0 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [0,0,0,0,0,0|1,0,3]=4 3 B11R1.40 C#CN(C)Cc1ccccc1 Amb27654928 [0,0,0,0,0,0|2,0,2]=4 4 B11R1.40 C#C\C(C)=C\c1ccccc1 Amb33476742 [0,0,0,0,0,0|1,0,1]=2 5 B11R1.40 C=C(C=O)Cc1ccccc1 Amb8392633 [0,0,0,0,0,0|0,0,2]=2 6 B11R1.40 C=C(CBr)Cc1ccccc1 Amb27481590 [0,0,0,0,0,0|1,0,3]=4 7 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [0,0,0,0,0,0|2,0,2]=4 8 B11R1.40 C=C(CCl)Cc1ccccc1 Amb25185403 [0,0,0,0,0,0|1,0,3]=4 9 B11R1.40 C=C(CCl)Sc1ccccc1 Amb27478090 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.40 C=C(CN)Cc1ccccc1 Amb26614383 [0,0,0,0,0,0|1,0,3]=4 11 B11R1.40 C=C(CN)Sc1ccccc1 Amb27847529 [0,0,0,0,0,0|2,0,2]=4 12 B11R1.40 C=C(CO)Sc1ccccc1 Amb27961782 [0,0,0,0,0,0|1,0,3]=4 13 B11R1.40 C=CC(=C)Sc1ccccc1 Amb4013516 [0,0,0,0,0,0|2,0,1]=3 14 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,0,0|2,0,1]=3 15 B11R1.40 C=CC(=O)Cc1ccccn1 Amb24425169 [0,0,0,0,0,0|3,0,1]=4 16 B11R1.40 C=CC(=O)Cc1cccnc1 Amb28365485 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.40 C=CC(=O)Cc1ccncc1 Amb27389580 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.40 C=CC(=O)Nc1ccccc1 Amb6843666 [0,0,0,0,0,0|3,0,0]=3 19 B11R1.40 C=CC(=O)Nc1ccccn1 Amb33532236 [0,0,0,0,0,0|4,0,0]=4 20 B11R1.40 C=CC(=O)Nc1cccnc1 Amb33532237 [0,0,0,0,0,0|4,0,0]=4 21 B11R1.40 C=CC(=O)Nc1ccncc1 Amb9480418 [0,0,0,0,0,0|4,0,0]=4 22 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [0,0,0,0,0,0|2,0,2]=4 23 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [0,0,0,0,0,0|1,0,2]=3 24 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [0,0,0,0,0,0|2,0,2]=4 26 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,0,0,0,0,0|2,0,2]=4 27 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [0,0,0,0,0,0|2,0,1]=3 28 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [0,0,0,0,0,0|2,0,1]=3 29 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [0,0,0,0,0,0|2,0,2]=4 30 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [0,0,0,0,0,0|2,0,1]=3 31 B11R1.40 C=C\C(C)=C/c1ccccc1 Amb27428211 [0,0,0,0,0,0|1,0,0]=1 32 B11R1.40 C=C\C(C)=C\c1ccccc1 Amb27950688 [0,0,0,0,0,0|1,0,0]=1 33 B11R1.40 C=C\C(C)=C\c1ccccn1 Amb24101881 [0,0,0,0,0,0|2,0,0]=2 34 B11R1.40 C=C\C(C)=C\c1cccnc1 Amb24085616 [0,0,0,0,0,0|2,0,0]=2 35 B11R1.40 C=C\C(C)=C\c1ccncc1 Amb24103157 [0,0,0,0,0,0|2,0,0]=2 36 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [0,0,0,0,0,0|1,0,3]=4 37 B11R1.40 CC(C#N)Nc1ccccc1 Amb17399903 [0,0,0,0,0,0|2,0,2]=4 38 B11R1.40 CC(C#N)Oc1ccccc1 Amb5780982 [0,0,0,0,0,0|2,0,2]=4 39 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,0,0,0,0,0|2,0,2]=4 40 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [0,0,0,0,0,0|0,0,2]=2 41 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [0,0,0,0,0,0|1,0,2]=3 42 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [0,0,0,0,0,0|1,0,2]=3 43 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,0,0,0,0,0|1,0,1]=2 44 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,0,0,0,0,0|1,0,1]=2 45 B11R1.40 CC(C=O)Sc1ccccn1 Amb35652165 [0,0,0,0,0,0|2,0,1]=3 46 B11R1.40 CC(C=O)Sc1ccncc1 Amb35652166 [0,0,0,0,0,0|2,0,1]=3 47 B11R1.40 CC(C=O)Sc1ccncn1 Amb30036851 [0,0,0,0,0,0|3,0,1]=4 48 B11R1.40 CC(C=O)Sc1cnccn1 Amb30036852 [0,0,0,0,0,0|3,0,1]=4 49 B11R1.40 CC(C=O)Sc1ncccn1 Amb30036850 [0,0,0,0,0,0|3,0,1]=4 50 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,0,0,0,0,0|1,0,3]=4 51 B11R1.40 CC(CBr)Oc1ccccc1 Amb17241866 [0,0,0,0,0,0|2,0,2]=4 52 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [0,0,0,0,0,0|1,0,3]=4 53 B11R1.40 CC(CCl)Oc1ccccc1 Amb17232796 [0,0,0,0,0,0|2,0,2]=4 54 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,0,0,0,0,0|1,0,3]=4 55 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [0,0,0,0,0,0|1,0,3]=4 56 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,0,0,0,0,0|2,0,2]=4 57 B11R1.40 CC(CN)Oc1ccccc1 Amb3938897 [0,0,0,0,0,0|2,0,2]=4 58 B11R1.40 CC(CN)Oc1ccccc1 Amb6365930 [0,0,0,0,0,0|2,0,2]=4 59 B11R1.40 CC(CN)Sc1ccccc1 Amb17485971 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [0,0,0,0,0,0|0,0,4]=4 61 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,0,0,0,0,0|1,0,3]=4 62 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [0,0,0,0,0,0|1,0,3]=4 63 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [0,0,0,0,0,0|2,0,2]=4 64 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [0,0,0,0,0,0|2,0,2]=4 65 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.40 CC(Nc1ccccc1)=S=O Amb27592896 [0,0,0,0,0,0|2,0,0]=2 67 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [0,0,0,0,0,0|2,0,2]=4 68 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [0,0,0,0,0,0|3,0,1]=4 69 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [0,0,0,0,0,0|3,0,1]=4 70 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [0,0,0,0,0,0|3,0,1]=4 71 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [0,0,0,0,0,0|2,0,2]=4 72 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,0,0,0,0,0|2,0,2]=4 73 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,0,0,0,0,0|2,0,2]=4 74 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [0,0,0,0,0,0|1,0,3]=4 75 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [0,0,0,0,0,0|1,0,1]=2 76 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [0,0,0,0,0,0|1,0,1]=2 77 B11R1.40 CC\C(C)=N\c1ccccn1 Amb27191786 [0,0,0,0,0,0|3,0,1]=4 78 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [0,0,0,0,0,0|2,0,1]=3 79 B11R1.40 CN(C#N)Cc1ccccc1 Amb25072835 [0,0,0,0,0,0|2,0,2]=4 80 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [0,0,0,0,0,0|1,0,1]=2 81 B11R1.40 CN(C=O)Cc1ccncc1 Amb27262023 [0,0,0,0,0,0|2,0,1]=3 82 B11R1.40 CN(C=O)Cc1cnccn1 Amb35600687 [0,0,0,0,0,0|3,0,1]=4 83 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,0,0,0,0,0|2,0,1]=3 84 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [0,0,0,0,0,0|3,0,1]=4 86 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [0,0,0,0,0,0|4,0,0]=4 87 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [0,0,0,0,0,0|4,0,0]=4 90 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [0,0,0,0,0,0|2,0,2]=4 91 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [0,0,0,0,0,0|2,0,2]=4 92 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [0,0,0,0,0,0|2,0,2]=4 93 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [0,0,0,0,0,0|2,0,0]=2 94 B11R1.40 CN\C(C)=C\c1ccccn1 Amb28423447 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.40 CN\C(C)=C\c1cccnc1 Amb27170157 [0,0,0,0,0,0|3,0,0]=3 96 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,0,0,0,0,0|3,0,1]=4 97 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,0,0,0,0,0|3,0,1]=4 98 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [0,0,0,0,0,0|3,0,1]=4 99 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,0,0|4,0,0]=4 100 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [0,0,0,0,0,0|4,0,0]=4 102 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [0,0,0,0,0,0|2,0,0]=2 103 B11R1.40 CO\C(C)=N/c1ccccn1 Amb24095834 [0,0,0,0,0,0|4,0,0]=4 104 B11R1.40 CO\C(C)=N\c1ccccn1 Amb27484618 [0,0,0,0,0,0|4,0,0]=4 105 B11R1.40 CO\C([O-])=N\c1ccccc1 Amb8488213 [0,0,0,0,0,0|4,0,0]=4 106 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [0,0,0,0,0,0|4,0,0]=4 107 B11R1.40 CSC(=S)Nc1ccccc1 Amb5716125 [0,0,0,0,0,0|4,0,0]=4 108 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,0,0,0,0,0|1,0,1]=2 109 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [0,0,0,0,0,0|1,0,3]=4 110 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [0,0,0,0,0,0|1,0,3]=4 111 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,0,0,0,0,0|1,0,3]=4 112 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [0,0,0,0,0,0|0,0,4]=4 113 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [0,0,0,0,0,0|1,0,3]=4 114 B11R1.40 