0 B11R1.166 BrC1=CC(=C(C=C1)[N+](=O)[O-])O AK-29073 [0,0,0,0,0,0|4,0,0]=4 1 B11R1.166 C1=C(C(=CC=C1C)B(O)O)Cl AK-39980 [0,0,0,0,0,0|4,0,0]=4 2 B11R1.166 C1=C(C(=CC=C1C)C(=O)O)N AK-25621 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.166 C1=C(C(=CC=C1Cl)C(C)=O)Cl AK-47301 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.166 C1=C([N+]([O-])=O)C(=CC(=C1)C)Cl AK-53744 [0,0,0,0,0,0|4,0,0]=4 5 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)F AK-46615 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.166 C1=CC(=CC(=C1C(C)=O)F)O AK-49094 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.166 C1=CC(=CC(=C1C(O)=O)C)C AK-47303 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.166 C1=CC(=CC(=C1C(O)=O)F)C AK-26324 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)C AK-73066 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)Cl AK-47585 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.166 C1=CC(=CC(=C1C(O)=O)O)F AK-29195 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.166 C1=CC(=CC(=C1[N+]([O-])=O)O)Cl AK-30056 [0,0,0,0,0,0|4,0,0]=4 13 B11R1.166 CC(=O)C1=C(N)C=C(C)C=C1 AK-75553 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.166 CC(C1=CC=C(Br)C=C1Cl)=O AK-77175 [0,0,0,0,0,0|3,0,1]=4 15 B11R1.166 CC(C1=CC=C(Br)C=C1F)=O AK-46535 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.166 CC(C1=CC=C(Br)C=C1N)=O AK-38008 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.166 CC(C1=CC=C(Br)C=C1O)=O AK-40002 [0,0,0,0,0,0|2,0,1]=3 18 B11R1.166 CC(C1=CC=C(C)C=C1F)=O AK115609 [0,0,0,0,0,0|2,0,1]=3 19 B11R1.166 CC(C1=CC=C(Cl)C=C1Br)=O AK-75637 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.166 CC(C1=CC=C(F)C=C1Cl)=O AK-53695 [0,0,0,0,0,0|3,0,1]=4 21 B11R1.166 CC(C1=CC=C(O)C=C1Br)=O AK-75734 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.166 CC(C1=CC=C(O)C=C1C)=O AK-50197 [0,0,0,0,0,0|3,0,1]=4 23 B11R1.166 CC(C1=CC=C(O)C=C1Cl)=O AK-36102 [0,0,0,0,0,0|3,0,1]=4 24 B11R1.166 CC(C1=CC=C(O)C=C1O)=O AK-50224 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.166 CC1=C(C=CC(=C1)C)B(O)O AK-35632 [0,0,0,0,0,0|4,0,0]=4 26 B11R1.166 CC1=CC=C(C(Br)=C1)N(C)C AK136564 [0,0,0,0,0,0|2,0,0]=2 27 B11R1.166 CC1=CC=C(C(O)=N1)[N+]([O-])=O AK-30343 [0,0,0,0,0,0|4,0,0]=4 28 B11R1.166 CC1=CC=C([N+]([O-])=O)C(F)=C1 AK-23702 [0,0,0,0,0,0|4,0,0]=4 29 B11R1.166 CC1=CC=C([N+]([O-])=O)C(N)=C1 AK-35723 [0,0,0,0,0,0|4,0,0]=4 30 B11R1.166 C[C@@H](N)C1=CC=C(Br)C=C1F AK544258 [0,0,0,0,0,0|3,0,0]=3 31 B11R1.166 C[C@@H](N)C1=CC=C(Cl)C=C1C AK134023 [0,0,0,0,0,0|3,0,0]=3 32 B11R1.166 C[C@@H](N)C1=CC=C(F)C=C1F AK-45015 [0,0,0,0,0,0|3,0,0]=3 33 B11R1.166 C[C@H](N)C1=CC=C(Br)C=C1F AK189376 [0,0,0,0,0,0|3,0,0]=3 34 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1C AK134048 [0,0,0,0,0,0|3,0,0]=3 35 B11R1.166 C[C@H](N)C1=CC=C(Cl)C=C1Cl AK130493 [0,0,0,0,0,0|3,0,0]=3 36 B11R1.166 C[C@H](N)C1=CC=C(F)C=C1F AK-73153 [0,0,0,0,0,0|3,0,0]=3 37 B11R1.166 ClC1=CC(=C(C=C1)C(C)=O)F AK-46375 [0,0,0,0,0,0|3,0,1]=4 38 B11R1.166 FC1=C(C=CC(=C1)C)B(O)O AK-27195 [0,0,0,0,0,0|4,0,0]=4 39 B11R1.166 FC1=C(C=CC(=C1)F)[C@H](C)N AK-42963 [0,0,0,0,0,0|3,0,0]=3 40 B11R1.166 NC1=CC(=C(C=C1)C(C)=O)O AK-34336 [0,0,0,0,0,0|2,0,1]=3 41 B11R1.166 N[C@H](C1=CC=C(C)C=C1C)C AK477325 [0,0,0,0,0,0|2,0,0]=2 42 B11R1.166 O=C(N)C1=CC=C(C)C=C1N AK-49754 [0,0,0,0,0,0|3,0,1]=4 43 B11R1.166 O=C(O)C1=CC=C(Br)C=C1O AK-44937 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.166 O=C(O)C1=CC=C(C)C=C1Br AK-36340 [0,0,0,0,0,0|3,0,1]=4 45 B11R1.166 O=C(O)C1=CC=C(C)C=C1Cl AK-36338 [0,0,0,0,0,0|3,0,1]=4 46 B11R1.166 O=C(O)C1=CC=C(C)C=C1I AK201253 [0,0,0,0,0,0|3,0,1]=4 47 B11R1.166 O=C(O)C1=CC=C(N)C=C1O AK-46320 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.166 O=C(O)C1=CC=C(O)C=C1O AK-88714 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.166 O=C([O-])C1=CC=C(N)C=C1O AK154081 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.166 OB(C1=CC=C(F)C=C1O)O AK-46419 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.166 OC1=C(C=CC(I)=C1)[N+]([O-])=O AK-80852 [0,0,0,0,0,0|4,0,0]=4 52 B11R1.166 OC1=CC(=NC=C1C(=O)O)C AK-25007 [0,0,0,0,0,0|3,0,1]=4 53 B11R1.166 OC1=CC(C)=CC=C1[N+]([O-])=O AK-29443 [0,0,0,0,0,0|3,0,0]=3 54 B11R1.166 OC1=CC=C(C(C)C)C(C)=C1 AK113729 [0,0,0,0,0,0|2,0,0]=2 55 B11R1.166 OC1=CC=C(C(C)C)C(O)=C1 AK-81550 [0,0,0,0,0,0|1,0,0]=1 56 B10R1.13 C1=C(B(O)O)C=CC(=C1)C AK-39805 [1,0,0,0,0,0|3,0,0]=4 57 B10R1.13 C1=C(C(C)C)C=CC(=C1)Br AK-47451 [1,0,0,0,0,0|1,0,0]=2 58 B10R1.13 C1=C(N(C)C)C=CC(=C1)Br AK-47628 [1,0,0,0,0,0|2,0,0]=3 59 B10R1.13 C1=C(N=CC(=C1)C(C)=O)C AK-25853 [1,0,0,0,0,0|2,0,1]=4 60 B10R1.13 C1=CC(=CC=C1C(C)=O)F AK-41690 [1,0,0,0,0,0|2,0,1]=4 61 B10R1.13 CC(Br)C1=CC=C(F)C=C1 AK-94758 [1,0,0,0,0,0|2,0,0]=3 62 B10R1.13 CC(C1=CC=C(Br)C=C1)=O AK124422 [1,0,0,0,0,0|2,0,1]=4 63 B10R1.13 CC(C1=CC=C(C)C=C1)=O AK-41305 [1,0,0,0,0,0|1,0,1]=3 64 B10R1.13 CC(C1=CC=C(N)C=C1)=O AK110424 [1,0,0,0,0,0|2,0,1]=4 65 B10R1.13 CC(C1=CC=C(O)C=C1)=O AK-86441 [1,0,0,0,0,0|2,0,1]=4 66 B10R1.13 CC(C1=CN=C(N)C=C1)C AK-81363 [1,0,0,0,0,0|2,0,0]=3 67 B10R1.13 CC(C1=NC=C(Br)C=N1)C AK173649 [1,0,0,0,0,0|3,0,0]=4 68 B10R1.13 CC(N)C1=CC=C(C)N=C1 AK684509 [1,0,0,0,0,0|2,0,0]=3 69 B10R1.13 CC(N)C1=CC=C(I)C=C1 AK-77292 [1,0,0,0,0,0|2,0,0]=3 70 B10R1.13 CC(N)C1=NC=C(C)C=C1 AK158768 [1,0,0,0,0,0|2,0,0]=3 71 B10R1.13 CC(O)C1=CC=C(Br)C=C1 AK117026 [1,0,0,0,0,0|2,0,0]=3 72 B10R1.13 CC(O)C1=CC=C(N)C=C1 AK109742 [1,0,0,0,0,0|2,0,0]=3 73 B10R1.13 CC(O)C1=CN=C(C)C=C1 AK-32149 [1,0,0,0,0,0|2,0,0]=3 74 B10R1.13 CC1=CC=C(S(O)=O)C=C1 AK-46949 [1,0,0,0,0,0|3,0,0]=4 