2,0,0,0,0,0|2,0,0]=4 602 B9R1.2 O=CC1=NC=CC(=C1)F Z1255396820 [2,0,0,0,0,0|2,0,0]=4 603 B9R1.2 OC1=CC(=CC=C1)CCl Z1198169502 [2,0,0,0,0,0|1,0,1]=4 604 B9R1.2 OCC1=CC(=CC=C1)O Z335245000 [2,0,0,0,0,0|0,0,2]=4 605 B9R1.6 CC(=O)C1=CC=CC=C1 Z57127548 [2,0,0,0,0,0|1,0,0]=3 606 B9R1.6 CC(=O)C1=CN=CC=C1 Z104474436 [2,0,0,0,0,0|2,0,0]=4 607 B9R1.6 CC(=O)C1=NC=CC=C1 Z104474432 [2,0,0,0,0,0|2,0,0]=4 608 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [2,0,0,0,0,0|1,0,1]=4 609 B9R1.6 CN(N)C1=CC=CC=C1 Z57985384 [2,0,0,0,0,0|2,0,0]=4 610 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [2,0,0,0,0,0|1,0,1]=4 611 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [2,0,0,0,0,0|1,0,1]=4 612 B9R1.6 N=C(N)C1=CC=CC=C1 Z166624376 [2,0,0,0,0,0|1,0,0]=3 613 B9R1.6 N=C(N)C1=CC=NC=C1 Z444349574 [2,0,0,0,0,0|2,0,0]=4 614 B9R1.6 N=C(N)C1=CN=CC=C1 Z444349586 [2,0,0,0,0,0|2,0,0]=4 615 B9R1.6 N=C(N)C1=NC=CC=C1 Z540728738 [2,0,0,0,0,0|2,0,0]=4 616 B9R1.6 NC(=O)C1=CN=CC=C1 Z33546463 [2,0,0,0,0,0|1,0,0]=3 617 B9R1.6 NC(=O)C1=CN=NC=C1 Z1203579431 [2,0,0,0,0,0|2,0,0]=4 618 B9R1.6 NC(=O)C1=NC=CC=C1 Z33546380 [2,0,0,0,0,0|1,0,0]=3 619 B9R1.6 NC(=O)C1=NC=CC=N1 Z1198151945 [2,0,0,0,0,0|2,0,0]=4 620 B9R1.6 NC(=O)C1=NC=CN=C1 Z33546644 [2,0,0,0,0,0|2,0,0]=4 621 B9R1.6 NC(=O)C1=NC=NC=C1 Z1203579432 [2,0,0,0,0,0|2,0,0]=4 622 B9R1.6 NC(=O)C1=NN=CC=C1 Z1203580134 [2,0,0,0,0,0|2,0,0]=4 623 B9R1.6 NC(=S)C1=CC=CC=C1 Z57070430 [2,0,0,0,0,0|0,1,0]=3 624 B9R1.6 NC(=S)C1=CC=NC=C1 Z317055504 [2,0,0,0,0,0|1,1,0]=4 625 B9R1.6 NC(=S)C1=CN=CC=C1 Z56960184 [2,0,0,0,0,0|1,1,0]=4 626 B9R1.6 NC(=S)C1=NC=CC=C1 Z56956073 [2,0,0,0,0,0|1,1,0]=4 627 B9R1.6 O=C(O)C1=CC=CC=C1 Z57127480 [2,0,0,0,0,0|1,0,0]=3 628 B9R1.6 O=C(O)C1=CC=NC=C1 Z104473016 [2,0,0,0,0,0|2,0,0]=4 629 B9R1.6 O=C(O)C1=CN=CC=C1 Z56755709 [2,0,0,0,0,0|2,0,0]=4 630 B9R1.6 O=C(O)C1=NC=CC=C1 Z57968195 [2,0,0,0,0,0|2,0,0]=4 631 B9R1.6 O=[S-](=O)C1=CC=CC=C1 Z104501326 [2,0,0,0,0,0|2,0,0]=4 632 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)C Z1269191523 [1,1,0,0,0,0|1,0,0]=3 633 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)Cl Z1269244993 [1,1,0,0,0,0|2,0,0]=4 634 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)F Z1269159079 [1,1,0,0,0,0|2,0,0]=4 635 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)N Z1269218710 [1,1,0,0,0,0|2,0,0]=4 636 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)C Z104477440 [1,1,0,0,0,0|1,0,0]=3 637 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)F Z513735432 [1,1,0,0,0,0|2,0,0]=4 638 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)N Z1198175137 [1,1,0,0,0,0|2,0,0]=4 639 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)O Z1198169413 [1,1,0,0,0,0|1,0,0]=3 640 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Br Z1269168018 [1,1,0,0,0,0|2,0,0]=4 641 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl Z104475662 [1,1,0,0,0,0|2,0,0]=4 642 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F Z1201622912 [1,1,0,0,0,0|2,0,0]=4 643 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)N Z979493752 [1,1,0,0,0,0|2,0,0]=4 644 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br Z199532232 [1,1,0,0,0,0|2,0,0]=4 645 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)C Z606338894 [1,1,0,0,0,0|1,0,0]=3 646 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Cl Z335437578 [1,1,0,0,0,0|2,0,0]=4 647 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F Z56968900 [1,1,0,0,0,0|2,0,0]=4 648 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)N Z1198150660 [1,1,0,0,0,0|2,0,0]=4 649 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O Z1201626572 [1,1,0,0,0,0|1,0,0]=3 650 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)N Z1255447249 [1,1,0,0,0,0|2,0,0]=4 651 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)O Z1198158301 [1,1,0,0,0,0|1,0,0]=3 652 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br Z1037557930 [1,1,0,0,0,0|2,0,0]=4 653 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [1,1,0,0,0,0|1,0,0]=3 654 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [1,1,0,0,0,0|2,0,0]=4 655 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F Z385458772 [1,1,0,0,0,0|2,0,0]=4 656 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N Z1664347745 [1,1,0,0,0,0|2,0,0]=4 657 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)C Z1255426822 [1,1,0,0,0,0|2,0,0]=4 658 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [1,1,0,0,0,0|1,0,1]=4 659 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [1,1,0,0,0,0|1,0,1]=4 660 B11R1.21 CC1=C(C=C(C=C1)C(=N)N)Br Z3325481828 [1,1,0,0,0,0|2,0,0]=4 661 B11R1.21 CC1=C(C=C(C=C1)C(=N)N)F Z1741959288 [1,1,0,0,0,0|2,0,0]=4 662 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)Br Z57206544 [1,1,0,0,0,0|1,0,0]=3 663 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F Z116821650 [1,1,0,0,0,0|1,0,0]=3 664 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)N Z57912417 [1,1,0,0,0,0|1,0,0]=3 665 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)O Z323032498 [1,1,0,0,0,0|0,0,0]=2 666 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Br Z57204180 [1,1,0,0,0,0|2,0,0]=4 667 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C Z104477078 [1,1,0,0,0,0|1,0,0]=3 668 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl Z1097117588 [1,1,0,0,0,0|2,0,0]=4 669 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F Z104510124 [1,1,0,0,0,0|2,0,0]=4 670 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I Z239685220 [1,1,0,0,0,0|2,0,0]=4 671 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)N Z57127001 [1,1,0,0,0,0|2,0,0]=4 672 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [1,1,0,0,0,0|1,0,0]=3 673 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [1,1,0,0,0,0|1,0,1]=4 674 B11R1.21 CC1=C(C=C(C=C1)S(=O)[O-])C Z1455991568 [1,1,0,0,0,0|2,0,0]=4 675 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])C Z104488476 [1,1,0,0,0,0|2,0,0]=4 676 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])O Z415740552 [1,1,0,0,0,0|2,0,0]=4 677 B11R1.21 CC1=C(C=C(N=C1)C(=O)O)C Z2894240161 [1,1,0,0,0,0|2,0,0]=4 678 B11R1.21 CC1=C(C=CC(=C1)C(=N)N)Br Z2574917660 [1,1,0,0,0,0|1,0,0]=3 679 B11R1.21 CC1=C(C=CC(=C1)C(=N)N)F Z317027402 [1,1,0,0,0,0|1,0,0]=3 680 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)I Z1118973913 [1,1,0,0,0,0|0,0,0]=2 681 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)N Z239125318 [1,1,0,0,0,0|0,0,0]=2 682 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br Z1269154857 [1,1,0,0,0,0|1,0,0]=3 683 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl Z1201618086 [1,1,0,0,0,0|1,0,0]=3 684 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F Z959335402 [1,1,0,0,0,0|1,0,0]=3 685 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)I Z239685242 [1,1,0,0,0,0|1,0,0]=3 686 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N Z223458490 [1,1,0,0,0,0|1,0,0]=3 687 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O Z995149794 [1,1,0,0,0,0|1,0,0]=3 688 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [1,1,0,0,0,0|1,0,1]=4 689 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z385459404 [1,1,0,0,0,0|2,0,0]=4 690 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])N Z56926519 [1,1,0,0,0,0|2,0,0]=4 691 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740536 [1,1,0,0,0,0|2,0,0]=4 692 B11R1.21 CC1=C(C=CC(=N1)C(=O)O)Br Z1269158838 [1,1,0,0,0,0|2,0,0]=4 693 B11R1.21 CC1=C(C=NC(=C1)C(=O)O)Cl Z1198173117 [1,1,0,0,0,0|2,0,0]=4 694 B11R1.21 CC1=C(C=NC(=C1)C(=O)O)N Z3397321417 [1,1,0,0,0,0|2,0,0]=4 695 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)C Z1198307150 [1,1,0,0,0,0|2,0,0]=4 696 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)O Z1255445643 [1,1,0,0,0,0|2,0,0]=4 697 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)Br Z1269138133 [1,1,0,0,0,0|2,0,0]=4 698 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)C Z3244908427 [1,1,0,0,0,0|2,0,0]=4 699 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)Cl Z1255381945 [1,1,0,0,0,0|2,0,0]=4 700 B11R1.21 CC1=C(N=CC(=C1)C(=O)O)F Z1198174583 [1,1,0,0,0,0|2,0,0]=4 701 B11R1.21 CN1C=C(C=CC1=O)C(=O)O Z356294138 [1,1,0,0,0,0|2,0,0]=4 702 B11R1.21 CN1C=CC(=CC1=O)C(=O)N Z317545418 [1,1,0,0,0,0|1,0,1]=4 703 B11R1.21 N=C(N)C1=CC(=C(C=C1)Cl)Cl Z1416282440 [1,1,0,0,0,0|2,0,0]=4 704 B11R1.21 N=C(N)C1=CC(=C(C=C1)F)Cl Z1366975529 [1,1,0,0,0,0|2,0,0]=4 705 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)F Z851822858 [1,1,0,0,0,0|1,0,0]=3 706 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)O Z1269119521 [1,1,0,0,0,0|0,0,0]=2 707 B11R1.21 NC(=O)C1=CC(=C(C=C1)Cl)N Z239125304 [1,1,0,0,0,0|1,0,0]=3 708 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)F Z82670082 [1,1,0,0,0,0|1,0,0]=3 709 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)N Z316119774 [1,1,0,0,0,0|1,0,0]=3 710 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)Br Z394874930 [1,1,0,0,0,0|1,0,0]=3 711 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)F Z1127744306 [1,1,0,0,0,0|1,0,0]=3 712 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)Br Z317054104 [1,1,0,0,0,0|1,0,0]=3 713 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)F Z995047024 [1,1,0,0,0,0|1,0,0]=3 714 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)N Z424798268 [1,1,0,0,0,0|1,0,0]=3 715 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)O Z1126161217 [1,1,0,0,0,0|0,0,0]=2 716 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [1,1,0,0,0,0|1,0,0]=3 717 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)F Z1255448698 [1,1,0,0,0,0|1,0,0]=3 718 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [1,1,0,0,0,0|0,0,0]=2 719 B11R1.21 NC(=O)C1=CC(=C(N=C1)Cl)Br Z1269178981 [1,1,0,0,0,0|2,0,0]=4 720 B11R1.21 NC(=O)C1=CC(=C(N=C1)Cl)Cl Z33546785 [1,1,0,0,0,0|2,0,0]=4 721 B11R1.21 NC(=O)C1=CC(=C(N=C1)N)Cl Z951173228 [1,1,0,0,0,0|2,0,0]=4 722 B11R1.21 NC(=O)C1=NC=C(C(=C1)Cl)Br Z2310130163 [1,1,0,0,0,0|2,0,0]=4 723 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Br Z319214986 [1,1,0,0,0,0|2,0,0]=4 724 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Cl Z1082868852 [1,1,0,0,0,0|2,0,0]=4 725 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)F Z756936498 [1,1,0,0,0,0|2,0,0]=4 726 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)N Z104484514 [1,1,0,0,0,0|2,0,0]=4 727 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [1,1,0,0,0,0|1,0,0]=3 728 B11R1.21 NC1=C(C=C(C=N1)C(=O)O)O Z3325079213 [1,1,0,0,0,0|2,0,0]=4 729 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Br Z57127000 [1,1,0,0,0,0|2,0,0]=4 730 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Cl Z104478358 [1,1,0,0,0,0|2,0,0]=4 731 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)F Z283856672 [1,1,0,0,0,0|2,0,0]=4 732 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)I Z1079174176 [1,1,0,0,0,0|2,0,0]=4 733 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)Cl Z1269111039 [1,1,0,0,0,0|2,0,0]=4 734 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)F Z756477072 [1,1,0,0,0,0|2,0,0]=4 735 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [1,1,0,0,0,0|1,0,0]=3 736 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Br Z1269180540 [1,1,0,0,0,0|2,0,0]=4 737 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Cl Z104474098 [1,1,0,0,0,0|2,0,0]=4 738 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)F Z636292752 [1,1,0,0,0,0|2,0,0]=4 739 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)I Z239685218 [1,1,0,0,0,0|2,0,0]=4 740 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [1,1,0,0,0,0|1,0,0]=3 741 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Br Z381356490 [1,1,0,0,0,0|2,0,0]=4 742 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Cl Z1203161796 [1,1,0,0,0,0|2,0,0]=4 743 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)F Z104341246 [1,1,0,0,0,0|2,0,0]=4 744 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)I Z1269207858 [1,1,0,0,0,0|2,0,0]=4 745 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [1,1,0,0,0,0|1,0,0]=3 746 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Br Z382582728 [1,1,0,0,0,0|2,0,0]=4 747 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Cl Z1269153522 [1,1,0,0,0,0|2,0,0]=4 748 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)F Z1115194701 [1,1,0,0,0,0|2,0,0]=4 749 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)I Z1269131507 [1,1,0,0,0,0|2,0,0]=4 750 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [1,1,0,0,0,0|1,0,0]=3 751 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Br Z57985393 [1,1,0,0,0,0|2,0,0]=4 752 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Cl Z104503564 [1,1,0,0,0,0|2,0,0]=4 753 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)F Z57073754 [1,1,0,0,0,0|2,0,0]=4 754 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [1,1,0,0,0,0|1,0,0]=3 755 B11R1.21 O=C(O)C1=CC(=C(C=C1)S)Br Z1269190145 [1,1,0,0,0,0|2,0,0]=4 756 B11R1.21 O=C(O)C1=CC(=C(N=C1)Br)O Z1269173146 [1,1,0,0,0,0|2,0,0]=4 757 B11R1.21 O=C(O)C1=CC(=C(N=C1)I)O Z1269115116 [1,1,0,0,0,0|2,0,0]=4 758 B11R1.21 O=C(O)C1=CN(C(=O)C=C1)O Z1255463617 [1,1,0,0,0,0|2,0,0]=4 759 B11R1.21 O=C(O)C1=NC(=C(C=C1)Br)O Z1269135378 [1,1,0,0,0,0|2,0,0]=4 760 B11R1.21 O=C(O)C1=NC=C(C(=C1)O)Br Z1269108466 [1,1,0,0,0,0|2,0,0]=4 761 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)O Z57160128 [1,1,0,0,0,0|2,0,0]=4 762 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)O Z1255450010 [1,1,0,0,0,0|2,0,0]=4 763 B11R1.23 CC1=CC(=CC=C1)C(=O)CN Z3026469451 [1,1,0,0,0,0|0,0,0]=2 764 B11R1.23 CC1=CC(=CC=C1)C(O)CN Z336086464 [1,1,0,0,0,0|0,0,2]=4 765 B11R1.23 CC1=CC=CC(=C1)C(C)C=O Z1222424653 [1,1,0,0,0,0|1,0,1]=4 766 B11R1.23 CCC(=O)C1=CC(=CC=C1)Br Z104486266 [1,1,0,0,0,0|2,0,0]=4 767 B11R1.23 CCC(=O)C1=CC(=CC=C1)Cl Z104477758 [1,1,0,0,0,0|2,0,0]=4 768 B11R1.23 CCC(=O)C1=CC(=CC=C1)N Z1203578334 [1,1,0,0,0,0|2,0,0]=4 769 B11R1.23 CCC(=O)C1=NC(=CC=C1)C Z1138558473 [1,1,0,0,0,0|2,0,0]=4 770 B11R1.23 CCC(N)C1=CC(=CC=C1)O Z4164634595 [1,1,0,0,0,0|1,0,1]=4 771 B11R1.23 CNC(=O)C1=CC(=CC=C1)Cl Z32016383 [1,1,0,0,0,0|1,0,0]=3 772 B11R1.23 CNC(=O)C1=CC(=CC=C1)F Z32016733 [1,1,0,0,0,0|1,0,0]=3 773 B11R1.23 CNC(=O)C1=CC(=CC=C1)N Z57040519 [1,1,0,0,0,0|1,0,0]=3 774 B11R1.23 CNC(=O)C1=CC(=CC=C1)O Z32016364 [1,1,0,0,0,0|0,0,0]=2 775 B11R1.23 CNC(=O)C1=CC(=CN=C1)Br Z30272319 [1,1,0,0,0,0|2,0,0]=4 776 B11R1.23 CNC(=O)C1=CC(=NC=C1)Cl Z246898914 [1,1,0,0,0,0|2,0,0]=4 777 B11R1.23 CNC(=O)C1=CC(=NC=C1)F Z802658800 [1,1,0,0,0,0|2,0,0]=4 778 B11R1.23 CNC(=O)C1=CC(=NC=C1)N Z959885372 [1,1,0,0,0,0|2,0,0]=4 779 B11R1.23 CNC(=O)C1=NC(=CC=C1)C Z286103568 [1,1,0,0,0,0|1,0,0]=3 780 B11R1.23 CNC(=O)C1=NC(=CC=C1)Cl Z969105050 [1,1,0,0,0,0|2,0,0]=4 781 B11R1.23 CNC(=O)C1=NC(=CC=C1)N Z969100806 [1,1,0,0,0,0|2,0,0]=4 782 B11R1.23 CNC(=O)C1=NC=CC(=C1)Cl Z94601331 [1,1,0,0,0,0|2,0,0]=4 783 B11R1.23 CNC(=O)C1=NC=CC(=C1)N Z425852394 [1,1,0,0,0,0|2,0,0]=4 784 B11R1.23 CNC(=O)C1=NC=CC(=C1)O Z1255501342 [1,1,0,0,0,0|1,0,0]=3 785 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [1,1,0,0,0,0|1,0,1]=4 786 B11R1.23 COC(=O)C1=CC(=CC=C1)C Z18750812 [1,1,0,0,0,0|1,0,0]=3 787 B11R1.23 COC(=O)C1=CC(=CC=C1)N Z57032594 [1,1,0,0,0,0|2,0,0]=4 788 B11R1.23 COC(=O)C1=CC(=CN=C1)C Z1255419726 [1,1,0,0,0,0|2,0,0]=4 789 B11R1.23 COC(=O)C1=CC(=CN=C1)O Z1160905337 [1,1,0,0,0,0|2,0,0]=4 790 B11R1.23 COC(=O)C1=CC(=NC=C1)C Z2894087606 [1,1,0,0,0,0|2,0,0]=4 791 B11R1.23 COC(=O)C1=CC(=NC=C1)O Z3617219808 [1,1,0,0,0,0|2,0,0]=4 792 B11R1.23 COC(=O)C1=NC(=CC=C1)C Z293555540 [1,1,0,0,0,0|2,0,0]=4 793 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Br Z57741780 [1,1,0,0,0,0|1,0,1]=4 794 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)Cl Z90662858 [1,1,0,0,0,0|1,0,1]=4 795 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)F Z381355872 [1,1,0,0,0,0|1,0,1]=4 796 B11R1.23 N/C(=N\O)/C1=CC(=CC=C1)O Z359513480 [1,1,0,0,0,0|0,0,1]=3 797 B11R1.23 NC(CO)C1=CC(=CC=C1)O Z3247611804 [1,1,0,0,0,0|0,0,2]=4 798 B11R1.23 NC1=CC=CC(=C1)/C(=N/O)/N Z364003720 [1,1,0,0,0,0|1,0,1]=4 799 B11R1.23 NCC(=O)C1=CC(=CC=C1)Br Z275368900 [1,1,0,0,0,0|1,0,0]=3 800 B11R1.23 NCC(=O)C1=CC(=CC=C1)Cl Z1741966377 [1,1,0,0,0,0|1,0,0]=3 801 B11R1.23 NCC(=O)C1=CC(=CC=C1)F Z3025863838 [1,1,0,0,0,0|1,0,0]=3 802 B11R1.23 NCC(=O)C1=CC(=CN=C1)Br Z2696739932 [1,1,0,0,0,0|2,0,0]=4 803 B11R1.23 NCC(O)C1=CC(=CC=C1)O Z3041501762 [1,1,0,0,0,0|0,0,2]=4 804 B11R1.23 NNC(=O)C1=CC(=CC=C1)Cl Z56899158 [1,1,0,0,0,0|1,0,0]=3 805 B11R1.23 NNC(=O)C1=CC(=CC=C1)N Z56922179 [1,1,0,0,0,0|1,0,0]=3 806 B11R1.23 NNC(=O)C1=CC(=CC=C1)O Z56930730 [1,1,0,0,0,0|0,0,0]=2 807 B11R1.23 NNC(=O)C1=CC(=NC=C1)Cl Z147123218 [1,1,0,0,0,0|2,0,0]=4 808 B11R1.23 NNC(=O)C1=NC(=CC=C1)Cl Z969099592 [1,1,0,0,0,0|2,0,0]=4 809 B11R1.23 NNC(=O)C1=NC(=CC=C1)F Z1621374251 [1,1,0,0,0,0|2,0,0]=4 810 B11R1.23 O=C(CBr)C1=CC=CC(=C1)Cl Z104482040 [1,1,0,0,0,0|2,0,0]=4 811 B11R1.23 O=C(CBr)C1=CC=CC(=C1)F Z111411220 [1,1,0,0,0,0|2,0,0]=4 812 B11R1.23 O=C(NO)C1=CC(=CC=C1)Br Z59181977 [1,1,0,0,0,0|1,0,0]=3 813 B11R1.23 O=C(NO)C1=CC(=CC=C1)Cl Z59181969 [1,1,0,0,0,0|1,0,0]=3 814 B11R1.23 O=C(NO)C1=CC(=CC=C1)O Z317038072 [1,1,0,0,0,0|0,0,0]=2 815 B11R1.23 O=CC(=O)C1=CC=CC(=C1)Br Z2472857402 [1,1,0,0,0,0|2,0,0]=4 816 B11R1.23 O=CC(=O)C1=CC=CC(=C1)O Z1255357387 [1,1,0,0,0,0|1,0,0]=3 817 B11R1.74 CC(=O)C1=CC(=CC(=C1)C)C Z608067730 [1,1,0,0,0,0|1,0,0]=3 818 B11R1.74 CC(=O)C1=CC(=CC(=C1)Cl)Cl Z1201618067 [1,1,0,0,0,0|2,0,0]=4 819 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)Br Z1269137682 [1,1,0,0,0,0|2,0,0]=4 820 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)Cl Z1201622911 [1,1,0,0,0,0|2,0,0]=4 821 B11R1.74 CC(=O)C1=CC(=CC(=C1)F)F Z838968642 [1,1,0,0,0,0|2,0,0]=4 822 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)F Z1255392410 [1,1,0,0,0,0|1,0,0]=3 823 B11R1.74 CC(=O)C1=CC(=CC(=C1)O)O Z1696862457 [1,1,0,0,0,0|1,0,0]=3 824 B11R1.74 CC1=CC(=CC(=C1)Br)C(=O)O Z1205656813 [1,1,0,0,0,0|1,0,0]=3 825 B11R1.74 CC1=CC(=CC(=C1)Br)C(C)N Z3083106287 [1,1,0,0,0,0|1,0,1]=4 826 B11R1.74 CC1=CC(=CC(=C1)C(=O)O)C Z104476972 [1,1,0,0,0,0|1,0,0]=3 827 B11R1.74 CC1=CC(=CC(=C1)C(C)N)C Z608067962 [1,1,0,0,0,0|1,0,1]=4 828 B11R1.74 CC1=CC(=CC(=C1)Cl)C(=O)O Z1198280234 [1,1,0,0,0,0|1,0,0]=3 829 B11R1.74 CC1=CC(=CC(=C1)F)C(=O)O Z1201622041 [1,1,0,0,0,0|1,0,0]=3 830 B11R1.74 CC1=CC(=CC(=C1)N)C(=O)N Z1255434530 [1,1,0,0,0,0|0,0,0]=2 831 B11R1.74 CC1=CC(=CC(=C1)N)C(=O)O Z1079174668 [1,1,0,0,0,0|1,0,0]=3 832 B11R1.74 CC1=CC(=CC(=C1)O)C(=O)O Z1198232670 [1,1,0,0,0,0|1,0,0]=3 833 B11R1.74 CC1=CC(=CC(=N1)C)C(=O)O Z3234892100 [1,1,0,0,0,0|2,0,0]=4 834 B11R1.74 CC1=CC(=CC(=O)N1)C(=O)O Z1198178343 [1,1,0,0,0,0|2,0,0]=4 835 B11R1.74 CC1=CC(=NC(=C1)Br)C(=O)O Z1269120539 [1,1,0,0,0,0|2,0,0]=4 836 B11R1.74 CC1=CC(=NC(=C1)C)C(=O)O Z2004548076 [1,1,0,0,0,0|2,0,0]=4 837 B11R1.74 CC1=CC(=NC(=C1)Cl)C(=O)O Z1198233196 [1,1,0,0,0,0|2,0,0]=4 838 B11R1.74 CC1=CC(=O)NC(=C1)C(=O)O Z2213893336 [1,1,0,0,0,0|2,0,0]=4 839 B11R1.74 CC1=NC(=CC(=C1)C(=O)Cl)Cl Z1203161819 [1,1,0,0,0,0|2,0,0]=4 840 B11R1.74 CC1=NC(=CC(=C1)C(=O)N)Cl Z1262627147 [1,1,0,0,0,0|1,0,0]=3 841 B11R1.74 CC1=NC(=CC(=C1)C(=O)O)Br Z1269142163 [1,1,0,0,0,0|2,0,0]=4 842 B11R1.74 CC1=NC(=CC(=C1)C(=O)O)Cl Z1203161820 [1,1,0,0,0,0|2,0,0]=4 843 B11R1.74 CC1=NC(=CC(=C1)Cl)C(=O)[O-] Z5864802442 [1,1,0,0,0,0|2,0,0]=4 844 B11R1.74 N=C(N)C1=CC(=CC(=C1)F)F Z3226566621 [1,1,0,0,0,0|2,0,0]=4 845 B11R1.74 NC(=O)C1=CC(=CC(=C1)F)Br Z406681428 [1,1,0,0,0,0|1,0,0]=3 846 B11R1.74 NC(=O)C1=CC(=CC(=C1)F)F Z33545379 [1,1,0,0,0,0|1,0,0]=3 847 B11R1.74 NC(=O)C1=CC(=CC(=C1)N)Cl Z1255460929 [1,1,0,0,0,0|1,0,0]=3 848 B11R1.74 NC(=O)C1=CC(=CC(=C1)O)Br Z1269113277 [1,1,0,0,0,0|0,0,0]=2 849 B11R1.74 NC1=CC(=CC(=C1)Br)C(=O)O Z57470132 [1,1,0,0,0,0|2,0,0]=4 850 B11R1.74 NC1=CC(=CC(=C1)C(=O)O)N Z104475660 [1,1,0,0,0,0|2,0,0]=4 851 B11R1.74 NC1=CC(=CC(=C1)Cl)C(=O)O Z1079174624 [1,1,0,0,0,0|2,0,0]=4 852 B11R1.74 NC1=CC(=CC(=C1)I)C(=O)O Z1079174574 [1,1,0,0,0,0|2,0,0]=4 853 B11R1.74 NC1=CC(=CC(=C1)O)C(=O)O Z1198170625 [1,1,0,0,0,0|1,0,0]=3 854 B11R1.74 O=C(O)C1=CC(=CC(=C1)Br)I Z1269214487 [1,1,0,0,0,0|2,0,0]=4 855 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)Br Z1269235666 [1,1,0,0,0,0|2,0,0]=4 856 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)Cl Z104476064 [1,1,0,0,0,0|2,0,0]=4 857 B11R1.74 O=C(O)C1=CC(=CC(=C1)Cl)I Z1269204711 [1,1,0,0,0,0|2,0,0]=4 858 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)Br Z406678876 [1,1,0,0,0,0|2,0,0]=4 859 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)Cl Z1203161797 [1,1,0,0,0,0|2,0,0]=4 860 B11R1.74 O=C(O)C1=CC(=CC(=C1)F)F Z104485974 [1,1,0,0,0,0|2,0,0]=4 861 B11R1.74 O=C(O)C1=CC(=CC(=C1)I)I Z277540160 [1,1,0,0,0,0|2,0,0]=4 862 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)Cl Z1198164258 [1,1,0,0,0,0|1,0,0]=3 863 B11R1.74 O=C(O)C1=CC(=CC(=C1)O)O Z1255485190 [1,1,0,0,0,0|1,0,0]=3 864 B11R1.74 O=C1C=C(C=C(N1)C(=O)O)O Z2028214371 [1,1,0,0,0,0|2,0,0]=4 865 B11R1.74 O=C1C=C(C=C(N1)O)C(=O)O Z56855768 [1,1,0,0,0,0|2,0,0]=4 866 B11R1.74 O=C1C=C(C=C(O1)C(=O)O)O Z1262546364 [1,1,0,0,0,0|2,0,0]=4 867 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)F Z1862003147 [1,1,0,0,0,0|2,0,0]=4 868 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)N Z45415578 [1,1,0,0,0,0|1,0,0]=3 869 B11R1.155 CC1=CC(=CC=C1)S(=O)(=O)O Z1222423483 [1,1,0,0,0,0|2,0,0]=4 870 B11R1.155 CC1=CC(=CN=C1)S(=O)(=O)N Z1255417183 [1,1,0,0,0,0|2,0,0]=4 871 B11R1.155 CC1=CC(=NC=C1)S(=O)(=O)N Z854066780 [1,1,0,0,0,0|2,0,0]=4 872 B11R1.155 CC1=NC(=CC=C1)S(=O)(=O)N Z854066740 [1,1,0,0,0,0|2,0,0]=4 873 B11R1.155 CS(=O)(=O)C1=CC(=CC=C1)O Z415743792 [1,1,0,0,0,0|2,0,0]=4 874 B11R1.155 NC1=CC(=CC=C1)S(=O)(=O)N Z56792385 [1,1,0,0,0,0|2,0,0]=4 875 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)Br Z45415621 [1,1,0,0,0,0|2,0,0]=4 876 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)Cl Z45415583 [1,1,0,0,0,0|2,0,0]=4 877 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)F Z45415568 [1,1,0,0,0,0|2,0,0]=4 878 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)I Z385450656 [1,1,0,0,0,0|2,0,0]=4 879 B11R1.155 NS(=O)(=O)C1=CC(=CC=C1)O Z1255464009 [1,1,0,0,0,0|1,0,0]=3 880 B11R1.155 O=S(=O)(F)C1=CC=CC(=C1)O Z1618008040 [1,1,0,0,0,0|2,0,0]=4 881 B11R1.159 CC(=O)C1=C(C(=CC=C1)C)C Z992749248 [1,1,0,0,0,0|1,0,0]=3 882 B11R1.159 CC(=O)C1=C(C(=CC=C1)Cl)Cl Z1020765790 [1,1,0,0,0,0|2,0,0]=4 883 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)F Z1255400699 [1,1,0,0,0,0|1,0,0]=3 884 B11R1.159 CC(=O)C1=C(C(=CC=C1)O)O Z1198162545 [1,1,0,0,0,0|1,0,0]=3 885 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)F Z1198233476 [1,1,0,0,0,0|0,0,0]=2 886 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)N Z135897518 [1,1,0,0,0,0|0,0,0]=2 887 B11R1.159 CC1=C(C(=CC=C1)C(=O)N)O Z68590334 [1,1,0,0,0,0|0,0,0]=2 888 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)Br Z1269235887 [1,1,0,0,0,0|1,0,0]=3 889 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)C Z56899190 [1,1,0,0,0,0|1,0,0]=3 890 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)Cl Z1201618851 [1,1,0,0,0,0|1,0,0]=3 891 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)F Z1201617985 [1,1,0,0,0,0|1,0,0]=3 892 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)I Z239685230 [1,1,0,0,0,0|1,0,0]=3 893 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)N Z94600359 [1,1,0,0,0,0|1,0,0]=3 894 B11R1.159 CC1=C(C(=CC=C1)C(=O)O)O Z56917421 [1,1,0,0,0,0|1,0,0]=3 895 B11R1.159 CC1=C(C(=CC=C1)[N+](=O)[O-])C Z104474110 [1,1,0,0,0,0|2,0,0]=4 896 B11R1.159 CC1=C(C(=CC=C1)[N+](=O)[O-])N Z104474176 [1,1,0,0,0,0|2,0,0]=4 897 B11R1.159 CC1=C(C(=CC=C1)[N+](=O)[O-])O Z415740554 [1,1,0,0,0,0|2,0,0]=4 898 B11R1.159 CC1=C(C(=CC=N1)C(=O)O)Cl Z5280750890 [1,1,0,0,0,0|2,0,0]=4 899 B11R1.159 CC1=C(C(=CC=N1)C(=O)O)N Z4359039250 [1,1,0,0,0,0|2,0,0]=4 900 B11R1.159 CC1=C(C(=CC=N1)C(=O)O)O Z3766096952 [1,1,0,0,0,0|2,0,0]=4 901 B11R1.159 CC1=C(C(=NC=C1)C(=O)O)Br Z1269191726 [1,1,0,0,0,0|2,0,0]=4 902 B11R1.159 CC1=C(C(=NC=C1)C(=O)O)F Z5647129108 [1,1,0,0,0,0|2,0,0]=4 903 B11R1.159 CC1=C(C(=NC=C1)C(=O)O)N Z1255440036 [1,1,0,0,0,0|2,0,0]=4 904 B11R1.159 CC1=C(C=CC=C1Br)C(=O)N Z1263881321 [1,1,0,0,0,0|1,0,0]=3 905 B11R1.159 CC1=C(C=CC=C1Br)C(=O)O Z1258930119 [1,1,0,0,0,0|2,0,0]=4 906 B11R1.159 CC1=C(C=CC=C1Cl)C(=O)O Z1255364850 [1,1,0,0,0,0|2,0,0]=4 907 B11R1.159 CC1=C(C=CC=C1F)C(=O)O Z1255399123 [1,1,0,0,0,0|2,0,0]=4 908 B11R1.159 CC1=C(C=CC=C1I)C(=O)O Z1049043374 [1,1,0,0,0,0|2,0,0]=4 909 B11R1.159 CC1=C(C=CC=C1N)C(=O)N Z239125324 [1,1,0,0,0,0|1,0,0]=3 910 B11R1.159 CC1=C(C=CC=C1N)C(=O)O Z234898187 [1,1,0,0,0,0|2,0,0]=4 911 B11R1.159 CC1=C(C=CC=C1O)C(=O)O Z1201620461 [1,1,0,0,0,0|1,0,0]=3 912 B11R1.159 CC1=C(C=CC=C1O)[N+](=O)[O-] Z415740538 [1,1,0,0,0,0|2,0,0]=4 913 B11R1.159 CC1=C(N=CC=C1O)C(=O)O Z5630144162 [1,1,0,0,0,0|2,0,0]=4 914 B11R1.159 CC1=CC=CC(=C1C)C(C)N Z992749600 [1,1,0,0,0,0|1,0,1]=4 915 B11R1.159 CC1=CC=CC(=C1N)S(=O)C Z1770193557 [1,1,0,0,0,0|2,0,0]=4 916 B11R1.159 CC1=CNC=C(C1=O)C(=O)O Z1582263000 [1,1,0,0,0,0|2,0,0]=4 917 B11R1.159 CN1C=CC=C(C1=O)C(=O)O Z852222336 [1,1,0,0,0,0|2,0,0]=4 918 B11R1.159 NC(=O)C1=C(C(=CC=C1)Br)F Z1269172585 [1,1,0,0,0,0|1,0,0]=3 919 B11R1.159 NC(=O)C1=C(C(=CC=C1)Cl)N Z1198170686 [1,1,0,0,0,0|1,0,0]=3 920 B11R1.159 NC(=O)C1=C(C(=CC=C1)Cl)O Z1255435741 [1,1,0,0,0,0|1,0,0]=3 921 B11R1.159 NC(=O)C1=C(C(=CC=C1)F)Cl Z1201622188 [1,1,0,0,0,0|1,0,0]=3 922 B11R1.159 NC(=O)C1=C(C(=CC=C1)F)F Z274460838 [1,1,0,0,0,0|1,0,0]=3 923 B11R1.159 NC(=O)C1=C(C(=CC=C1)F)I Z1269110382 [1,1,0,0,0,0|1,0,0]=3 924 B11R1.159 NC(=O)C1=C(C(=CC=C1)O)N Z1255418231 [1,1,0,0,0,0|0,0,0]=2 925 B11R1.159 NC(=O)C1=C(C(=NC=C1)Cl)Br Z2310130066 [1,1,0,0,0,0|2,0,0]=4 926 B11R1.159 NC1=C(C(=CC=C1)C(=O)O)Br Z1269145609 [1,1,0,0,0,0|2,0,0]=4 927 B11R1.159 NC1=C(C(=CC=C1)C(=O)O)F Z1198170687 [1,1,0,0,0,0|2,0,0]=4 928 B11R1.159 NC1=C(C(=CC=C1)C(=O)O)O Z1255423499 [1,1,0,0,0,0|2,0,0]=4 929 B11R1.159 NC1=C(C=CC=C1Br)C(=O)O Z362758726 [1,1,0,0,0,0|2,0,0]=4 930 B11R1.159 NC1=C(C=CC=C1Cl)C(=O)O Z164708876 [1,1,0,0,0,0|2,0,0]=4 931 B11R1.159 NC1=C(C=CC=C1F)C(=O)O Z362758748 [1,1,0,0,0,0|2,0,0]=4 932 B11R1.159 NC1=C(C=CC=C1I)C(=O)O Z362758740 [1,1,0,0,0,0|2,0,0]=4 933 B11R1.159 NC1=C(C=CC=C1O)C(=O)O Z1255485352 [1,1,0,0,0,0|1,0,0]=3 934 B11R1.159 NC1=C(C=CC=C1O)[N+](=O)[O-] Z406354582 [1,1,0,0,0,0|2,0,0]=4 935 B11R1.159 O=C(O)C1=C(C(=CC=C1)Br)Br Z1269195357 [1,1,0,0,0,0|2,0,0]=4 936 B11R1.159 O=C(O)C1=C(C(=CC=C1)Br)Cl Z1258974854 [1,1,0,0,0,0|2,0,0]=4 937 B11R1.159 O=C(O)C1=C(C(=CC=C1)Br)I Z1094749266 [1,1,0,0,0,0|2,0,0]=4 938 B11R1.159 O=C(O)C1=C(C(=CC=C1)Br)O Z367679360 [1,1,0,0,0,0|2,0,0]=4 939 B11R1.159 O=C(O)C1=C(C(=CC=C1)Cl)Cl Z56899108 [1,1,0,0,0,0|2,0,0]=4 940 B11R1.159 O=C(O)C1=C(C(=CC=C1)Cl)F Z1203161795 [1,1,0,0,0,0|2,0,0]=4 941 B11R1.159 O=C(O)C1=C(C(=CC=C1)Cl)O Z367679194 [1,1,0,0,0,0|2,0,0]=4 942 B11R1.159 O=C(O)C1=C(C(=CC=C1)F)Br Z1269235363 [1,1,0,0,0,0|2,0,0]=4 943 B11R1.159 O=C(O)C1=C(C(=CC=C1)F)Cl Z1201620734 [1,1,0,0,0,0|2,0,0]=4 944 B11R1.159 O=C(O)C1=C(C(=CC=C1)F)F Z959143646 [1,1,0,0,0,0|2,0,0]=4 945 B11R1.159 O=C(O)C1=C(C(=CC=C1)F)I Z1269119221 [1,1,0,0,0,0|2,0,0]=4 946 B11R1.159 O=C(O)C1=C(C(=CC=C1)I)F Z1269149504 [1,1,0,0,0,0|2,0,0]=4 947 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)Cl Z1198219365 [1,1,0,0,0,0|1,0,0]=3 948 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)F Z1201621446 [1,1,0,0,0,0|1,0,0]=3 949 B11R1.159 O=C(O)C1=C(C(=CC=C1)O)O Z367679198 [1,1,0,0,0,0|1,0,0]=3 950 B11R1.159 O=C(O)C1=C(C(=NC=C1)O)O Z1270381543 [1,1,0,0,0,0|2,0,0]=4 951 B11R1.159 O=C(O)C1=CC=CN(C1=O)O Z1255442590 [1,1,0,0,0,0|2,0,0]=4 952 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)F Z1269120232 [1,1,0,0,0,0|2,0,0]=4 953 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)O Z104500026 [1,1,0,0,0,0|2,0,0]=4 954 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)C Z104486864 [1,1,0,0,0,0|1,0,0]=3 955 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)F Z1020765768 [1,1,0,0,0,0|1,0,0]=3 956 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)O Z85923114 [1,1,0,0,0,0|1,0,0]=3 957 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)Cl Z56963405 [1,1,0,0,0,0|2,0,0]=4 958 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)N Z1198173283 [1,1,0,0,0,0|2,0,0]=4 959 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)O Z57101024 [1,1,0,0,0,0|2,0,0]=4 960 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)F Z57046229 [1,1,0,0,0,0|2,0,0]=4 961 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)N Z1198233574 [1,1,0,0,0,0|2,0,0]=4 962 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)O Z56858268 [1,1,0,0,0,0|2,0,0]=4 963 B11R1.167 CC(=O)C1=C(C=CC(=C1)I)Br Z1269211640 [1,1,0,0,0,0|2,0,0]=4 964 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)C Z1203581134 [1,1,0,0,0,0|2,0,0]=4 965 B11R1.167 CC(=O)C1=C(C=CC(=C1)N)F Z2037273341 [1,1,0,0,0,0|2,0,0]=4 966 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)F Z1198184516 [1,1,0,0,0,0|1,0,0]=3 967 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)N Z1255417279 [1,1,0,0,0,0|1,0,0]=3 968 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O Z56889030 [1,1,0,0,0,0|1,0,0]=3 969 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [1,1,0,0,0,0|1,0,1]=4 970 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)N Z1259107965 [1,1,0,0,0,0|1,0,0]=3 971 B11R1.167 CC1=C(C=C(C=C1)Br)C(=O)O Z1255526918 [1,1,0,0,0,0|2,0,0]=4 972 B11R1.167 CC1=C(C=C(C=C1)Cl)C(=O)O Z1203161815 [1,1,0,0,0,0|2,0,0]=4 973 B11R1.167 CC1=C(C=C(C=C1)F)C(=O)O Z203881854 [1,1,0,0,0,0|2,0,0]=4 974 B11R1.167 CC1=C(C=C(C=C1)I)C(=O)O Z1269149718 [1,1,0,0,0,0|2,0,0]=4 975 B11R1.167 CC1=C(C=C(C=C1)N)C(=O)N Z802642238 [1,1,0,0,0,0|1,0,0]=3 976 B11R1.167 CC1=C(C=C(C=C1)N)C(=O)O Z802851852 [1,1,0,0,0,0|2,0,0]=4 977 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)N Z1255405404 [1,1,0,0,0,0|0,0,0]=2 978 B11R1.167 CC1=C(C=C(C=C1)O)C(=O)O Z1255379858 [1,1,0,0,0,0|1,0,0]=3 979 B11R1.167 CC1=C(C=C(C=N1)F)C(=O)N Z4657504777 [1,1,0,0,0,0|2,0,0]=4 980 B11R1.167 CC1=CC(=C(C=C1)Br)C(=O)O Z1269210419 [1,1,0,0,0,0|1,0,0]=3 981 B11R1.167 CC1=CC(=C(C=C1)C)C(=O)O Z85921039 [1,1,0,0,0,0|1,0,0]=3 982 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N Z56347427 [1,1,0,0,0,0|1,0,1]=4 983 B11R1.167 CC1=CC(=C(C=C1)Cl)[N+](=O)[O-] Z393629992 [1,1,0,0,0,0|2,0,0]=4 984 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O Z732710380 [1,1,0,0,0,0|1,0,0]=3 985 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O Z979715400 [1,1,0,0,0,0|1,0,0]=3 986 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)N Z992346212 [1,1,0,0,0,0|0,0,0]=2 987 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)O Z111833788 [1,1,0,0,0,0|1,0,0]=3 988 B11R1.167 CC1=CC(=C(C=C1)N)[N+](=O)[O-] Z104475996 [1,1,0,0,0,0|2,0,0]=4 989 B11R1.167 CC1=CC(=C(C=C1)O)C(=O)O Z147642456 [1,1,0,0,0,0|1,0,0]=3 990 B11R1.167 CC1=CC(=C(C=C1)O)[N+](=O)[O-] Z85939128 [1,1,0,0,0,0|2,0,0]=4 991 B11R1.167 CC1=CC(=C(N=C1)Cl)C(=O)O Z1198173148 [1,1,0,0,0,0|2,0,0]=4 992 B11R1.167 CC1=CC(=C(N=C1)F)C(=O)O Z1255396165 [1,1,0,0,0,0|2,0,0]=4 993 B11R1.167 CC1=CC(=C(N=C1)N)C(=O)O Z1197890692 [1,1,0,0,0,0|2,0,0]=4 994 B11R1.167 CC1=CN=C(C=C1C(=O)O)C Z3182541714 [1,1,0,0,0,0|2,0,0]=4 995 B11R1.167 CC1=NC(=C(C=C1)Br)C(=O)O Z1269136490 [1,1,0,0,0,0|2,0,0]=4 996 B11R1.167 CC1=NC(=C(C=C1)C)C(=O)O Z3272981162 [1,1,0,0,0,0|2,0,0]=4 997 B11R1.167 CC1=NC(=C(C=C1)F)C(=O)O Z4646465276 [1,1,0,0,0,0|2,0,0]=4 998 B11R1.167 CC1=NC(=C(C=C1)O)C(=O)O Z1255363761 [1,1,0,0,0,0|2,0,0]=4 999 B11R1.167 CC1=NC=C(C(=C1)C(=O)O)Br Z1269171533 [1,1,0,0,0,0|2,0,0]=4 1000 B11R1.167 CN1C=CC(=O)C(=C1)C(=O)O Z1255493292 [1,1,0,0,0,0|2,0,0]=4 1001 B11R1.167 N=C(N)C1=C(C=CC(=C1)Cl)O Z1849013983 [1,1,0,0,0,0|2,0,0]=4 1002 B11R1.167 NC(=O)C1=C(C=CC(=C1)Br)N Z424995924 [1,1,0,0,0,0|1,0,0]=3 1003 B11R1.167 NC(=O)C1=C(C=CC(=C1)Br)O Z68590257 [1,1,0,0,0,0|1,0,0]=3 1004 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)F Z116821726 [1,1,0,0,0,0|1,0,0]=3 1005 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)N Z239125320 [1,1,0,0,0,0|1,0,0]=3 1006 B11R1.167 NC(=O)C1=C(C=CC(=C1)Cl)O Z57032581 [1,1,0,0,0,0|1,0,0]=3 1007 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)Br Z101186138 [1,1,0,0,0,0|1,0,0]=3 1008 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)N Z376434962 [1,1,0,0,0,0|1,0,0]=3 1009 B11R1.167 NC(=O)C1=C(C=CC(=C1)F)O Z1255466467 [1,1,0,0,0,0|1,0,0]=3 1010 B11R1.167 NC(=O)C1=C(C=CC(=C1)I)O Z68590383 [1,1,0,0,0,0|1,0,0]=3 1011 B11R1.167 NC(=O)C1=C(C=CC(=C1)N)Cl Z239125310 [1,1,0,0,0,0|1,0,0]=3 1012 B11R1.167 NC(=O)C1=C(C=CC(=C1)N)F Z316119778 [1,1,0,0,0,0|1,0,0]=3 1013 B11R1.167 NC(=O)C1=C(C=CC(=N1)Cl)Cl Z145120848 [1,1,0,0,0,0|2,0,0]=4 1014 B11R1.167 NC(=O)C1=C(C=NC(=C1)Cl)Cl Z1201627818 [1,1,0,0,0,0|2,0,0]=4 1015 B11R1.167 NC(=O)C1=C(N=CC(=C1)Br)N Z959893232 [1,1,0,0,0,0|2,0,0]=4 1016 B11R1.167 NC(=O)C1=CC(=CNC1=O)F Z2651648139 [1,1,0,0,0,0|2,0,0]=4 1017 B11R1.167 NC1=C(C=C(C=C1)Br)C(=O)O Z104484428 [1,1,0,0,0,0|2,0,0]=4 1018 B11R1.167 NC1=C(C=C(C=C1)Cl)C(=O)O Z104485568 [1,1,0,0,0,0|2,0,0]=4 1019 B11R1.167 