C[C@H](CN)Oc1ccccc1 Amb27803833 [0,0,0,0,0,0|2,0,2]=4 115 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,0,0,0,0,0|0,0,4]=4 116 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [0,0,0,0,0,0|1,0,3]=4 117 B11R1.40 C[SiH](CO)Cc1ccccc1 Amb27981860 [0,0,0,0,0,0|0,1,3]=4 118 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [0,0,0,0,0,0|1,0,1]=2 119 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [0,0,0,0,0,0|1,0,1]=2 120 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [0,0,0,0,0,0|1,0,1]=2 121 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [0,0,0,0,0,0|0,0,2]=2 122 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [0,0,0,0,0,0|0,1,1]=2 123 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [0,0,0,0,0,0|1,0,1]=2 124 B11R1.40 C\C(=C\c1ccccn1)CCl Amb27622092 [0,0,0,0,0,0|2,0,1]=3 125 B11R1.40 C\C(=C\c1cccnc1)CN Amb27480311 [0,0,0,0,0,0|2,0,1]=3 126 B11R1.40 C\C(=C\c1ccncc1)CBr Amb28454468 [0,0,0,0,0,0|2,0,1]=3 127 B11R1.40 C\C(=C\c1ccncc1)CN Amb27242023 [0,0,0,0,0,0|2,0,1]=3 128 B11R1.40 C\C(=C\c1ccncc1)CO Amb27663027 [0,0,0,0,0,0|1,0,2]=3 129 B11R1.40 C\C(=C\c1cnccn1)CBr Amb35600903 [0,0,0,0,0,0|3,0,1]=4 130 B11R1.40 C\C(=C\c1cnccn1)CCl Amb35600900 [0,0,0,0,0,0|3,0,1]=4 131 B11R1.40 C\C(=C\c1cnccn1)CN Amb35602987 [0,0,0,0,0,0|3,0,1]=4 132 B11R1.40 C\C(=N\N)Nc1ccccc1 Amb27198359 [0,0,0,0,0,0|3,0,0]=3 133 B11R1.40 C\C(=N\O)Nc1ccccc1 Amb2610722 [0,0,0,0,0,0|2,0,1]=3 134 B11R1.40 C\C(C#N)=C\c1ccccc1 Amb27421076 [0,0,0,0,0,0|1,0,1]=2 135 B11R1.40 C\C(C=O)=C/c1ccccc1 Amb6608709 [0,0,0,0,0,0|0,0,0]=0 136 B11R1.40 C\C(C=O)=C/c1ccccn1 Amb1014105 [0,0,0,0,0,0|1,0,0]=1 137 B11R1.40 C\C(C=O)=C/c1cccnc1 Amb17334266 [0,0,0,0,0,0|1,0,0]=1 138 B11R1.40 C\C(C=O)=C/c1ccncc1 Amb17334268 [0,0,0,0,0,0|1,0,0]=1 139 B11R1.40 C\C(C=O)=C/c1cncnc1 Amb28058466 [0,0,0,0,0,0|2,0,0]=2 140 B11R1.40 C\C(C=O)=C\c1cccnc1 Amb28070736 [0,0,0,0,0,0|1,0,0]=1 141 B11R1.40 C\C(Cc1ccncc1)=N/O Amb32663046 [0,0,0,0,0,0|2,0,2]=4 142 B11R1.40 C\C(Cc1ccncc1)=N\N Amb27840230 [0,0,0,0,0,0|3,0,1]=4 143 B11R1.40 C\C(Cc1ccncc1)=N\O Amb24417230 [0,0,0,0,0,0|2,0,2]=4 144 B11R1.40 C\C=C(\C)Nc1ccccc1 Amb27597055 [0,0,0,0,0,0|2,0,0]=2 145 B11R1.40 C\N=C(\C)Oc1ccccc1 Amb27260339 [0,0,0,0,0,0|3,0,0]=3 146 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [0,0,0,0,0,0|3,0,1]=4 147 B11R1.40 ClC\C(Cl)=N\c1ccccc1 Amb27875115 [0,0,0,0,0,0|3,0,1]=4 148 B11R1.40 Cl\C=C(/Cl)Oc1ccccc1 Amb34048810 [0,0,0,0,0,0|3,0,0]=3 149 B11R1.40 Cl\C=C(\Cl)Cc1ccccc1 Amb27657562 [0,0,0,0,0,0|2,0,1]=3 150 B11R1.40 Cl\C=C(\Cl)Oc1ccccc1 Amb25968444 [0,0,0,0,0,0|3,0,0]=3 151 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [0,0,0,0,0,0|2,0,1]=3 152 B11R1.40 F\C(=C\Cl)Oc1ccccc1 Amb27477898 [0,0,0,0,0,0|3,0,0]=3 153 B11R1.40 F\C(=C\Cl)Sc1ccccc1 Amb28383507 [0,0,0,0,0,0|3,0,0]=3 154 B11R1.40 N#CC(=O)Cc1ccccc1 Amb26498532 [0,0,0,0,0,0|2,0,2]=4 155 B11R1.40 N#CC(=O)Nc1ccccc1 Amb4006113 [0,0,0,0,0,0|3,0,1]=4 156 B11R1.40 N#CC(=O)Oc1ccccc1 Amb27813575 [0,0,0,0,0,0|3,0,1]=4 157 B11R1.40 N#CC(=S)Nc1ccccc1 Amb8515443 [0,0,0,0,0,0|3,0,1]=4 158 B11R1.40 N#C\C(F)=C/c1ccccn1 Amb26559758 [0,0,0,0,0,0|3,0,1]=4 159 B11R1.40 N#C\C(F)=C\c1ccccc1 Amb18644314 [0,0,0,0,0,0|2,0,1]=3 160 B11R1.40 N#C\C(F)=C\c1ccccn1 Amb25696340 [0,0,0,0,0,0|3,0,1]=4 161 B11R1.40 N=C(CCl)Cc1ccccc1 Amb27878974 [0,0,0,0,0,0|2,0,2]=4 162 B11R1.40 N=C(CCl)Nc1ccccc1 Amb27234641 [0,0,0,0,0,0|3,0,1]=4 163 B11R1.40 N=C(CCl)Sc1ccccc1 Amb29847983 [0,0,0,0,0,0|3,0,1]=4 164 B11R1.40 N=C(CF)Nc1ccccc1 Amb27863862 [0,0,0,0,0,0|3,0,1]=4 165 B11R1.40 N=C(CO)Nc1ccccc1 Amb28062227 [0,0,0,0,0,0|2,0,2]=4 166 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [0,0,0,0,0,0|3,0,1]=4 167 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [0,0,0,0,0,0|2,0,2]=4 168 B11R1.40 N=C(NN)Nc1ccccc1 Amb32712057 [0,0,0,0,0,0|4,0,0]=4 169 B11R1.40 N=C(NN)Oc1ccccc1 Amb27769041 [0,0,0,0,0,0|4,0,0]=4 170 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,0,0|2,0,2]=4 171 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [0,0,0,0,0,0|2,0,2]=4 172 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [0,0,0,0,0,0|3,0,1]=4 173 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [0,0,0,0,0,0|3,0,1]=4 174 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [0,0,0,0,0,0|3,0,1]=4 175 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [0,0,0,0,0,0|3,0,1]=4 176 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [0,0,0,0,0,0|4,0,0]=4 177 B11R1.40 NNC(=O)Nc1ccccc1 Amb9825866 [0,0,0,0,0,0|4,0,0]=4 178 B11R1.40 NNC(=O)Oc1ccccc1 Amb2737176 [0,0,0,0,0,0|4,0,0]=4 179 B11R1.40 NNC(=S)Nc1ccccc1 Amb6335759 [0,0,0,0,0,0|4,0,0]=4 180 B11R1.40 NNC(=S)Oc1ccccc1 Amb28248761 [0,0,0,0,0,0|4,0,0]=4 181 B11R1.40 NNC(=S)Sc1ccccc1 Amb27254132 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.40 NN\C(S)=N\c1ccccc1 Amb8468017 [0,0,0,0,0,0|4,0,0]=4 183 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [0,0,0,0,0,0|4,0,0]=4 184 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [0,0,0,0,0,0|1,0,2]=3 185 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb18799378 [0,0,0,0,0,0|3,0,1]=4 186 B11R1.40 N\C(=N/O)Nc1ccccc1 Amb33743404 [0,0,0,0,0,0|3,0,1]=4 187 B11R1.40 N\C(=N\Cl)Nc1ccccc1 Amb27244827 [0,0,0,0,0,0|4,0,0]=4 188 B11R1.40 N\C(Cc1ccccc1)=N/O Amb1159399 [0,0,0,0,0,0|2,0,2]=4 189 B11R1.40 N\C(Cc1ccccc1)=N\O Amb1106303 [0,0,0,0,0,0|2,0,2]=4 190 B11R1.40 N\N=C(\N)Nc1ccccc1 Amb25046170 [0,0,0,0,0,0|4,0,0]=4 191 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [0,0,0,0,0,0|2,0,2]=4 192 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [0,0,0,0,0,0|3,0,1]=4 193 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [0,0,0,0,0,0|3,0,1]=4 194 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [0,0,0,0,0,0|2,0,2]=4 195 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [0,0,0,0,0,0|3,0,1]=4 196 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [0,0,0,0,0,0|3,0,1]=4 197 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [0,0,0,0,0,0|3,0,1]=4 198 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [0,0,0,0,0,0|3,0,1]=4 199 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [0,0,0,0,0,0|2,0,2]=4 200 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [0,0,0,0,0,0|2,1,1]=4 201 B11R1.40 O=C(NO)Nc1ccccc1 Amb2746999 [0,0,0,0,0,0|3,0,1]=4 202 B11R1.40 O=C(NO)Oc1ccccc1 Amb22493600 [0,0,0,0,0,0|3,0,1]=4 203 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,0,0|1,0,1]=2 204 B11R1.40 O=CC(=O)Nc1ccccc1 Amb27643437 [0,0,0,0,0,0|2,0,0]=2 205 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [0,0,0,0,0,0|1,0,2]=3 206 B11R1.40 O=CC(Cl)Cc1cccnc1 Amb27866890 [0,0,0,0,0,0|2,0,2]=4 207 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [0,0,0,0,0,0|1,0,2]=3 208 B11R1.40 O=CC(O)Cc1ccccn1 Amb28345542 [0,0,0,0,0,0|2,0,2]=4 209 B11R1.40 O=CN(O)Cc1ccccc1 Amb27873557 [0,0,0,0,0,0|2,0,1]=3 210 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [0,0,0,0,0,0|1,0,2]=3 211 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [0,0,0,0,0,0|1,0,2]=3 212 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [0,0,0,0,0,0|1,0,2]=3 213 B11R1.40 O=C\C(Br)=C/c1ccccc1 Amb25047719 [0,0,0,0,0,0|1,0,0]=1 214 B11R1.40 O=C\C(Br)=C\c1ccccc1 Amb6608679 [0,0,0,0,0,0|1,0,0]=1 215 B11R1.40 O=C\C(Cl)=C/c1ccccc1 Amb6297306 [0,0,0,0,0,0|1,0,0]=1 216 B11R1.40 O=C\C(Cl)=C\c1ccccc1 Amb2792752 [0,0,0,0,0,0|1,0,0]=1 217 B11R1.40 O=C\C(Cl)=C\c1ccccn1 Amb18126489 [0,0,0,0,0,0|2,0,0]=2 218 B11R1.40 O=C\C(O)=C\c1ccccc1 Amb18124881 [0,0,0,0,0,0|1,0,0]=1 219 B11R1.40 O=NN(O)Cc1ccccc1 Amb28131432 [0,0,0,0,0,0|3,0,1]=4 220 B11R1.40 O=N\C(Br)=C/c1ccccc1 Amb27862869 [0,0,0,0,0,0|2,0,0]=2 221 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [0,0,0,0,0,0|1,0,2]=3 222 B11R1.40 ONC(=S)Nc1ccccc1 Amb9824829 [0,0,0,0,0,0|3,0,1]=4 223 B11R1.40 O\N=C(/Cl)Cc1ccccc1 