75 B10R1.13 CN(C)C1=CC=C(C=C1)I AK101968 [1,0,0,0,0,0|2,0,0]=3 76 B10R1.13 CN(C)C1=CC=C(Cl)C=C1 AK136579 [1,0,0,0,0,0|2,0,0]=3 77 B10R1.13 CN(C)C1=CC=C(O)C=C1 AK-64702 [1,0,0,0,0,0|2,0,0]=3 78 B10R1.13 CN(C)C1=NC=C(Br)C=C1 AK-25675 [1,0,0,0,0,0|3,0,0]=4 79 B10R1.13 CN(C)C1=NC=C(I)C=C1 AK117849 [1,0,0,0,0,0|3,0,0]=4 80 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-45030 [1,0,0,0,0,0|2,0,0]=3 81 B10R1.13 C[C@@H](N)C1=CC=C(F)C=C1 AK-89611 [1,0,0,0,0,0|2,0,0]=3 82 B10R1.13 C[C@@H](N)C1=CC=C(I)C=C1 AK-43006 [1,0,0,0,0,0|2,0,0]=3 83 B10R1.13 C[C@@H](N)C1=NC=C(F)C=C1 AK204056 [1,0,0,0,0,0|3,0,0]=4 84 B10R1.13 C[C@@H](O)C1=CC=C(Br)C=C1 AK-79215 [1,0,0,0,0,0|2,0,0]=3 85 B10R1.13 C[C@H](N)C1=CC=C(Br)C=C1 AK-34471 [1,0,0,0,0,0|2,0,0]=3 86 B10R1.13 C[C@H](N)C1=CC=C(I)C=C1 AK548805 [1,0,0,0,0,0|2,0,0]=3 87 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK173009 [1,0,0,0,0,0|3,0,0]=4 88 B10R1.13 C[C@H](N)C1=NC=C(Br)C=C1 AK321169 [1,0,0,0,0,0|3,0,0]=4 89 B10R1.13 C[C@H](N)C1=NC=C(F)C=C1 AK668421 [1,0,0,0,0,0|3,0,0]=4 90 B10R1.13 C[C@H](O)C1=CC=C(Br)C=C1 AK-79189 [1,0,0,0,0,0|2,0,0]=3 91 B10R1.13 C[C@H](O)C1=CC=C(Cl)C=C1 AK-79216 [1,0,0,0,0,0|2,0,0]=3 92 B10R1.13 ClC1=NC=C(C=N1)C(C)C AK-25128 [1,0,0,0,0,0|3,0,0]=4 93 B10R1.13 FC(C1=CC=C(Cl)C=C1)F AK-77798 [1,0,0,0,0,0|3,0,0]=4 94 B10R1.13 NC1=CC=C(C(C)C)N=C1 AK-30855 [1,0,0,0,0,0|2,0,0]=3 95 B10R1.13 N[C@@H](C1=CC=C(Br)C=C1)C AK-35249 [1,0,0,0,0,0|2,0,0]=3 96 B10R1.13 N[C@@H](C1=CC=C(C)C=C1)C AK-45033 [1,0,0,0,0,0|1,0,0]=2 97 B10R1.13 N[C@H](C1=CC=C(F)C=C1)C AK-98664 [1,0,0,0,0,0|2,0,0]=3 98 B10R1.13 O=C(O)C1=CC=C(C)C=C1 AK106262 [1,0,0,0,0,0|2,0,1]=4 99 B10R1.13 O=S(C1=CC=C(C)C=C1)O AK143296 [1,0,0,0,0,0|3,0,0]=4 100 B10R1.13 O=S(C1=CC=C(C)C=C1)[O-] AK106973 [1,0,0,0,0,0|3,0,0]=4 101 B10R1.13 O=[S@@](C1=CC=C(C)C=C1)N AK-81446 [1,0,0,0,0,0|3,0,0]=4 102 B10R1.13 OC1=CC=C(C(C)=C)C=C1 AK117164 [1,0,0,0,0,0|1,0,2]=4 103 B10R1.13 OC1=CC=C(C(O)C)C=C1 AK-45202 [1,0,0,0,0,0|2,0,0]=3 104 B10R1.13 OC1=CC=C(C=C1)C(F)F AK-76781 [1,0,0,0,0,0|3,0,0]=4 105 B10R1.13 OC1=CC=C(N(C)C)C=C1 AK103764 [1,0,0,0,0,0|2,0,0]=3 106 B10R1.13 OC1=CC=C([C@H](N)C)C=C1 AK608003 [1,0,0,0,0,0|2,0,0]=3 107 B10R1.25 BrC1=C(C#N)C=CC(=C1)C AK-35136 [1,0,0,0,0,0|2,0,1]=4 108 B10R1.25 BrC1=C(C=CC(=C1)O)OC AK-25497 [1,0,0,0,0,0|3,0,0]=4 109 B10R1.25 BrC1=C(CBr)C=CC(=C1)F AK-35842 [1,0,0,0,0,0|3,0,0]=4 110 B10R1.25 BrC1=CC(=C(C=C1)OC)C AK-54791 [1,0,0,0,0,0|3,0,0]=4 111 B10R1.25 C1=C(C(=CC(=C1)C)N)C#N AK-34455 [1,0,0,0,0,0|2,0,1]=4 112 B10R1.25 C1=CC(=CC(=C1C#N)Cl)C AK-34090 [1,0,0,0,0,0|2,0,1]=4 113 B10R1.25 C1=CC(=CC(=C1C#N)F)C AK-36561 [1,0,0,0,0,0|2,0,1]=4 114 B10R1.25 CC1=CC(Br)=CC=C1CBr AK-59622 [1,0,0,0,0,0|3,0,0]=4 115 B10R1.25 CC1=CC(Br)=CC=C1CF AK687461 [1,0,0,0,0,0|3,0,0]=4 116 B10R1.25 CC1=CC(Cl)=C(CN)C=C1 AK-76787 [1,0,0,0,0,0|2,0,0]=3 117 B10R1.25 CC1=CC(I)=CC=C1OC AK135933 [1,0,0,0,0,0|3,0,0]=4 118 B10R1.25 CC1=CC=C(C(Br)=C1)NC AK189204 [1,0,0,0,0,0|2,0,0]=3 119 B10R1.25 CC1=CC=C(CBr)C(Br)=N1 AK156211 [1,0,0,0,0,0|3,0,0]=4 120 B10R1.25 CC1=CC=C(OC)C(Br)=N1 AK-59810 [1,0,0,0,0,0|3,0,0]=4 121 B10R1.25 CC1=CC=C(OC)C(Cl)=N1 AK150744 [1,0,0,0,0,0|3,0,0]=4 122 B10R1.25 CC1=CN=C(CBr)C(C)=C1 AK147252 [1,0,0,0,0,0|3,0,0]=4 123 B10R1.25 CC1=CN=C(CCl)C(C)=C1 AK103627 [1,0,0,0,0,0|3,0,0]=4 124 B10R1.25 CC1=CN=C(CO)C(C)=C1 AK102022 [1,0,0,0,0,0|3,0,0]=4 125 B10R1.25 CC1=CN=C(OC)C(Br)=C1 AK-40365 [1,0,0,0,0,0|3,0,0]=4 126 B10R1.25 CC1=CN=C(OC)C(Cl)=C1 AK133238 [1,0,0,0,0,0|3,0,0]=4 127 B10R1.25 COC1=C(F)C=C(Br)C=C1 AK-34268 [1,0,0,0,0,0|3,0,0]=4 128 B10R1.25 COC1=C(N)C=C(I)C=C1 AK-36369 [1,0,0,0,0,0|3,0,0]=4 129 B10R1.25 COC1=C(O)C=C(Cl)C=C1 AK-81614 [1,0,0,0,0,0|2,0,0]=3 130 B10R1.25 COC1=C(O)C=C(N)C=C1 AK-63517 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.25 COC1=CC=C(Br)C=C1I AK120134 [1,0,0,0,0,0|3,0,0]=4 132 B10R1.25 COC1=CC=C(Cl)C=C1Br AK-35821 [1,0,0,0,0,0|3,0,0]=4 133 B10R1.25 COC1=CC=C(Cl)C=C1I AK-26072 [1,0,0,0,0,0|3,0,0]=4 134 B10R1.25 COC1=CC=C(F)C=C1Br AK-35213 [1,0,0,0,0,0|3,0,0]=4 135 B10R1.25 COC1=CC=C(I)C=C1F AK143337 [1,0,0,0,0,0|3,0,0]=4 136 B10R1.25 ClC1=CC(=C(C=O)C=C1)O AK-23506 [1,0,0,0,0,0|2,0,1]=4 137 B10R1.25 FC1=CC(=C(C=C1)OC)O AK-36233 [1,0,0,0,0,0|2,0,0]=3 138 B10R1.25 FC1=CC=C(C(=C1)O)C=O AK-25824 [1,0,0,0,0,0|2,0,1]=4 139 B10R1.25 FC1=CC=C(CBr)C(Cl)=C1 AK-86341 [1,0,0,0,0,0|3,0,0]=4 140 B10R1.25 N#CC1=CC=C(Br)C=C1O AK-68396 [1,0,0,0,0,0|2,0,1]=4 141 B10R1.25 N#CC1=CC=C(C)C=C1C AK326723 [1,0,0,0,0,0|2,0,1]=4 142 B10R1.25 N#CC1=CC=C(Cl)C=C1O AK-68106 [1,0,0,0,0,0|2,0,1]=4 143 B10R1.25 N#CC1=CC=C(F)C=C1O AK158554 [1,0,0,0,0,0|2,0,1]=4 144 B10R1.25 N#CC1=CC=C(N)C=C1O AK321552 [1,0,0,0,0,0|2,0,1]=4 145 B10R1.25 N#CC1=CC=C(O)C=C1O AK-86504 [1,0,0,0,0,0|2,0,1]=4 146 B10R1.25 NC1=CC(Br)=CC=C1CC AK153468 [1,0,0,0,0,0|2,0,0]=3 147 B10R1.25 NC1=CC(Br)=CC=C1NC AK149385 [1,0,0,0,0,0|3,0,0]=4 148 B10R1.25 NC1=CC(Br)=CC=C1OC AK-39543 [1,0,0,0,0,0|3,0,0]=4 149 B10R1.25 NC1=CC(Cl)=CC=C1CC AK476943 [1,0,0,0,0,0|2,0,0]=3 150 B10R1.25 NC1=CC(Cl)=CC=C1NC AK138294 [1,0,0,0,0,0|3,0,0]=4 151 B10R1.25 NC1=CC(F)=CC=C1OC AK-33948 [1,0,0,0,0,0|3,0,0]=4 152 B10R1.25 NC1=CC=C(OC)C(Br)=C1 AK-33883 [1,0,0,0,0,0|3,0,0]=4 153 B10R1.25 NC1=CC=C(OC)C(C)=C1 AK-33185 [1,0,0,0,0,0|3,0,0]=4 154 B10R1.25 NC1=CC=C(OC)C(F)=C1 AK-25856 [1,0,0,0,0,0|3,0,0]=4 155 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-39498 [1,0,0,0,0,0|3,0,0]=4 156 B10R1.25 NC1=CC=C(OC)C(I)=C1 AK-61933 [1,0,0,0,0,0|3,0,0]=4 157 B10R1.25 NC1=CC=C(OC)C(N)=C1 AK-93491 [1,0,0,0,0,0|3,0,0]=4 158 B10R1.25 NCC1=C(Cl)C=C(Cl)C=C1 