NC1=C(C=C(C=C1)F)C(=O)O Z56946871 [1,1,0,0,0,0|2,0,0]=4 1020 B11R1.167 NC1=C(C=C(C=C1)I)C(=O)O Z56754067 [1,1,0,0,0,0|2,0,0]=4 1021 B11R1.167 NC1=C(C=C(C=C1)O)C(=O)O Z104474092 [1,1,0,0,0,0|1,0,0]=3 1022 B11R1.167 NC1=C(C=C(C=C1)O)[N+](=O)[O-] Z431554226 [1,1,0,0,0,0|2,0,0]=4 1023 B11R1.167 NC1=C(C=C(C=N1)O)C(=O)O Z2491075097 [1,1,0,0,0,0|2,0,0]=4 1024 B11R1.167 NC1=CC(=C(C=C1)Br)C(=O)O Z902266056 [1,1,0,0,0,0|2,0,0]=4 1025 B11R1.167 NC1=CC(=C(C=C1)Cl)C(=O)O Z214391864 [1,1,0,0,0,0|2,0,0]=4 1026 B11R1.167 NC1=CC(=C(C=C1)F)C(=O)O Z235362843 [1,1,0,0,0,0|2,0,0]=4 1027 B11R1.167 NC1=CC(=C(C=C1)O)C(=O)O Z57127471 [1,1,0,0,0,0|2,0,0]=4 1028 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)Cl Z104478416 [1,1,0,0,0,0|2,0,0]=4 1029 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)F Z104510340 [1,1,0,0,0,0|2,0,0]=4 1030 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)I Z56921138 [1,1,0,0,0,0|2,0,0]=4 1031 B11R1.167 O=C(O)C1=C(C=CC(=C1)Br)O Z104500554 [1,1,0,0,0,0|2,0,0]=4 1032 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)Br Z317098896 [1,1,0,0,0,0|2,0,0]=4 1033 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)Cl Z104475668 [1,1,0,0,0,0|2,0,0]=4 1034 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)F Z107365798 [1,1,0,0,0,0|2,0,0]=4 1035 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)I Z239685226 [1,1,0,0,0,0|2,0,0]=4 1036 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)O Z104500560 [1,1,0,0,0,0|2,0,0]=4 1037 B11R1.167 O=C(O)C1=C(C=CC(=C1)Cl)S Z838079260 [1,1,0,0,0,0|2,0,0]=4 1038 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)Br Z104510142 [1,1,0,0,0,0|2,0,0]=4 1039 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)Cl Z1201619425 [1,1,0,0,0,0|2,0,0]=4 1040 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)F Z89265799 [1,1,0,0,0,0|2,0,0]=4 1041 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)I Z317078348 [1,1,0,0,0,0|2,0,0]=4 1042 B11R1.167 O=C(O)C1=C(C=CC(=C1)F)O Z367679206 [1,1,0,0,0,0|2,0,0]=4 1043 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)Cl Z1269238996 [1,1,0,0,0,0|2,0,0]=4 1044 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)F Z1269165995 [1,1,0,0,0,0|2,0,0]=4 1045 B11R1.167 O=C(O)C1=C(C=CC(=C1)I)I Z1037337344 [1,1,0,0,0,0|2,0,0]=4 1046 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)Cl Z1201622697 [1,1,0,0,0,0|1,0,0]=3 1047 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)O Z275164274 [1,1,0,0,0,0|1,0,0]=3 1048 B11R1.167 O=C(O)C1=C(C=CC(=C1)S)F Z1255439840 [1,1,0,0,0,0|1,1,0]=4 1049 B11R1.9 CCC1=CC(=CC(=C1)F)C=O Z3243590901 [1,1,0,0,0,0|1,0,0]=3 1050 B11R1.9 COC1=CC(=CC(=C1)Br)C=O Z1269112446 [1,1,0,0,0,0|0,0,0]=2 1051 B11R1.9 COC1=CC(=CC(=C1)C)C#N Z1255420193 [1,1,0,0,0,0|0,0,2]=4 1052 B11R1.9 COC1=CC(=CC(=C1)C)C=O Z1198308161 [1,1,0,0,0,0|0,0,0]=2 1053 B11R1.9 COC1=CC(=CC(=C1)C)CN Z1255382555 [1,1,0,0,0,0|0,0,1]=3 1054 B11R1.9 COC1=CC(=CC(=C1)Cl)C=O Z1198176472 [1,1,0,0,0,0|0,0,0]=2 1055 B11R1.9 COC1=CC(=CC(=C1)Cl)CO Z1198176471 [1,1,0,0,0,0|0,0,2]=4 1056 B11R1.9 COC1=CC(=CC(=C1)F)C=O Z1255387605 [1,1,0,0,0,0|0,0,0]=2 1057 B11R1.9 COC1=CC(=CC(=C1)F)CO Z1255391474 [1,1,0,0,0,0|0,0,2]=4 1058 B11R1.9 COC1=CC(=CC(=C1)O)C#N Z1198330385 [1,1,0,0,0,0|0,0,2]=4 1059 B11R1.9 COC1=CC(=CC(=C1)O)C=O Z1255401668 [1,1,0,0,0,0|0,0,0]=2 1060 B11R1.9 COC1=CC(=CC(=C1)OC)N Z104477210 [1,1,0,0,0,0|2,0,0]=4 1061 B11R1.9 COC1=CC(=CC(=C1)OC)O Z56347218 [1,1,0,0,0,0|2,0,0]=4 1062 B11R1.9 COC1=CC(=NC(=C1)C)C=O Z1255363827 [1,1,0,0,0,0|1,0,0]=3 1063 B11R1.9 COC1=CC(=O)OC(=C1)C=O Z1511747356 [1,1,0,0,0,0|1,0,0]=3 1064 B11R1.9 COC1=NC(=CC(=C1)C=O)C Z1255500328 [1,1,0,0,0,0|1,0,0]=3 1065 B11R1.9 COC1=NC(=CC(=C1)C=O)Cl Z1198168744 [1,1,0,0,0,0|1,0,0]=3 1066 B11R1.9 N#CC1=CC(=CC(=C1)Cl)C=O Z1255505616 [1,1,0,0,0,0|2,0,0]=4 1067 B11R1.9 N#CC1=CC(=CC(=C1)F)C=O Z1198165377 [1,1,0,0,0,0|2,0,0]=4 1068 B11R1.9 O=CC1=CC(=CC(=C1)CO)I Z2511818781 [1,1,0,0,0,0|2,0,0]=4 1069 B11R1.189 C=CCC1=CC(=CC=C1)C=O Z1255375343 [1,1,0,0,0,0|1,0,1]=4 1070 B11R1.189 CCC1=CC(=CC=C1)CNC Z6010478687 [1,1,0,0,0,0|1,0,1]=4 1071 B11R1.189 CCCC1=CC(=CC=C1)C=O Z1216844686 [1,1,0,0,0,0|1,0,0]=3 1072 B11R1.189 CCNC1=CC(=CC=C1)OC Z286367386 [1,1,0,0,0,0|1,0,1]=4 1073 B11R1.189 CCOC1=CC(=CC=C1)C#N Z54464104 [1,1,0,0,0,0|0,0,2]=4 1074 B11R1.189 CCOC1=CC(=CC=C1)C=O Z53836051 [1,1,0,0,0,0|0,0,0]=2 1075 B11R1.189 CCOC1=CC(=CC=C1)CN Z239604652 [1,1,0,0,0,0|0,0,1]=3 1076 B11R1.189 CCOC1=CC(=CN=C1)C=O Z1255363707 [1,1,0,0,0,0|1,0,0]=3 1077 B11R1.189 CCOC1=NC(=CC=C1)C=O Z1198307154 [1,1,0,0,0,0|1,0,0]=3 1078 B11R1.189 CCOC1=NC(=CC=C1)CN Z4625400793 [1,1,0,0,0,0|1,0,1]=4 1079 B11R1.189 CCOC1=NC=CC(=C1)C=O Z1255393446 [1,1,0,0,0,0|1,0,0]=3 1080 B11R1.189 CCOC1=NC=CC(=C1)CN Z240084028 [1,1,0,0,0,0|1,0,1]=4 1081 B11R1.189 CCOC1=NC=NC(=C1)C=O Z3242916814 [1,1,0,0,0,0|2,0,0]=4 1082 B11R1.189 CCSC1=CC(=CC=C1)C=O Z1274324472 [1,1,0,0,0,0|0,1,0]=3 1083 B11R1.189 CNCC1=CC(=CC=C1)OC Z56939284 [1,1,0,0,0,0|0,0,1]=3 1084 B11R1.189 CNCC1=CC(=CN=C1)OC Z1255362175 [1,1,0,0,0,0|1,0,1]=4 1085 B11R1.189 CNCC1=CC(=NC=C1)OC Z5851214102 [1,1,0,0,0,0|1,0,1]=4 1086 B11R1.189 CNCC1=NC(=CC=C1)OC Z4595018713 [1,1,0,0,0,0|1,0,1]=4 1087 B11R1.189 COC1=CC(=CC=C1)CC#N Z285184582 [1,1,0,0,0,0|0,0,2]=4 1088 B11R1.189 COC1=CC(=CC=C1)CCN Z285143778 [1,1,0,0,0,0|0,0,1]=3 1089 B11R1.189 COC1=CC(=CC=C1)N=C=S Z56899053 [1,1,0,0,0,0|0,1,1]=4 1090 B11R1.189 COC1=NC(=CC=C1)CCN Z1139189688 [1,1,0,0,0,0|1,0,1]=4 1091 B11R1.189 COC1=NC=CC(=C1)CCN Z2298160753 [1,1,0,0,0,0|1,0,1]=4 1092 B11R1.189 COCC1=CC(=CC=C1)C#N Z295205410 [1,1,0,0,0,0|0,0,2]=4 1093 B11R1.189 COCC1=CC(=CC=C1)C=O Z1262327697 [1,1,0,0,0,0|0,0,0]=2 1094 B11R1.189 COCC1=CC(=CC=C1)CN Z240084738 [1,1,0,0,0,0|0,0,1]=3 1095 B11R1.189 COCC1=CC(=CC=C1)CO Z1266889515 [1,1,0,0,0,0|0,0,2]=4 1096 B11R1.189 CSC1=CC(=CC=C1)CCN Z4873760169 [1,1,0,0,0,0|0,1,1]=4 1097 B11R1.189 CSCC1=CC(=CC=C1)CN Z732208422 [1,1,0,0,0,0|0,1,1]=4 1098 B11R1.189 O=CC1=CC=CC(=C1)OCF Z1511895109 [1,1,0,0,0,0|0,0,0]=2 1099 B11R1.189 [N-]=[N+]=NC1=CC(=CC=C1)C=O Z1508543543 [1,1,0,0,0,0|2,0,0]=4 1100 B11R1.267 C#CC1=C(C(=CC=C1)C=O)F Z2238688674 [1,1,0,0,0,0|1,0,1]=4 1101 B11R1.267 CCC1=C(C(=CC=C1)C=O)F Z2044808788 [1,1,0,0,0,0|1,0,0]=3 1102 B11R1.267 CCC1=C(C(=CC=C1)C=O)O Z1255399776 [1,1,0,0,0,0|1,0,0]=3 1103 B11R1.267 CNC1=C(C(=CC=C1)OC)Br Z3864796658 [1,1,0,0,0,0|2,0,0]=4 1104 B11R1.267 CNC1=C(C(=CC=C1)OC)N Z1255401544 [1,1,0,0,0,0|2,0,0]=4 1105 B11R1.267 COC1=C(C(=CC=C1)C#N)N Z1198221994 [1,1,0,0,0,0|0,0,2]=4 1106 B11R1.267 COC1=C(C(=CC=C1)C=O)Br Z1269149587 [1,1,0,0,0,0|0,0,0]=2 1107 B11R1.267 COC1=C(C(=CC=C1)C=O)C Z1198307350 [1,1,0,0,0,0|0,0,0]=2 1108 B11R1.267 COC1=C(C(=CC=C1)C=O)Cl Z1255387516 [1,1,0,0,0,0|0,0,0]=2 1109 B11R1.267 COC1=C(C(=CC=C1)C=O)F Z1255373110 [1,1,0,0,0,0|0,0,0]=2 1110 B11R1.267 COC1=C(C(=CC=C1)C=O)O Z57921503 [1,1,0,0,0,0|0,0,0]=2 1111 B11R1.267 COC1=C(C(=CC=C1)CN)Cl Z3244608696 [1,1,0,0,0,0|0,0,1]=3 1112 B11R1.267 COC1=C(C(=CC=C1)CN)O Z1263529631 [1,1,0,0,0,0|0,0,1]=3 1113 B11R1.267 COC1=C(C(=CC=C1)CO)C Z1255443548 [1,1,0,0,0,0|0,0,2]=4 1114 B11R1.267 COC1=C(C(=CC=C1)SC)N Z1262669516 [1,1,0,0,0,0|2,0,0]=4 1115 B11R1.267 COC1=C(C(=CC=N1)C=O)Br Z1269173940 [1,1,0,0,0,0|1,0,0]=3 1116 B11R1.267 COC1=C(C(=CC=N1)C=O)F Z1255440944 [1,1,0,0,0,0|1,0,0]=3 1117 B11R1.267 COC1=C(C(=CN=C1)C=O)C Z1255398418 [1,1,0,0,0,0|1,0,0]=3 1118 B11R1.267 COC1=C(C(=NC=C1)C=O)C Z1198173028 [1,1,0,0,0,0|1,0,0]=3 1119 B11R1.267 COC1=CC=CC(=C1Br)OC Z1269143259 [1,1,0,0,0,0|2,0,0]=4 1120 B11R1.267 COC1=CC=CC(=C1I)OC Z1269162770 [1,1,0,0,0,0|2,0,0]=4 1121 B11R1.267 COC1=CC=CC(=C1O)OC Z104477654 [1,1,0,0,0,0|2,0,0]=4 1122 B11R1.267 COC1=CC=CC(=C1S)OC Z1198177412 [1,1,0,0,0,0|2,0,0]=4 1123 B11R1.267 N#CC1=C(C(=CC=C1)C=O)Br Z1269141014 [1,1,0,0,0,0|2,0,0]=4 1124 B11R1.267 N#CC1=C(C(=CC=C1)C=O)O Z1255460193 [1,1,0,0,0,0|2,0,0]=4 1125 B11R1.280 C#CC1=C(C=CC(=C1)OC)Cl Z1080386020 [1,1,0,0,0,0|1,0,1]=4 1126 B11R1.280 C#CC1=CC(=C(C=C1)Cl)OC Z1341622595 [1,1,0,0,0,0|1,0,1]=4 1127 B11R1.280 C#CC1=CC(=C(C=C1)F)C=O Z1681377714 [1,1,0,0,0,0|1,0,1]=4 1128 B11R1.280 CC1=C(C=C(C=C1)C=O)C#N Z1201626331 [1,1,0,0,0,0|2,0,0]=4 1129 B11R1.280 CCC1=C(C=CC(=C1)C=O)F Z1255357885 [1,1,0,0,0,0|1,0,0]=3 1130 B11R1.280 CCC1=C(C=CC(=C1)OC)Br Z1269109771 [1,1,0,0,0,0|1,0,1]=4 1131 B11R1.280 CCC1=CC(=C(C=C1)Br)C=O Z2511826756 [1,1,0,0,0,0|1,0,0]=3 1132 B11R1.280 CCC1=CC(=C(C=C1)F)C=O Z1251415032 [1,1,0,0,0,0|1,0,0]=3 1133 B11R1.280 CCC1=CC(=C(C=C1)O)C=O Z979493236 [1,1,0,0,0,0|1,0,0]=3 1134 B11R1.280 CCC1=CC(=C(C=C1)O)OC Z57234301 [1,1,0,0,0,0|1,0,1]=4 1135 B11R1.280 CNC1=C(C=CC(=C1)OC)Br Z5989973729 [1,1,0,0,0,0|2,0,0]=4 1136 B11R1.280 CNC1=CC(=C(C=C1)C)OC Z5981152945 [1,1,0,0,0,0|2,0,0]=4 1137 B11R1.280 COC1=C(C=CC(=C1)C#N)C Z1079179078 [1,1,0,0,0,0|0,0,2]=4 1138 B11R1.280 COC1=C(C=CC(=C1)C#N)I Z1269177439 [1,1,0,0,0,0|0,0,2]=4 1139 B11R1.280 COC1=C(C=CC(=C1)C#N)N Z1201627144 [1,1,0,0,0,0|0,0,2]=4 1140 B11R1.280 COC1=C(C=CC(=C1)C#N)O Z56963393 [1,1,0,0,0,0|0,0,2]=4 1141 B11R1.280 COC1=C(C=CC(=C1)C=O)C Z1079442616 [1,1,0,0,0,0|0,0,0]=2 1142 B11R1.280 COC1=C(C=CC(=C1)C=O)Cl Z1198175109 [1,1,0,0,0,0|0,0,0]=2 1143 B11R1.280 COC1=C(C=CC(=C1)C=O)F Z1203161973 [1,1,0,0,0,0|0,0,0]=2 1144 B11R1.280 COC1=C(C=CC(=C1)C=O)O Z57772449 [1,1,0,0,0,0|0,0,0]=2 1145 B11R1.280 COC1=C(C=CC(=C1)C=O)S Z835750876 [1,1,0,0,0,0|0,0,0]=2 1146 B11R1.280 COC1=C(C=CC(=C1)CN)C Z812517018 [1,1,0,0,0,0|0,0,1]=3 1147 B11R1.280 COC1=C(C=CC(=C1)CN)F Z3235016255 [1,1,0,0,0,0|0,0,1]=3 1148 B11R1.280 COC1=C(C=CC(=C1)CN)N Z3223855819 [1,1,0,0,0,0|0,0,1]=3 1149 B11R1.280 COC1=C(C=CC(=C1)CN)O Z381785798 [1,1,0,0,0,0|0,0,1]=3 1150 B11R1.280 COC1=C(C=CC(=C1)CO)C Z397587200 [1,1,0,0,0,0|0,0,2]=4 1151 B11R1.280 COC1=C(C=CC(=C1)CO)Cl Z1255366940 [1,1,0,0,0,0|0,0,2]=4 1152 B11R1.280 COC1=C(C=CC(=C1)CO)F Z1201620066 [1,1,0,0,0,0|0,0,2]=4 1153 B11R1.280 COC1=C(C=CC(=C1)CO)O Z56347244 [1,1,0,0,0,0|0,0,2]=4 1154 B11R1.280 COC1=C(C=CC(=C1)SC)N Z1147225829 [1,1,0,0,0,0|2,0,0]=4 1155 B11R1.280 COC1=C(C=CC(=N1)C=O)C Z1198311272 [1,1,0,0,0,0|1,0,0]=3 1156 B11R1.280 COC1=C(C=NC(=C1)C=O)C Z1255441804 [1,1,0,0,0,0|1,0,0]=3 1157 B11R1.280 COC1=C(N=CC(=C1)C=O)C Z1255504574 [1,1,0,0,0,0|1,0,0]=3 1158 B11R1.280 COC1=CC(=C(C=C1)Br)C#N Z963455460 [1,1,0,0,0,0|0,0,2]=4 1159 B11R1.280 COC1=CC(=C(C=C1)Br)C=O Z1079442692 [1,1,0,0,0,0|0,0,0]=2 1160 B11R1.280 COC1=CC(=C(C=C1)Br)CN Z451350504 [1,1,0,0,0,0|0,0,1]=3 1161 B11R1.280 COC1=CC(=C(C=C1)Br)OC Z299596224 [1,1,0,0,0,0|2,0,0]=4 1162 B11R1.280 COC1=CC(=C(C=C1)C)C=O Z1201626604 [1,1,0,0,0,0|0,0,0]=2 1163 B11R1.280 COC1=CC(=C(C=C1)Cl)C=O Z1201625883 [1,1,0,0,0,0|0,0,0]=2 1164 B11R1.280 COC1=CC(=C(C=C1)Cl)CN Z4754676571 [1,1,0,0,0,0|0,0,1]=3 1165 B11R1.280 COC1=CC(=C(C=C1)Cl)CO Z1255492919 [1,1,0,0,0,0|0,0,2]=4 1166 B11R1.280 COC1=CC(=C(C=C1)F)C=O Z1203161971 [1,1,0,0,0,0|0,0,0]=2 1167 B11R1.280 COC1=CC(=C(C=C1)F)CN Z2526366648 [1,1,0,0,0,0|0,0,1]=3 1168 B11R1.280 COC1=CC(=C(C=C1)I)C=O Z1269167723 [1,1,0,0,0,0|0,0,0]=2 1169 B11R1.280 COC1=CC(=C(C=C1)N)OC Z104478344 [1,1,0,0,0,0|2,0,0]=4 