Amb33625234 [0,0,0,0,0,0|2,0,2]=4 224 B11R1.40 O\N=C(/O)Cc1ccccc1 Amb19986986 [0,0,0,0,0,0|2,0,2]=4 225 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [0,0,0,0,0,0|2,0,2]=4 226 B10R1.17 BrC\C=C\c1ccccc1 Amb8513086 [1,0,0,0,0,0|1,0,1]=3 227 B10R1.17 BrC\C=C\c1ccccn1 Amb28365946 [1,0,0,0,0,0|2,0,1]=4 228 B10R1.17 Br\C=C\Cc1ccccc1 Amb33134791 [1,0,0,0,0,0|1,0,1]=3 229 B10R1.17 Br\C=C\Oc1ccccc1 Amb28145099 [1,0,0,0,0,0|2,0,0]=3 230 B10R1.17 Br\C=C\Sc1ccccc1 Amb26993510 [1,0,0,0,0,0|2,0,0]=3 231 B10R1.17 C#C\C=C/c1cccnc1 Amb24085625 [1,0,0,0,0,0|2,0,1]=4 232 B10R1.17 C#C\C=C\c1ccccc1 Amb33082101 [1,0,0,0,0,0|1,0,1]=3 233 B10R1.17 C=C=COc1ccccc1 Amb17673264 [1,0,0,0,0,0|2,0,1]=4 234 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [1,0,0,0,0,0|1,0,2]=4 235 B10R1.17 C=CCCc1ccccc1 Amb2721241 [1,0,0,0,0,0|1,0,2]=4 236 B10R1.17 C=CCNc1ccccc1 Amb2720315 [1,0,0,0,0,0|2,0,1]=4 237 B10R1.17 C=CCOc1ccccc1 Amb2842273 [1,0,0,0,0,0|2,0,1]=4 238 B10R1.17 C=CCSc1ccccc1 Amb3836099 [1,0,0,0,0,0|2,0,1]=4 239 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|2,0,1]=4 240 B10R1.17 C=C\C=C\c1ccccc1 Amb17938988 [1,0,0,0,0,0|1,0,0]=2 241 B10R1.17 C=C\C=C\c1cccnc1 Amb27976078 [1,0,0,0,0,0|2,0,0]=3 242 B10R1.17 CC=C=Cc1ccccc1 Amb27435633 [1,0,0,0,0,0|1,0,1]=3 243 B10R1.17 CC\C=C/c1cccnc1 Amb24602371 [1,0,0,0,0,0|2,0,1]=4 244 B10R1.17 CC\C=C\c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,1]=3 245 B10R1.17 CC\C=C\c1cccnc1 Amb28076152 [1,0,0,0,0,0|2,0,1]=4 246 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|2,0,1]=4 247 B10R1.17 CN=C=Cc1ccccc1 Amb27423885 [1,0,0,0,0,0|2,0,1]=4 248 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [1,0,0,0,0,0|3,0,0]=4 249 B10R1.17 CO\C=C/c1ccncc1 Amb24103279 [1,0,0,0,0,0|3,0,0]=4 250 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|2,0,0]=3 251 B10R1.17 CO\C=N\c1ccccc1 Amb6297410 [1,0,0,0,0,0|3,0,0]=4 252 B10R1.17 CS\C=C\c1ccccc1 Amb27654244 [1,0,0,0,0,0|2,0,0]=3 253 B10R1.17 C\C=C/Cc1cccnc1 Amb27470932 [1,0,0,0,0,0|2,0,1]=4 254 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [1,0,0,0,0,0|1,0,1]=3 255 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,0]=3 256 B10R1.17 C\C=N\Nc1ccccc1 Amb27788878 [1,0,0,0,0,0|3,0,0]=4 257 B10R1.17 ClC\C=C\c1ccccc1 Amb6608898 [1,0,0,0,0,0|1,0,1]=3 258 B10R1.17 ClC\C=C\c1cccnc1 Amb26369517 [1,0,0,0,0,0|2,0,1]=4 259 B10R1.17 ClC\C=C\c1ccncc1 Amb27392424 [1,0,0,0,0,0|2,0,1]=4 260 B10R1.17 Cl\C=C/Oc1ccccc1 Amb27865618 [1,0,0,0,0,0|2,0,0]=3 261 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb2613089 [1,0,0,0,0,0|2,0,1]=4 262 B10R1.17 FC\C=C\c1ccccc1 Amb27449580 [1,0,0,0,0,0|1,0,1]=3 263 B10R1.17 N#C\C=C/c1cccnc1 Amb27453523 [1,0,0,0,0,0|2,0,1]=4 264 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,0,0,0,0,0|1,0,1]=3 265 B10R1.17 N#C\C=C\c1ccccn1 Amb32658017 [1,0,0,0,0,0|2,0,1]=4 266 B10R1.17 N#C\C=C\c1cccnc1 Amb17477822 [1,0,0,0,0,0|2,0,1]=4 267 B10R1.17 N#C\C=C\c1ccncc1 Amb17477821 [1,0,0,0,0,0|2,0,1]=4 268 B10R1.17 N=CC#Cc1ccccc1 Amb27848552 [1,0,0,0,0,0|1,0,2]=4 269 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,0,0,0,0,0|1,0,1]=3 270 B10R1.17 NC\C=C/c1ccccc1 Amb6383106 [1,0,0,0,0,0|1,0,1]=3 271 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,0,0,0,0,0|1,0,1]=3 272 B10R1.17 NC\C=C\c1ccccc1 Amb4019220 [1,0,0,0,0,0|1,0,1]=3 273 B10R1.17 NC\C=C\c1ccccn1 Amb18063261 [1,0,0,0,0,0|2,0,1]=4 274 B10R1.17 NC\C=C\c1cccnc1 Amb18063302 [1,0,0,0,0,0|2,0,1]=4 275 B10R1.17 NC\C=C\c1cccnc1 Amb31148908 [1,0,0,0,0,0|2,0,1]=4 276 B10R1.17 NC\C=C\c1ccncc1 Amb18062333 [1,0,0,0,0,0|2,0,1]=4 277 B10R1.17 N\N=C\Nc1ccccc1 Amb27770569 [1,0,0,0,0,0|3,0,0]=4 278 B10R1.17 O=C=C\C=C1/C=CC=CN1 Amb27779702 [1,0,0,0,0,0|1,0,1]=3 279 B10R1.17 O=C=NCc1ccccc1 Amb3939117 [1,0,0,0,0,0|1,0,2]=4 280 B10R1.17 O=CC#Cc1ccccc1 Amb3778943 [1,0,0,0,0,0|0,0,2]=3 281 B10R1.17 O=CC#Cc1cccnc1 Amb25950612 [1,0,0,0,0,0|1,0,2]=4 282 B10R1.17 O=CCCc1ccccc1 Amb2720576 [1,0,0,0,0,0|0,0,2]=3 283 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,0,0,0,0,0|1,0,2]=4 284 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,0,0,0,0,0|1,0,2]=4 285 B10R1.17 O=CCCc1ccncc1 Amb8388451 [1,0,0,0,0,0|1,0,2]=4 286 B10R1.17 O=CCOc1ccccc1 Amb3465095 [1,0,0,0,0,0|1,0,1]=3 287 B10R1.17 O=CCOc1ccccn1 Amb27823582 [1,0,0,0,0,0|2,0,1]=4 288 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,0,0,0,0,0|1,0,1]=3 289 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,0,0,0,0,0|1,0,1]=3 290 B10R1.17 O=CNCc1ccccn1 Amb22370826 [1,0,0,0,0,0|2,0,1]=4 291 B10R1.17 O=CNCc1cccnc1 Amb2694543 [1,0,0,0,0,0|2,0,1]=4 292 B10R1.17 O=CNNc1ccccc1 Amb2721099 [1,0,0,0,0,0|2,0,0]=3 293 B10R1.17 O=CNNc1ccncc1 Amb26560692 [1,0,0,0,0,0|3,0,0]=4 294 B10R1.17 O=COCc1ccccc1 Amb4605893 [1,0,0,0,0,0|1,0,1]=3 295 B10R1.17 O=C[CH]Cc1ccccc1 Amb34916523 [1,0,0,0,0,0|0,0,2]=3 296 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,0,0,0,0,0|0,0,0]=1 297 B10R1.17 O=C\C=C\c1ccccc1 Amb2792758 [1,0,0,0,0,0|0,0,0]=1 298 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [1,0,0,0,0,0|1,0,0]=2 299 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [1,0,0,0,0,0|1,0,0]=2 300 B10R1.17 O=C\C=C\c1cccnn1 Amb18642956 [1,0,0,0,0,0|2,0,0]=3 301 B10R1.17 O=C\C=C\c1ccncc1 Amb33249631 [1,0,0,0,0,0|1,0,0]=2 302 B10R1.17 O=C\C=C\c1ccncn1 Amb18642951 [1,0,0,0,0,0|2,0,0]=3 303 B10R1.17 O=C\C=C\c1cnccn1 Amb35600870 [1,0,0,0,0,0|2,0,0]=3 304 B10R1.17 O=C\C=C\c1cncnc1 Amb25130263 [1,0,0,0,0,0|2,0,0]=3 305 B10R1.17 O=C\C=C\c1ncccn1 Amb33270347 [1,0,0,0,0,0|2,0,0]=3 306 B10R1.17 OC\C=C/c1ccccn1 Amb26391968 [1,0,0,0,0,0|1,0,2]=4 307 B10R1.17 OC\C=C/c1ccncc1 Amb27617653 [1,0,0,0,0,0|1,0,2]=4 308 B10R1.17 OC\C=C\c1ccccc1 Amb7809230 [1,0,0,0,0,0|0,0,2]=3 309 B10R1.17 OC\C=C\c1ccccn1 Amb22749315 [1,0,0,0,0,0|1,0,2]=4 310 B10R1.17 OC\C=C\c1cccnc1 Amb17619713 [1,0,0,0,0,0|1,0,2]=4 311 B10R1.17 OC\C=C\c1ccncc1 Amb22749186 [1,0,0,0,0,0|1,0,2]=4 312 B10R1.17 O\N=C\Cc1ccccc1 Amb31275669 [1,0,0,0,0,0|1,0,2]=4 313 B10R1.17 O\N=C\Nc1ccccc1 Amb27449667 [1,0,0,0,0,0|2,0,1]=4 314 B10R1.17 SC\C=C\c1ccccc1 Amb6255720 [1,0,0,0,0,0|0,1,1]=3 315 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,0,0,0,0,0|2,0,0]=3 316 B10R1.18 BrC(Br)=Cc1cccnc1 Amb24349522 [1,0,0,0,0,0|3,0,0]=4 317 B10R1.18 BrC(Br)=Cc1ccncc1 Amb26516830 [1,0,0,0,0,0|3,0,0]=4 318 B10R1.18 C=C(Br)Cc1ccccc1 Amb2685457 [1,0,0,0,0,0|1,0,1]=3 319 B10R1.18 C=C(C)Cc1cccnc1 Amb27624891 [1,0,0,0,0,0|1,0,1]=3 320 B10R1.18 C=C(Cl)Cc1ccccc1 Amb27172505 [1,0,0,0,0,0|1,0,1]=3 321 B10R1.18 C=C(Cl)Cc1ccccn1 Amb6299557 [1,0,0,0,0,0|2,0,1]=4 322 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [1,0,0,0,0,0|1,0,1]=3 323 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,0,0,0,0,0|2,0,0]=3 324 B10R1.18 CC(=N)Nc1ccccn1 Amb28050174 [1,0,0,0,0,0|3,0,0]=4 325 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,0,0,0,0,0|1,0,1]=3 326 B10R1.18 CC(=O)C[n+]1ccccc1 Amb4018023 [1,0,0,0,0,0|1,0,1]=3 327 B10R1.18 CC(=O)C[n+]1ccccc1 Amb6366487 [1,0,0,0,0,0|1,0,1]=3 328 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [1,0,0,0,0,0|0,0,1]=2 329 B10R1.18 CC(=O)Cc1ccccn1 Amb33527266 [1,0,0,0,0,0|1,0,1]=3 330 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,0,0,0,0,0|1,0,1]=3 331 B10R1.18 CC(=O)Cc1cccnc1 Amb22587708 [1,0,0,0,0,0|1,0,1]=3 332 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,0,0,0,0,0|1,0,1]=3 333 B10R1.18 CC(=O)Cc1ccncc1 Amb8390737 [1,0,0,0,0,0|1,0,1]=3 334 B10R1.18 CC(=O)Cc1ccncn1 Amb33225151 [1,0,0,0,0,0|2,0,1]=4 335 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [1,0,0,0,0,0|2,0,1]=4 336 B10R1.18 CC(=O)Cc1cncnc1 Amb25328576 [1,0,0,0,0,0|2,0,1]=4 337 B10R1.18 CC(=O)Cc1ncccn1 Amb21864927 [1,0,0,0,0,0|2,0,1]=4 338 B10R1.18 CC(=O)Nc1ccccc1 Amb6346349 [1,0,0,0,0,0|1,0,0]=2 339 B10R1.18 CC(=O)Nc1ccccn1 Amb6374183 [1,0,0,0,0,0|2,0,0]=3 340 