AK-89648 [1,0,0,0,0,0|3,0,0]=4 159 B10R1.25 NCC1=CC=C(Br)C=C1C AK156403 [1,0,0,0,0,0|3,0,0]=4 160 B10R1.25 NCC1=CC=C(Br)C=C1C AK431800 [1,0,0,0,0,0|3,0,0]=4 161 B10R1.25 NCC1=CC=C(Br)C=C1F AK-40759 [1,0,0,0,0,0|3,0,0]=4 162 B10R1.25 NCC1=CC=C(Cl)C=C1Br AK601695 [1,0,0,0,0,0|3,0,0]=4 163 B10R1.25 NCC1=CC=C(F)C=C1F AK-61922 [1,0,0,0,0,0|3,0,0]=4 164 B10R1.25 NNC1=CC=C(C)C=C1C AK-35813 [1,0,0,0,0,0|3,0,0]=4 165 B10R1.25 NNC1=CC=C(C)C=C1Cl AK-36824 [1,0,0,0,0,0|3,0,0]=4 166 B10R1.25 O=CC1=CC=C(Br)C=C1O AK-24055 [1,0,0,0,0,0|2,0,1]=4 167 B10R1.25 O=CC1=CC=C(C)C=C1Br AK-36471 [1,0,0,0,0,0|2,0,1]=4 168 B10R1.25 O=CC1=CC=C(C)C=C1C AK-51228 [1,0,0,0,0,0|2,0,1]=4 169 B10R1.25 O=CC1=CC=C(C)C=C1Cl AK-51348 [1,0,0,0,0,0|2,0,1]=4 170 B10R1.25 O=CC1=CC=C(C)C=C1F AK-25429 [1,0,0,0,0,0|2,0,1]=4 171 B10R1.25 O=CC1=CC=C(C)C=C1O AK-30310 [1,0,0,0,0,0|1,0,1]=3 172 B10R1.25 O=CC1=CC=C(I)C=C1O AK137741 [1,0,0,0,0,0|2,0,1]=4 173 B10R1.25 O=CC1=CC=C(O)C=C1O AK-50262 [1,0,0,0,0,0|2,0,1]=4 174 B10R1.25 OC1=C(C#N)C=CC(=C1)C AK-33832 [1,0,0,0,0,0|1,0,1]=3 175 B10R1.25 OC1=CC(Br)=CC=C1CN AK154932 [1,0,0,0,0,0|2,0,0]=3 176 B10R1.25 OC1=CC(Br)=CC=C1OC AK159188 [1,0,0,0,0,0|2,0,0]=3 177 B10R1.25 OC1=CC=C(OC)C(F)=C1 AK-35214 [1,0,0,0,0,0|3,0,0]=4 178 B10R1.25 OC1=CC=C(OC)C(O)=C1 AK114475 [1,0,0,0,0,0|2,0,0]=3 179 B10R1.25 OCC1=C(Br)C=C(Br)C=C1 AK-76830 [1,0,0,0,0,0|3,0,0]=4 180 B10R1.25 OCC1=C(F)C=C(Cl)C=C1 AK-46376 [1,0,0,0,0,0|3,0,0]=4 181 B10R1.25 OCC1=CC=C(Br)C=C1C AK-59623 [1,0,0,0,0,0|3,0,0]=4 182 B10R1.25 OCC1=CC=C(Br)C=C1N AK-30952 [1,0,0,0,0,0|3,0,0]=4 183 B10R1.25 OCC1=CC=C(C)C=C1C AK-61593 [1,0,0,0,0,0|2,0,0]=3 184 B10R1.25 OCC1=CC=C(Cl)C=C1Cl AK-86288 [1,0,0,0,0,0|3,0,0]=4 185 B10R1.25 OCC1=CC=C(N)C=C1C AK143112 [1,0,0,0,0,0|3,0,0]=4 186 B10R1.61 C1=C(C(=CC=C1)B(O)O)O AK-45876 [1,0,0,0,0,0|3,0,0]=4 187 B10R1.61 C1=CC(=C(C=C1)N(C)C)N AK-65098 [1,0,0,0,0,0|2,0,0]=3 188 B10R1.61 C1=CC=CC(=C1C(C)=O)Br AK-48030 [1,0,0,0,0,0|2,0,1]=4 189 B10R1.61 C1=CC=CC(=C1C(C)=O)N AK-27106 [1,0,0,0,0,0|2,0,1]=4 190 B10R1.61 C1=CC=CC(=C1O)C(=O)C AK-44482 [1,0,0,0,0,0|1,0,1]=3 191 B10R1.61 CC(=O)C1=C(I)C=CC=C1 AK-84650 [1,0,0,0,0,0|2,0,1]=4 192 B10R1.61 CC(C)C1=C(Cl)N=CN=C1 AK110098 [1,0,0,0,0,0|3,0,0]=4 193 B10R1.61 CC(C1=C(O)C=NC=C1)=O AK-68365 [1,0,0,0,0,0|2,0,1]=4 194 B10R1.61 CC(C1=CC=CC=C1Br)C AK-80369 [1,0,0,0,0,0|1,0,0]=2 195 B10R1.61 CC(C1=CC=CC=C1C)=O AK-76969 [1,0,0,0,0,0|2,0,1]=4 196 B10R1.61 CC(C1=CC=CC=C1F)=O AK-44672 [1,0,0,0,0,0|2,0,1]=4 197 B10R1.61 CC(C1=CC=CC=C1I)C AK113600 [1,0,0,0,0,0|1,0,0]=2 198 B10R1.61 CC(C1=NC=CC=C1O)=O AK-57786 [1,0,0,0,0,0|2,0,1]=4 199 B10R1.61 CC(N)C1=CC=CC=C1Br AK548207 [1,0,0,0,0,0|2,0,0]=3 200 B10R1.61 CC(N)C1=CC=CC=C1Cl AK-78769 [1,0,0,0,0,0|2,0,0]=3 201 B10R1.61 CC(N)C1=CC=CC=C1Cl AK133214 [1,0,0,0,0,0|2,0,0]=3 202 B10R1.61 CC(N)C1=CC=CC=C1F AK-78757 [1,0,0,0,0,0|2,0,0]=3 203 B10R1.61 CC(N)C1=NC=CC=C1C AK670791 [1,0,0,0,0,0|3,0,0]=4 204 B10R1.61 CC(O)C1=C(F)C=NC=C1 AK174609 [1,0,0,0,0,0|3,0,0]=4 205 B10R1.61 CC(O)C1=CC=CN=C1Cl AK118779 [1,0,0,0,0,0|3,0,0]=4 206 B10R1.61 CN(C)C1=C(Br)C=NC=C1 AK113556 [1,0,0,0,0,0|3,0,0]=4 207 B10R1.61 CN(C)C1=C(O)C=CC=C1 AK-49738 [1,0,0,0,0,0|1,0,0]=2 208 B10R1.61 CN(C)C1=CC=CC=C1Br AK-86039 [1,0,0,0,0,0|2,0,0]=3 209 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK114068 [1,0,0,0,0,0|2,0,0]=3 210 B10R1.61 C[C@@H](N)C1=CC=CC=C1Br AK155333 [1,0,0,0,0,0|2,0,0]=3 211 B10R1.61 C[C@@H](N)C1=CC=CC=C1C AK-45079 [1,0,0,0,0,0|2,0,0]=3 212 B10R1.61 C[C@@H](N)C1=CC=CC=C1Cl AK-42131 [1,0,0,0,0,0|2,0,0]=3 213 B10R1.61 C[C@@H](N)C1=CC=CC=C1F AK-33841 [1,0,0,0,0,0|2,0,0]=3 214 B10R1.61 C[C@@H](O)C1=CC=CC=C1Cl AK-49059 [1,0,0,0,0,0|2,0,0]=3 215 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK-59163 [1,0,0,0,0,0|2,0,0]=3 216 B10R1.61 C[C@H](N)C1=CC=CC=C1Br AK174547 [1,0,0,0,0,0|2,0,0]=3 217 B10R1.61 C[C@H](N)C1=CC=CC=C1C AK162902 [1,0,0,0,0,0|2,0,0]=3 218 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK-36100 [1,0,0,0,0,0|2,0,0]=3 219 B10R1.61 C[C@H](N)C1=CC=CC=C1F AK162903 [1,0,0,0,0,0|2,0,0]=3 220 B10R1.61 C[C@H](O)C1=CC=CC=C1Cl AK-57726 [1,0,0,0,0,0|2,0,0]=3 221 B10R1.61 C[C@H](O)C1=CC=CC=C1F AK114295 [1,0,0,0,0,0|2,0,0]=3 222 B10R1.61 NC(C1=CC=CC=C1Br)C AK-50562 [1,0,0,0,0,0|2,0,0]=3 223 B10R1.61 NC1=C(C(C)C)C=NC=C1 AK349169 [1,0,0,0,0,0|2,0,0]=3 224 B10R1.61 N[C@@H](C1=CC=CC=C1F)C AK-42098 [1,0,0,0,0,0|2,0,0]=3 225 B10R1.61 OC1=CC=CC=C1C(N)=O AK-81394 [1,0,0,0,0,0|2,0,1]=4 226 B10R1.61 OC1=CC=CC=C1C(O)=O AK397674 [1,0,0,0,0,0|2,0,1]=4 227 B12R1.57 CC(C1=CC=C(Br)C=C1OC)=O AK104826 [0,1,0,0,0,0|2,0,1]=4 228 B12R1.57 COC1=C(C=CC(N)=C1)C(C)=O AK-86813 [0,1,0,0,0,0|2,0,1]=4 229 B12R1.126 CC(N)(C1=CC=C(Cl)C=C1Cl)C AK164911 [0,1,0,0,0,0|2,0,0]=3 230 B12R1.126 CC1=CC(Cl)=C(C=C1)C(F)(F)F AK-36272 [0,1,0,0,0,0|3,0,0]=4 231 B12R1.126 NC1=CC(C)=CC=C1C(F)(F)F AK122430 [0,1,0,0,0,0|3,0,0]=4 232 B12R1.126 NC1=CC=C(C(C)(C)C)C(Br)=C1 AK130597 [0,1,0,0,0,0|2,0,0]=3 233 B12R1.232 CC(C1=CC(F)=C(Br)C=C1O)=O AK252572 [0,1,0,0,0,0|2,0,1]=4 234 B12R1.232 CC(C1=CC(O)=C(O)C=C1O)=O AK153502 [0,1,0,0,0,0|2,0,1]=4 235 B12R1.232 O=C1C(C(C)C)=CC(C(C)=C1)=O AK101679 [0,1,0,0,0,0|0,0,1]=2 236 B12R1.232 OC1=CC(C)=C(Br)C=C1[N+]([O-])=O AK-50977 [0,1,0,0,0,0|3,0,0]=4 237 B12R1.452 C1=CC(=CC(=C1C(C)=O)F)OC AK-36270 [0,1,0,0,0,0|2,0,1]=4 238 B12R1.452 CC(C1=CC=C(OC)C=C1O)=O AK-79421 [0,1,0,0,0,0|1,0,1]=3 239 B12R1.452 COC1=CC(O)=C(C=C1)C(O)=O AK-34197 [0,1,0,0,0,0|2,0,1]=4 240 B12R1.452 COC1=CC(O)=C(C=C1)C([O-])=O AK103858 [0,1,0,0,0,0|2,0,1]=4 241 B12R1.452 C[C@H](N)C1=CC=C(OC)C=C1F AK133432 [0,1,0,0,0,0|2,0,0]=3 242 B12R1.452 O=CC1=CC=C(N(C)C)C(C)=C1 AK-57047 [0,1,0,0,0,0|2,0,1]=4 243 B12R1.452 OC1=CC(OC)=CC=C1[N+]([O-])=O AK-29448 [0,1,0,0,0,0|3,0,0]=4 244 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O AK-96677 [0,1,0,0,0,0|2,0,1]=4 245 B12R1.1000 CC(O)C1=C(F)C=C(Br)C=C1F AK167902 [0,1,0,0,0,0|3,0,0]=4 246 B12R1.1703 BrC1=C(C(=O)OC)C=CC(=C1)C AK-46754 [0,1,0,0,0,0|2,0,1]=4 247 B12R1.1703 C1=C(C(=CC(=C1)O)O)C(OC)=O AK-50554 [0,1,0,0,0,0|2,0,1]=4 248 B12R1.1703 C1=CC(=CC(=C1C(OC)=O)O)N AK-45502 [0,1,0,0,0,0|2,0,1]=4 249 B12R1.1703 CC[C@@H](C1=CC=C(C)C=C1C)N AK134037 [0,1,0,0,0,0|2,0,0]=3 250 B12R1.1703 COC(=O)C1=C(O)C=C(C)C=C1 AK-82342 [0,1,0,0,0,0|1,0,1]=3 251 B12R1.1703 COC(=O)C1=CC=C(C)C=C1N AK-61296 [0,1,0,0,0,0|2,0,1]=4 252 B12R1.1703 ClC1=CC=C(C(N)CO)C(Cl)=C1 AK523897 [0,1,0,0,0,0|3,0,0]=4 253 B12R1.1703 ClC1=CC=C(C(N)CO)C(Cl)=C1 AK670792 [0,1,0,0,0,0|3,0,0]=4 254 B12R1.1703 FC1=CC(=C(C(=O)OC)C=C1)O AK-49085 [0,1,0,0,0,0|2,0,1]=4 255 B12R1.1703 O=C(OC)C1=CC=C(Br)C=C1O AK-88441 [0,1,0,0,0,0|2,0,1]=4 256 B12R1.1703 O=C(OC)C1=CC=C(C)C=C1C AK140642 [0,1,0,0,0,0|2,0,1]=4 257 B12R1.1703 O=C(OC)C1=CC=C(Cl)C=C1O AK-46989 [0,1,0,0,0,0|2,0,1]=4 258 B12R1.1703 O=C(OC)C1=CC=C(I)C=C1O AK144550 [0,1,0,0,0,0|2,0,1]=4 259 B12R2.612 CC1=CC=C2C(N)CCC2=C1 AK-60573 [0,0,0,1,0,0|2,0,0]=3 260 B12R2.612 CC1=NOC2=C1C=CC(=C2)O AK-24401 [0,0,0,1,0,0|2,0,1]=4 261 B12R2.612 CC1=NOC2=CC(Br)=CC=C12 AK-80171 [0,0,0,1,0,0|2,0,1]=4 262 B12R2.612 NC1CCC2=C1C=CC(Cl)=C2 AK-31447 [0,0,0,1,0,0|3,0,0]=4 263 B12R2.612 NC1COC2=CC(Br)=CC=C12 AK-27555 [0,0,0,1,0,0|2,0,0]=3 264 B12R2.612 N[C@@H]1CCC2=C1C=CC(Br)=C2 AK175313 [0,0,0,1,0,0|3,0,0]=4 265 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK-76304 [0,0,0,1,0,0|3,0,0]=4 266 B12R2.612 N[C@@H]1CCC2=C1C=CC(Cl)=C2 AK544242 [0,0,0,1,0,0|3,0,0]=4 267 B12R2.612 N[C@@H]1CCC2=C1C=CC(F)=C2 AK-42485 [0,0,0,1,0,0|3,0,0]=4 268 B12R2.612 N[C@H]1CCC2=C1C=CC(Br)=C2 AK-51085 [0,0,0,1,0,0|3,0,0]=4 269 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK-76305 [0,0,0,1,0,0|3,0,0]=4 270 B12R2.612 N[C@H]1CCC2=C1C=CC(Cl)=C2 AK544243 [0,0,0,1,0,0|3,0,0]=4 271 B12R2.612 O=C1CCC2=C1C=CC(C)=C2 AK-41812 [0,0,0,1,0,0|2,0,1]=4 272 B12R2.612 O=C1COC2=CC(Br)=CC=C12 AK-33982 [0,0,0,1,0,0|2,0,1]=4 273 B12R2.612 O=C1COC2=CC(Cl)=CC=C12 AK-25773 [0,0,0,1,0,0|2,0,1]=4 274 B12R2.612 O=C1COC2=CC(O)=CC=C12 AK-27229 [0,0,0,1,0,0|2,0,1]=4 275 B12R2.612 O=C1NOC2=CC(C)=CC=C12 AK-67760 [0,0,0,1,0,0|2,0,1]=4 276 B12R2.612 OC1CCC2=C1C=CC(Cl)=C2 AK109538 [0,0,0,1,0,0|3,0,0]=4 277 B12R1.233 CC(OC1=CC=C(Br)C=C1Cl)C AK-61659 [0,0,0,0,0,1|2,0,0]=3 278 B9R1.1 BrC1=CN=C(C=C1)CC AK-34965 [2,0,0,0,0,0|2,0,0]=4 279 B9R1.1 C1=C(C=CC(=C1)CN)O AK-47356 [2,0,0,0,0,0|2,0,0]=4 280 B9R1.1 C1=C(NN)C=CC(=C1)C AK-47398 [2,0,0,0,0,0|2,0,0]=4 281 B9R1.1 C1=CC(=CC=C1Br)CC AK-47528 [2,0,0,0,0,0|1,0,0]=3 282 B9R1.1 C1=CC(=CC=C1CO)O AK-47325 [2,0,0,0,0,0|2,0,0]=4 283 B9R1.1 C1=CC(=CC=C1I)NC AK-39846 [2,0,0,0,0,0|2,0,0]=4 284 B9R1.1 CC1=CC=C(C=O)C=C1 AK-65210 [2,0,0,0,0,0|1,0,1]=4 285 B9R1.1 CC1=CC=C(CO)C=N1 AK-78311 [2,0,0,0,0,0|2,0,0]=4 286 B9R1.1 CC1=CN=C(OC)C=C1 AK-58301 [2,0,0,0,0,0|2,0,0]=4 287 B9R1.1 CC1=NC=C(CBr)C=C1 AK139052 [2,0,0,0,0,0|2,0,0]=4 288 B9R1.1 CC1=NC=C(CCl)C=C1 AK123163 [2,0,0,0,0,0|2,0,0]=4 289 B9R1.1 CCC1=CN=C(C=N1)C AK-58106 [2,0,0,0,0,0|2,0,0]=4 290 B9R1.1 CCC1=CN=C(Cl)C=C1 AK-48582 [2,0,0,0,0,0|2,0,0]=4 291 B9R1.1 CCC1=NC=C(Cl)C=C1 AK134672 [2,0,0,0,0,0|2,0,0]=4 292 B9R1.1 CNC1=CC=C(Cl)C=C1 AK129065 [2,0,0,0,0,0|2,0,0]=4 293 B9R1.1 CNC1=CC=C(F)C=C1 AK-87253 [2,0,0,0,0,0|2,0,0]=4 294 B9R1.1 COC1=CC=C(Cl)C=C1 AK116963 [2,0,0,0,0,0|2,0,0]=4 295 B9R1.1 COC1=CC=C(I)C=C1 AK-44747 [2,0,0,0,0,0|2,0,0]=4 296 B9R1.1 COC1=CC=C(O)C=C1 AK-46469 [2,0,0,0,0,0|2,0,0]=4 297 B9R1.1 IC1=CC=C(CBr)C=C1 AK-54650 [2,0,0,0,0,0|2,0,0]=4 298 B9R1.1 IC1=CC=C(CC)C=C1 AK121966 [2,0,0,0,0,0|1,0,0]=3 299 B9R1.1 NC1=CC=C(CC)N=C1 AK-78651 [2,0,0,0,0,0|2,0,0]=4 300 B9R1.1 NC1=CC=C(NC)C=C1 AK-86240 [2,0,0,0,0,0|2,0,0]=4 301 B9R1.1 NCC1=CC=C(Br)C=C1 AK-46356 [2,0,0,0,0,0|2,0,0]=4 302 B9R1.1 NCC1=CC=C(Br)C=C1 AK-49170 [2,0,0,0,0,0|2,0,0]=4 303 B9R1.1 NCC1=CC=C(Cl)C=C1 AK-44456 [2,0,0,0,0,0|2,0,0]=4 304 B9R1.1 NCC1=CC=C(I)C=C1 AK-81624 [2,0,0,0,0,0|2,0,0]=4 305 B9R1.1 NCC1=NC=C(C)C=C1 AK150805 [2,0,0,0,0,0|2,0,0]=4 306 B9R1.1 OCC1=CC=C(Br)C=C1 AK-93775 [2,0,0,0,0,0|2,0,0]=4 307 B9R1.1 OCC1=CC=C(C)C=C1 AK-92302 [2,0,0,0,0,0|1,0,0]=3 308 B9R1.1 OCC1=CC=C(Cl)C=C1 AK-94754 [2,0,0,0,0,0|2,0,0]=4 309 B9R1.1 OCC1=CC=C(I)C=C1 AK-72872 [2,0,0,0,0,0|2,0,0]=4 310 B9R1.1 OCC1=CC=C(N)C=C1 AK-51503 [2,0,0,0,0,0|2,0,0]=4 311 B9R1.6 C1=NC(=CC=C1)C(C)C AK-46532 [2,0,0,0,0,0|1,0,0]=3 312 B9R1.6 CC(N)C1=CC=CN=C1 AK-35649 [2,0,0,0,0,0|2,0,0]=4 313 B9R1.6 CC(O)C1=NC=CC=C1 AK-53453 [2,0,0,0,0,0|2,0,0]=4 314 B9R1.6 CN(C)C1=NC=CC=C1 AK-78706 [2,0,0,0,0,0|2,0,0]=4 315 B9R1.6 C[C@@H](N)C1=CC=CC=C1 AK668263 [2,0,0,0,0,0|1,0,0]=3 316 B9R1.6 C[C@@H](N)C1=CC=CN=C1 AK152012 [2,0,0,0,0,0|2,0,0]=4 317 B9R1.6 C[C@@H](N)C1=NC=CC=C1 AK122419 [2,0,0,0,0,0|2,0,0]=4 318 B9R1.6 C[C@@H](O)C1=CC=CC=C1 AK-79205 [2,0,0,0,0,0|1,0,0]=3 319 B9R1.6 C[C@@H](O)C1=CC=NC=C1 AK-45022 [2,0,0,0,0,0|2,0,0]=4 320 B9R1.6 C[C@@H](O)C1=NC=CC=C1 AK-79201 [2,0,0,0,0,0|2,0,0]=4 321 B9R1.6 C[C@H](N)C1=CC=CN=C1 AK151271 [2,0,0,0,0,0|2,0,0]=4 322 B9R1.6 C[C@H](O)C1=CC=NC=C1 AK-79199 [2,0,0,0,0,0|2,0,0]=4 323 B9R1.6 N1=C(C=CC=C1)[C@@H](C)N AK-37082 [2,0,0,0,0,0|2,0,0]=4 324 B9R1.6 N[C@@H](C1=CC=NC=C1)C AK202973 [2,0,0,0,0,0|2,0,0]=4 325 B9R1.6 N[C@H](C1=NC=CC=C1)C AK-37110 [2,0,0,0,0,0|2,0,0]=4 326 B9R1.15 BrCC1=C(I)C=CC=C1 