1170 B11R1.280 COC1=CC(=C(C=C1)O)C=O Z56899054 [1,1,0,0,0,0|0,0,0]=2 1171 B11R1.280 COC1=CC(=C(C=C1)O)CN Z1268152343 [1,1,0,0,0,0|0,0,1]=3 1172 B11R1.280 COC1=CC(=C(N=C1)F)C=O Z1255500297 [1,1,0,0,0,0|1,0,0]=3 1173 B11R1.280 COC1=NC(=C(C=C1)C)C=O Z1198311271 [1,1,0,0,0,0|1,0,0]=3 1174 B11R1.280 COC1=NC(=C(C=C1)C)CN Z4607149761 [1,1,0,0,0,0|1,0,1]=4 1175 B11R1.280 COC1=NC(=C(C=C1)F)C=O Z1255448445 [1,1,0,0,0,0|1,0,0]=3 1176 B11R1.280 COC1=NC=C(C(=C1)C=O)Br Z1269208118 [1,1,0,0,0,0|1,0,0]=3 1177 B11R1.280 COC1=NC=C(C(=C1)C=O)Cl Z1255416593 [1,1,0,0,0,0|1,0,0]=3 1178 B11R1.280 COC1=NC=C(C(=C1)C=O)F Z1198177117 [1,1,0,0,0,0|1,0,0]=3 1179 B11R1.280 CSC1=C(C=CC(=C1)C=O)O Z1255433772 [1,1,0,0,0,0|0,1,0]=3 1180 B11R1.280 CSC1=CC(=C(C=C1)Br)C=O Z2511826750 [1,1,0,0,0,0|0,1,0]=3 1181 B11R1.280 N#CC1=C(C=CC(=C1)C=O)Cl Z1255359596 [1,1,0,0,0,0|2,0,0]=4 1182 B11R1.280 N#CC1=C(C=CC(=C1)C=O)F Z1255488904 [1,1,0,0,0,0|2,0,0]=4 1183 B11R1.280 N#CC1=CC(=C(C=C1)Br)C=O Z1269115109 [1,1,0,0,0,0|2,0,0]=4 1184 B11R1.280 O=CC1=C(C=CC(=C1)CCl)O Z55993011 [1,1,0,0,0,0|2,0,0]=4 1185 B11R1.280 O=CC1=C(C=CC(=C1)CO)O Z1198153315 [1,1,0,0,0,0|2,0,0]=4 1186 B11R1.280 O=CC1=CC(=C(C=C1)O)CO Z1198723368 [1,1,0,0,0,0|2,0,0]=4 1187 B11R1.44 CCC1=CC=C(O1)C(=O)NN Z367823626 [0,1,0,0,1,0|2,0,0]=4 1188 B11R1.44 CCC1=CC=C(S1)C(=O)NC Z183857056 [0,1,0,0,1,0|2,0,0]=4 1189 B11R1.45 COC1=CC=C(S1)S(=O)(=O)N Z1216838718 [0,1,0,0,1,0|2,0,0]=4 1190 B11R1.48 CCC1=C(C=C(S1)C(=O)N)C Z84563384 [0,1,0,0,1,0|2,0,0]=4 1191 B11R1.48 CCC1=C(SC(=C1)C(=O)N)C Z33545911 [0,1,0,0,1,0|2,0,0]=4 1192 B11R1.48 COC1=C(SC(=C1)C(=O)O)Br Z1518607679 [0,1,0,0,1,0|2,0,0]=4 1193 B11R1.48 COC1=C(SC(=C1)C(=O)O)Cl Z1262545034 [0,1,0,0,1,0|2,0,0]=4 1194 B11R1.124 CCOC1=CC=C(O1)C(=O)C Z2895178482 [0,1,0,0,1,0|2,0,0]=4 1195 B11R1.124 COCC1=CC(=CS1)C(=O)O Z1262519516 [0,1,0,0,1,0|2,0,0]=4 1196 B11R1.124 COCC1=CC(=NO1)C(=O)N Z1270393711 [0,1,0,0,1,0|2,0,0]=4 1197 B11R1.124 COCC1=CC=C(S1)C(=O)O Z1134175323 [0,1,0,0,1,0|2,0,0]=4 1198 B11R1.49 COC1=C(SC(=C1)C)C(=O)O Z1192359567 [0,1,0,0,1,0|2,0,0]=4 1199 B11R1.58 COC1=C(C=CS1)S(=O)(=O)N Z3074480415 [0,1,0,0,1,0|2,0,0]=4 1200 B11R1.58 COC1=C(SC=C1)S(=O)(=O)N Z1373575127 [0,1,0,0,1,0|2,0,0]=4 1201 B11R1.64 COC1=C(SC=C1C(=O)O)C Z1262557644 [0,1,0,0,1,0|2,0,0]=4 1202 B11R1.64 COC1=C(SC=C1C(=O)O)Cl Z1201618693 [0,1,0,0,1,0|2,0,0]=4 1203 B11R1.64 COC1=C(SC=C1C)C(=O)O Z1198181420 [0,1,0,0,1,0|2,0,0]=4 1204 B11R1.193 CCOC1=C(C=CS1)C(=O)O Z1262555526 [0,1,0,0,1,0|2,0,0]=4 1205 B11R1.193 CCOC1=C(SC=C1)C(=O)O Z1124714289 [0,1,0,0,1,0|2,0,0]=4 1206 B11R1.193 COCC1=C(OC=C1)C(=O)O Z382719530 [0,1,0,0,1,0|2,0,0]=4 1207 B11R1.193 COCC1=C(SC=C1)C(=O)O Z1143239739 [0,1,0,0,1,0|2,0,0]=4 1208 B13R1.52 CCC1=C(C=CC(=C1)NC(=O)C)C Z1216820081 [0,1,0,0,0,1|2,0,0]=4 1209 B13R1.52 COC1=C(C=CC(=C1)CC(=O)N)C Z194976376 [0,1,0,0,0,1|0,0,0]=2 1210 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Br Z1269221903 [0,1,0,0,0,1|1,0,0]=3 1211 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)C Z168876634 [0,1,0,0,0,1|1,0,0]=3 1212 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl Z1269148038 [0,1,0,0,0,1|1,0,0]=3 1213 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)N Z4184587402 [0,1,0,0,0,1|1,0,0]=3 1214 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)O Z1203162033 [0,1,0,0,0,1|1,0,0]=3 1215 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [0,1,0,0,0,1|1,0,1]=4 1216 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)N Z278204678 [0,1,0,0,0,1|1,0,0]=3 1217 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)Br Z1321379839 [0,1,0,0,0,1|0,0,0]=2 1218 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)F Z1763025566 [0,1,0,0,0,1|0,0,0]=2 1219 B13R1.52 N#CC1=C(C=CC(=C1)NC(=O)N)F Z975770678 [0,1,0,0,0,1|2,0,0]=4 1220 B13R1.56 COC1=CC(=CC(=C1)Br)CC(=O)O Z1269126011 [0,1,0,0,0,1|1,0,0]=3 1221 B13R1.56 COC1=CC(=CC(=C1)F)CC(C)N Z2240804320 [0,1,0,0,0,1|1,0,1]=4 1222 B13R1.80 COC1=CC(=CC=C1)CS(=O)(=O)N Z954606354 [0,1,0,0,0,1|1,0,0]=3 1223 B13R1.81 C#CC1=CC=CC(=C1)NC(=O)CN Z594413892 [0,1,0,0,0,1|1,0,1]=4 1224 B13R1.81 C=CC(=O)NC1=CC(=NC=C1)OC Z2040470716 [0,1,0,0,0,1|2,0,0]=4 1225 B13R1.81 C=CC(=O)NC1=CC=CC(=C1)OC Z440633646 [0,1,0,0,0,1|1,0,0]=3 1226 B13R1.81 CCC(=O)NC1=CC(=CC=C1)SC Z28149503 [0,1,0,0,0,1|1,1,0]=4 1227 B13R1.81 CCC1=CC(=CC=C1)NC(=O)CCl Z56822823 [0,1,0,0,0,1|2,0,0]=4 1228 B13R1.81 CCC1=CC(=CC=C1)NC(=O)CN Z234895473 [0,1,0,0,0,1|1,0,0]=3 1229 B13R1.81 CNC(=O)CC1=CC(=CC=C1)OC Z32016972 [0,1,0,0,0,1|0,0,0]=2 1230 B13R1.81 CNC(=O)NC1=CC(=CC=C1)OC Z177089804 [0,1,0,0,0,1|0,0,0]=2 1231 B13R1.81 CNC(=S)NC1=CC(=CC=C1)SC Z45798966 [0,1,0,0,0,1|0,2,0]=4 1232 B13R1.81 COC1=CC(=CC=C1)CC(=O)CCl Z1255424725 [0,1,0,0,0,1|1,0,0]=3 1233 B13R1.81 COC1=CC(=CC=C1)NC(=O)CCl Z56896296 [0,1,0,0,0,1|1,0,0]=3 1234 B13R1.81 COC1=CC(=CC=C1)NC(=O)CN Z1449747347 [0,1,0,0,0,1|0,0,0]=2 1235 B13R1.81 COC1=CC(=CC=C1)NC(=S)NN Z56828900 [0,1,0,0,0,1|0,1,0]=3 1236 B13R1.81 COC1=CC(=CC=C1)OC(C)CN Z844631912 [0,1,0,0,0,1|1,0,1]=4 1237 B13R1.81 COC1=NC(=CC=C1)NC(=O)CCl Z1813146137 [0,1,0,0,0,1|2,0,0]=4 1238 B13R1.81 CSC1=CC(=CC=C1)NC(=O)CCl Z56899194 [0,1,0,0,0,1|1,1,0]=4 1239 B13R1.81 N#CC1=CC=CC(=C1)NC(=O)CN Z3244658583 [0,1,0,0,0,1|2,0,0]=4 1240 B13R1.97 COC1=CC(=C(C=C1)Br)CC(=O)O Z1259136095 [0,1,0,0,0,1|1,0,0]=3 1241 B13R1.97 COC1=CC(=C(C=C1)Cl)CC(=O)O Z1269186781 [0,1,0,0,0,1|1,0,0]=3 1242 B13R1.97 COC1=CC(=C(C=C1)F)CC(=O)O Z1255436471 [0,1,0,0,0,1|1,0,0]=3 1243 B13R1.97 COC1=CC(=C(C=C1)O)CC(C)N Z4167757598 [0,1,0,0,0,1|1,0,1]=4 1244 B13R1.373 CCOC1=CC(=CC=C1)CC(=O)O Z816000396 [0,1,0,0,0,1|1,0,0]=3 1245 B13R1.373 CCOC1=NC(=CC=C1)CC(=O)O Z2866617448 [0,1,0,0,0,1|2,0,0]=4 1246 B13R1.373 COCC1=CC(=CC=C1)CC(=O)O Z1262528442 [0,1,0,0,0,1|1,0,0]=3 1247 B13R1.373 NCCC1=CC(=CC=C1)CC(=O)O Z4749814700 [0,1,0,0,0,1|2,0,0]=4 1248 B13R1.587 CC(=O)NC1=CC(=CC=C1)C(=O)C Z30816194 [0,1,0,0,0,1|2,0,0]=4 1249 B13R1.587 CC(=O)NC1=CC=CC(=C1)C(C)C Z28798875 [0,1,0,0,0,1|2,0,0]=4 1250 B13R1.587 CC(=O)NC1=CC=CC(=C1)C(C)N Z278079466 [0,1,0,0,0,1|2,0,0]=4 1251 B13R1.587 CC(=O)NC1=CC=CC(=C1)C(C)O Z228586172 [0,1,0,0,0,1|2,0,0]=4 1252 B13R1.587 CC(=O)NC1=CC=CC(=C1)N(C)C Z27714897 [0,1,0,0,0,1|2,0,0]=4 1253 B13R1.587 CC(=O)NC1=CC=CC(=C1)[C@H](C)O Z1127664341 [0,1,0,0,0,1|2,0,0]=4 1254 B13R1.587 CC(C)C1=CC(=CC=C1)NC(=S)N Z271134324 [0,1,0,0,0,1|1,1,0]=4 1255 B13R1.587 NC(=O)NC1=CC(=CC=C1)B(O)O Z1262639454 [0,1,0,0,0,1|2,0,0]=4 1256 B13R1.587 NC(=O)NC1=CC(=CC=C1)C(=O)N Z101185716 [0,1,0,0,0,1|2,0,0]=4 1257 B13R1.587 NC(=O)NC1=CC(=CC=C1)C(=O)O Z90122506 [0,1,0,0,0,1|2,0,0]=4 1258 B13R1.587 NC(=O)NC1=CC(=CC=C1)[N+](=O)[O-] Z166687114 [0,1,0,0,0,1|2,0,0]=4 1259 B13R1.641 COC1=C(C(=CC=C1)CC(=O)O)Cl Z1269111432 [0,1,0,0,0,1|1,0,0]=3 1260 B13R1.641 COC1=C(C(=CC=C1)CC(=O)O)F Z1255379726 [0,1,0,0,0,1|1,0,0]=3 1261 B13R1.642 COC1=CC(=CC=C1)C(C)C(=O)O Z784767752 [0,1,0,0,0,1|1,0,0]=3 1262 B13R1.642 COC1=CC(=CC=C1)C(N)C(=O)O Z317024678 [0,1,0,0,0,1|1,0,0]=3 1263 B13R1.31 CCOC1=CC(=CC(=C1)F)C(=O)C Z1255394032 [0,2,0,0,0,0|1,0,0]=3 1264 B13R1.31 CCOC1=CC(=CC(=C1)F)C(=O)O Z1255418913 [0,2,0,0,0,0|1,0,0]=3 1265 B13R1.31 CCOC1=CC(=O)OC(=C1)C(=O)O Z1262521102 [0,2,0,0,0,0|2,0,0]=4 1266 B13R1.31 COCC1=CC(=CC(=C1)Br)C(=O)O Z3239220204 [0,2,0,0,0,0|1,0,0]=3 1267 B13R1.57 COC1=CC(=CC(=C1)Cl)C(C)(C)N Z4763968111 [0,2,0,0,0,0|1,0,1]=4 1268 B13R1.57 COC1=CC(=CC(=C1)N)S(=O)(=O)C Z1430581630 [0,2,0,0,0,0|2,0,0]=4 1269 B13R1.126 CC(C)C1=CC(=CC(=C1)Br)C(=O)O Z1278925765 [0,2,0,0,0,0|2,0,0]=4 1270 B13R1.126 CC(C)C1=CC(=CC(=C1)F)C(=O)O Z1262558338 [0,2,0,0,0,0|2,0,0]=4 1271 B13R1.126 CC1=CC(=CC(=C1)C(=O)N)C(=O)O Z1509757748 [0,2,0,0,0,0|2,0,0]=4 1272 B13R1.126 CN(C)C1=CC(=CC(=C1)Br)C(=O)O Z1462204087 [0,2,0,0,0,0|2,0,0]=4 1273 B13R1.126 NC(=O)C1=CC(=CC(=C1)C(=O)N)N Z56922062 [0,2,0,0,0,0|2,0,0]=4 1274 B13R1.126 NC(=O)C1=CC(=CC(=C1)F)C(=O)O Z1862022840 [0,2,0,0,0,0|2,0,0]=4 1275 B13R1.126 NC(=O)C1=CC(=CC(=C1)N)C(=O)O Z1079174558 [0,2,0,0,0,0|2,0,0]=4 1276 B13R1.298 COC1=C(C(=CC(=C1)C(=O)O)Cl)O Z104442658 [0,2,0,0,0,0|1,0,0]=3 1277 B13R1.298 COC1=C(C(=CC(=C1)C(=O)O)F)F Z1198165262 [0,2,0,0,0,0|1,0,0]=3 1278 B13R1.298 COC1=C(C(=CC(=C1)C(=O)O)N)Cl Z3001657507 [0,2,0,0,0,0|1,0,0]=3 1279 B13R1.298 COC1=C(C(=CC(=C1)C(=O)O)N)N Z3018407415 [0,2,0,0,0,0|1,0,0]=3 1280 B13R1.298 COC1=C(C(=CC(=C1)C(=O)O)N)O Z3003010810 [0,2,0,0,0,0|1,0,0]=3 1281 B13R1.299 CCC1=C(C(=CC(=C1)Br)C(=O)O)N Z1436097948 [0,2,0,0,0,0|2,0,0]=4 1282 B13R1.299 COC1=C(C(=CC(=C1)Br)C(=O)C)O Z2090024827 [0,2,0,0,0,0|1,0,0]=3 1283 B13R1.299 COC1=C(C(=CC(=C1)C)C(=O)O)C Z1255440702 [0,2,0,0,0,0|1,0,0]=3 1284 B13R1.299 COC1=C(C(=CC(=C1)C)C(=O)O)N Z2037273317 [0,2,0,0,0,0|1,0,0]=3 1285 B13R1.299 COC1=C(C(=CC(=C1)C)C(=O)O)O Z367679332 [0,2,0,0,0,0|1,0,0]=3 1286 B13R1.299 COC1=C(C(=CC(=C1)F)C(=O)O)N Z821177462 [0,2,0,0,0,0|1,0,0]=3 1287 B13R1.313 CCC1=CC(=CC(=C1)OC)C(=O)O Z1255505916 [0,2,0,0,0,0|1,0,0]=3 1288 B13R1.313 COC1=CC(=CC(=C1)C(=O)O)OC Z104476958 [0,2,0,0,0,0|1,0,0]=3 1289 B13R1.313 COC1=CC(=CC(=C1)C(C)N)OC Z4966524078 [0,2,0,0,0,0|1,0,1]=4 1290 B13R1.313 COC1=CC(=CC(=N1)OC)C(=O)O Z1255438074 [0,2,0,0,0,0|2,0,0]=4 1291 B13R1.313 CSC1=CC(=CC(=C1)C(=O)O)SC Z1508984932 [0,2,0,0,0,0|1,1,0]=4 1292 B13R1.314 COC(=O)C1=CC(=CC(=C1)I)OC Z1416179436 [0,2,0,0,0,0|1,0,0]=3 1293 B13R1.314 COC1=CC(=CC(=C1)Cl)C(=O)CN Z3301405085 [0,2,0,0,0,0|0,0,0]=2 1294 B13R1.314 COC1=CC(=CC(=C1)F)C(=O)CCl Z1999522283 [0,2,0,0,0,0|1,0,0]=3 1295 B13R1.437 COC1=CC(=C(C(=C1)Br)N)C(=O)O Z1269195251 [0,2,0,0,0,0|1,0,0]=3 1296 B13R1.437 COC1=CC(=C(C(=C1)Br)O)C(=O)O Z1269137366 [0,2,0,0,0,0|1,0,0]=3 1297 B13R1.437 COC1=CC(=C(C(=C1)C)N)C(=O)O Z1029457416 [0,2,0,0,0,0|1,0,0]=3 1298 B13R1.437 COC1=CC(=C(C(=C1)Cl)F)C(=O)O Z1486020842 [0,2,0,0,0,0|1,0,0]=3 1299 B13R1.437 COC1=CC(=C(C(=C1)F)Br)C(=O)O Z2733495174 [0,2,0,0,0,0|1,0,0]=3 1300 B13R1.13 CC(=O)C1=C(C=CC(=C1)C(=O)O)C Z1551959921 [0,2,0,0,0,0|2,0,0]=4 1301 B13R1.13 CC(=O)C1=C(C=CC(=C1)C(=O)O)O Z316120698 [0,2,0,0,0,0|2,0,0]=4 1302 B13R1.13 CC(=O)C1=CC(=C(C=C1)Br)C(=O)O Z2181909319 [0,2,0,0,0,0|2,0,0]=4 1303 B13R1.13 CC(=O)C1=CC(=C(C=C1)O)C(=O)C Z1263715077 [0,2,0,0,0,0|2,0,0]=4 1304 B13R1.13 CC(C)C1=C(C=CC(=C1)C(=O)O)O Z1255501223 [0,2,0,0,0,0|2,0,0]=4 1305 B13R1.13 CC(C)C1=CC(=C(C=C1)F)C(=O)O Z1171158001 [0,2,0,0,0,0|2,0,0]=4 1306 B13R1.13 CC(C)C1=CC(=C(C=C1)N)C(=O)O Z362758700 [0,2,0,0,0,0|2,0,0]=4 1307 B13R1.13 CC(C)C1=CC(=C(C=C1)O)C(=O)O Z367679362 [0,2,0,0,0,0|2,0,0]=4 1308 B13R1.13 CC(N)C1=CC(=C(C=C1)O)C(=O)N Z5385355796 [0,2,0,0,0,0|1,0,0]=3 1309 B13R1.13 CC1=C(C=C(C=C1)C(=O)N)C(=O)O Z1262539310 [0,2,0,0,0,0|2,0,0]=4 1310 B13R1.13 CC1=C(C=C(C=C1)C(C)C)C(=O)O Z1259111969 [0,2,0,0,0,0|2,0,0]=4 1311 B13R1.13 CN(C)C1=CC(=C(C=C1)Br)C(=O)O Z2238737808 [0,2,0,0,0,0|2,0,0]=4 1312 B13R1.13 CN(C)C1=CC(=C(C=C1)N)C(=O)N Z802841122 [0,2,0,0,0,0|1,0,0]=3 1313 B13R1.13 CN(C)C1=CC(=C(C=C1)N)C(=O)O Z715584814 [0,2,0,0,0,0|2,0,0]=4 1314 B13R1.13 NC(=O)C1=C(C=CC(=C1)C(=O)O)O Z1255381713 [0,2,0,0,0,0|2,0,0]=4 1315 B13R1.13 NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])Cl