B10R1.18 CC(=O)Nc1cccnc1 Amb6608635 [1,0,0,0,0,0|2,0,0]=3 341 B10R1.18 CC(=O)Nc1ccncc1 Amb6395765 [1,0,0,0,0,0|2,0,0]=3 342 B10R1.18 CC(=O)Nc1ccncn1 Amb24072458 [1,0,0,0,0,0|3,0,0]=4 343 B10R1.18 CC(=O)Nc1cnccn1 Amb2609548 [1,0,0,0,0,0|3,0,0]=4 344 B10R1.18 CC(=O)Nc1cncnc1 Amb21962991 [1,0,0,0,0,0|3,0,0]=4 345 B10R1.18 CC(=O)Nc1ncccn1 Amb3373225 [1,0,0,0,0,0|3,0,0]=4 346 B10R1.18 CC(=O)Oc1cccnc1 Amb6297781 [1,0,0,0,0,0|2,0,0]=3 347 B10R1.18 CC(=O)Oc1ccncc1 Amb22522585 [1,0,0,0,0,0|2,0,0]=3 348 B10R1.18 CC(=O)Oc1cnccn1 Amb28457181 [1,0,0,0,0,0|3,0,0]=4 349 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,0,0,0,0,0|1,0,0]=2 350 B10R1.18 CC(=O)Sc1cccnc1 Amb27429372 [1,0,0,0,0,0|2,0,0]=3 351 B10R1.18 CC(=O)\C=C1/C=CCCC1 Amb27209037 [1,0,0,0,0,0|0,0,3]=4 352 B10R1.18 CC(=S)Cc1ccncc1 Amb27184042 [1,0,0,0,0,0|1,1,1]=4 353 B10R1.18 CC(=S)Nc1ccccc1 Amb2613341 [1,0,0,0,0,0|1,1,0]=3 354 B10R1.18 CC(=S)Oc1ccncc1 Amb27237851 [1,0,0,0,0,0|2,1,0]=4 355 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [1,0,0,0,0,0|1,0,2]=4 356 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [1,0,0,0,0,0|0,0,1]=2 357 B10R1.18 CC(C)=Cc1ccncc1 Amb27658833 [1,0,0,0,0,0|1,0,1]=3 358 B10R1.18 CC(C)=Cc1cncnc1 Amb28208545 [1,0,0,0,0,0|2,0,1]=4 359 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [1,0,0,0,0,0|0,0,3]=4 360 B10R1.18 CC(C)Nc1ccccc1 Amb2720884 [1,0,0,0,0,0|1,0,2]=4 361 B10R1.18 CC(C)Oc1ccccc1 Amb3429104 [1,0,0,0,0,0|1,0,2]=4 362 B10R1.18 CC(C)Sc1ccccc1 Amb5721900 [1,0,0,0,0,0|1,0,2]=4 363 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [1,0,0,0,0,0|1,0,2]=4 364 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [1,0,0,0,0,0|1,0,2]=4 365 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [1,0,0,0,0,0|0,0,3]=4 366 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [1,0,0,0,0,0|1,0,2]=4 367 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [1,0,0,0,0,0|1,0,2]=4 368 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,0,0,0,0,0|0,1,2]=4 369 B10R1.18 CN(C)Cc1ccccc1 Amb6608891 [1,0,0,0,0,0|1,0,2]=4 370 B10R1.18 CN(C)Sc1ccccc1 Amb28388759 [1,0,0,0,0,0|2,0,1]=4 371 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [1,0,0,0,0,0|2,0,1]=4 372 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [1,0,0,0,0,0|1,0,2]=4 373 B10R1.18 CP(C)Cc1ccccc1 Amb26928754 [1,0,0,0,0,0|1,0,2]=4 374 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,0,0,0,0,0|1,0,1]=3 375 B10R1.18 CS(=O)Nc1ccccc1 Amb27777995 [1,0,0,0,0,0|2,0,0]=3 376 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [1,0,0,0,0,0|1,0,2]=4 377 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [1,0,0,0,0,0|1,0,2]=4 378 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [1,0,0,0,0,0|1,0,2]=4 379 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,0,0,0,0,0|0,0,3]=4 380 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [1,0,0,0,0,0|1,0,2]=4 381 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [1,0,0,0,0,0|1,0,2]=4 382 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [1,0,0,0,0,0|1,0,2]=4 383 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [1,0,0,0,0,0|0,0,3]=4 384 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,0,0,0,0,0|0,1,2]=4 385 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,0,0,0,0,0|0,1,2]=4 386 B10R1.18 C\C(O)=C/c1ccccc1 Amb24095309 [1,0,0,0,0,0|0,0,1]=2 387 B10R1.18 C\[N+]([O-])=C/c1ccccc1 Amb3988092 [1,0,0,0,0,0|1,0,1]=3 388 B10R1.18 C\[N+]([O-])=C/c1ccccn1 Amb2537020 [1,0,0,0,0,0|2,0,1]=4 389 B10R1.18 C\[N+]([O-])=C\c1ccccc1 Amb2420785 [1,0,0,0,0,0|1,0,1]=3 390 B10R1.18 C\[N+]([O-])=C\c1ccccn1 Amb2954709 [1,0,0,0,0,0|2,0,1]=4 391 B10R1.18 C\[N+]([O-])=C\c1ccncc1 Amb27965296 [1,0,0,0,0,0|2,0,1]=4 392 B10R1.18 ClC(Cl)=Cc1ccccc1 Amb26554175 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.18 ClC(Cl)=Cc1ccccn1 Amb27603877 [1,0,0,0,0,0|3,0,0]=4 394 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.18 F\C(Br)=C\c1ccccc1 Amb24053589 [1,0,0,0,0,0|2,0,0]=3 396 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [1,0,0,0,0,0|2,0,1]=4 397 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [1,0,0,0,0,0|2,0,1]=4 398 B10R1.18 N=C(N)Nc1ccccc1 Amb20249360 [1,0,0,0,0,0|3,0,0]=4 399 B10R1.18 N=C(N)Nc1ccccc1 Amb30982925 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.18 N=C(N)Nc1ccccc1 Amb8384582 [1,0,0,0,0,0|3,0,0]=4 401 B10R1.18 N=C(N)Nc1ccccc1 Amb8629200 [1,0,0,0,0,0|3,0,0]=4 402 B10R1.18 N=C(N)Sc1ccccc1 Amb27837617 [1,0,0,0,0,0|3,0,0]=4 403 B10R1.18 N=C(N)[NH2+]c1ccccc1 Amb27773651 [1,0,0,0,0,0|3,0,0]=4 404 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,0,0,0,0,0|2,0,1]=4 405 B10R1.18 NC(=O)C[n+]1ccccc1 Amb2684428 [1,0,0,0,0,0|2,0,1]=4 406 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,0,0,0,0,0|1,0,1]=3 407 B10R1.18 NC(=O)Cc1cccnc1 Amb21856113 [1,0,0,0,0,0|2,0,1]=4 408 B10R1.18 NC(=O)Cc1ccncc1 Amb4010849 [1,0,0,0,0,0|2,0,1]=4 409 B10R1.18 NC(=O)Nc1ccccc1 Amb3106756 [1,0,0,0,0,0|2,0,0]=3 410 B10R1.18 NC(=O)Nc1ccccn1 Amb2691587 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,0,0,0,0,0|3,0,0]=4 412 B10R1.18 NC(=O)Nc1ccncc1 Amb23581130 [1,0,0,0,0,0|3,0,0]=4 413 B10R1.18 NC(=O)Oc1ccccc1 Amb4037283 [1,0,0,0,0,0|2,0,0]=3 414 B10R1.18 NC(=O)Sc1ccccc1 Amb28182472 [1,0,0,0,0,0|2,0,0]=3 415 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,0,0,0,0,0|1,1,1]=4 416 B10R1.18 NC(=S)Nc1ccccc1 Amb6356934 [1,0,0,0,0,0|2,1,0]=4 417 B10R1.18 NC(=S)Oc1ccccc1 Amb27453485 [1,0,0,0,0,0|2,1,0]=4 418 B10R1.18 NC(=S)Sc1ccccc1 Amb27407677 [1,0,0,0,0,0|2,1,0]=4 419 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.18 NC(N)=Nc1ccccc1 Amb2722869 [1,0,0,0,0,0|3,0,0]=4 421 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [1,0,0,0,0,0|2,0,1]=4 422 B10R1.18 O=C(Br)Cc1ccccc1 Amb2609678 [1,0,0,0,0,0|1,0,1]=3 423 B10R1.18 O=C(Br)Nc1ccccc1 Amb27229968 [1,0,0,0,0,0|2,0,0]=3 424 B10R1.18 O=C(Cl)Cc1ccccc1 Amb2792901 [1,0,0,0,0,0|1,0,1]=3 425 B10R1.18 O=C(Cl)Cc1ccccn1 Amb26458529 [1,0,0,0,0,0|2,0,1]=4 426 B10R1.18 O=C(Cl)Cc1cccnc1 Amb24605722 [1,0,0,0,0,0|2,0,1]=4 427 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,0,0,0,0,0|2,0,0]=3 428 B10R1.18 O=C(Cl)Nc1cccnc1 Amb35637042 [1,0,0,0,0,0|3,0,0]=4 429 B10R1.18 O=C(Cl)Nc1ccncc1 Amb32789666 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.18 O=C(Cl)Oc1ccccc1 Amb6296594 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.18 O=C(Cl)Oc1ccccn1 Amb33296824 [1,0,0,0,0,0|3,0,0]=4 432 B10R1.18 O=C(Cl)Oc1cccnc1 Amb26956091 [1,0,0,0,0,0|3,0,0]=4 433 B10R1.18 O=C(Cl)Oc1ccncc1 Amb33297023 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.18 O=C(Cl)Sc1ccccc1 Amb4006578 [1,0,0,0,0,0|2,0,0]=3 435 B10R1.18 O=C(Cl)[NH2+]c1ccccc1 Amb9787354 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,0,0,0,0,0|2,0,0]=3 437 B10R1.18 O=C(O)C[n+]1ccccc1 Amb23468426 [1,0,0,0,0,0|2,0,1]=4 438 B10R1.18 O=C(O)Cc1cc[nH+]cc1 Amb24113836 [1,0,0,0,0,0|2,0,1]=4 439 B10R1.18 O=C(O)Cc1cccc[nH+]1 Amb24113838 [1,0,0,0,0,0|2,0,1]=4 440 B10R1.18 O=C(O)Cc1ccccc1 Amb6461144 [1,0,0,0,0,0|1,0,1]=3 441 B10R1.18 O=C(O)Cc1ccccn1 Amb2720201 [1,0,0,0,0,0|2,0,1]=4 442 B10R1.18 O=C(O)Cc1ccccn1 Amb3940142 [1,0,0,0,0,0|2,0,1]=4 443 B10R1.18 O=C(O)Cc1cccnc1 Amb2720203 [1,0,0,0,0,0|2,0,1]=4 444 B10R1.18 O=C(O)Cc1cccnc1 Amb2720470 [1,0,0,0,0,0|2,0,1]=4 445 B10R1.18 O=C(O)Cc1ccncc1 Amb2720202 [1,0,0,0,0,0|2,0,1]=4 446 B10R1.18 O=C(O)Cc1ccncc1 Amb3940535 [1,0,0,0,0,0|2,0,1]=4 447 B10R1.18 O=C(O)Nc1ccccc1 Amb34916595 [1,0,0,0,0,0|2,0,0]=3 448 B10R1.18 O=C(O)Nc1cccnc1 Amb24102579 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.18 O=C(O)Nc1ccncc1 Amb24070647 [1,0,0,0,0,0|3,0,0]=4 450 B10R1.18 O=C([O-])Cc1ccccc1 Amb20240609 [1,0,0,0,0,0|1,0,1]=3 451 B10R1.18 O=C([O-])Cc1ccccc1 Amb20246797 [1,0,0,0,0,0|1,0,1]=3 452 B10R1.18 O=C([O-])Cc1ccccn1 Amb22000882 [1,0,0,0,0,0|2,0,1]=4 453 