AK-54648 [2,0,0,0,0,0|2,0,0]=4 327 B9R1.15 C1=C(C(=CC=C1)Br)CC AK-46714 [2,0,0,0,0,0|1,0,0]=3 328 B9R1.15 C1=C(C(=CC=C1)Br)CN AK-73129 [2,0,0,0,0,0|2,0,0]=4 329 B9R1.15 C1=C(C(=CC=C1)Cl)CO AK-46748 [2,0,0,0,0,0|2,0,0]=4 330 B9R1.15 C1=CC=CC(=C1C#N)O AK-47282 [2,0,0,0,0,0|1,0,1]=4 331 B9R1.15 C1=CC=CC(=C1CO)Br AK-51234 [2,0,0,0,0,0|2,0,0]=4 332 B9R1.15 C1=CC=CC(=C1O)CO AK-47595 [2,0,0,0,0,0|1,0,0]=3 333 B9R1.15 C1=CC=CC(=C1OC)F AK-46555 [2,0,0,0,0,0|2,0,0]=4 334 B9R1.15 CC1=CC=CC=C1CC AK-49977 [2,0,0,0,0,0|1,0,0]=3 335 B9R1.15 CCC1=C(Br)C=CN=C1 AK328293 [2,0,0,0,0,0|2,0,0]=4 336 B9R1.15 CCC1=C(Br)C=NC=C1 AK-81618 [2,0,0,0,0,0|2,0,0]=4 337 B9R1.15 CCC1=NC=CC=C1Br AK128590 [2,0,0,0,0,0|2,0,0]=4 338 B9R1.15 CNC1=CC=CC=C1Cl AK163346 [2,0,0,0,0,0|2,0,0]=4 339 B9R1.15 CNC1=CC=CC=C1F AK-48931 [2,0,0,0,0,0|2,0,0]=4 340 B9R1.15 COC1=CC=CC=C1Br AK-76806 [2,0,0,0,0,0|2,0,0]=4 341 B9R1.15 NC1=CC=CC=C1NC AK-35283 [2,0,0,0,0,0|2,0,0]=4 342 B9R1.15 NCC1=CC=CC=C1C AK-89642 [2,0,0,0,0,0|2,0,0]=4 343 B9R1.15 NCC1=CC=CC=C1Cl AK-78184 [2,0,0,0,0,0|2,0,0]=4 344 B9R1.15 NCC1=CC=CC=C1F AK-88519 [2,0,0,0,0,0|2,0,0]=4 345 B9R1.15 NCC1=CC=CC=C1I AK-94126 [2,0,0,0,0,0|2,0,0]=4 346 B9R1.15 OC1=CC=CC=C1CN AK-49022 [2,0,0,0,0,0|1,0,0]=3 347 B9R1.15 OC1=CC=CC=C1CN AK167666 [2,0,0,0,0,0|1,0,0]=3 348 B9R1.15 OC1=CC=CC=C1OC AK114448 [2,0,0,0,0,0|1,0,0]=3 349 B9R1.15 OC1=CC=CN=C1CN AK-82086 [2,0,0,0,0,0|2,0,0]=4 350 B9R1.15 OC1=CC=CN=C1OC AK261041 [2,0,0,0,0,0|2,0,0]=4 351 B9R1.15 OCC1=CC=CC=C1I AK-77177 [2,0,0,0,0,0|2,0,0]=4 352 B9R1.15 OCC1=CC=CC=C1N AK-49868 [2,0,0,0,0,0|2,0,0]=4 353 B9R1.69 BrC1=C(C=C(C=C1)C)N AK-26077 [2,0,0,0,0,0|2,0,0]=4 354 B9R1.69 BrC1=C(C=C(C=C1)Cl)O AK-33177 [2,0,0,0,0,0|2,0,0]=4 355 B9R1.69 BrC1=C(C=CC(=C1)O)C AK-35826 [2,0,0,0,0,0|2,0,0]=4 356 B9R1.69 BrC1=CC(=C(C=C1)C)Cl AK-53761 [2,0,0,0,0,0|2,0,0]=4 357 B9R1.69 BrC1=CC(=C(C=C1)C)O AK-23990 [2,0,0,0,0,0|1,0,0]=3 358 B9R1.69 BrC1=CN=C(C(=C1)O)C AK-54789 [2,0,0,0,0,0|2,0,0]=4 359 B9R1.69 C1=C(C(=CC=C1Br)C)Br AK-53776 [2,0,0,0,0,0|2,0,0]=4 360 B9R1.69 C1=C(C(=CC=C1Br)C)F AK-47312 [2,0,0,0,0,0|2,0,0]=4 361 B9R1.69 C1=C(C(=CC=C1C)Br)Cl AK-53768 [2,0,0,0,0,0|2,0,0]=4 362 B9R1.69 C1=C(C(=CC=C1C)C)Br AK-47276 [2,0,0,0,0,0|1,0,0]=3 363 B9R1.69 C1=C(C(=CC=C1C)Cl)Br AK-35694 [2,0,0,0,0,0|2,0,0]=4 364 B9R1.69 C1=C(C(=CC=C1C)O)Cl AK-36041 [2,0,0,0,0,0|2,0,0]=4 365 B9R1.69 C1=C(C(=CC=C1F)C)N AK-34872 [2,0,0,0,0,0|2,0,0]=4 366 B9R1.69 C1=C(C(=CC=C1N)C)Br AK-36357 [2,0,0,0,0,0|2,0,0]=4 367 B9R1.69 C1=C(C)C=CC(=C1N)Cl AK-36982 [2,0,0,0,0,0|2,0,0]=4 368 B9R1.69 C1=C(C)C=CC(=C1N)F AK-35225 [2,0,0,0,0,0|2,0,0]=4 369 B9R1.69 C1=C(C=CC(=C1N)C)I AK-36510 [2,0,0,0,0,0|2,0,0]=4 370 B9R1.69 C1=C(Cl)C=CC(=C1O)N AK-34515 [2,0,0,0,0,0|2,0,0]=4 371 B9R1.69 C1=C(F)C=CC(=C1O)C AK-47653 [2,0,0,0,0,0|1,0,0]=3 372 B9R1.69 C1=C(F)C=CC(=C1O)Cl AK-34944 [2,0,0,0,0,0|2,0,0]=4 373 B9R1.69 C1=C(F)C=CC(=C1O)N AK-28298 [2,0,0,0,0,0|2,0,0]=4 374 B9R1.69 C1=C(N)C=CC(=C1O)C AK-46680 [2,0,0,0,0,0|1,0,0]=3 375 B9R1.69 CC1=C(Br)C=C(I)C=C1 AK-34449 [2,0,0,0,0,0|2,0,0]=4 376 B9R1.69 CC1=C(C)C=C(I)C=C1 AK-87089 [2,0,0,0,0,0|2,0,0]=4 377 B9R1.69 CC1=C(Cl)C=C(O)C=C1 AK-35860 [2,0,0,0,0,0|2,0,0]=4 378 B9R1.69 CC1=C(I)C=C(Br)C=C1 AK-77204 [2,0,0,0,0,0|2,0,0]=4 379 B9R1.69 CC1=C(N)C=C(Br)C=C1 AK-35005 [2,0,0,0,0,0|2,0,0]=4 380 B9R1.69 CC1=CC(I)=C(Br)C=C1 AK-40336 [2,0,0,0,0,0|2,0,0]=4 381 B9R1.69 CC1=CC(O)=C(Br)C=C1 AK-89491 [2,0,0,0,0,0|1,0,0]=3 382 B9R1.69 CC1=CC=C(Br)C(Br)=C1 AK-86340 [2,0,0,0,0,0|2,0,0]=4 383 B9R1.69 CC1=CC=C(Br)C(F)=C1 AK-43505 [2,0,0,0,0,0|2,0,0]=4 384 B9R1.69 CC1=CC=C(C)C(N)=N1 AK-29554 [2,0,0,0,0,0|2,0,0]=4 385 B9R1.69 CC1=CC=C(Cl)C=C1Br AK-34468 [2,0,0,0,0,0|2,0,0]=4 386 B9R1.69 CC1=CC=C(F)C(Cl)=C1 AK-53765 [2,0,0,0,0,0|2,0,0]=4 387 B9R1.69 CC1=CC=C(F)C(I)=C1 AK115137 [2,0,0,0,0,0|2,0,0]=4 388 B9R1.69 CC1=CC=C(F)C=C1Br AK-33261 [2,0,0,0,0,0|2,0,0]=4 389 B9R1.69 CC1=CC=C(F)C=C1Cl AK-53758 [2,0,0,0,0,0|2,0,0]=4 390 B9R1.69 CC1=CC=C(F)C=C1I AK-57736 [2,0,0,0,0,0|2,0,0]=4 391 B9R1.69 CC1=CC=C(I)C(Br)=C1 AK117493 [2,0,0,0,0,0|2,0,0]=4 392 B9R1.69 CC1=CC=C(I)C(F)=C1 AK-35223 [2,0,0,0,0,0|2,0,0]=4 393 B9R1.69 CC1=CC=C(I)C=C1F AK-53774 [2,0,0,0,0,0|2,0,0]=4 394 B9R1.69 CC1=CC=C(N)C(N)=C1 AK-45900 [2,0,0,0,0,0|2,0,0]=4 395 B9R1.69 ClC1=C(C=C(C=C1)C)F AK-46384 [2,0,0,0,0,0|2,0,0]=4 396 B9R1.69 ClC1=CC(=C(C=C1)F)O AK-25539 [2,0,0,0,0,0|2,0,0]=4 397 B9R1.69 FC1=C(C=CC(=C1)O)C AK-35222 [2,0,0,0,0,0|2,0,0]=4 398 B9R1.69 NC1=CC(C)=CC=C1I AK-33114 [2,0,0,0,0,0|2,0,0]=4 399 B9R1.69 NC1=CC(C)=NC=C1C AK126931 [2,0,0,0,0,0|2,0,0]=4 400 B9R1.69 NC1=CC=C(C)C(F)=C1 AK-35221 [2,0,0,0,0,0|2,0,0]=4 401 B9R1.69 NC1=CC=C(C)C(I)=C1 AK-94144 [2,0,0,0,0,0|2,0,0]=4 402 B9R1.69 NC1=CC=C(C)C=C1Br AK-35743 [2,0,0,0,0,0|2,0,0]=4 403 B9R1.69 NC1=CC=C(C)C=C1Cl AK-35861 [2,0,0,0,0,0|2,0,0]=4 404 B9R1.69 NC1=CC=C(C)C=C1F AK-25990 [2,0,0,0,0,0|2,0,0]=4 405 B9R1.69 NC1=CC=C(C)C=C1I AK-41007 [2,0,0,0,0,0|2,0,0]=4 406 B9R1.69 OC1=C(Br)C=CC(I)=C1 AK-79113 [2,0,0,0,0,0|2,0,0]=4 407 B9R1.69 OC1=CC(Br)=CC=C1Br AK-34499 [2,0,0,0,0,0|2,0,0]=4 408 B9R1.69 OC1=CC(Br)=CC=C1Cl AK-24766 [2,0,0,0,0,0|2,0,0]=4 409 B9R1.69 OC1=CC(Br)=CC=C1F AK-29778 [2,0,0,0,0,0|2,0,0]=4 410 B9R1.69 OC1=CC(Br)=CC=C1I AK110142 [2,0,0,0,0,0|2,0,0]=4 411 B9R1.69 OC1=CC(Br)=CC=C1N AK-34937 [2,0,0,0,0,0|2,0,0]=4 412 B9R1.69 OC1=CC(C)=CC=C1F AK-35958 [2,0,0,0,0,0|1,0,0]=3 413 B9R1.69 OC1=CC(C)=CC=C1N AK-86217 [2,0,0,0,0,0|1,0,0]=3 414 B9R1.69 OC1=CC(C)=CN=C1Cl AK126258 [2,0,0,0,0,0|2,0,0]=4 415 B9R1.69 OC1=CC(C)=NC=C1Br AK150768 [2,0,0,0,0,0|2,0,0]=4 416 B9R1.69 