Z33546470 [0,2,0,0,0,0|2,0,0]=4 1316 B13R1.13 NC(=O)C1=C(C=CC(=C1)[N+](=O)[O-])N Z959893168 [0,2,0,0,0,0|2,0,0]=4 1317 B13R1.13 NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-] Z33546376 [0,2,0,0,0,0|2,0,0]=4 1318 B13R1.13 NC(=O)C1=CC(=C(C=C1)N)[N+](=O)[O-] Z33546467 [0,2,0,0,0,0|2,0,0]=4 1319 B13R1.49 CCC1=C(C=CC(=C1)C(=O)OC)N Z1262687926 [0,2,0,0,0,0|2,0,0]=4 1320 B13R1.49 CNC(=O)C1=CC(=C(C=C1)C)OC Z135505592 [0,2,0,0,0,0|0,0,0]=2 1321 B13R1.49 CNC(=O)C1=CC(=C(C=C1)F)SC Z1556061081 [0,2,0,0,0,0|0,1,0]=3 1322 B13R1.49 CNC(=O)C1=CC(=C(C=C1)N)OC Z1126164960 [0,2,0,0,0,0|0,0,0]=2 1323 B13R1.49 CNC(=O)C1=CC(=C(C=C1)O)C=O Z1255385731 [0,2,0,0,0,0|2,0,0]=4 1324 B13R1.49 CNC1=C(C=CC(=C1)C(=O)OC)N Z1255498224 [0,2,0,0,0,0|2,0,0]=4 1325 B13R1.49 COC(=O)C1=CC(=C(C=C1)O)OC Z104500600 [0,2,0,0,0,0|1,0,0]=3 1326 B13R1.49 COC(=O)C1=CC(=C(N=C1)C)OC Z1222424952 [0,2,0,0,0,0|2,0,0]=4 1327 B13R1.49 COC1=C(C=CC(=C1)C(=O)CN)O Z4654934301 [0,2,0,0,0,0|0,0,0]=2 1328 B13R1.49 COC1=C(C=CC(=C1)C(O)CN)O Z2574937385 [0,2,0,0,0,0|0,0,2]=4 1329 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)C)N Z1147220045 [0,2,0,0,0,0|2,0,0]=4 1330 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)Cl)F Z1203133412 [0,2,0,0,0,0|2,0,0]=4 1331 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)F)O Z1513827302 [0,2,0,0,0,0|2,0,0]=4 1332 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)N)Br Z992054218 [0,2,0,0,0,0|1,0,0]=3 1333 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)N)Cl Z969575870 [0,2,0,0,0,0|1,0,0]=3 1334 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)N)N Z1269205697 [0,2,0,0,0,0|1,0,0]=3 1335 B13R1.50 COC1=C(C=CC(=C1)S(=O)(=O)N)O Z1269225101 [0,2,0,0,0,0|1,0,0]=3 1336 B13R1.354 CC(=O)C1=CC(=C(C=C1)O)CCCl Z1270334070 [0,2,0,0,0,0|2,0,0]=4 1337 B13R1.354 CCCC1=C(C=CC(=C1)C(=O)O)Cl Z1262534442 [0,2,0,0,0,0|2,0,0]=4 1338 B13R1.354 CCOC1=C(C=CC(=C1)C(=O)O)C Z197301834 [0,2,0,0,0,0|1,0,0]=3 1339 B13R1.354 COCC1=C(C=CC(=C1)[N+](=O)[O-])Cl Z394692678 [0,2,0,0,0,0|2,0,0]=4 1340 B13R1.354 COCC1=C(C=CC(=C1)[N+](=O)[O-])N Z960434492 [0,2,0,0,0,0|2,0,0]=4 1341 B13R1.354 CSCC1=C(C=CC(=C1)C(=O)N)F Z1319052478 [0,2,0,0,0,0|0,1,0]=3 1342 B13R1.354 CSCC1=C(C=CC(=C1)C(=O)O)F Z1080732112 [0,2,0,0,0,0|1,1,0]=4 1343 B13R1.651 CNC1=C(C=C(C(=C1)C(=O)N)Cl)Cl Z2034678675 [0,2,0,0,0,0|1,0,0]=3 1344 B13R1.651 COC1=C(C=C(C(=C1)C(=O)C)F)F Z2311004808 [0,2,0,0,0,0|1,0,0]=3 1345 B13R1.651 COC1=C(C=C(C(=C1)C(=O)C)F)O Z1255399946 [0,2,0,0,0,0|1,0,0]=3 1346 B13R1.651 COC1=C(C=C(C(=C1)C(=O)C)O)O Z1416187799 [0,2,0,0,0,0|1,0,0]=3 1347 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)Br)C Z1486016129 [0,2,0,0,0,0|1,0,0]=3 1348 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)Cl)Cl Z1269124173 [0,2,0,0,0,0|1,0,0]=3 1349 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)F)Br Z3242946229 [0,2,0,0,0,0|1,0,0]=3 1350 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)F)N Z1255365803 [0,2,0,0,0,0|1,0,0]=3 1351 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)N)Br Z1618029543 [0,2,0,0,0,0|1,0,0]=3 1352 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)N)Cl Z5590164839 [0,2,0,0,0,0|1,0,0]=3 1353 B13R1.651 COC1=C(C=C(C(=C1)C(=O)O)N)F Z905174286 [0,2,0,0,0,0|1,0,0]=3 1354 B13R1.651 COC1=C(C=C(C(=C1)[N+](=O)[O-])Cl)N Z56871702 [0,2,0,0,0,0|2,0,0]=4 1355 B13R1.651 CSC1=C(C=C(C(=C1)C(=O)O)Cl)Cl Z1403247583 [0,2,0,0,0,0|1,1,0]=4 1356 B13R1.3091 C=C(C)C1=CC(=C(C=C1)OC)OC Z1238836374 [0,2,0,0,0,0|2,0,0]=4 1357 B13R1.3091 CCC1=C(C=C(C=C1)C(=O)O)CC Z1262524593 [0,2,0,0,0,0|2,0,0]=4 1358 B13R1.3091 CCC1=C(C=C(C=C1)C(=O)O)OC Z1198232631 [0,2,0,0,0,0|1,0,0]=3 1359 B13R1.3091 CCC1=C(C=CC(=C1)C(=O)O)OC Z1255466895 [0,2,0,0,0,0|2,0,0]=4 1360 B13R1.3091 COC1=C(C=C(C=C1)C(=O)C)OC Z54182939 [0,2,0,0,0,0|1,0,0]=3 1361 B13R1.3091 COC1=C(C=C(C=C1)C(=O)N)OC Z33546772 [0,2,0,0,0,0|0,0,0]=2 1362 B13R1.3091 COC1=C(C=C(C=C1)C(=O)O)OC Z104478452 [0,2,0,0,0,0|1,0,0]=3 1363 B13R1.3091 COC1=C(C=C(C=C1)C(=S)N)OC Z56998594 [0,2,0,0,0,0|0,1,0]=3 1364 B13R1.3091 COC1=C(C=C(C=C1)C(C)N)OC Z444350090 [0,2,0,0,0,0|1,0,1]=4 1365 B13R1.3091 COC1=C(C=CC(=C1)C(=O)C)C#N Z1513608423 [0,2,0,0,0,0|1,0,0]=3 1366 B13R1.3091 COC1=C(C=CC(=C1)C(=O)C)SC Z927375054 [0,2,0,0,0,0|1,0,0]=3 1367 B13R1.3091 COC1=C(C=CC(=C1)C(=O)O)C#N Z1255464361 [0,2,0,0,0,0|1,0,0]=3 1368 B13R1.3091 COC1=C(C=CC(=C1)C(=O)O)C=O Z1262528048 [0,2,0,0,0,0|1,0,0]=3 1369 B13R1.3091 COC1=C(C=CC(=C1)[N+](=O)[O-])C#N Z1255431637 [0,2,0,0,0,0|2,0,0]=4 1370 B13R1.3091 COC1=C(C=CC(=C1)[N+](=O)[O-])CN Z4283395290 [0,2,0,0,0,0|2,0,0]=4 1371 B13R1.3091 COC1=C(N=C(C=C1)C(=O)O)OC Z1201625961 [0,2,0,0,0,0|2,0,0]=4 1372 B13R1.3230 COC1=C(C(=CC=C1C)C(=O)O)F Z1681375317 [0,2,0,0,0,0|1,0,0]=3 1373 B13R1.3230 COC1=C(C(=CC=C1F)C(=O)O)F Z1201621729 [0,2,0,0,0,0|1,0,0]=3 1374 B13R1.3230 COC1=C(C=CC(=C1F)C(=O)N)Cl Z1269216160 [0,2,0,0,0,0|0,0,0]=2 1375 B13R1.3230 COC1=C(C=CC(=C1N)C(=O)O)Cl Z808619710 [0,2,0,0,0,0|1,0,0]=3 1376 B13R1.345 CC(=O)C1=CC(=CC=C1)S(=O)(=O)N Z45415590 [0,2,0,0,0,0|2,0,0]=4 1377 B13R1.345 CC(C)(C)C1=CC(=CC=C1)C(=O)O Z1201621071 [0,2,0,0,0,0|2,0,0]=4 1378 B13R1.345 CC(C)C1=CC(=CC=C1)S(=O)(=O)N Z401602462 [0,2,0,0,0,0|2,0,0]=4 1379 B13R1.345 CC(N)C1=CC(=CC=C1)S(=O)(=O)N Z96092061 [0,2,0,0,0,0|2,0,0]=4 1380 B13R1.345 CC(O)C1=CC(=CC=C1)S(=O)(=O)N Z425781416 [0,2,0,0,0,0|2,0,0]=4 1381 B13R1.345 CS(=O)(=O)C1=CC(=CC=C1)C(=N)N Z2379150400 [0,2,0,0,0,0|1,1,0]=4 1382 B13R1.345 CS(=O)(=O)C1=CC(=CC=C1)C(=O)N Z33545896 [0,2,0,0,0,0|0,1,0]=3 1383 B13R1.345 CS(=O)(=O)C1=CC(=CC=C1)C(=O)O Z56989684 [0,2,0,0,0,0|1,1,0]=4 1384 B13R1.345 C[C@@H](O)C1=CC(=CC=C1)S(=O)(=O)N Z1127664477 [0,2,0,0,0,0|2,0,0]=4 1385 B13R1.345 C[C@H](O)C1=CC(=CC=C1)S(=O)(=O)N Z1127664363 [0,2,0,0,0,0|2,0,0]=4 1386 B13R1.345 NC(=O)C1=CC(=CC=C1)C(F)(F)F Z33546480 [0,2,0,0,0,0|2,0,0]=4 1387 B13R1.345 NC(=O)C1=CC(=CC=C1)S(=O)(=O)Cl Z285672624 [0,2,0,0,0,0|1,1,0]=4 1388 B13R1.345 NC(=O)C1=CC(=CC=C1)S(=O)(=O)N Z33546716 [0,2,0,0,0,0|1,1,0]=4 1389 B13R1.543 CN(C)C1=CC(=CC=C1)C(=O)CCl Z4155261735 [0,2,0,0,0,0|2,0,0]=4 1390 B13R1.543 CN(C)C1=CC(=CC=C1)C(=O)NN Z56858159 [0,2,0,0,0,0|1,0,0]=3 1391 B13R1.543 CNC(=O)C1=CC(=CC=C1)B(O)O Z1171974291 [0,2,0,0,0,0|2,0,0]=4 1392 B13R1.543 CNC(=O)C1=CC(=CC=C1)C(=O)O Z425331720 [0,2,0,0,0,0|2,0,0]=4 1393 B13R1.543 CNC(=O)C1=CC(=CC=C1)N(C)C Z32016575 [0,2,0,0,0,0|1,0,0]=3 1394 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=N)N Z2574923569 [0,2,0,0,0,0|1,0,0]=3 1395 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=O)N Z326029350 [0,2,0,0,0,0|0,0,0]=2 1396 B13R1.543 COC(=O)C1=CC(=CC=C1)C(=O)O Z425331302 [0,2,0,0,0,0|1,0,0]=3 1397 B13R1.543 COC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z19668576 [0,2,0,0,0,0|2,0,0]=4 1398 B13R1.543 COC(=O)C1=CC(=CN=C1)C(=N)N Z2719790752 [0,2,0,0,0,0|2,0,0]=4 1399 B13R1.543 COC(=O)C1=CC(=CN=C1)C(=O)C Z1255447215 [0,2,0,0,0,0|2,0,0]=4 1400 B13R1.543 COC(=O)C1=CC(=CN=C1)C(=O)O Z451334748 [0,2,0,0,0,0|2,0,0]=4 1401 B13R1.543 COC(=O)C1=CC(=NC=C1)C(=O)O Z1198159155 [0,2,0,0,0,0|2,0,0]=4 1402 B13R1.543 COC(=O)C1=NC(=CC=C1)C(=O)C Z1198181830 [0,2,0,0,0,0|2,0,0]=4 1403 B13R1.543 COC(=O)C1=NC(=CC=C1)C(=O)O Z425797000 [0,2,0,0,0,0|2,0,0]=4 1404 B13R1.543 COC(=O)C1=NC=CC(=C1)C(=O)O Z1255450491 [0,2,0,0,0,0|2,0,0]=4 1405 B13R1.543 N=C(N)C1=CC=CC(=C1)C(N)CF Z3400557494 [0,2,0,0,0,0|2,0,0]=4 1406 B13R1.543 NNC(=O)C1=CC(=CC=C1)[N+](=O)[O-] Z56922145 [0,2,0,0,0,0|2,0,0]=4 1407 B13R1.3801 CC(C)C1=C(C(=CC=C1)C(=O)O)F Z1947296509 [0,2,0,0,0,0|2,0,0]=4 1408 B13R1.3801 CC(C)C1=C(C(=CC=C1)C(=O)O)N Z362758756 [0,2,0,0,0,0|2,0,0]=4 1409 B13R1.3801 CC1=C(C=CC=C1C(=O)N)[N+](=O)[O-] Z33546929 [0,2,0,0,0,0|2,0,0]=4 1410 B13R1.3801 NC(=O)C1=C(C(=CC=C1)B(O)O)F Z1255467352 [0,2,0,0,0,0|2,0,0]=4 1411 B13R1.3801 NC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])O Z1255404232 [0,2,0,0,0,0|2,0,0]=4 1412 B13R1.374 CNC(=O)C1=CC(=CC=C1)CCN Z992904598 [0,2,0,0,0,0|1,0,0]=3 1413 B13R1.374 CNC(=O)C1=CC(=CC=C1)CSC Z135505366 [0,2,0,0,0,0|0,1,0]=3 1414 B13R1.374 CNC(=O)C1=CC(=CN=C1)COC Z1693698580 [0,2,0,0,0,0|1,0,0]=3 1415 B13R1.374 CNCC1=CC(=CC=C1)C(=O)OC Z3243816713 [0,2,0,0,0,0|2,0,0]=4 1416 B13R1.374 COC(=O)C1=CC(=CC=C1)CCN Z1682072452 [0,2,0,0,0,0|2,0,0]=4 1417 B13R1.374 COCC1=CC(=NC=C1)C(=O)OC Z2732566512 [0,2,0,0,0,0|2,0,0]=4 1418 B13R1.375 CCCC1=CC(=CC=C1)S(=O)(=O)N Z1216845290 [0,2,0,0,0,0|2,0,0]=4 1419 B13R1.375 CCOC1=CC(=CC=C1)S(=O)(=O)N Z821179222 [0,2,0,0,0,0|1,0,0]=3 1420 B13R1.375 COCC1=CC(=CC=C1)S(=O)(=O)Cl Z401602074 [0,2,0,0,0,0|2,0,0]=4 1421 B13R1.377 CCOC1=C(C(=CC=C1)C(=O)O)N Z594219142 [0,2,0,0,0,0|1,0,0]=3 1422 B13R1.377 CCOC1=C(C(=CC=N1)C(=O)O)F Z1777238407 [0,2,0,0,0,0|2,0,0]=4 1423 B13R1.377 COCC1=C(C(=CC=C1)C(=O)O)C Z4959312681 [0,2,0,0,0,0|1,0,0]=3 1424 B13R1.387 CCCC1=CC(=C(C=C1)N)C(=O)O Z362758718 [0,2,0,0,0,0|2,0,0]=4 1425 B13R1.387 CCNC1=CC(=C(C=C1)F)C(=O)C Z2067348246 [0,2,0,0,0,0|2,0,0]=4 1426 B13R1.387 CCOC1=CC(=C(C=C1)N)C(=O)N Z802832880 [0,2,0,0,0,0|0,0,0]=2 1427 B13R1.387 CCOC1=CC(=C(C=C1)N)C(=O)O Z594219072 [0,2,0,0,0,0|1,0,0]=3 1428 B13R1.387 CCOC1=CC(=C(C=C1)N)[N+](=O)[O-] Z57160694 [0,2,0,0,0,0|2,0,0]=4 1429 B13R1.387 CCOC1=NC(=C(C=C1)Cl)C(=O)O Z335089304 [0,2,0,0,0,0|2,0,0]=4 1430 B13R1.387 CCSC1=CC(=C(C=C1)Br)C(=O)O Z1551949164 [0,2,0,0,0,0|1,1,0]=4 1431 B13R1.568 C#CCNC1=CC=CC(=C1)C(=O)O Z228589476 [0,2,0,0,0,0|2,0,0]=4 1432 B13R1.568 C#CCOC1=CC=CC(=C1)C(=O)C Z54482915 [0,2,0,0,0,0|1,0,0]=3 1433 B13R1.568 C#CCOC1=CC=CC(=C1)C(C)N Z600462408 [0,2,0,0,0,0|1,0,1]=4 1434 B13R1.568 C#CCSC1=CC=CC(=C1)C(=O)O Z1201631111 [0,2,0,0,0,0|1,1,0]=4 1435 B13R1.568 CCCOC1=CC(=CC=C1)C(=O)O Z111782536 [0,2,0,0,0,0|1,0,0]=3 1436 B13R1.568 CCCSC1=CC(=CC=C1)C(=O)O Z1201631482 [0,2,0,0,0,0|1,1,0]=4 1437 B13R1.568 CCNCC1=CC(=CC=C1)C(=O)N Z1416203141 [0,2,0,0,0,0|1,0,0]=3 1438 B13R1.568 N#CCSC1=CC=CC(=C1)C(=O)O Z1201631105 [0,2,0,0,0,0|1,1,0]=4 1439 B13R1.568 NCCCC1=CC(=CC=C1)C(=O)O Z2312248402 [0,2,0,0,0,0|2,0,0]=4 1440 B13R1.568 NCCOC1=CC(=CC=C1)C(=O)O Z2106608086 [0,2,0,0,0,0|1,0,0]=3 1441 B13R1.568 O=C(O)C1=CC(=NC=C1)OCCO Z332379856 [0,2,0,0,0,0|2,0,0]=4 1442 B13R1.568 O=[N+]([O-])C1=CC(=CC=C1)OCCBr Z285922252 [0,2,0,0,0,0|2,0,0]=4 1443 B13R1.82 CCC1=C(C(=CC=C1)C(=O)OC)N Z594218900 [0,2,0,0,0,0|2,0,0]=4 1444 B13R1.82 CNC1=C(C(=CC=C1)C(=O)OC)C Z1082871938 [0,2,0,0,0,0|2,0,0]=4 1445 B13R1.82 COC(=O)C1=C(C(=CC=C1)OC)N Z594219104 [0,2,0,0,0,0|1,0,0]=3 1446 B13R1.82 COC(=O)C1=C(C(=CC=C1)OC)O Z16076230 [0,2,0,0,0,0|1,0,0]=3 1447 B13R1.82 COC(=O)C1=C(C(=CC=C1)SC)N Z1770193276 [0,2,0,0,0,0|1,1,0]=4 1448 B13R1.82 COC(=O)C1=C(C(=CC=N1)OC)F Z1255359428 [0,2,0,0,0,0|2,0,0]=4 1449 B13R1.82 COC(=O)C1=C(C(=CC=N1)OC)N Z4748963891 [0,2,0,0,0,0|2,0,0]=4 1450 B13R1.82 COC1=C(C(=CC=C1)C(=O)NN)O Z71422915 [0,2,0,0,0,0|0,0,0]=2 1451 B13R1.460 CCNC(=O)C1=CC(=CC=C1)C#N Z32025093 [0,2,0,0,0,0|2,0,0]=4 1452 B13R1.460 CCNC(=O)C1=CC(=CC=C1)C=O Z1068186398 [0,2,0,0,0,0|2,0,0]=4 1453 B13R1.460 CCNC(=O)C1=CC(=CC=C1)CN Z425389696 [0,2,0,0,0,0|2,0,0]=4 1454 B13R1.460 CCNC(C)C1=CC(=CC=C1)OC Z398513626 [0,2,0,0,0,0|1,0,1]=4 