B10R1.18 O=C([O-])Cc1cccnc1 Amb33513106 [1,0,0,0,0,0|2,0,1]=4 454 B10R1.18 O=C([O-])Oc1ccccc1 Amb5540415 [1,0,0,0,0,0|2,0,0]=3 455 B10R1.18 O=S(Cl)Cc1ccccc1 Amb28050330 [1,0,0,0,0,0|2,0,1]=4 456 B10R1.18 O=S(O)Cc1ccccc1 Amb27872793 [1,0,0,0,0,0|2,0,1]=4 457 B10R1.18 O=S(O)Oc1ccccc1 Amb27964140 [1,0,0,0,0,0|3,0,0]=4 458 B10R1.18 O=S([O-])Cc1ccccc1 Amb28430335 [1,0,0,0,0,0|2,0,1]=4 459 B10R1.18 O=[N+]([O-])Cc1ccccc1 Amb10606416 [1,0,0,0,0,0|2,0,1]=4 460 B10R1.18 O=[N+]([O-])Nc1ccccc1 Amb17939349 [1,0,0,0,0,0|3,0,0]=4 461 B10R1.18 O=[PH](O)Cc1ccccc1 Amb24617740 [1,0,0,0,0,0|2,0,1]=4 462 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,0,0,0,0,0|1,0,2]=4 463 B10R1.18 S=C(Cl)Cc1ccccc1 Amb28203639 [1,0,0,0,0,0|1,1,1]=4 464 B10R1.18 S=C(Cl)Oc1ccccc1 Amb6365789 [1,0,0,0,0,0|2,1,0]=4 465 B10R1.18 S=C(Cl)Sc1ccccc1 Amb9800285 [1,0,0,0,0,0|2,1,0]=4 466 B10R1.18 S=C(S)Nc1ccccc1 Amb28049925 [1,0,0,0,0,0|2,1,0]=4 467 B12R1.32 C#CC\C(C)=C\c1ccccc1 Amb33476744 [0,1,0,0,0,0|1,0,1]=3 468 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [0,1,0,0,0,0|3,0,0]=4 469 B12R1.32 C=CCC(C)Nc1ccccc1 Amb27794468 [0,1,0,0,0,0|2,0,1]=4 470 B12R1.32 C=CCN(C)Cc1ccccc1 Amb6360694 [0,1,0,0,0,0|2,0,1]=4 471 B12R1.32 C=CNC(=O)Cc1ccccc1 Amb27455089 [0,1,0,0,0,0|2,0,1]=4 472 B12R1.32 C=CNC(=S)Cc1ccccc1 Amb27239916 [0,1,0,0,0,0|2,0,1]=4 473 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,1,0,0,0,0|2,0,1]=4 474 B12R1.32 C=COC(=S)Nc1ccccc1 Amb27969249 [0,1,0,0,0,0|3,0,0]=4 475 B12R1.32 CC(=C\C=O)\C=C1\C=CCCC1 Amb27493467 [0,1,0,0,0,0|0,0,3]=4 476 B12R1.32 CC(=C\c1ccccc1)\C=C\N Amb27788151 [0,1,0,0,0,0|1,0,0]=2 477 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,1,0,0,0,0|0,0,3]=4 478 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [0,1,0,0,0,0|0,0,2]=3 479 B12R1.32 CC(Cc1ccccn1)NC=O Amb29889266 [0,1,0,0,0,0|1,0,2]=4 480 B12R1.32 CC(\C=N\O)=C/c1ccccc1 Amb4036028 [0,1,0,0,0,0|0,0,1]=2 481 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,1,0,0,0,0|2,0,1]=4 482 B12R1.32 CCO\C(C)=N\c1ccccc1 Amb17939699 [0,1,0,0,0,0|2,0,1]=4 483 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,1,0,0,0,0|1,0,1]=3 484 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [0,1,0,0,0,0|1,0,1]=3 485 B12R1.32 CNC\C(C)=C\c1cccnc1 Amb28042037 [0,1,0,0,0,0|2,0,1]=4 486 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [0,1,0,0,0,0|0,1,2]=4 487 B12R1.32 C\C(=C/c1ccccc1)CC#N Amb33476434 [0,1,0,0,0,0|1,0,1]=3 488 B12R1.32 C\C(=C/c1ccccc1)CC=O Amb32952974 [0,1,0,0,0,0|0,0,0]=1 489 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,1,0,0,0,0|1,0,1]=3 490 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,1,0,0,0,0|1,0,1]=3 491 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,1,0,0,0,0|0,0,2]=3 492 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,1,0,0,0,0|0,1,1]=3 493 B12R1.32 C\C(=C/c1ccccc1)CNN Amb27769440 [0,1,0,0,0,0|1,0,1]=3 494 B12R1.32 C\C(=C/c1ccccc1)CNO Amb33506732 [0,1,0,0,0,0|0,0,2]=3 495 B12R1.32 C\C(=C/c1ccccc1)CON Amb33476431 [0,1,0,0,0,0|0,0,2]=3 496 B12R1.32 C\C(=C\C=O)Cc1ccccc1 Amb27435409 [0,1,0,0,0,0|0,0,1]=2 497 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [0,1,0,0,0,0|0,0,2]=3 498 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,1,0,0,0,0|1,0,1]=3 499 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,1,0,0,0,0|1,0,1]=3 500 B12R1.32 C\C(=C\c1ccccc1)N=[N+]=[N-] Amb27659480 [0,1,0,0,0,0|2,0,0]=3 501 B12R1.32 C\C(=C\c1ccccc1)NC=O Amb27669841 [0,1,0,0,0,0|0,0,0]=1 502 B12R1.32 C\C(=C\c1cccnc1)CCN Amb25179223 [0,1,0,0,0,0|2,0,1]=4 503 B12R1.32 C\C(N=[N+]=[N-])=N/c1ccccc1 Amb27828032 [0,1,0,0,0,0|3,0,0]=4 504 B12R1.32 C\C(N=[N+]=[N-])=N\c1ccccc1 Amb28143628 [0,1,0,0,0,0|3,0,0]=4 505 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [0,1,0,0,0,0|3,0,0]=4 506 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.32 C\C=C\C(=S)Nc1ccccc1 Amb28285588 [0,1,0,0,0,0|3,0,0]=4 508 B12R1.32 C\C=C\C(C)Nc1ccccc1 Amb28245278 [0,1,0,0,0,0|2,0,1]=4 509 B12R1.32 N#C\C=C(/N)Cc1ccccc1 Amb28195853 [0,1,0,0,0,0|2,0,1]=4 510 B12R1.32 N#C\C=C(\N)Nc1ccccc1 Amb27607188 [0,1,0,0,0,0|3,0,0]=4 511 B12R1.32 NCC\C(Br)=C\c1ccccc1 Amb27770057 [0,1,0,0,0,0|2,0,1]=4 512 B12R1.32 NCC\C(Cl)=C/c1ccccc1 Amb27881313 [0,1,0,0,0,0|2,0,1]=4 513 B12R1.32 NCC\C(Cl)=C\c1ccccc1 Amb27843483 [0,1,0,0,0,0|2,0,1]=4 514 B12R1.32 N\C=N\C(=S)Nc1ccccc1 Amb27441755 [0,1,0,0,0,0|3,0,0]=4 515 B12R1.32 O=C(\C=C\Cl)Nc1ccccc1 Amb28342211 [0,1,0,0,0,0|3,0,0]=4 516 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [0,1,0,0,0,0|3,0,0]=4 517 B12R1.32 O=C(\C=N\O)Nc1ccccc1 Amb1205570 [0,1,0,0,0,0|2,0,1]=4 518 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [0,1,0,0,0,0|1,0,2]=4 519 B12R1.32 O=C=NC(=O)Oc1ccccc1 Amb22348017 [0,1,0,0,0,0|2,0,1]=4 520 B12R1.32 O=C=NC(=S)Cc1ccccc1 Amb27178259 [0,1,0,0,0,0|1,0,2]=4 521 B12R1.32 O=CCC(=S)Nc1ccccc1 Amb28073090 [0,1,0,0,0,0|2,0,0]=3 522 B12R1.32 O=CNC(=O)Cc1ccccc1 Amb6360720 [0,1,0,0,0,0|1,0,1]=3 523 B12R1.32 OC\C=C(\Cl)Cc1ccccc1 Amb27841976 [0,1,0,0,0,0|1,0,2]=4 524 B12R1.32 [C-]#[N+]C\C(C)=C\c1ccccc1 Amb33476725 [0,1,0,0,0,0|1,0,1]=3 525 B12R1.32 [N-]=[N+]=CC(=O)Cc1ccccc1 Amb749121 [0,1,0,0,0,0|2,0,1]=4 526 B12R1.34 C#CC(C)C(=O)c1ccccc1 Amb27861418 [0,1,0,0,0,0|1,0,2]=4 527 B12R1.34 C=C(C(=O)CC)c1ccccc1 Amb27177863 [0,1,0,0,0,0|2,0,1]=4 528 B12R1.34 C=C(C(=O)CO)c1ccccc1 Amb27175970 [0,1,0,0,0,0|1,0,2]=4 529 B12R1.34 C=C(C(=O)OC)c1ccccc1 Amb8392364 [0,1,0,0,0,0|3,0,0]=4 530 B12R1.34 C=C(C=O)C(C)c1ccccc1 Amb8392634 [0,1,0,0,0,0|0,0,2]=3 531 B12R1.34 C=C(CO)C(=C)c1ccccc1 Amb27432138 [0,1,0,0,0,0|0,0,3]=4 532 B12R1.34 C=C(OC)C(=O)c1ccccc1 Amb17594034 [0,1,0,0,0,0|2,0,1]=4 533 B12R1.34 C=C=C(C)C(N)c1ccccc1 Amb27984710 [0,1,0,0,0,0|1,0,2]=4 534 B12R1.34 C=CC(=C)[C@H](O)c1ccccc1 Amb28138679 [0,1,0,0,0,0|1,0,2]=4 535 B12R1.34 C=CC(=O)C(C)c1ccccc1 Amb24537754 [0,1,0,0,0,0|2,0,1]=4 536 B12R1.34 C=CC(=O)N(C)c1ccccc1 Amb9480405 [0,1,0,0,0,0|3,0,0]=4 537 B12R1.34 C=CC(C)C(=O)c1ccccc1 Amb27749794 [0,1,0,0,0,0|1,0,1]=3 538 B12R1.34 C=CC(C)C(N)c1ccccc1 Amb27392398 [0,1,0,0,0,0|1,0,2]=4 539 B12R1.34 C=CC(C)N(C)c1ccccc1 Amb27979353 [0,1,0,0,0,0|2,0,1]=4 540 B12R1.34 C=CC(Cl)C(=O)c1ccccc1 Amb27841407 [0,1,0,0,0,0|2,0,1]=4 541 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccccc1 Amb25071531 [0,1,0,0,0,0|1,0,2]=4 542 B12R1.34 CC(C#N)C(=O)c1ccccc1 Amb33529617 [0,1,0,0,0,0|1,0,2]=4 543 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,1,0,0,0,0|0,0,1]=2 544 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [0,1,0,0,0,0|0,0,2]=3 545 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [0,1,0,0,0,0|0,0,2]=3 546 B12R1.34 CC(C=O)S(=O)c1ccccc1 Amb27224791 [0,1,0,0,0,0|1,0,1]=3 547 B12R1.34 CC(CCl)C(=O)c1ccccc1 Amb4006275 [0,1,0,0,0,0|1,0,2]=4 548 B12R1.34 CC(CO)C(=O)c1ccccc1 Amb8392341 [0,1,0,0,0,0|0,0,3]=4 549 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [0,1,0,0,0,0|1,0,2]=4 550 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [0,1,0,0,0,0|1,0,2]=4 551 B12R1.34 CC(c1ccccc1)N(O)C=O Amb10606548 [0,1,0,0,0,0|2,0,1]=4 552 B12R1.34 CCC(=N)C(=O)c1ccccc1 Amb27590280 [0,1,0,0,0,0|2,0,1]=4 553 B12R1.34 CCC(=O)C(=O)c1ccccc1 Amb17400106 [0,1,0,0,0,0|2,0,1]=4 554 B12R1.34 CCC(C)C(=O)c1ccccc1 Amb8850439 [0,1,0,0,0,0|1,0,2]=4 555 B12R1.34 CCN(C)C(=N)c1ccccc1 Amb28253999 [0,1,0,0,0,0|2,0,1]=4 556 B12R1.34 CN(C(=O)C=O)c1ccccc1 Amb28287730 [0,1,0,0,0,0|2,0,0]=3 557 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|3,0,0]=4 558 B12R1.34 CNC(C)C(=O)c1ccccc1 Amb8384820 [0,1,0,0,0,0|2,0,1]=4 559 B12R1.34 CN[C@H](C)C(=O)c1ccccc1 Amb28129791 [0,1,0,0,0,0|2,0,1]=4 560 B12R1.34 COC(=O)C(=O)c1ccccc1 Amb6296065 [0,1,0,0,0,0|3,0,0]=4 561 B12R1.34 CON(C)C(=O)c1ccccc1 Amb4037088 [0,1,0,0,0,0|3,0,0]=4 562 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,0|2,0,1]=4 563 B12R1.34 C[C@@H](CO)C(=O)c1ccccc1 