OC1=CC(Cl)=CC=C1I AK-58638 [2,0,0,0,0,0|2,0,0]=4 417 B9R1.69 OC1=CC(F)=CC=C1F AK-34467 [2,0,0,0,0,0|2,0,0]=4 418 B9R1.69 OC1=CC(I)=CC=C1Cl AK-34537 [2,0,0,0,0,0|2,0,0]=4 419 B9R1.69 OC1=CC(I)=CC=C1F AK-33857 [2,0,0,0,0,0|2,0,0]=4 420 B9R1.69 OC1=CC(N)=CC=C1Cl AK-48422 [2,0,0,0,0,0|2,0,0]=4 421 B9R1.69 OC1=CC=C(Br)C(O)=C1 AK-61188 [2,0,0,0,0,0|2,0,0]=4 422 B9R1.69 OC1=CC=C(Br)C=C1O AK-61181 [2,0,0,0,0,0|2,0,0]=4 423 B9R1.69 OC1=CC=C(C)C(N)=C1 AK-34510 [2,0,0,0,0,0|2,0,0]=4 424 B9R1.69 OC1=CC=C(C)C(O)=C1 AK-81912 [2,0,0,0,0,0|1,0,0]=3 425 B9R1.69 OC1=CC=C(C)C=C1Br AK-36035 [2,0,0,0,0,0|2,0,0]=4 426 B9R1.69 OC1=CC=C(C)C=C1F AK-53739 [2,0,0,0,0,0|2,0,0]=4 427 B9R1.69 OC1=CC=C(C)C=C1I AK137668 [2,0,0,0,0,0|2,0,0]=4 428 B9R1.69 OC1=CC=C(C)C=C1O AK163402 [2,0,0,0,0,0|1,0,0]=3 429 B9R1.69 OC1=CC=C(F)C(O)=C1 AK-46483 [2,0,0,0,0,0|2,0,0]=4 430 B9R1.69 OC1=CC=C(N)C(O)=C1 AK-96646 [2,0,0,0,0,0|2,0,0]=4 431 B9R1.69 OC1=CC=C(N)C=C1O AK118715 [2,0,0,0,0,0|2,0,0]=4 432 B9R1.69 OC1=CC=C(O)C=C1O AK164434 [2,0,0,0,0,0|2,0,0]=4 433 B11R1.3 C1=C(N(C)C)C=CC(=C1)C=O AK-72833 [1,1,0,0,0,0|1,0,1]=4 434 B11R1.3 CC(C)C1=CC=C(CN)C=C1 AK-61820 [1,1,0,0,0,0|0,0,0]=2 435 B11R1.3 CC(C1=CC=C(CBr)C=C1)=O AK-35404 [1,1,0,0,0,0|1,0,1]=4 436 B11R1.3 CC(C1=CC=C(CN)C=C1)=O AK158889 [1,1,0,0,0,0|1,0,1]=4 437 B11R1.3 CC(C1=CC=C(NC)C=C1)=O AK145581 [1,1,0,0,0,0|1,0,1]=4 438 B11R1.3 CC(C1=CC=C(SC)C=C1)=O AK164075 [1,1,0,0,0,0|1,0,1]=4 439 B11R1.3 CN(C)C1=CC=C(OC)C=C1 AK136005 [1,1,0,0,0,0|1,0,0]=3 440 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)N AK-34162 [1,1,0,0,0,0|1,0,0]=3 441 B11R1.3 COC1=CC=C(C=C1)[C@@H](C)O AK103062 [1,1,0,0,0,0|1,0,0]=3 442 B11R1.3 COC1=CC=C(C=C1)[C@H](C)O AK103063 [1,1,0,0,0,0|1,0,0]=3 443 B11R1.3 N#CC1=CC=C([C@@H](N)C)C=C1 AK133451 [1,1,0,0,0,0|1,0,1]=4 444 B11R1.3 N#CC1=CC=C([C@H](N)C)C=C1 AK133444 [1,1,0,0,0,0|1,0,1]=4 445 B11R1.3 [C@@H](C)(N)C1=CC=C(OC)C=C1 AK-41700 [1,1,0,0,0,0|1,0,0]=3 446 B11R1.19 CC(C1=CC=C(Br)C=C1)(C)C AK-88487 [1,1,0,0,0,0|1,0,0]=3 447 B11R1.19 CC(F)(F)C1=CC=C(Br)C=C1 AK-67199 [1,1,0,0,0,0|2,0,0]=4 448 B11R1.19 CC(O)(C1=CC=C(Br)C=C1)C AK-41776 [1,1,0,0,0,0|1,0,0]=3 449 B11R1.19 CC1=CC=C(C=C1)C(F)(F)F AK-72556 [1,1,0,0,0,0|2,0,0]=4 450 B11R1.19 C[Si](C)(C)C1=CC=C(Br)C=C1 AK-82203 [1,1,0,0,0,0|1,1,0]=4 451 B11R1.19 IC1=CC=C(C(C)(C)C)C=C1 AK-80497 [1,1,0,0,0,0|1,0,0]=3 452 B11R1.19 NC1=CC=C(C(C)(C)C)C=C1 AK136142 [1,1,0,0,0,0|1,0,0]=3 453 B11R1.19 O=S(C1=CC=C(C)C=C1)(C)=O AK-94753 [1,1,0,0,0,0|2,0,0]=4 454 B11R1.21 C[C@@H](N)C1=CC=C(C)C(Cl)=C1 AK134018 [1,1,0,0,0,0|1,0,0]=3 455 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(C)=C1 AK-42499 [1,1,0,0,0,0|2,0,0]=4 456 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(Cl)=C1 AK172663 [1,1,0,0,0,0|2,0,0]=4 457 B11R1.21 C[C@@H](N)C1=CC=C(Cl)C(F)=C1 AK-42083 [1,1,0,0,0,0|2,0,0]=4 458 B11R1.21 C[C@@H](N)C1=CC=C(F)C(Cl)=C1 AK-42066 [1,1,0,0,0,0|2,0,0]=4 459 B11R1.21 C[C@@H](N)C1=CC=C(F)C(F)=C1 AK-42176 [1,1,0,0,0,0|2,0,0]=4 460 B11R1.21 C[C@H](N)C1=CC(Cl)=C(Cl)C=C1 AK110178 [1,1,0,0,0,0|2,0,0]=4 461 B11R1.21 C[C@H](N)C1=CC=C(Br)C(Cl)=C1 AK172718 [1,1,0,0,0,0|2,0,0]=4 462 B11R1.21 C[C@H](N)C1=CC=C(C)C(Cl)=C1 AK-42498 [1,1,0,0,0,0|1,0,0]=3 463 B11R1.21 C[C@H](N)C1=CC=C(C)C(F)=C1 AK544256 [1,1,0,0,0,0|1,0,0]=3 464 B11R1.21 C[C@H](N)C1=CC=C(Cl)C(F)=C1 AK-42082 [1,1,0,0,0,0|2,0,0]=4 465 B11R1.21 C[C@H](N)C1=CC=C(F)C(Br)=C1 AK338978 [1,1,0,0,0,0|2,0,0]=4 466 B11R1.21 C[C@H](N)C1=CC=C(F)C(C)=C1 AK-42488 [1,1,0,0,0,0|2,0,0]=4 467 B11R1.21 C[C@H](N)C1=CC=C(F)C(C)=C1 AK119914 [1,1,0,0,0,0|2,0,0]=4 468 B11R1.21 C[C@H](N)C1=CC=C(F)C(Cl)=C1 AK-42507 [1,1,0,0,0,0|2,0,0]=4 469 B11R1.21 C[C@H](N)C1=CC=C(F)C(F)=C1 AK160111 [1,1,0,0,0,0|2,0,0]=4 470 B11R1.22 BrC1=CC=C(C(N)CO)C=C1 AK607944 [1,1,0,0,0,0|2,0,0]=4 471 B11R1.22 BrC1=CC=C([C@@H](N)CO)C=C1 AK172682 [1,1,0,0,0,0|2,0,0]=4 472 B11R1.22 C1=C(C=CC(=C1)C)C(CBr)=O AK-73063 [1,1,0,0,0,0|1,0,1]=4 473 B11R1.22 CC1=CC=C([C@H](N)CO)C=C1 AK544255 [1,1,0,0,0,0|1,0,0]=3 474 B11R1.22 CCC(C1=CC=C(Br)C=C1)N AK116183 [1,1,0,0,0,0|2,0,0]=4 475 B11R1.22 CC[C@@H](C1=CC=C(Br)C=C1)N AK607954 [1,1,0,0,0,0|2,0,0]=4 476 B11R1.22 CC[C@@H](C1=CC=C(Cl)C=C1)N AK-53923 [1,1,0,0,0,0|2,0,0]=4 477 B11R1.22 CC[C@H](C1=CC=C(Br)C=C1)N AK172711 [1,1,0,0,0,0|2,0,0]=4 478 B11R1.22 CC[C@H](C1=CC=C(C)C=C1)N AK-93290 [1,1,0,0,0,0|1,0,0]=3 479 B11R1.22 CC[C@H](C1=CC=C(Cl)C=C1)N AK133438 [1,1,0,0,0,0|2,0,0]=4 480 B11R1.22 C[C@@H](NC)C1=CC=C(Cl)C=C1 AK607981 [1,1,0,0,0,0|1,0,0]=3 481 B11R1.22 C[C@H](NC)C1=CC=C(Br)C=C1 AK172763 [1,1,0,0,0,0|1,0,0]=3 482 B11R1.22 C[C@H](NC)C1=CC=C(Cl)C=C1 AK607980 [1,1,0,0,0,0|1,0,0]=3 483 B11R1.22 ClC1=CC=C([C@@H](N)CO)C=C1 AK486779 [1,1,0,0,0,0|2,0,0]=4 484 B11R1.22 ClC1=CC=C([C@H](N)CO)C=C1 AK607971 [1,1,0,0,0,0|2,0,0]=4 485 B11R1.22 FC1=CC=C([C@@H](N)CO)C=C1 AK117861 [1,1,0,0,0,0|2,0,0]=4 486 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117823 [1,1,0,0,0,0|2,0,0]=4 487 B11R1.22 FC1=CC=C([C@H](N)CO)C=C1 AK117858 [1,1,0,0,0,0|2,0,0]=4 488 B11R1.22 NC(C1=CC=C(F)C=C1)CC AK470003 [1,1,0,0,0,0|2,0,0]=4 489 B11R1.22 NC1=CC=C(C(C)CC)C=C1 AK-76838 [1,1,0,0,0,0|1,0,0]=3 490 B11R1.22 NCC(O)C1=CC=C(O)C=C1 AK163650 [1,1,0,0,0,0|2,0,0]=4 491 B11R1.22 N[C@@H](C1=CC=C(F)C=C1)CC AK-42100 [1,1,0,0,0,0|2,0,0]=4 492 B11R1.22 N[C@@H](CO)C1=CC=C(F)C=C1 AK101499 [1,1,0,0,0,0|2,0,0]=4 493 B11R1.22 N[C@H](C1=CC=C(F)C=C1)CC AK-42091 [1,1,0,0,0,0|2,0,0]=4 494 B11R1.22 O=C(OC)C1=CC=C(C)C=C1 AK110414 [1,1,0,0,0,0|1,0,1]=4 495 B11R1.22 OC1=CC=C(C(C)CN)C=C1 AK-47813 [1,1,0,0,0,0|1,0,0]=3 496 B11R1.22 OC1=CC=C([C@@H](N)CO)C=C1 AK544250 [1,1,0,0,0,0|2,0,0]=4 497 B11R1.22 OC1=CC=C([C@H](N)CO)C=C1 AK608028 [1,1,0,0,0,0|2,0,0]=4 498 B11R1.22 OCC(O)C1=CC=C(Br)C=C1 AK110007 [1,1,0,0,0,0|2,0,0]=4 499 B11R1.22 OC[C@@H](N)C1=CC=C(Br)C=C1 AK338220 [1,1,0,0,0,0|2,0,0]=4 500 B11R1.22 OC[C@H](N)C1=CC=C(Br)C=C1 AK202041 [1,1,0,0,0,0|2,0,0]=4 501 B11R1.37 BrC1=CC=C(CO)C(CO)=C1 AK173578 [1,1,0,0,0,0|2,0,0]=4 502 B11R1.37 COC1=C(C#N)C=CC(=C1)C AK-49163 [1,1,0,0,0,0|1,0,1]=4 503 B11R1.37 COC1=C(CO)C=C(F)C=C1 AK-37523 [1,1,0,0,0,0|2,0,0]=4 504 B11R1.37 COC1=C(CO)C=CC(Br)=C1 AK-63352 [1,1,0,0,0,0|2,0,0]=4 505 B11R1.37 COC1=C(OC)C=C(Br)C=C1 AK-48100 [1,1,0,0,0,0|2,0,0]=4 506 B11R1.37 COC1=C(OC)C=C(C)C=C1 AK-48281 [1,1,0,0,0,0|1,0,0]=3 507 B11R1.37 COC1=CC(F)=CC=C1OC AK-68288 [1,1,0,0,0,0|2,0,0]=4 508 B11R1.37 NC1=CC=C(OC)C(OC)=C1 AK-44039 [1,1,0,0,0,0|2,0,0]=4 509 B11R1.37 NCC1=CC=C(F)C=C1OC AK-80099 [1,1,0,0,0,0|2,0,0]=4 510 B11R1.37 O=CC1=CC=C(C)C=C1OC AK106344 [1,1,0,0,0,0|1,0,1]=4 511 B11R1.81 CCCC1=C(O)C=C(O)C=C1 AK-81520 [1,1,0,0,0,0|1,0,0]=3 512 B11R1.81 CNCC1=C(Cl)C=C(Cl)C=C1 AK-16707 [1,1,0,0,0,0|2,0,0]=4 513 B11R1.81 CNCC1=CC=C(Cl)C=C1Cl AK-16701 [1,1,0,0,0,0|2,0,0]=4 514 B11R1.81 CNCC1=CC=C(F)C=C1F AK-80365 [1,1,0,0,0,0|2,0,0]=4 515 B11R1.81 ClC1=CC=C(C(Cl)=C1)CCO AK-39241 [1,1,0,0,0,0|2,0,0]=4 516 B11R1.81 N#CCC1=CC=C(C)C=C1F AK-35439 [1,1,0,0,0,0|1,0,1]=4 517 B11R1.81 NC1=CC(C)=CC=C1OCC AK327686 [1,1,0,0,0,0|1,0,0]=3 518 B11R1.81 NC1=CC=C(COC)C(F)=C1 AK162067 [1,1,0,0,0,0|2,0,0]=4 519 B11R1.81 NC1=CC=C(OCC)C(Cl)=C1 AK121334 [1,1,0,0,0,0|2,0,0]=4 520 B11R1.81 NC1=CC=C(OCC)C(N)=C1 AK-93490 [1,1,0,0,0,0|2,0,0]=4 521 B11R1.81 NCCC1=C(F)C=C(F)C=C1 AK-58290 [1,1,0,0,0,0|2,0,0]=4 522 B11R1.277 NC1=CC(OC)=C(Br)C=C1C AK-49423 [1,1,0,0,0,0|2,0,0]=4 523 B11R1.279 C1=C(C=CC(=C1O)C=O)OC AK-26247 [1,1,0,0,0,0|1,0,1]=4 524 B11R1.279 C1=C(C=CC(=C1O)OC)CO AK-46780 [1,1,0,0,0,0|1,0,0]=3 525 B11R1.279 CC1=CC(CCl)=CC=C1OC AK117491 [1,1,0,0,0,0|2,0,0]=4 526 B11R1.279 COC1=C(C=C(C=C1)OC)O AK-75677 [1,1,0,0,0,0|1,0,0]=3 527 B11R1.279 COC1=C(N)C=C(CO)C=C1 AK-80791 [1,1,0,0,0,0|2,0,0]=4 528 B11R1.279 COC1=CC=C(CBr)C=C1Cl AK-46361 [1,1,0,0,0,0|2,0,0]=4 529 B11R1.279 COC1=CC=C(OC)C(Br)=C1 AK-44610 [1,1,0,0,0,0|2,0,0]=4 530 B11R1.279 COC1=CC=C(OC)C(F)=C1 AK-53728 [1,1,0,0,0,0|2,0,0]=4 531 B11R1.279 N#CC1=CC=C(OC)C=C1O AK-26764 [1,1,0,0,0,0|1,0,1]=4 532 B11R1.279 NC1=CC(CC)=CC=C1OC AK456630 [1,1,0,0,0,0|2,0,0]=4 533 B11R1.279 NCC1=CC=C(OC)C(Cl)=C1 AK-16614 [1,1,0,0,0,0|2,0,0]=4 534 B11R1.279 NCC1=CC=C(OC)C(F)=C1 AK117550 [1,1,0,0,0,0|2,0,0]=4 535 B11R1.279 O=CC1=CC=C(OC)C(O)=C1 AK-26987 [1,1,0,0,0,0|1,0,1]=4 536 B11R1.279 OC1=C(C=CC(=C1)C#N)OC AK-39764 [1,1,0,0,0,0|1,0,1]=4 537 B11R1.279 OC1=CC(CC)=CC=C1C=O AK209435 [1,1,0,0,0,0|1,0,1]=4 538 B11R1.279 OCC1=CC=C(OC)C(Br)=C1 AK-34956 [1,1,0,0,0,0|2,0,0]=4 539 B11R1.464 CC1=C(C(C)=CC(C)=C1)CO AK324057 [1,1,0,0,0,0|2,0,0]=4 540 B11R1.464 CC1=CC(C)=C(CBr)C(C)=C1 AK122870 [1,1,0,0,0,0|2,0,0]=4 541 B11R1.464 CC1=CC(C)=C(CCl)C(C)=C1 AK-86368 [1,1,0,0,0,0|2,0,0]=4 542 B11R1.464 NCC1=C(C)C=C(C)C=C1C AK-89647 [1,1,0,0,0,0|2,0,0]=4 543 B11R1.53 COC1=NC=CN=C1C(C)C AK116762 [1,1,0,0,0,0|2,0,0]=4 544 B11R1.53 N#CC1=CC=CC=C1C(O)C AK144989 [1,1,0,0,0,0|2,0,0]=4 545 B11R1.87 C1=CC=CC(=C1C(F)(F)F)O AK-50536 [1,1,0,0,0,0|2,0,0]=4 546 B11R1.87 CC(C)(O)C1=C(Br)C=CC=C1 AK-38217 [1,1,0,0,0,0|1,0,0]=3 547 B11R1.87 CC(C1=CC=CC=C1Br)(C)C AK148384 [1,1,0,0,0,0|1,0,0]=3 548 B11R1.87 CC(N)(C1=CC=CC=C1Br)C AK122030 [1,1,0,0,0,0|1,0,0]=3 549 B11R1.87 CC(O)(C1=CC=CC=C1N)C AK125202 [1,1,0,0,0,0|1,0,0]=3 550 B11R1.87 CC(O)(C1=NC=CC=C1Br)C AK167904 [1,1,0,0,0,0|2,0,0]=4 551 B11R1.87 CP(C)(=O)C1=C(N)C=CC=C1 AK103382 [1,1,0,0,0,0|2,0,0]=4 552 B11R1.87 NC1=CC=CC=C1C(C)(C)C AK-77148 [1,1,0,0,0,0|1,0,0]=3 553 B11R1.156 CC(C1=C(C)C=CC=C1O)=O AK-64408 [1,1,0,0,0,0|1,0,1]=4 554 B11R1.156 CC(C1=C(O)C=CC=C1Br)=O AK-31671 [1,1,0,0,0,0|1,0,1]=4 555 B11R1.156 CC(C1=C(O)C=CC=C1Cl)=O AK-29397 [1,1,0,0,0,0|1,0,1]=4 556 B11R1.156 CC(C1=C(O)C=CC=C1F)=O AK-86499 [1,1,0,0,0,0|1,0,1]=4 557 B11R1.156 CC(C1=C(O)C=CC=C1O)=O AK-47368 [1,1,0,0,0,0|1,0,1]=4 558 B11R1.156 CC(N)C1=C(Cl)C=CC=C1Cl AK-68659 [1,1,0,0,0,0|2,0,0]=4 559 B11R1.156 CC(N)C1=C(F)C=CC=C1Cl AK607949 [1,1,0,0,0,0|2,0,0]=4 560 B11R1.156 CC(O)C1=C(F)C=CC=C1Br AK144493 [1,1,0,0,0,0|2,0,0]=4 561 B11R1.156 C[C@@H](N)C1=C(C)C=CC=C1C AK-42481 [1,1,0,0,0,0|2,0,0]=4 562 B11R1.156 C[C@@H](N)C1=C(Cl)C=CC=C1Cl AK-93232 [1,1,0,0,0,0|2,0,0]=4 563 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1Cl AK134065 [1,1,0,0,0,0|2,0,0]=4 564 B11R1.156 C[C@@H](N)C1=C(F)C=CC=C1F AK-42489 [1,1,0,0,0,0|2,0,0]=4 565 B11R1.156 C[C@H](N)C1=C(C)C=CC=C1C AK-42483 [1,1,0,0,0,0|2,0,0]=4 566 B11R1.156 C[C@H](N)C1=C(Cl)C=CC=C1Cl AK607972 [1,1,0,0,0,0|2,0,0]=4 567 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1Cl AK134087 [1,1,0,0,0,0|2,0,0]=4 568 B11R1.156 C[C@H](N)C1=C(F)C=CC=C1F AK-42490 [1,1,0,0,0,0|2,0,0]=4 569 B11R1.156 NC(C1=C(F)C=CC=C1F)C AK405737 [1,1,0,0,0,0|2,0,0]=4 570 B11R1.159 CC(C)C1=CC=CC(O)=C1O AK109526 [1,1,0,0,0,0|0,0,0]=2 571 B11R1.159 CC(C1=CC=CC(Br)=C1O)=O AK-33819 [1,1,0,0,0,0|1,0,1]=4 572 B11R1.159 CC(C1=CC=CC(Cl)=C1O)=O AK-34682 [1,1,0,0,0,0|1,0,1]=4 573 B11R1.159 CC(C1=CC=CC(N)=C1O)=O AK-26283 [1,1,0,0,0,0|1,0,1]=4 574 B11R1.159 CC(C1=CC=CC(O)=C1O)=O AK-33157 [1,1,0,0,0,0|1,0,1]=4 575 B11R1.159 CC(N)C1=CC=CC(Cl)=C1F AK338219 [1,1,0,0,0,0|2,0,0]=4 576 B11R1.159 C[C@@H](N)C1=CC=CC(Cl)=C1F AK-42505 [1,1,0,0,0,0|2,0,0]=4 577 B11R1.159 C[C@H](N)C1=CC=CC(Cl)=C1F AK151381 [1,1,0,0,0,0|2,0,0]=4 578 B11R1.159 NC(C)C1=CC=CC(Cl)=C1Cl