1455 B13R1.460 CCOC(=O)C1=CC(=CC=C1)NC Z2760930228 [0,2,0,0,0,0|2,0,0]=4 1456 B13R1.460 COC1=CC(=CC=C1)C(=O)CC#N Z56960306 [0,2,0,0,0,0|0,0,1]=3 1457 B13R1.460 CONC(=O)C1=CC(=CC=C1)C#N Z245507142 [0,2,0,0,0,0|2,0,0]=4 1458 B13R1.460 CONC(=O)C1=CC(=CC=C1)OC Z245507046 [0,2,0,0,0,0|0,0,0]=2 1459 B13R1.646 CCC(NC)C1=CC(=CC=C1)OC Z513792210 [0,2,0,0,0,0|1,0,1]=4 1460 B13R1.646 COC1=CC(=CC=C1)C(C=O)C=O Z979247236 [0,2,0,0,0,0|1,0,1]=4 1461 B13R1.646 COC1=CC=CC(=C1)C(CN)OC Z2670815973 [0,2,0,0,0,0|0,0,2]=4 1462 B13R1.2431 CCC1=CC(=C(C=C1)N)C(=O)OC Z594218572 [0,2,0,0,0,0|2,0,0]=4 1463 B13R1.2431 CNC(=O)C1=C(C=CC(=C1)C=O)F Z2511822915 [0,2,0,0,0,0|2,0,0]=4 1464 B13R1.2431 CNC(=O)C1=C(C=CC(=C1)OC)Br Z30271260 [0,2,0,0,0,0|0,0,0]=2 1465 B13R1.2431 CNC(=O)C1=C(C=CC(=C1)OC)N Z609550372 [0,2,0,0,0,0|0,0,0]=2 1466 B13R1.2431 CNC(=O)C1=C(C=CC(=C1)OC)O Z242124446 [0,2,0,0,0,0|0,0,0]=2 1467 B13R1.2431 CNC(=O)C1=C(C=CC(=C1)SC)C Z281303476 [0,2,0,0,0,0|0,1,0]=3 1468 B13R1.2431 COC(=O)C1=C(C=CC(=C1)OC)N Z594219054 [0,2,0,0,0,0|1,0,0]=3 1469 B13R1.2431 COC(=O)C1=C(C=CC(=C1)OC)O Z24427281 [0,2,0,0,0,0|1,0,0]=3 1470 B13R1.2431 COC(=O)C1=C(C=NC(=C1)OC)Br Z1269167381 [0,2,0,0,0,0|2,0,0]=4 1471 B13R1.2431 COC(=O)C1=C(C=NC(=C1)OC)N Z1416196818 [0,2,0,0,0,0|2,0,0]=4 1472 B13R1.2431 COC1=CC(=C(C=C1)O)C(=O)CCl Z1508664271 [0,2,0,0,0,0|1,0,0]=3 1473 B13R1.3040 COC1=CC(=CC=C1)C(C)(C)CN Z801752006 [0,2,0,0,0,0|1,0,1]=4 1474 B13R1.3040 COC1=CC(=CC=C1)C(F)(F)CN Z4188715617 [0,2,0,0,0,0|1,0,1]=4 1475 B13R1.98 COC1=CC(=C(C=C1)Br)S(=O)(=O)F Z2216273204 [0,2,0,0,0,0|2,0,0]=4 1476 B13R1.98 COC1=CC(=C(C=C1)C)S(=O)(=O)N Z1269237699 [0,2,0,0,0,0|1,0,0]=3 1477 B13R1.98 COC1=CC(=C(C=C1)I)S(=O)(=O)F Z3016190927 [0,2,0,0,0,0|2,0,0]=4 1478 B13R1.98 COC1=CC(=C(C=C1)N)S(=O)(=O)C Z1405078342 [0,2,0,0,0,0|2,0,0]=4 1479 B13R1.98 COC1=CC(=C(C=C1)N)S(=O)(=O)O Z1269122561 [0,2,0,0,0,0|2,0,0]=4 1480 B13R1.645 COC1=C(C(=CC=C1)S(=O)(=O)C)N Z1509442799 [0,2,0,0,0,0|2,0,0]=4 1481 B13R1.645 COC1=C(C(=CC=C1)S(=O)(=O)N)N Z1269241332 [0,2,0,0,0,0|1,0,0]=3 1482 B13R1.2137 COC1=C(C(=CC=C1)C(=O)O)C=O Z1262516683 [0,2,0,0,0,0|1,0,0]=3 1483 B13R1.2137 COC1=C(C(=CC=C1)C(=O)O)OC Z104476536 [0,2,0,0,0,0|1,0,0]=3 1484 B13R1.2137 COC1=C(C(=CC=C1)C(=S)N)OC Z56983142 [0,2,0,0,0,0|0,1,0]=3 1485 B13R1.2137 COC1=C(C(=CC=C1)[N+](=O)[O-])C=O Z826537398 [0,2,0,0,0,0|2,0,0]=4 1486 B13R1.3097 CCC1=C(C(=C(C=C1)F)C(=O)O)F Z2732605593 [0,2,0,0,0,0|2,0,0]=4 1487 B13R1.3097 COC1=C(C(=C(C=C1)Br)C(=O)O)C Z1269177161 [0,2,0,0,0,0|1,0,0]=3 1488 B13R1.3097 COC1=C(C(=C(C=C1)Br)C(=O)O)N Z755998694 [0,2,0,0,0,0|1,0,0]=3 1489 B13R1.3097 COC1=C(C(=C(C=C1)C)C(=O)O)N Z228589684 [0,2,0,0,0,0|1,0,0]=3 1490 B13R1.3097 COC1=C(C(=C(C=C1)Cl)C(=O)O)N Z228589672 [0,2,0,0,0,0|1,0,0]=3 1491 B13R1.3097 COC1=C(C(=C(C=C1)F)C(=O)O)Cl Z1269198637 [0,2,0,0,0,0|1,0,0]=3 1492 B13R1.3097 COC1=C(C(=C(C=C1)F)C(=O)O)F Z1201622916 [0,2,0,0,0,0|1,0,0]=3 1493 B13R1.3097 COC1=C(C(=C(C=C1)N)C(=O)O)Br Z1184914962 [0,2,0,0,0,0|1,0,0]=3 1494 B13R1.2430 CNC1=C(C=C(C=C1)OC)[N+](=O)[O-] Z54745176 [0,2,0,0,0,0|2,0,0]=4 1495 B13R1.2430 COC1=CC(=C(C=C1)C=O)C(=O)C Z1511903062 [0,2,0,0,0,0|1,0,0]=3 1496 B13R1.2430 COC1=CC(=C(C=C1)C=O)C(=O)O Z1198170018 [0,2,0,0,0,0|1,0,0]=3 1497 B13R1.2430 COC1=CC(=C(C=C1)C=O)[N+](=O)[O-] Z1143242456 [0,2,0,0,0,0|2,0,0]=4 1498 B13R1.2430 COC1=CC(=C(C=C1)OC)C(=O)C Z104479138 [0,2,0,0,0,0|1,0,0]=3 1499 B13R1.2430 COC1=CC(=C(C=C1)OC)C(=O)O Z57050098 [0,2,0,0,0,0|1,0,0]=3 1500 B13R1.2430 COC1=CC(=C(C=C1)OC)C(C)N Z90666848 [0,2,0,0,0,0|1,0,1]=4 1501 B13R1.2430 COC1=NC(=C(C=C1)OC)C(=O)O Z1255405999 [0,2,0,0,0,0|2,0,0]=4 1502 B11R1.90 CN1C=CC=C1/C=C/C(=O)O Z2312400648 [0,0,1,1,0,0|2,0,0]=4 1503 B11R1.91 NC(=O)/C=C/C1=CN=CC=C1 Z284112150 [0,0,1,1,0,0|2,0,0]=4 1504 B11R2.106 O=C1NCCC2=C1C=CS2 Z1486036948 [0,0,0,1,1,0|2,0,0]=4 1505 B11R2.106 O=C1NCCC2=CNC=C12 Z2181988060 [0,0,0,1,1,0|2,0,0]=4 1506 B13R2.81 COC1=CC(=CC=C1)[C@@H]2C[C@H]2N Z2236704792 [0,0,0,1,0,1|1,0,1]=4 1507 B13R2.581 CCC1=C2N=C(SC2=CC=C1)N Z1741967085 [0,0,0,1,0,1|2,0,0]=4 1508 B13R2.581 COC1=C2CC(CC2=CC=C1)N Z1255380738 [0,0,0,1,0,1|1,0,1]=4 1509 B13R2.581 COC1=C2N=C(SC2=CC=C1)N Z104442614 [0,0,0,1,0,1|1,0,0]=3 1510 B13R2.581 COC1=C2NC(=NC2=CC=C1)N Z1255426088 [0,0,0,1,0,1|1,0,0]=3 1511 B13R2.581 COC1=C2SC(=NC2=CC=C1)S Z1255443684 [0,0,0,1,0,1|1,1,0]=4 1512 B13R2.581 N#CC1=CC=CC2=C1NC(=O)C2 Z1201621659 [0,0,0,1,0,1|2,0,0]=4 1513 B13R2.581 NCC1=C2NC(=O)CC2=CC=C1 Z4741673841 [0,0,0,1,0,1|2,0,0]=4 1514 B13R2.1279 O=C(O)CC1=CC2=C(C=C1)CC2 Z1551937159 [0,0,0,1,0,1|2,0,0]=4 1515 B13R2.2121 CCC1=CC2=C(C=C1)N=C(S2)N Z56919761 [0,0,0,1,0,1|2,0,0]=4 1516 B13R2.2121 CNC1=CC2=C(C=C1)NC(=N2)C Z1403499839 [0,0,0,1,0,1|2,0,0]=4 1517 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)C Z90123542 [0,0,0,1,0,1|1,0,1]=4 1518 B13R2.2121 COC1=CC2=C(C=C1)N=C(S2)N Z56756338 [0,0,0,1,0,1|1,0,0]=3 1519 B13R2.2121 COC1=CC2=C(C=C1)NC(=C2)C Z1197882538 [0,0,0,1,0,1|1,0,0]=3 1520 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)C Z1587257377 [0,0,0,1,0,1|1,0,0]=3 1521 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)N Z1198160975 [0,0,0,1,0,1|1,0,0]=3 1522 B13R2.2121 COC1=CC2=C(C=C1)NC(=N2)S Z221604426 [0,0,0,1,0,1|0,1,0]=3 1523 B13R2.2121 COC1=CC2=C(C=C1)NC(C2)C Z1255421552 [0,0,0,1,0,1|1,0,1]=4 1524 B13R2.2121 COC1=CC2=C(C=C1)OC(=N2)N Z1255435333 [0,0,0,1,0,1|0,0,1]=3 1525 B13R2.2121 COC1=NC=C2CC(=O)NC2=C1 Z1198180903 [0,0,0,1,0,1|2,0,0]=4 1526 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)C2 Z336286144 [0,0,0,1,0,1|2,0,0]=4 1527 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)N2 Z1198169635 [0,0,0,1,0,1|2,0,0]=4 1528 B13R2.2121 N#CC1=CC2=C(C=C1)NC(=O)O2 Z1255403754 [0,0,0,1,0,1|2,0,0]=4 1529 B13R2.2121 NCC1=CC2=C(C=C1)NC(=O)C2 Z1431002537 [0,0,0,1,0,1|2,0,0]=4 1530 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)N2 Z385370012 [0,0,0,1,0,1|2,0,0]=4 1531 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)O2 Z385370014 [0,0,0,1,0,1|2,0,0]=4 1532 B13R2.430 CC(=O)C1=CC2=C(C=C1)CCC2 Z90665628 [0,1,0,1,0,0|2,0,0]=4 1533 B13R2.430 CC(=O)C1=CC2=C(C=C1)CNC2 Z2306626530 [0,1,0,1,0,0|2,0,0]=4 1534 B13R2.430 CC(=O)C1=CC2=C(C=C1)COC2 Z851017722 [0,1,0,1,0,0|1,0,0]=3 1535 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCC2 Z212063108 [0,1,0,1,0,0|2,0,0]=4 1536 B13R2.430 CC(=O)C1=CC2=C(C=C1)OCO2 Z104477826 [0,1,0,1,0,0|1,0,0]=3 1537 B13R2.430 CC(N)C1=CC2=C(C=C1)OCO2 Z221421640 [0,1,0,1,0,0|1,0,1]=4 1538 B13R2.430 C[C@@H](N)C1=CC2=C(C=C1)OCO2 Z360055458 [0,1,0,1,0,0|1,0,1]=4 1539 B13R2.430 NC(=O)C1=CC2=C(C=C1)C=NN2 Z241898658 [0,1,0,1,0,0|1,0,1]=4 1540 B13R2.430 NC(=O)C1=CC2=C(C=C1)CCC2 Z49524894 [0,1,0,1,0,0|1,0,0]=3 1541 B13R2.430 NC(=O)C1=CC2=C(C=C1)COC2 Z955504160 [0,1,0,1,0,0|0,0,0]=2 1542 B13R2.430 NC(=O)C1=CC2=C(C=C1)N=CO2 Z1082678580 [0,1,0,1,0,0|0,0,1]=3 1543 B13R2.430 NC(=O)C1=CC2=C(C=C1)N=CS2 Z33546392 [0,1,0,1,0,0|0,1,1]=4 1544 B13R2.430 NC(=O)C1=CC2=C(C=C1)NC=C2 Z1151517060 [0,1,0,1,0,0|1,0,1]=4 1545 B13R2.430 NC(=O)C1=CC2=C(C=C1)NC=N2 Z33546770 [0,1,0,1,0,0|1,0,1]=4 1546 B13R2.430 NC(=O)C1=CC2=C(C=C1)NCC2 Z1696091761 [0,1,0,1,0,0|1,0,0]=3 1547 B13R2.430 NC(=O)C1=CC2=C(C=C1)NN=C2 Z394695606 [0,1,0,1,0,0|2,0,0]=4 1548 B13R2.430 NC(=O)C1=CC2=C(C=C1)NN=N2 Z337982582 [0,1,0,1,0,0|2,0,0]=4 1549 B13R2.430 NC(=O)C1=CC2=C(C=C1)OCC2 Z337983212 [0,1,0,1,0,0|1,0,0]=3 1550 B13R2.430 NC(=O)C1=CC2=C(C=C1)OCO2 Z33546650 [0,1,0,1,0,0|0,0,0]=2 1551 B13R2.430 NC(=O)C1=CC2=C(C=C1)SC=N2 Z1255366065 [0,1,0,1,0,0|1,0,1]=4 1552 B13R2.430 NC(=O)C1=CC2=NSN=C2C=C1 Z1255458604 [0,1,0,1,0,0|1,1,0]=4 1553 B13R2.430 NC(=S)C1=CC2=C(C=C1)OCO2 Z381430268 [0,1,0,1,0,0|0,1,0]=3 1554 B13R2.430 O=C(O)C1=CC2=C(C=C1)C=NO2 Z1551943591 [0,1,0,1,0,0|1,0,1]=4 1555 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCC2 Z85936364 [0,1,0,1,0,0|2,0,0]=4 1556 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCN2 Z2895200811 [0,1,0,1,0,0|2,0,0]=4 1557 B13R2.430 O=C(O)C1=CC2=C(C=C1)CCO2 Z1198272392 [0,1,0,1,0,0|1,0,0]=3 1558 B13R2.430 O=C(O)C1=CC2=C(C=C1)CNC2 Z1142498037 [0,1,0,1,0,0|2,0,0]=4 1559 B13R2.430 O=C(O)C1=CC2=C(C=C1)COC2 Z940646330 [0,1,0,1,0,0|1,0,0]=3 1560 B13R2.430 O=C(O)C1=CC2=C(C=C1)OCO2 Z104476884 [0,1,0,1,0,0|1,0,0]=3 1561 B13R2.430 O=C(O)C1=CC2=NON=C2C=C1 Z1255372852 [0,1,0,1,0,0|2,0,0]=4 1562 B13R2.430 O=C(O)C1=NC=C2OCOC2=C1 Z1255382393 [0,1,0,1,0,0|2,0,0]=4 1563 B13R2.429 CC(=O)C1=CC(=CC=C1)C2CC2 Z992239782 [0,1,0,1,0,0|2,0,0]=4 1564 B13R2.429 O=C(O)C1=CC(=CC=C1)C2CC2 Z992239746 [0,1,0,1,0,0|2,0,0]=4 1565 B13R2.429 O=[N+]([O-])C1=CC(=CC=C1)C2CO2 Z970069252 [0,1,0,1,0,0|2,0,0]=4 1566 B13R2.5569 CC(=O)C1=C2OCOC2=CC=C1 Z1255451889 [0,1,0,1,0,0|1,0,0]=3 1567 B13R2.5569 NC(=O)C1=C2CNCC2=CC=C1 Z2581631533 [0,1,0,1,0,0|1,0,0]=3 1568 B13R2.5569 NC(=O)C1=C2N=CNC2=CC=C1 Z1255430314 [0,1,0,1,0,0|1,0,1]=4 1569 B13R2.5569 NC(=O)C1=C2NC=CC2=CC=C1 Z1255438908 [0,1,0,1,0,0|1,0,1]=4 1570 B13R2.5569 NC(=O)C1=C2NN=CC2=CC=C1 Z296759592 [0,1,0,1,0,0|2,0,0]=4 1571 B13R2.5569 NC(=O)C1=C2NN=NC2=CC=C1 Z1633462057 [0,1,0,1,0,0|2,0,0]=4 1572 B13R2.5569 NC(=O)C1=C2OCCC2=CC=C1 Z1262683459 [0,1,0,1,0,0|1,0,0]=3 1573 B13R2.5569 NC(=O)C1=C2OCOC2=CC=C1 Z741559894 [0,1,0,1,0,0|0,0,0]=2 1574 B13R2.5569 NC(=O)C1=C2SC=CC2=CC=C1 Z1255391990 [0,1,0,1,0,0|1,0,1]=4 1575 B13R2.5569 O=C(O)C1=C2C=NOC2=CC=C1 Z1813134883 [0,1,0,1,0,0|1,0,1]=4 1576 B13R2.5569 O=C(O)C1=C2CCNC2=CC=C1 Z2906281204 [0,1,0,1,0,0|2,0,0]=4 1577 B13R2.5569 O=C(O)C1=C2CCOC2=CC=C1 Z1198272391 [0,1,0,1,0,0|1,0,0]=3 1578 B13R2.5569 O=C(O)C1=C2CCOC2=NC=C1 Z3727382654 [0,1,0,1,0,0|2,0,0]=4 1579 B13R2.5569 O=C(O)C1=C2NCCC2=CC=C1 Z1198341662 [0,1,0,1,0,0|2,0,0]=4 1580 B13R2.5569 O=C(O)C1=C2OCCC2=CC=C1 Z1201620458 [0,1,0,1,0,0|2,0,0]=4 1581 B13R2.5569 O=C(O)C1=C2OCOC2=CC=C1 Z553832512 [0,1,0,1,0,0|1,0,0]=3 1582 B13R2.5569 O=C(O)C1=CC=CC2=NON=C12 Z1262517688 [0,1,0,1,0,0|2,0,0]=4 1583 B13R2.573 COC1=C2CCC(=O)C2=CC=C1 Z334686332 [0,1,0,1,0,0|1,0,0]=3 1584 B13R2.573 COC1=C2CCC(C2=CC=C1)N Z334686352 [0,1,0,1,0,0|1,0,1]=4 1585 B13R2.573 COC1=C2CNC(=O)C2=CC=C1 Z1198221039 [0,1,0,1,0,0|0,0,0]=2 1586 B13R2.573 COC1=C2NC=C(C2=CC=N1)I Z1269132309 [0,1,0,1,0,0|2,0,0]=4 1587 B13R2.573 COC1=C2OCC(C2=CC=C1)N Z3244827605 [0,1,0,1,0,0|0,0,2]=4 1588 B13R2.573 COC1=CC=CN2C1=NNC2=O Z1813147479 [0,1,0,1,0,0|1,0,0]=3 1589 B13R2.669 COC1=CC2=C(C=C1)CCC2N Z3234887230 [0,1,0,1,0,0|1,0,1]=4 1590 B13R2.669 COC1=CC2=C(C=C1)CNC2=O Z1198176505 [0,1,0,1,0,0|0,0,0]=2 1591 B13R2.669 COC1=CC2=C(C=C1)NN=C2N Z1198276906 [0,1,0,1,0,0|1,0,0]=3 1592 B13R2.669 COC1=CC2=C(C=C1)OCC2=O Z334863074 [0,1,0,1,0,0|1,0,0]=3 1593 B13R2.669 COC1=NC2=C(C=C1)NC=C2I Z1269217997 [0,1,0,1,0,0|2,0,0]=4 1594 B13R2.669 NCC1=CC2=C(C=C1)CNC2=O Z1255358776 [0,1,0,1,0,0|2,0,0]=4 1595 B13R2.2033 COC1=CC(=CC=C1)C2(CC2)N Z2039477462 [0,1,0,1,0,0|1,0,1]=4 1596 B9R1.35 CC(=O)C1=CC=C(O1)C Z94598638 [1,0,0,0,1,0|2,0,0]=4 1597 B9R1.35 CC(=O)C1=CN(C=C1)C Z1255475557 [1,0,0,0,1,0|2,0,0]=4 1598 B9R1.35 CC(=O)C1=CSC(=C1)C Z1238833318 [1,0,0,0,1,0|2,0,0]=4 1599 B9R1.35 CC1=CC(=CN1)C(=O)O Z1198267230 [1,0,0,0,1,0|2,0,0]=4 1600 