Amb27599400 [0,1,0,0,0,0|0,0,3]=4 564 B12R1.34 C[C@H](C=O)N(O)c1ccccc1 Amb27780818 [0,1,0,0,0,0|1,0,1]=3 565 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [0,1,0,0,0,0|0,0,2]=3 566 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [0,1,0,0,0,0|0,0,2]=3 567 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [0,1,0,0,0,0|0,0,2]=3 568 B12R1.34 C\C(=C(\F)C=O)c1ccccc1 Amb24757282 [0,1,0,0,0,0|1,0,0]=2 569 B12R1.34 C\C(=C(\N)C#N)c1ccccc1 Amb28385624 [0,1,0,0,0,0|2,0,1]=4 570 B12R1.34 C\C(=C(\O)C=O)c1ccccc1 Amb27797353 [0,1,0,0,0,0|1,0,0]=2 571 B12R1.34 C\C(=C/Cl)C(=O)c1ccccc1 Amb28290358 [0,1,0,0,0,0|1,0,0]=2 572 B12R1.34 C\C(=C/O)C(=O)c1ccccc1 Amb28386635 [0,1,0,0,0,0|0,0,1]=2 573 B12R1.34 C\C(=C\F)C(=O)c1ccccc1 Amb27854298 [0,1,0,0,0,0|1,0,0]=2 574 B12R1.34 C\C(=C\N)C(=O)c1ccccc1 Amb2386654 [0,1,0,0,0,0|1,0,0]=2 575 B12R1.34 C\C(=N/O)C(=O)c1ccccc1 Amb2720251 [0,1,0,0,0,0|1,0,1]=3 576 B12R1.34 C\C(=N\N)C(=O)c1ccccc1 Amb24745786 [0,1,0,0,0,0|2,0,0]=3 577 B12R1.34 C\C(=N\O)C(=O)c1cccnc1 Amb27854653 [0,1,0,0,0,0|2,0,1]=4 578 B12R1.34 C\C(=N\O)C(=O)c1ccncc1 Amb26364709 [0,1,0,0,0,0|2,0,1]=4 579 B12R1.34 C\C(=N\O)C(Cl)c1ccccc1 Amb28436906 [0,1,0,0,0,0|1,0,2]=4 580 B12R1.34 C\C(=N\O)[C@H](O)c1ccccc1 Amb28246601 [0,1,0,0,0,0|1,0,2]=4 581 B12R1.34 C\C(C#N)=C(\Br)c1ccccc1 Amb4016262 [0,1,0,0,0,0|1,0,1]=3 582 B12R1.34 C\C(C#N)=C(\N)c1ccccc1 Amb2602491 [0,1,0,0,0,0|1,0,1]=3 583 B12R1.34 C\C(C=O)=C(\Cl)c1ccccc1 Amb18648444 [0,1,0,0,0,0|0,0,0]=1 584 B12R1.34 C\C(C=O)=C(\S)c1ccccc1 Amb18648152 [0,1,0,0,0,0|0,0,0]=1 585 B12R1.34 C\C=C(/F)C(=O)c1ccccc1 Amb27176127 [0,1,0,0,0,0|2,0,0]=3 586 B12R1.34 C\C=C(\Br)C(=O)c1ccccc1 Amb27776890 [0,1,0,0,0,0|2,0,0]=3 587 B12R1.34 C\C=C(\C)C(=O)c1ccccc1 Amb25730208 [0,1,0,0,0,0|1,0,0]=2 588 B12R1.34 C\C=C(\C)C(O)c1ccccc1 Amb27764784 [0,1,0,0,0,0|1,0,1]=3 589 B12R1.34 C\C=C(\C)C(O)c1ccccn1 Amb28188219 [0,1,0,0,0,0|2,0,1]=4 590 B12R1.34 C\C=C(\Cl)N(C)c1ccccc1 Amb27619788 [0,1,0,0,0,0|3,0,0]=4 591 B12R1.34 C\N=C(/C)C(Cl)c1ccccc1 Amb28343046 [0,1,0,0,0,0|2,0,1]=4 592 B12R1.34 C\N=C(\C)C(O)c1ccccc1 Amb27761496 [0,1,0,0,0,0|2,0,1]=4 593 B12R1.34 N#CC(=O)C(=O)c1ccccc1 Amb27433531 [0,1,0,0,0,0|2,0,1]=4 594 B12R1.34 NC(=S=O)C(=O)c1ccccc1 Amb27483110 [0,1,0,0,0,0|2,0,0]=3 595 B12R1.34 O=C(CBr)C(=O)c1ccccc1 Amb17406921 [0,1,0,0,0,0|2,0,1]=4 596 B12R1.34 O=C(CO)C(=O)c1ccccc1 Amb27178026 [0,1,0,0,0,0|1,0,2]=4 597 B12R1.34 O=C(\C(Cl)=C/Cl)c1ccccc1 Amb26558724 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.34 O=C(\C(Cl)=C\Cl)c1ccccc1 Amb27402575 [0,1,0,0,0,0|2,0,0]=3 599 B12R1.34 O=CC(Cl)C(=O)c1ccccc1 Amb28364135 [0,1,0,0,0,0|1,0,1]=3 600 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [0,1,0,0,0,0|1,0,2]=4 601 B12R1.34 O=CC(F)C(=O)c1ccccc1 Amb26485248 [0,1,0,0,0,0|1,0,1]=3 602 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [0,1,0,0,0,0|1,0,2]=4 603 B12R1.34 OC\C(F)=C(\F)c1ccccc1 Amb27426618 [0,1,0,0,0,0|1,0,2]=4 604 B12R1.43 C=C(C)C(=O)Nc1ccccc1 Amb6384289 [0,1,0,0,0,0|3,0,0]=4 605 B12R1.43 C=C(C)C(=O)Oc1ccccc1 Amb8394675 [0,1,0,0,0,0|3,0,0]=4 606 B12R1.43 C=C(C)C(=S)Nc1ccccc1 Amb28243811 [0,1,0,0,0,0|3,0,0]=4 607 B12R1.43 C=C(C)C(C)Nc1ccccc1 Amb28368457 [0,1,0,0,0,0|2,0,1]=4 608 B12R1.43 C=C(Cc1ccccc1)C(=O)Cl Amb27416413 [0,1,0,0,0,0|0,0,2]=3 609 B12R1.43 C=C(Cc1ccccc1)C(=O)O Amb8393733 [0,1,0,0,0,0|0,0,2]=3 610 B12R1.43 C=C(Cc1ccccc1)[N+](=O)[O-] Amb33295355 [0,1,0,0,0,0|1,0,2]=4 611 B12R1.43 C=C(Cc1cccnc1)C(=O)O Amb26636551 [0,1,0,0,0,0|1,0,2]=4 612 B12R1.43 C=C(Cc1ccncc1)C(=O)O Amb27389258 [0,1,0,0,0,0|1,0,2]=4 613 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 Amb27751263 [0,1,0,0,0,0|3,0,0]=4 614 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,1,0,0,0,0|1,0,1]=3 615 B12R1.43 CC(=O)C(=O)Cc1ccccn1 Amb26923275 [0,1,0,0,0,0|2,0,1]=4 616 B12R1.43 CC(=O)C(=O)Cc1cccnc1 Amb24556780 [0,1,0,0,0,0|2,0,1]=4 617 B12R1.43 CC(=O)C(=O)Cc1ccncc1 Amb24555440 [0,1,0,0,0,0|2,0,1]=4 618 B12R1.43 CC(=O)C(=O)Nc1ccccc1 Amb2383839 [0,1,0,0,0,0|2,0,0]=3 619 B12R1.43 CC(=O)C(=O)Nc1cccnc1 Amb28319843 [0,1,0,0,0,0|3,0,0]=4 620 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [0,1,0,0,0,0|1,0,2]=4 621 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [0,1,0,0,0,0|0,0,2]=3 622 B12R1.43 CC(=O)C(C)Cc1ccccn1 Amb27231621 [0,1,0,0,0,0|1,0,2]=4 623 B12R1.43 CC(=O)C(C)Cc1cccnc1 Amb27960854 [0,1,0,0,0,0|1,0,2]=4 624 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [0,1,0,0,0,0|1,0,1]=3 625 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [0,1,0,0,0,0|1,0,1]=3 626 B12R1.43 CC(=O)C(C)Oc1cccnc1 Amb2407640 [0,1,0,0,0,0|2,0,1]=4 627 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [0,1,0,0,0,0|1,0,1]=3 628 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [0,1,0,0,0,0|1,0,2]=4 629 B12R1.43 CC(=O)C(Cl)Oc1ccccc1 Amb27878745 [0,1,0,0,0,0|2,0,1]=4 630 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [0,1,0,0,0,0|1,0,2]=4 631 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [0,1,0,0,0,0|1,0,2]=4 632 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [0,1,0,0,0,0|1,0,2]=4 633 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,1,0,0,0,0|1,0,2]=4 634 B12R1.43 CC(=O)N(C)Cc1ccccc1 Amb3886652 [0,1,0,0,0,0|1,0,1]=3 635 B12R1.43 CC(=O)N(C)Cc1ccccn1 Amb27262191 [0,1,0,0,0,0|2,0,1]=4 636 B12R1.43 CC(=O)N(C)Cc1cccnc1 Amb33544307 [0,1,0,0,0,0|2,0,1]=4 637 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,1,0,0,0,0|2,0,0]=3 638 B12R1.43 CC(=O)[C@@H](C)Cc1cccnc1 Amb27177781 [0,1,0,0,0,0|1,0,2]=4 639 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [0,1,0,0,0,0|1,0,2]=4 640 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [0,1,0,0,0,0|1,0,2]=4 641 B12R1.43 CC(=O)\C(Br)=C\c1ccccc1 Amb17596166 [0,1,0,0,0,0|1,0,0]=2 642 B12R1.43 CC(=O)\C(C)=C\c1ccccc1 Amb17594004 [0,1,0,0,0,0|0,0,0]=1 643 B12R1.43 CC(=O)\C(C)=C\c1cccnc1 Amb25373091 [0,1,0,0,0,0|1,0,0]=2 644 B12R1.43 CC(=O)\C(C)=C\c1cnccn1 Amb35601037 [0,1,0,0,0,0|2,0,0]=3 645 B12R1.43 CC(=O)\C(C)=N\c1ccccc1 Amb24537849 [0,1,0,0,0,0|1,0,0]=2 646 B12R1.43 CC(C)=C(C)Sc1ccccc1 Amb28284519 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.43 CC(Cc1ccccc1)C(=O)Cl Amb5744098 [0,1,0,0,0,0|0,0,2]=3 648 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [0,1,0,0,0,0|0,0,2]=3 649 B12R1.43 CC(Cc1ccccc1)C(N)=O Amb2701804 [0,1,0,0,0,0|0,0,2]=3 650 B12R1.43 CC(Cc1ccccc1)[N+](=O)[O-] Amb17689219 [0,1,0,0,0,0|1,0,2]=4 651 B12R1.43 CC(Cc1ccccn1)C(=O)Cl Amb5744095 [0,1,0,0,0,0|1,0,2]=4 652 B12R1.43 CC(Cc1ccccn1)C(=O)O Amb5744008 [0,1,0,0,0,0|1,0,2]=4 653 B12R1.43 CC(Cc1cccnc1)C(=O)Cl Amb5744096 [0,1,0,0,0,0|1,0,2]=4 654 B12R1.43 CC(Cc1cccnc1)C(=O)O Amb5744009 [0,1,0,0,0,0|1,0,2]=4 655 B12R1.43 CC(Cc1cccnc1)C(N)=O Amb28072992 [0,1,0,0,0,0|1,0,2]=4 656 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb33743550 [0,1,0,0,0,0|1,0,2]=4 657 B12R1.43 CC(Cc1ccncc1)C(=O)O Amb5744010 [0,1,0,0,0,0|1,0,2]=4 658 B12R1.43 CC(Nc1ccccc1)C(=O)O Amb1213440 [0,1,0,0,0,0|1,0,1]=3 659 B12R1.43 CC(Nc1ccccc1)C(N)=S Amb27955863 [0,1,0,0,0,0|1,1,1]=4 660 B12R1.43 CC(Nc1cccnc1)C(=O)O Amb18270393 [0,1,0,0,0,0|2,0,1]=4 661 B12R1.43 CC(Nc1cccnc1)C(N)=O Amb27831365 [0,1,0,0,0,0|2,0,1]=4 662 B12R1.43 CC(Oc1ccccc1)C(=O)Cl Amb3939464 [0,1,0,0,0,0|1,0,1]=3 663 B12R1.43 CC(Oc1ccccc1)C(=O)O Amb9702438 [0,1,0,0,0,0|1,0,1]=3 664 B12R1.43 CC(Oc1ccccc1)C(N)=O Amb3886659 [0,1,0,0,0,0|1,0,1]=3 665 B12R1.43 CC(Oc1ccccc1)C(N)=S Amb17233851 [0,1,0,0,0,0|1,1,1]=4 666 B12R1.43 CC(Oc1ccccn1)C(=O)O Amb26054640 [0,1,0,0,0,0|2,0,1]=4 667 B12R1.43 CC(Oc1cccnc1)C(=O)O Amb9783585 [0,1,0,0,0,0|2,0,1]=4 668 B12R1.43 CC(Sc1ccccc1)C(=O)Cl Amb17143250 [0,1,0,0,0,0|1,0,1]=3 669 B12R1.43 CC(Sc1ccccc1)C(=O)O Amb9745732 [0,1,0,0,0,0|1,0,1]=3 670 B12R1.43 CC(Sc1ccccc1)C(N)=O Amb10665761 [0,1,0,0,0,0|1,0,1]=3 671 B12R1.43 CC(Sc1ccccn1)C(=O)O Amb9710966 [0,1,0,0,0,0|2,0,1]=4 672 B12R1.43 CC(Sc1ccccn1)C(N)=O Amb13953849 [0,1,0,0,0,0|2,0,1]=4 673 B12R1.43 CC(Sc1ccncc1)C(=O)O Amb6265772 [0,1,0,0,0,0|2,0,1]=4 674 B12R1.43 CC(Sc1ccncc1)C(N)=O Amb27652645 [0,1,0,0,0,0|2,0,1]=4 675 B12R1.43 CN(Cc1ccccc1)C(=N)N Amb4476991 [0,1,0,0,0,0|2,0,1]=4 676 B12R1.43 CN(Cc1ccccc1)C(=N)N Amb8503406 [0,1,0,0,0,0|2,0,1]=4 677 B12R1.43 CN(Cc1ccccc1)C(=O)Cl Amb17563090 [0,1,0,0,0,0|1,0,1]=3 678 B12R1.43 CN(Cc1ccccc1)C(N)=O Amb6250028 [0,1,0,0,0,0|1,0,1]=3 679 B12R1.43 CN(Cc1ccccc1)C(N)=S Amb6251792 [0,1,0,0,0,0|1,1,1]=4 680 B12R1.43 CN(Cc1ccccn1)C(=O)Cl Amb27639695 [0,1,0,0,0,0|2,0,1]=4 681 B12R1.43 CN(Cc1ccncc1)C(=O)Cl Amb24357639 [0,1,0,0,0,0|2,0,1]=4 682 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [0,1,0,0,0,0|0,0,2]=3 683 B12R1.43 C[C@@H](Cc1ccccn1)C(=O)O Amb10843999 [0,1,0,0,0,0|1,0,2]=4 684 B12R1.43 C[C@@H](Cc1cccnc1)C(=O)O Amb10844005 [0,1,0,0,0,0|1,0,2]=4 685 B12R1.43 C[C@@H](Cc1ccncc1)C(=O)O Amb10844007 [0,1,0,0,0,0|1,0,2]=4 686 B12R1.43 C[C@@H](Nc1ccccc1)C(=O)O Amb22801823 [0,1,0,0,0,0|1,0,1]=3 687 B12R1.43 C[C@@H](Oc1ccccc1)C(=O)O Amb22736710 [0,1,0,0,0,0|1,0,1]=3 688 B12R1.43 C[C@@H](Oc1cccnc1)C(=O)O Amb28288991 [0,1,0,0,0,0|2,0,1]=4 689 B12R1.43 C[C@@H](Sc1ccccc1)C(=O)O Amb27425234 [0,1,0,0,0,0|1,0,1]=3 690 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [0,1,0,0,0,0|0,0,2]=3 691 B12R1.43 C[C@H](Cc1ccccc1)C(N)=O Amb28319376 [0,1,0,0,0,0|0,0,2]=3 692 B12R1.43 C[C@H](Cc1ccccn1)C(=O)O Amb10843998 [0,1,0,0,0,0|1,0,2]=4 693 B12R1.43 C[C@H](Cc1cccnc1)C(=O)O Amb10844004 [0,1,0,0,0,0|1,0,2]=4 694 B12R1.43 C[C@H](Cc1ccncc1)C(=O)O Amb10844006 [0,1,0,0,0,0|1,0,2]=4 695 B12R1.43 C[C@H](Nc1ccccc1)C(=O)O Amb24434019 [0,1,0,0,0,0|1,0,1]=3 696 B12R1.43 C[C@H](Oc1ccccc1)C(=O)O Amb22736711 [0,1,0,0,0,0|1,0,1]=3 697 B12R1.43 C[C@H](Oc1ccccc1)C(N)=O Amb27431501 [0,1,0,0,0,0|1,0,1]=3 698 B12R1.43 C[C@H](Oc1cccnc1)C(=O)O Amb28197526 [0,1,0,0,0,0|2,0,1]=4 699 B12R1.43 C\C(=C/c1ccccc1)B(O)O Amb26348065 [0,1,0,0,0,0|1,0,1]=3 700 B12R1.43 C\C(=C/c1ccccc1)C(=N)N Amb32952072 [0,1,0,0,0,0|1,0,0]=2 701 B12R1.43 C\C(=C/c1ccccc1)C(=O)Cl Amb24061289 [0,1,0,0,0,0|0,0,0]=1 702 B12R1.43 C\C(=C/c1ccccc1)C(=O)O Amb8513246 [0,1,0,0,0,0|0,0,0]=1 703 B12R1.43 C\C(=C/c1ccccc1)C(C)Br Amb27654847 [0,1,0,0,0,0|1,0,1]=3 704 B12R1.43 C\C(=C/c1ccccc1)C(C)Cl Amb27779593 [0,1,0,0,0,0|1,0,1]=3 705 B12R1.43 C\C(=C/c1ccccc1)C(C)N Amb33329380 [0,1,0,0,0,0|1,0,1]=3 706 B12R1.43 C\C(=C/c1ccccc1)C(C)O Amb27762014 [0,1,0,0,0,0|0,0,2]=3 707 B12R1.43 C\C(=C/c1ccccc1)C(N)=S Amb33082670 [0,1,0,0,0,0|0,1,0]=2 708 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)N Amb33476129 [0,1,0,0,0,0|1,0,1]=3 709 B12R1.43 C\C(=C/c1ccccc1)[C@@H](C)O Amb32952077 [0,1,0,0,0,0|0,0,2]=3 710 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)N Amb27261769 [0,1,0,0,0,0|1,0,1]=3 711 B12R1.43 C\C(=C/c1ccccc1)[C@H](C)O Amb27589732 [0,1,0,0,0,0|0,0,2]=3 712 B12R1.43 C\C(=C/c1ccccc1)[N+](=O)[O-] Amb6320973 [0,1,0,0,0,0|1,0,0]=2 713 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb30584914 [0,1,0,0,0,0|1,0,0]=2 714 B12R1.43 C\C(=C/c1ccccn1)C(=O)O Amb33995393 [0,1,0,0,0,0|1,0,0]=2 715 B12R1.43 C\C(=C/c1ccccn1)C(C)Br Amb28424271 [0,1,0,0,0,0|2,0,1]=4 716 B12R1.43 C\C(=C/c1ccccn1)C(C)Cl Amb28250570 [0,1,0,0,0,0|2,0,1]=4 717 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb30584915 [0,1,0,0,0,0|1,0,0]=2 718 B12R1.43 C\C(=C/c1cccnc1)C(=O)O Amb5743927 [0,1,0,0,0,0|1,0,0]=2 719 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb30584913 [0,1,0,0,0,0|1,0,0]=2 720 B12R1.43 C\C(=C/c1ccncc1)C(=O)O Amb5743928 [0,1,0,0,0,0|1,0,0]=2 721 B12R1.43 C\C(=C/c1ccncc1)C(C)Br Amb27258845 [0,1,0,0,0,0|2,0,1]=4 722 B12R1.43 C\C(=C/c1cncnc1)C(=O)O Amb27755121 [0,1,0,0,0,0|2,0,0]=3 723 B12R1.43 C\C(=C\c1ccccc1)C(=O)O Amb24603461 [0,1,0,0,0,0|0,0,0]=1 724 B12R1.43 C\C(=C\c1ccccc1)C(N)=S Amb27466528 [0,1,0,0,0,0|0,1,0]=2 725 B12R1.43 C\C(=C\c1ccccc1)[N+](=O)[O-] Amb21520351 [0,1,0,0,0,0|1,0,0]=2 726 B12R1.43 C\C(=C\c1cccnc1)C(=O)O Amb27837141 [0,1,0,0,0,0|1,0,0]=2 727 B12R1.43 C\C(=C\c1cccnc1)[N+](=O)[O-] Amb25294704 [0,1,0,0,0,0|2,0,0]=3 728 B12R1.43 C\C(=C\c1ccncc1)C(=O)O Amb27882270 [0,1,0,0,0,0|1,0,0]=2 729 B12R1.43 C\C(=C\c1cnccn1)C(=O)O Amb27622051 [0,1,0,0,0,0|2,0,0]=3 730 B12R1.43 C\C(=C\c1cnccn1)[N+](=O)[O-] Amb35600888 [0,1,0,0,0,0|3,0,0]=4 731 B12R1.43 Cl\C(=C/c1ccccc1)P(Cl)Cl Amb4297325 [0,1,0,0,0,0|3,0,0]=4 732 B12R1.43 FC(F)=C(F)Oc1ccccc1 Amb10841028 [0,1,0,0,0,0|3,0,0]=4 733 B12R1.43 N=C(N)C(=O)Cc1ccccc1 Amb27257229 [0,1,0,0,0,0|2,0,1]=4 734 B12R1.43 N=C(Nc1ccccc1)C(=O)O Amb18645991 [0,1,0,0,0,0|2,0,0]=3 735 B12R1.43 NC(=O)C(=O)Cc1ccccc1 Amb28119010 [0,1,0,0,0,0|1,0,1]=3 736 B12R1.43 NC(=O)C(=O)Nc1ccccc1 Amb1859924 [0,1,0,0,0,0|2,0,0]=3 737 B12R1.43 NC(=O)C(=O)Oc1ccccc1 Amb26619370 [0,1,0,0,0,0|2,0,0]=3 738 B12R1.43 NC(=O)C(=S)Nc1ccccc1 Amb6316935 [0,1,0,0,0,0|2,0,0]=3 739 B12R1.43 NC(=O)C(=S)Nc1ccccn1 Amb6870743 [0,1,0,0,0,0|3,0,0]=4 740 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,1,0,0,0,0|1,0,2]=4 741 B12R1.43 NC(=O)C(Cl)Cc1ccccc1 Amb17204334 [0,1,0,0,0,0|1,0,2]=4 742 B12R1.43 NC(=O)C(F)Sc1ccccc1 Amb27865643 [0,1,0,0,0,0|2,0,1]=4 743 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,1,0,0,0,0|1,0,2]=4 744 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb9727200 [0,1,0,0,0,0|1,0,2]=4 745 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,1,0,0,0,0|2,0,1]=4 746 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,1,0,0,0,0|1,0,2]=4 747 B12R1.43 NC(=O)C(S)Cc1ccccc1 Amb27663190 [0,1,0,0,0,0|1,0,2]=4 748 B12R1.43 NC(=O)N(O)Cc1ccccc1 Amb27966850 [0,1,0,0,0,0|2,0,1]=4 749 B12R1.43 NC(=O)[C@@H](Br)Cc1ccccc1 Amb27240179 [0,1,0,0,0,0|1,0,2]=4 750 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb6295777 [0,1,0,0,0,0|1,0,2]=4 751 B12R1.43 NC(=O)[C@@H](N)Cc1ccccc1 Amb9825510 [0,1,0,0,0,0|1,0,2]=4 752 B12R1.43 NC(=O)[C@@H](O)Cc1ccccc1 Amb26371653 [0,1,0,0,0,0|1,0,2]=4 753 B12R1.43 NC(=O)[C@H](Cl)Cc1ccccc1 Amb28385619 [0,1,0,0,0,0|1,0,2]=4 754 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb16183950 [0,1,0,0,0,0|1,0,2]=4 755 B12R1.43 NC(=O)[C@H](N)Cc1ccccc1 Amb33800758 [0,1,0,0,0,0|1,0,2]=4 756 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,1,0,0,0,0|1,0,2]=4 757 B12R1.43 NC(=O)\C(Cl)=C\c1ccccc1 Amb3724521 [0,1,0,0,0,0|1,0,0]=2 758 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb19958284 [0,1,0,0,0,0|1,0,2]=4 759 B12R1.43 NC(Cc1ccccc1)C(=O)O Amb9703092 [0,1,0,0,0,0|1,0,2]=4 760 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)Cl Amb27955901 [0,1,0,0,0,0|1,0,2]=4 761 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb22351110 [0,1,0,0,0,0|1,0,2]=4 762 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O Amb3940754 [0,1,0,0,0,0|1,0,2]=4 763 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)S Amb27407796 [0,1,0,0,0,0|1,0,2]=4 764 B12R1.43 N[C@H](Cc1ccccc1)C(=O)O Amb2725663 [0,1,0,0,0,0|1,0,2]=4 765 B12R1.43 N\C(=C/c1ccccc1)C(=O)O Amb24081025 [0,1,0,0,0,0|1,0,0]=2 766 B12R1.43 N\C(=C/c1ccncn1)C(=O)O Amb24390213 [0,1,0,0,0,0|3,0,0]=4 767 B12R1.43 N\C(=C\c1ccccc1)C(=O)O Amb27148014 [0,1,0,0,0,0|1,0,0]=2 768 B12R1.43 N\C(=C\c1ccccn1)C(=O)O Amb27770994 [0,1,0,0,0,0|2,0,0]=3 769 B12R1.43 N\C(=C\c1cnccn1)C(=O)O Amb27624449 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.43 O=C(Br)C(Br)Cc1ccccc1 Amb27840480 [0,1,0,0,0,0|1,0,2]=4 771 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,1,0,0,0,0|1,0,2]=4 772 B12R1.43 O=C(Cl)C(F)Cc1ccccc1 Amb27615534 [0,1,0,0,0,0|1,0,2]=4 773 B12R1.43 O=C(Cl)C(O)Cc1ccccc1 Amb27632817 [0,1,0,0,0,0|1,0,2]=4 774 B12R1.43 O=C(Cl)\C(F)=C/c1ccccc1 Amb27416385 [0,1,0,0,0,0|1,0,0]=2 775 B12R1.43 O=C(O)C(=O)C[n+]1ccccc1 Amb28287668 [0,1,0,0,0,0|2,0,1]=4 776 B12R1.43 O=C(O)C(=O)Cc1ccccc1 Amb2718694 [0,1,0,0,0,0|1,0,1]=3 777 