AK555588 [1,1,0,0,0,0|2,0,0]=4 579 B11R1.167 C1=C(Br)C=CC(=C1C(=O)C)O AK-47862 [1,1,0,0,0,0|1,0,1]=4 580 B11R1.167 CC(=O)C1=C(O)C=CC(C)=C1 AK-30761 [1,1,0,0,0,0|1,0,1]=4 581 B11R1.167 CC(=O)C1=C(O)C=CC(Cl)=C1 AK-30762 [1,1,0,0,0,0|1,0,1]=4 582 B11R1.167 CC(C1=CC(F)=CC=C1O)=O AK-45396 [1,1,0,0,0,0|1,0,1]=4 583 B11R1.167 CC(C1=CC(I)=CC=C1F)C AK685324 [1,1,0,0,0,0|1,0,0]=3 584 B11R1.167 CC(C1=CC(N)=CC=C1O)=O AK116395 [1,1,0,0,0,0|1,0,1]=4 585 B11R1.167 CC(C1=CC(O)=CC=C1O)=O AK-51301 [1,1,0,0,0,0|1,0,1]=4 586 B11R1.167 CC(N)C1=CC(Cl)=CC=C1F AK338981 [1,1,0,0,0,0|2,0,0]=4 587 B11R1.167 CC(O)C1=C(C)C=CC(Cl)=C1 AK425566 [1,1,0,0,0,0|2,0,0]=4 588 B11R1.167 CC(O)C1=CC(Br)=CC=C1F AK-28060 [1,1,0,0,0,0|2,0,0]=4 589 B11R1.167 OC1=CC=C(C)C=C1C(C)C AK126296 [1,1,0,0,0,0|0,0,0]=2 590 B11R1.167 OC1=CC=C(I)C(N(C)C)=C1 AK549977 [1,1,0,0,0,0|2,0,0]=4 591 B11R1.222 CC(C1=CC=CC=C1C)C#N AK165081 [1,1,0,0,0,0|1,0,1]=4 592 B11R1.222 CCC(C1=CC=CC=C1F)N AK544261 [1,1,0,0,0,0|2,0,0]=4 593 B11R1.222 CC[C@@H](C1=CC=CC=C1F)N AK134089 [1,1,0,0,0,0|2,0,0]=4 594 B11R1.222 ClC1=CC=CC=C1[C@H](N)CO AK548235 [1,1,0,0,0,0|2,0,0]=4 595 B11R1.222 NC1=CC=CC=C1C(C)CC AK122191 [1,1,0,0,0,0|1,0,0]=3 596 B11R1.222 N[C@@H](C1=CC=CC=C1C)CC AK-42242 [1,1,0,0,0,0|2,0,0]=4 597 B11R1.222 N[C@H](C1=CC=CC=C1Cl)CC AK-42248 [1,1,0,0,0,0|2,0,0]=4 598 B11R1.222 O[C@@H](C1=CC=CC=C1Cl)CO AK-44949 [1,1,0,0,0,0|2,0,0]=4 599 B13R1.51 CC(C)CC1=C(C=C(Br)C=C1)C#N AK103448 [0,1,0,0,0,1|2,0,0]=4 600 B13R1.51 O=CC1=CC(Br)=CC=C1OC(C)C AK-24296 [0,1,0,0,0,1|1,0,1]=4 601 B13R1.51 O=CC1=CC(C)=CC=C1OC(C)C AK279629 [0,1,0,0,0,1|0,0,1]=3 602 B13R1.99 COC1=CC(OC)=C(C=C1)C(C)=O AK-79423 [0,2,0,0,0,0|1,0,1]=4 603 B13R1.2065 O=C(OC)C1=CC=C(C)C=C1OC AK-38348 [0,2,0,0,0,0|1,0,1]=4 604 B13R1.652 COC1=CC(F)=C(C(C)C)C=C1Br AK171873 [0,2,0,0,0,0|1,0,0]=3 605 B13R1.1807 COC(=O)C1=C(O)C=C(C)C(Br)=C1 AK-82138 [0,2,0,0,0,0|1,0,1]=4 606 B13R1.95 O=C(OC)C1=CC=C(OC)C=C1O AK-89760 [0,2,0,0,0,0|1,0,1]=4 607 B13R1.120 NC1=CC([N+]([O-])=O)=CC=C1C(C)C AK100799 [0,2,0,0,0,0|2,0,0]=4 608 B13R1.120 O=[N+](C1=CC=C(C(C)C)C(Br)=C1)[O-] AK-43158 [0,2,0,0,0,0|2,0,0]=4 609 B13R1.961 FC1=CC(Br)=CC=C1C(OC)OC AK146301 [0,2,0,0,0,0|2,0,0]=4 610 B11R2.34 BrC1=CC=C(C=C1)C2CC2 AK-76692 [1,0,0,1,0,0|1,0,0]=3 611 B11R2.34 BrC1=CN=C(C2CC2)C=C1 AK-83540 [1,0,0,1,0,0|2,0,0]=4 612 B11R2.34 BrC1=NC=C(C2CC2)C=C1 AK131652 [1,0,0,1,0,0|2,0,0]=4 613 B11R2.34 FC1=NC=C(C2CC2)C=C1 AK132519 [1,0,0,1,0,0|2,0,0]=4 614 B11R2.34 NC1=CC=C(C2CC2)C=C1 AK124361 [1,0,0,1,0,0|1,0,0]=3 615 B11R2.34 NC1=CC=C(C2CC2)N=C1 AK-64994 [1,0,0,1,0,0|2,0,0]=4 616 B11R2.34 NC1=NC=C(C2CC2)C=C1 AK129592 [1,0,0,1,0,0|2,0,0]=4 617 B11R2.34 O=C1C=CC(C2CC2)=CN1 AK132527 [1,0,0,1,0,0|2,0,0]=4 618 B11R2.34 OC1=CC=C(C2CC2)C=C1 AK-80032 [1,0,0,1,0,0|1,0,0]=3 619 B11R2.36 BrC1=CC2=C(C=C1)CCN2 AK-30084 [1,0,0,1,0,0|2,0,0]=4 620 B11R2.36 BrC1=CC2=C(C=C1)CCN2 AK-48733 [1,0,0,1,0,0|2,0,0]=4 621 B11R2.36 BrC1=CC=C2CCOC2=C1 AK114300 [1,0,0,1,0,0|1,0,0]=3 622 B11R2.36 BrC1=CC=C2OCOC2=C1 AK-34440 [1,0,0,1,0,0|2,0,0]=4 623 B11R2.36 ClC1=CC2=C(C=C1)CCN2 AK-46887 [1,0,0,1,0,0|2,0,0]=4 624 B11R2.36 ClC1=CC=C2C(=C1)NCC2 AK-30184 [1,0,0,1,0,0|2,0,0]=4 625 B11R2.36 FC1=CC2=C(CCC2)C=C1 AK105101 [1,0,0,1,0,0|2,0,0]=4 626 B11R2.36 NC1=CC2=C(OCO2)C=C1 AK-33266 [1,0,0,1,0,0|2,0,0]=4 627 B11R2.36 NC1=CC=C2OCOC2=C1 AK100870 [1,0,0,1,0,0|2,0,0]=4 628 B11R2.36 OC1=CC2=C(C=C1)CCN2 AK145623 [1,0,0,1,0,0|2,0,0]=4 629 B11R2.1 C1=CC=CC2=C1C(CO2)=O AK-45365 [1,0,0,1,0,0|1,0,1]=4 630 B11R2.1 NC1CCC2=C1C=CC=C2 AK-44750 [1,0,0,1,0,0|2,0,0]=4 631 B11R2.1 NC1CCC2=CC=CC=C12 AK-96028 [1,0,0,1,0,0|2,0,0]=4 632 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 AK-44891 [1,0,0,1,0,0|2,0,0]=4 633 B11R2.1 N[C@H]1CCC2=C1C=CC=C2 AK-89530 [1,0,0,1,0,0|2,0,0]=4 634 B11R2.1 N[C@H]1COC2=CC=CC=C12 AK172653 [1,0,0,1,0,0|1,0,0]=3 635 B11R2.1 OC1CCC2=C1C=CC=C2 AK151987 [1,0,0,1,0,0|2,0,0]=4 636 B11R2.55 ClC1=C(C2CC2)C=NC=C1 AK543867 [1,0,0,1,0,0|2,0,0]=4 637 B11R2.55 FC1=NC=CC=C1C2CC2 AK131938 [1,0,0,1,0,0|2,0,0]=4 638 B11R2.55 NC1=CC=CC=C1C2CC2 AK142855 [1,0,0,1,0,0|1,0,0]=3 639 B11R2.55 NC1=NC=CC=C1C2CC2 AK131946 [1,0,0,1,0,0|2,0,0]=4 640 B11R2.55 O=C1C(C2CC2)=CC=CN1 AK131947 [1,0,0,1,0,0|1,0,1]=4 641 B13R2.3051 CC1(C)OC2=CC=C(Br)C=C2O1 AK115913 [0,0,0,1,0,1|1,0,0]=3 642 B13R2.3683 CC1NC2=C(C=C(F)C=C2)CC1 AK-31866 [0,0,0,1,0,1|2,0,0]=4 643 B13R2.5179 NC1CCCC2=C1C=CC(C)=C2 AK687515 [0,1,0,1,0,0|2,0,0]=4 644 B13R2.5179 NC1CCOC2=C1C=CC(F)=C2 AK-50863 [0,1,0,1,0,0|2,0,0]=4 645 B13R2.5179 N[C@@H]1CCOC2=C1C=CC(Br)=C2 AK172744 [0,1,0,1,0,0|2,0,0]=4 646 B13R2.5179 N[C@@H]1CCOC2=C1C=CC(F)=C2 AK-50861 [0,1,0,1,0,0|2,0,0]=4 647 B13R2.5179 O=C1CCOC2=C1C=CC(C)=C2 AK201267 [0,1,0,1,0,0|1,0,1]=4 648 B13R2.5179 OC1CCOC2=C1C=CC(Br)=C2 AK201268 [0,1,0,1,0,0|2,0,0]=4 649 B9R1.35 CC1=CSC(C(C)C)=N1 AK114355 [1,0,0,0,1,0|2,0,0]=4 650 B11R1.20 CC(NC1=CC=C(C)C=C1)=O AK208638 [1,0,0,0,0,1|1,0,1]=4 651 B11R1.20 CC(NC1=CC=C(F)C=C1)C AK-53729 [1,0,0,0,0,1|1,0,0]=3 652 B11R1.20 CC(OC1=CN=C(Cl)C=C1)C AK143478 [1,0,0,0,0,1|2,0,0]=4 653 B11R1.20 NC1=CC=C(CN(C)C)C=C1 AK-35964 [1,0,0,0,0,1|2,0,0]=4 654 B11R1.20 NC1=CC=C(OC(C)C)C=C1 AK-42665 [1,0,0,0,0,1|1,0,0]=3 655 B11R1.86 C1=C(OC(C)C)C(=CC=C1)N AK-39887 [1,0,0,0,0,1|1,0,0]=3 656 B11R1.86 CC(C)OC1=CC=CC=C1Br AK-45390 [1,0,0,0,0,1|1,0,0]=3 657 B11R1.86 CC(NC1=CC=CC=C1O)=O AK116958 [1,0,0,0,0,1|1,0,1]=4 658 B11R1.86 CC(OC1=NC=CC=C1Br)C AK127008 [1,0,0,0,0,1|2,0,0]=4 659 B11R1.86 OC1=CC=CC=C1OC(F)F AK135667 [1,0,0,0,0,1|2,0,0]=4 660 B11R1.86 OC1=CC=CN=C1CN(C)C AK-34123 [1,0,0,0,0,1|2,0,0]=4