B9R1.35 CC1=CC(=CO1)C(=O)O Z1205493994 [1,0,0,0,1,0|2,0,0]=4 1601 B9R1.35 CC1=CC(=CS1)C(=O)O Z979749380 [1,0,0,0,1,0|2,0,0]=4 1602 B9R1.35 CC1=CC=C(O1)C(=N)N Z3235164533 [1,0,0,0,1,0|2,0,0]=4 1603 B9R1.35 CC1=CC=C(O1)C(=O)N Z33547151 [1,0,0,0,1,0|1,0,0]=3 1604 B9R1.35 CC1=CC=C(O1)C(=O)O Z56895714 [1,0,0,0,1,0|2,0,0]=4 1605 B9R1.35 CC1=CC=C(S1)C(=O)O Z104494884 [1,0,0,0,1,0|2,0,0]=4 1606 B9R1.35 CC1=CNC(=C1)C(=O)O Z1201622537 [1,0,0,0,1,0|2,0,0]=4 1607 B9R1.35 CC1=COC(=C1)C(=O)O Z1205494707 [1,0,0,0,1,0|2,0,0]=4 1608 B9R1.35 CC1=CSC(=C1)C(=O)O Z1203160201 [1,0,0,0,1,0|2,0,0]=4 1609 B9R1.35 CC1=NC=C(S1)C(=O)N Z915738900 [1,0,0,0,1,0|2,0,0]=4 1610 B9R1.35 CN1C=C(C=N1)C(=O)N Z101186202 [1,0,0,0,1,0|2,0,0]=4 1611 B9R1.35 CN1C=CC(=C1)C(=O)O Z1198315029 [1,0,0,0,1,0|2,0,0]=4 1612 B9R1.35 NC(=O)C1=CC(=CN1)N Z1198394173 [1,0,0,0,1,0|2,0,0]=4 1613 B9R1.35 NC(=O)C1=CC(=CS1)Br Z274460840 [1,0,0,0,1,0|2,0,0]=4 1614 B9R1.35 NC(=O)C1=CC(=CS1)N Z1203653961 [1,0,0,0,1,0|2,0,0]=4 1615 B9R1.35 NC(=O)C1=CC=C(O1)Br Z33546653 [1,0,0,0,1,0|2,0,0]=4 1616 B9R1.35 NC(=O)C1=CC=C(S1)Br Z33546697 [1,0,0,0,1,0|2,0,0]=4 1617 B9R1.35 NC(=O)C1=COC(=C1)Br Z337983072 [1,0,0,0,1,0|2,0,0]=4 1618 B9R1.35 NC(=O)C1=CSC(=C1)Br Z337982980 [1,0,0,0,1,0|2,0,0]=4 1619 B9R1.35 NC(=O)C1=CSC(=C1)I Z1151517068 [1,0,0,0,1,0|2,0,0]=4 1620 B9R1.35 O=C(O)C1=CC(=CS1)O Z1157742699 [1,0,0,0,1,0|2,0,0]=4 1621 B9R1.41 CC(=O)C1=C(C=CO1)C Z1386912896 [1,0,0,0,1,0|2,0,0]=4 1622 B9R1.41 CC(=O)C1=C(C=CS1)C Z837063696 [1,0,0,0,1,0|2,0,0]=4 1623 B9R1.41 CC(=O)C1=CC=CN1C Z1255461119 [1,0,0,0,1,0|2,0,0]=4 1624 B9R1.41 CC1=C(C=CN1)C(=O)O Z1203731440 [1,0,0,0,1,0|2,0,0]=4 1625 B9R1.41 CC1=C(C=CO1)C(=N)N Z1198218315 [1,0,0,0,1,0|2,0,0]=4 1626 B9R1.41 CC1=C(C=CO1)C(=O)O Z104479606 [1,0,0,0,1,0|2,0,0]=4 1627 B9R1.41 CC1=C(C=CS1)C(=O)O Z1198158842 [1,0,0,0,1,0|2,0,0]=4 1628 B9R1.41 CC1=C(NC=C1)C(=O)O Z1198173378 [1,0,0,0,1,0|2,0,0]=4 1629 B9R1.41 CC1=C(OC=C1)C(=N)N Z1255465907 [1,0,0,0,1,0|2,0,0]=4 1630 B9R1.41 CC1=C(OC=C1)C(=O)N Z278515020 [1,0,0,0,1,0|1,0,0]=3 1631 B9R1.41 CC1=C(OC=C1)C(=O)O Z147652428 [1,0,0,0,1,0|2,0,0]=4 1632 B9R1.41 CC1=C(SC=C1)C(=O)O Z104474228 [1,0,0,0,1,0|2,0,0]=4 1633 B9R1.41 CC1=CNC=C1C(=O)O Z385477350 [1,0,0,0,1,0|2,0,0]=4 1634 B9R1.41 CC1=COC=C1C(=O)O Z1205494071 [1,0,0,0,1,0|2,0,0]=4 1635 B9R1.41 CC1=CSC=C1C(=O)O Z1198160007 [1,0,0,0,1,0|2,0,0]=4 1636 B9R1.41 CC1=NOC=C1C(=O)N Z1203586398 [1,0,0,0,1,0|2,0,0]=4 1637 B9R1.41 CN1C=CC=C1C(=N)N Z4914354380 [1,0,0,0,1,0|2,0,0]=4 1638 B9R1.41 CN1C=CC=C1C(=O)N Z56852683 [1,0,0,0,1,0|1,0,0]=3 1639 B9R1.41 CN1C=CC=C1C(=O)O Z56899027 [1,0,0,0,1,0|2,0,0]=4 1640 B9R1.41 CN1C=CN=C1C(=O)N Z1203578467 [1,0,0,0,1,0|2,0,0]=4 1641 B9R1.41 NC(=O)C1=C(C=CS1)N Z756172862 [1,0,0,0,1,0|2,0,0]=4 1642 B9R1.41 NC(=O)C1=C(N=CN1)O Z1198170628 [1,0,0,0,1,0|2,0,0]=4 1643 B9R1.41 NC(=O)C1=C(SC=C1)Br Z1269126697 [1,0,0,0,1,0|2,0,0]=4 1644 B9R1.41 NC(=O)C1=C(SC=C1)N Z56800649 [1,0,0,0,1,0|2,0,0]=4 1645 B9R1.14 CCC1=C(OC=C1)C=O Z1511886468 [1,0,0,0,1,0|2,0,0]=4 1646 B9R1.14 CCC1=C(SC=C1)C=O Z1362759539 [1,0,0,0,1,0|2,0,0]=4 1647 B9R1.14 CCN1C=CC=C1C=O Z425487130 [1,0,0,0,1,0|2,0,0]=4 1648 B9R1.14 COC1=C(C=CS1)C=O Z3174715855 [1,0,0,0,1,0|1,0,0]=3 1649 B9R1.14 COC1=C(SC=C1)C=O Z1201621119 [1,0,0,0,1,0|1,0,0]=3 1650 B9R1.14 COC1=CSC=C1C=O Z1504677181 [1,0,0,0,1,0|1,0,0]=3 1651 B9R1.14 COC1=NNC=C1C=O Z1198187051 [1,0,0,0,1,0|2,0,0]=4 1652 B9R1.14 COC1=NSC=C1C=O Z2755723970 [1,0,0,0,1,0|2,0,0]=4 1653 B9R1.14 CSC1=CSC=C1C=O Z1511755848 [1,0,0,0,1,0|1,1,0]=4 1654 B9R1.21 CCC1=CC=C(N1)C=O Z1251356864 [1,0,0,0,1,0|2,0,0]=4 1655 B9R1.21 CCC1=CC=C(O1)C=O Z274774406 [1,0,0,0,1,0|2,0,0]=4 1656 B9R1.21 CCC1=CC=C(S1)C=O Z385369988 [1,0,0,0,1,0|2,0,0]=4 1657 B9R1.21 CCN1C=CC(=C1)C=O Z1255361868 [1,0,0,0,1,0|2,0,0]=4 1658 B9R1.21 COC1=CC=C(O1)C=O Z1309664827 [1,0,0,0,1,0|1,0,0]=3 1659 B9R1.21 COC1=CC=C(S1)C=O Z1255429054 [1,0,0,0,1,0|1,0,0]=3 1660 B9R1.21 COC1=NC(=CS1)C=O Z1216842200 [1,0,0,0,1,0|2,0,0]=4 1661 B9R1.21 COC1=NC=C(S1)C=O Z1198220900 [1,0,0,0,1,0|2,0,0]=4 1662 B9R1.21 COC1=NSC(=C1)C=O Z1216842689 [1,0,0,0,1,0|2,0,0]=4 1663 B9R1.21 CSC1=CC=C(N1)C=O Z1198158851 [1,0,0,0,1,0|1,1,0]=4 1664 B9R1.21 CSC1=CC=C(O1)C=O Z1157748816 [1,0,0,0,1,0|1,1,0]=4 1665 B9R1.21 CSC1=CC=C(S1)C=O Z367487368 [1,0,0,0,1,0|1,1,0]=4 1666 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,0,0,0,0,1|2,0,0]=4 1667 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,0,0,0,0,1|2,0,0]=4 1668 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,0,0,0,0,1|2,0,0]=4 1669 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [1,0,0,0,0,1|2,0,0]=4 1670 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [1,0,0,0,0,1|2,0,0]=4 1671 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [1,0,0,0,0,1|2,0,0]=4 1672 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [1,0,0,0,0,1|1,0,0]=3 1673 B11R1.157 CC(=O)NC1=C[N+](=CC=C1)C Z56760720 [1,0,0,0,0,1|2,0,0]=4 1674 B11R1.157 CC(=O)NC1=NC(=CC=C1)C Z183992496 [1,0,0,0,0,1|2,0,0]=4 1675 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,0,0,0,0,1|1,0,1]=4 1676 B11R1.157 CC1=CC(=CC=C1)NC(=N)N Z979503154 [1,0,0,0,0,1|1,0,0]=3 1677 B11R1.157 CC1=CC(=CC=C1)NC(=S)N Z56921365 [1,0,0,0,0,1|0,1,0]=3 1678 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,0,0,0,0,1|2,0,0]=4 1679 B11R1.157 C[N+]1=CC(=CC=C1)NC(=O)N Z56791760 [1,0,0,0,0,1|1,0,0]=3 1680 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,0,0,0,0,1|2,0,0]=4 1681 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,0,0,0,0,1|2,0,0]=4 1682 B11R1.157 N=C(N)NC1=CC(=CC=C1)Cl Z979503082 [1,0,0,0,0,1|2,0,0]=4 1683 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,0,0,0,0,1|1,0,0]=3 1684 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,0,0,0,0,1|1,0,0]=3 1685 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,0,0,0,0,1|0,0,0]=2 1686 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [1,0,0,0,0,1|1,0,0]=3 1687 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [1,0,0,0,0,1|1,0,0]=3 1688 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [1,0,0,0,0,1|1,0,0]=3 1689 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [1,0,0,0,0,1|1,0,0]=3 1690 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,0,0,0,0,1|0,0,0]=2 1691 B11R1.157 NC(=S)NC1=CC(=CC=C1)Br Z111871258 [1,0,0,0,0,1|1,1,0]=4 1692 B11R1.157 NC(=S)NC1=CC(=CC=C1)Cl Z199466968 [1,0,0,0,0,1|1,1,0]=4 1693 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [1,0,0,0,0,1|0,1,0]=3 1694 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,0,0,0,0,1|2,0,0]=4 1695 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,0,0,0,0,1|2,0,0]=4 1696 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,0,0,0,0,1|2,0,0]=4 1697 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,0,0,0,0,1|2,0,0]=4 1698 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,0,0,0,0,1|2,0,0]=4 1699 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,0,0,0,0,1|1,0,0]=3 1700 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [1,0,0,0,0,1|2,0,0]=4 1701 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [1,0,0,0,0,1|2,0,0]=4 1702 B11R1.3 C#CC1=CC=C(C=C1)C(=O)N Z1203579154 [0,0,0,0,1,1|1,0,1]=4 1703 B11R1.3 C=CC1=CC=C(C=C1)C(=O)N Z1203578780 [0,0,0,0,1,1|1,0,1]=4 1704 B11R1.3 CCC1=CC=C(C=C1)C(=N)N Z1268152427 [0,0,0,0,1,1|2,0,0]=4 1705 B11R1.3 CCC1=CC=C(C=C1)C(=O)O Z104478474 [0,0,0,0,1,1|2,0,0]=4 1706 B11R1.3 CCC1=CC=C(C=C1)C(=S)N Z57989304 [0,0,0,0,1,1|1,1,0]=4 1707 B11R1.3 CCC1=CN=C(C=C1)C(=O)O Z3693286572 [0,0,0,0,1,1|2,0,0]=4 1708 B11R1.3 CCC1=NC=C(C=C1)C(=O)O Z5589439234 [0,0,0,0,1,1|2,0,0]=4 1709 B11R1.3 CNC1=CC=C(C=C1)C(=N)N Z1815149179 [0,0,0,0,1,1|2,0,0]=4 1710 B11R1.3 CNC1=CC=C(C=C1)C(=O)C Z1082871512 [0,0,0,0,1,1|2,0,0]=4 1711 B11R1.3 CNC1=CC=C(C=C1)C(=O)N Z744754554 [0,0,0,0,1,1|1,0,0]=3 1712 B11R1.3 CNC1=CC=C(C=C1)C(=O)O Z727574068 [0,0,0,0,1,1|2,0,0]=4 1713 B11R1.3 CNC1=CN=C(C=C1)C(=O)O Z1498958162 [0,0,0,0,1,1|2,0,0]=4 1714 B11R1.3 CNC1=NC=C(C=C1)C(=O)N Z960186538 [0,0,0,0,1,1|1,0,0]=3 1715 B11R1.3 CNC1=NC=C(C=C1)C(=O)O Z330796292 [0,0,0,0,1,1|2,0,0]=4 1716 B11R1.3 COC1=CC=C(C=C1)C(=N)N Z228583094 [0,0,0,0,1,1|1,0,0]=3 1717 B11R1.3 COC1=CC=C(C=C1)C(=O)C Z53832960 [0,0,0,0,1,1|1,0,0]=3 1718 B11R1.3 COC1=CC=C(C=C1)C(=O)N Z33546492 [0,0,0,0,1,1|0,0,0]=2 1719 B11R1.3 COC1=CC=C(C=C1)C(=O)O Z56931884 [0,0,0,0,1,1|1,0,0]=3 1720 B11R1.3 COC1=CC=C(C=C1)C(=S)N Z56964598 [0,0,0,0,1,1|0,1,0]=3 1721 B11R1.3 COC1=CC=C(C=C1)[N+](=O)[O-] Z31131411 [0,0,0,0,1,1|2,0,0]=4 1722 B11R1.3 COC1=CN=C(C=C1)C(=N)N Z1255420591 [0,0,0,0,1,1|1,0,0]=3 1723 B11R1.3 COC1=CN=C(N=C1)C(=O)O Z1255462743 [0,0,0,0,1,1|2,0,0]=4 1724 B11R1.3 COC1=NC=C(C=C1)C(=N)N Z594272030 [0,0,0,0,1,1|1,0,0]=3 1725 B11R1.3 COC1=NC=C(C=C1)C(=O)O Z135188086 [0,0,0,0,1,1|1,0,0]=3 1726 B11R1.3 COC1=NC=C(C=C1)C(C)N Z3083124760 [0,0,0,0,1,1|1,0,1]=4 1727 B11R1.3 COC1=NC=C(C=N1)C(=O)O Z274574982 [0,0,0,0,1,1|2,0,0]=4 1728 B11R1.3 COC1=NC=C(N=C1)C(=N)N Z3778988390 [0,0,0,0,1,1|2,0,0]=4 1729 B11R1.3 COC1=NN=C(C=C1)C(=O)O Z502287048 [0,0,0,0,1,1|2,0,0]=4 1730 B11R1.3 CSC1=CC=C(C=C1)C(=N)N Z1267881768 [0,0,0,0,1,1|1,1,0]=4 1731 B11R1.3 CSC1=CC=C(C=C1)C(=O)C Z57036277 [0,0,0,0,1,1|1,1,0]=4 1732 B11R1.3 CSC1=CC=C(C=C1)C(=O)O Z57989066 [0,0,0,0,1,1|1,1,0]=4 1733 B11R1.3 CSC1=NC=C(C=C1)C(=O)O Z732206884 [0,0,0,0,1,1|1,1,0]=4 1734 B11R1.3 N#CC1=CC=C(C=C1)C(=O)N Z33546655 [0,0,0,0,1,1|2,0,0]=4 1735 B11R1.3 N#CC1=CN=C(C=C1)C(=O)N Z1147474196 [0,0,0,0,1,1|2,0,0]=4 1736 B11R1.3 NC(=O)C1=CC=C(C=C1)C=O Z316909626 [0,0,0,0,1,1|2,0,0]=4 1737 B11R1.3 NC(=O)C1=CC=C(C=C1)CCl Z154669306 [0,0,0,0,1,1|2,0,0]=4 1738 B11R1.3 NC(=O)C1=CC=C(C=C1)CO Z33545420 [0,0,0,0,1,1|2,0,0]=4 1739 B11R1.3 NCC1=CC=C(C=C1)C(=O)N Z57036329 [0,0,0,0,1,1|2,0,0]=4 1740 B13R1.643 CCC1=CC(=CC=C1)OCC(=O)O Z56910356 [0,0,0,0,0,2|2,0,0]=4 1741 B13R1.643 CNC1=CC(=CC=C1)CCC(=O)O Z1623872023 [0,0,0,0,0,2|2,0,0]=4 1742 B13R1.643 COC1=CC(=CC=C1)/C=C/C(=O)C Z85921945 [0,0,0,0,0,2|1,0,0]=3 1743 B13R1.643 COC1=CC(=CC=C1)/C=C/C(=O)O Z104494816 [0,0,0,0,0,2|1,0,0]=3 1744 B13R1.643 COC1=CC(=CC=C1)CCC(=O)O Z169916350 [0,0,0,0,0,2|1,0,0]=3 1745 B13R1.643 COC1=CC(=CC=C1)CNC(=O)N Z198194944 [0,0,0,0,0,2|0,0,0]=2 1746 B13R1.643 COC1=CC(=CC=C1)NCC(=O)N Z104592028 [0,0,0,0,0,2|0,0,0]=2 1747 B13R1.643 COC1=CC(=CC=C1)NCC(=O)O Z274534684 [0,0,0,0,0,2|1,0,0]=3 1748 B13R1.643 COC1=CC(=CC=C1)OCC(=O)O Z56782975 [0,0,0,0,0,2|1,0,0]=3 1749 B13R1.643 COC1=CC(=CC=C1)SCC(=O)N Z290601360 [0,0,0,0,0,2|0,0,0]=2 1750 B13R1.643 COC1=CC(=CC=C1)SCC(=O)O Z239812082 [0,0,0,0,0,2|1,0,0]=3 1751 B13R1.643 COC1=CC(=CN=C1)/C=C/C(=O)O Z1649893282 [0,0,0,0,0,2|2,0,0]=4 1752 B13R1.643 COC1=CC(=CN=C1)CCC(=O)O Z1255460812 [0,0,0,0,0,2|2,0,0]=4 1753 B13R1.643 COC1=NC(=CC=C1)CCC(=O)O Z3379430802 [0,0,0,0,0,2|2,0,0]=4 1754 B13R1.643 COC1=NC=CC(=C1)CNC(=N)N Z2235790869 [0,0,0,0,0,2|2,0,0]=4 1755 B13R1.643 N#CC1=CC=CC(=C1)OCC(=O)N Z18083670 [0,0,0,0,0,2|2,0,0]=4 1756 B13R1.643 NC(=O)COC1=CC(=CC=C1)CO Z57462495 [0,0,0,0,0,2|2,0,0]=4 1757 B13R1.643 NCC1=CC(=CC=C1)OCC(=O)N Z239127266 [0,0,0,0,0,2|2,0,0]=4