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb17477815 [0,1,0,0,0,0|2,0,1]=4 778 B12R1.43 O=C(O)C(=O)Cc1ccccn1 Amb32952891 [0,1,0,0,0,0|2,0,1]=4 779 B12R1.43 O=C(O)C(=O)Cc1cccnc1 Amb17232515 [0,1,0,0,0,0|2,0,1]=4 780 B12R1.43 O=C(O)C(=O)Cc1ccncc1 Amb17477816 [0,1,0,0,0,0|2,0,1]=4 781 B12R1.43 O=C(O)C(=O)Nc1ccccc1 Amb838962 [0,1,0,0,0,0|2,0,0]=3 782 B12R1.43 O=C(O)C(=O)Nc1ccccn1 Amb9303802 [0,1,0,0,0,0|3,0,0]=4 783 B12R1.43 O=C(O)C(=O)Nc1cccnc1 Amb9303807 [0,1,0,0,0,0|3,0,0]=4 784 B12R1.43 O=C(O)C(=O)Nc1ccncc1 Amb9303811 [0,1,0,0,0,0|3,0,0]=4 785 B12R1.43 O=C(O)C(=S)Nc1ccccc1 Amb10558556 [0,1,0,0,0,0|2,0,0]=3 786 B12R1.43 O=C(O)C(=S)Oc1ccccc1 Amb27484078 [0,1,0,0,0,0|2,0,0]=3 787 B12R1.43 O=C(O)C(Br)Cc1ccccc1 Amb8392806 [0,1,0,0,0,0|1,0,2]=4 788 B12R1.43 O=C(O)C(Cl)Cc1ccccc1 Amb17204339 [0,1,0,0,0,0|1,0,2]=4 789 B12R1.43 O=C(O)C(Cl)Sc1ccccc1 Amb27797220 [0,1,0,0,0,0|2,0,1]=4 790 B12R1.43 O=C(O)C(F)Cc1ccccc1 Amb27863462 [0,1,0,0,0,0|1,0,2]=4 791 B12R1.43 O=C(O)C(O)Cc1ccccc1 Amb2718772 [0,1,0,0,0,0|1,0,2]=4 792 B12R1.43 O=C(O)C(O)Oc1ccccc1 Amb27645391 [0,1,0,0,0,0|2,0,1]=4 793 B12R1.43 O=C(O)C(S)Cc1ccccc1 Amb18289035 [0,1,0,0,0,0|1,0,2]=4 794 B12R1.43 O=C(O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,1,0,0,0,0|1,0,2]=4 795 B12R1.43 O=C(O)[C@@H](F)Cc1ccccc1 Amb27983597 [0,1,0,0,0,0|1,0,2]=4 796 B12R1.43 O=C(O)[C@@H](O)Cc1ccccc1 Amb6295887 [0,1,0,0,0,0|1,0,2]=4 797 B12R1.43 O=C(O)[C@H](O)Cc1ccccc1 Amb3940793 [0,1,0,0,0,0|1,0,2]=4 798 B12R1.43 O=C(O)\C(Br)=C\c1ccccc1 Amb2794045 [0,1,0,0,0,0|1,0,0]=2 799 B12R1.43 O=C(O)\C(Cl)=C/c1ccccc1 Amb18648695 [0,1,0,0,0,0|1,0,0]=2 800 B12R1.43 O=C(O)\C(Cl)=C\c1ccccc1 Amb19651416 [0,1,0,0,0,0|1,0,0]=2 801 B12R1.43 O=C(O)\C(Cl)=C\c1cccnc1 Amb26448364 [0,1,0,0,0,0|2,0,0]=3 802 B12R1.43 O=C(O)\C(F)=C\c1ccccc1 Amb24093652 [0,1,0,0,0,0|1,0,0]=2 803 B12R1.43 O=C(O)\C(F)=C\c1ccccn1 Amb27977069 [0,1,0,0,0,0|2,0,0]=3 804 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb17614474 [0,1,0,0,0,0|2,0,0]=3 805 B12R1.43 O=C(O)\C(F)=C\c1cccnc1 Amb31339126 [0,1,0,0,0,0|2,0,0]=3 806 B12R1.43 O=C(O)\C(F)=C\c1cnccn1 Amb35600945 [0,1,0,0,0,0|3,0,0]=4 807 B12R1.43 O=C(O)\C(S)=C/c1ccccc1 Amb2550972 [0,1,0,0,0,0|1,0,0]=2 808 B12R1.43 O=C(O)\C(S)=C\c1ccccc1 Amb1250109 [0,1,0,0,0,0|1,0,0]=2 809 B12R1.43 O=C(O)\C(S)=C\c1ccccn1 Amb1761004 [0,1,0,0,0,0|2,0,0]=3 810 B12R1.43 O=C(O)\C(S)=C\c1ccncc1 Amb1761003 [0,1,0,0,0,0|2,0,0]=3 811 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb19884048 [0,1,0,0,0,0|1,0,1]=3 812 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb6365780 [0,1,0,0,0,0|1,0,1]=3 813 B12R1.43 O=C([O-])C(=O)Cc1ccccc1 Amb8393076 [0,1,0,0,0,0|1,0,1]=3 814 B12R1.43 O=C([O-])C(O)Cc1ccccc1 Amb33513053 [0,1,0,0,0,0|1,0,2]=4 815 B12R1.43 O=[N+]([O-])\C(F)=C\c1ccccc1 Amb27843539 [0,1,0,0,0,0|2,0,0]=3 816 B12R1.43 OB(O)\C(F)=C\c1ccccc1 Amb25667549 [0,1,0,0,0,0|2,0,1]=4 817 B12R1.49 C=CC(=O)Cc1ccc(F)cc1 Amb2699674 [0,1,0,0,0,0|2,0,1]=4 818 B12R1.49 C=CC(=O)Cc1ccc(I)cc1 Amb27412684 [0,1,0,0,0,0|2,0,1]=4 819 B12R1.49 C=CC(=O)Cc1ccc(O)cc1 Amb27164620 [0,1,0,0,0,0|2,0,1]=4 820 B12R1.49 C=CC(=O)Nc1ccc(Br)cc1 Amb6843658 [0,1,0,0,0,0|3,0,0]=4 821 B12R1.49 C=CC(=O)Nc1ccc(C)cc1 Amb6843669 [0,1,0,0,0,0|3,0,0]=4 822 B12R1.49 C=CC(=O)Nc1ccc(Cl)cc1 Amb33532238 [0,1,0,0,0,0|3,0,0]=4 823 B12R1.49 C=CC(=O)Nc1ccc(F)cc1 Amb6843679 [0,1,0,0,0,0|3,0,0]=4 824 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [0,1,0,0,0,0|3,0,0]=4 825 B12R1.49 C=CC(=O)Oc1ccc(I)cc1 Amb28188352 [0,1,0,0,0,0|3,0,0]=4 826 B12R1.49 C=CC(=O)Oc1ccc(O)cc1 Amb27668978 [0,1,0,0,0,0|3,0,0]=4 827 B12R1.49 C=CC(C)Nc1ccc(C)cc1 Amb27650694 [0,1,0,0,0,0|2,0,1]=4 828 B12R1.49 C=CC(C)Nc1ccc(F)cc1 Amb27273562 [0,1,0,0,0,0|2,0,1]=4 829 B12R1.49 C=CC(C)Nc1ccc(I)cc1 Amb27984516 [0,1,0,0,0,0|2,0,1]=4 830 B12R1.49 C=CC(C)Nc1ccc(N)cc1 Amb27410792 [0,1,0,0,0,0|2,0,1]=4 831 B12R1.49 C=CC(C)Oc1ccc(Br)cc1 Amb25893737 [0,1,0,0,0,0|2,0,1]=4 832 B12R1.49 C=CC(C)Oc1ccc(F)cc1 Amb27807106 [0,1,0,0,0,0|2,0,1]=4 833 B12R1.49 C=CC(C)Oc1ccc(N)cc1 Amb18990276 [0,1,0,0,0,0|2,0,1]=4 834 B12R1.49 C=CC(C)Oc1ccc(O)cc1 Amb18798279 [0,1,0,0,0,0|2,0,1]=4 835 B12R1.49 C=CC(C)Sc1ccc(Br)cc1 Amb28206880 [0,1,0,0,0,0|2,0,1]=4 836 B12R1.49 C=CN(C)Cc1ccc(O)cc1 Amb24408917 [0,1,0,0,0,0|2,0,1]=4 837 B12R1.49 CC(C=O)Cc1ccc(Br)cc1 Amb25060263 [0,1,0,0,0,0|0,0,2]=3 838 B12R1.49 CC(C=O)Cc1ccc(Cl)cc1 Amb18648716 [0,1,0,0,0,0|0,0,2]=3 839 B12R1.49 CC(C=O)Cc1ccc(F)cc1 Amb26011993 [0,1,0,0,0,0|0,0,2]=3 840 B12R1.49 CC(C=O)Cc1ccc(I)cc1 Amb28187361 [0,1,0,0,0,0|0,0,2]=3 841 B12R1.49 CC(C=O)Cc1ccc(N)cc1 Amb27398345 [0,1,0,0,0,0|0,0,2]=3 842 B12R1.49 CC(C=O)Oc1ccc(Br)cc1 Amb30020612 [0,1,0,0,0,0|1,0,1]=3 843 B12R1.49 CC(C=O)Oc1ccc(Cl)cc1 Amb27619207 [0,1,0,0,0,0|1,0,1]=3 844 B12R1.49 CC(C=O)Oc1ccc(F)cc1 Amb30020594 [0,1,0,0,0,0|1,0,1]=3 845 B12R1.49 CC(C=O)Oc1ccc(I)cc1 Amb30020617 [0,1,0,0,0,0|1,0,1]=3 846 B12R1.49 CC(C=O)Sc1ccc(Br)cc1 Amb30020877 [0,1,0,0,0,0|1,0,1]=3 847 B12R1.49 CC(C=O)Sc1ccc(Br)cn1 Amb30020880 [0,1,0,0,0,0|2,0,1]=4 848 B12R1.49 CC(C=O)Sc1ccc(Cl)cc1 Amb30020870 [0,1,0,0,0,0|1,0,1]=3 849 B12R1.49 CC(C=O)Sc1ccc(Cl)cn1 Amb30020874 [0,1,0,0,0,0|2,0,1]=4 850 B12R1.49 CC(C=O)Sc1ccc(F)cc1 Amb30020862 [0,1,0,0,0,0|1,0,1]=3 851 B12R1.49 CC(Cc1ccc(C)cc1)=[N+]=[N-] Amb27265864 [0,1,0,0,0,0|2,0,1]=4 852 B12R1.49 CN(C=O)Cc1ccc(Br)cc1 Amb28456997 [0,1,0,0,0,0|1,0,1]=3 853 B12R1.49 C\C(=C/c1ccc(F)cc1)CCl Amb27392272 [0,1,0,0,0,0|1,0,1]=3 854 B12R1.49 C\C(=C/c1ccc(F)cc1)CN Amb18646339 [0,1,0,0,0,0|1,0,1]=3 855 B12R1.49 C\C(=C\Cl)Sc1ccc(C)cc1 Amb27216507 [0,1,0,0,0,0|2,0,0]=3 856 B12R1.49 C\C(=C\c1ccc(Br)cc1)CBr Amb27260624 [0,1,0,0,0,0|1,0,1]=3 857 B12R1.49 C\C(=C\c1ccc(Br)cn1)CCl Amb27406388 [0,1,0,0,0,0|2,0,1]=4 858 B12R1.49 C\C(=C\c1ccc(C)cc1)CBr Amb27801976 [0,1,0,0,0,0|1,0,1]=3 859 B12R1.49 C\C(=C\c1ccc(C)cn1)CBr Amb28187618 [0,1,0,0,0,0|2,0,1]=4 860 B12R1.49 C\C(=C\c1ccc(C)cn1)CO Amb27757476 [0,1,0,0,0,0|1,0,2]=4 861 B12R1.49 C\C(=C\c1ccc(C)nc1)CBr Amb27615308 [0,1,0,0,0,0|2,0,1]=4 862 B12R1.49 C\C(=C\c1ccc(C)nc1)CN Amb28043543 [0,1,0,0,0,0|2,0,1]=4 863 B12R1.49 C\C(=C\c1ccc(C)nc1)CO Amb27487979 [0,1,0,0,0,0|1,0,2]=4 864 B12R1.49 C\C(=C\c1ccc(F)cc1)CN Amb27950381 [0,1,0,0,0,0|1,0,1]=3 865 B12R1.49 C\C(=C\c1ccc(O)cc1)CO Amb27490394 [0,1,0,0,0,0|0,0,2]=3 866 B12R1.49 C\C(=N\N)Nc1ccc(C)cc1 Amb25991311 [0,1,0,0,0,0|3,0,0]=4 867 B12R1.49 C\C(=N\O)Nc1ccc(F)cc1 Amb25872757 [0,1,0,0,0,0|2,0,1]=4 868 B12R1.49 C\C(C#N)=C\c1ccc(F)cc1 Amb26641810 [0,1,0,0,0,0|1,0,1]=3 869 B12R1.49 C\C(C#N)=C\c1ccc(O)cc1 Amb28422701 [0,1,0,0,0,0|1,0,1]=3 870 B12R1.49 C\C(C=O)=C/c1ccc(Br)cc1 Amb17343202 [0,1,0,0,0,0|0,0,0]=1 871 B12R1.49 C\C(C=O)=C/c1ccc(C)cc1 Amb17334499 [0,1,0,0,0,0|0,0,0]=1 872 B12R1.49 C\C(C=O)=C/c1ccc(Cl)cc1 Amb17335458 [0,1,0,0,0,0|0,0,0]=1 873 B12R1.49 C\C(C=O)=C/c1ccc(F)cc1 Amb17334600 [0,1,0,0,0,0|0,0,0]=1 874 B12R1.49 C\C(C=O)=C/c1ccc(O)cc1 Amb17334556 [0,1,0,0,0,0|0,0,0]=1 875 B12R1.49 C\C(C=O)=C\c1ccc(Br)cn1 Amb28369368 [0,1,0,0,0,0|1,0,0]=2 876 B12R1.49 C\C(C=O)=C\c1ccc(C)cn1 Amb27766685 [0,1,0,0,0,0|1,0,0]=2 877 B12R1.49 C\C(C=O)=C\c1ccc(C)nc1 Amb28043537 [0,1,0,0,0,0|1,0,0]=2 878 B12R1.49 C\C(C=O)=C\c1ccc(Cl)cc1 Amb27474894 [0,1,0,0,0,0|0,0,0]=1 879 B12R1.49 C\C(Cc1ccc(Br)cc1)=N/O Amb6297502 [0,1,0,0,0,0|1,0,2]=4 880 B12R1.49 C\C(Cc1ccc(C)cc1)=N/O Amb26315441 [0,1,0,0,0,0|1,0,2]=4 881 B12R1.49 C\C(Cc1ccc(Cl)cc1)=N/O Amb6297503 [0,1,0,0,0,0|1,0,2]=4 882 B12R1.49 C\C(Cc1ccc(F)cc1)=N/O Amb6296338 [0,1,0,0,0,0|1,0,2]=4 883 B12R1.49 C\C(Cc1ccc(I)cc1)=N/O Amb28207885 [0,1,0,0,0,0|1,0,2]=4 884 B12R1.49 C\C(Cc1ccc(O)cc1)=N\N Amb27231947 [0,1,0,0,0,0|2,0,1]=4 885 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,1,0,0,0,0|0,0,2]=3 886 B12R1.49 Cc1ccc(CC(C)C=O)cn1 Amb28046135 [0,1,0,0,0,0|1,0,2]=4 887 B12R1.49 Cc1ccc(CC(Cl)C=O)cc1 Amb17204328 [0,1,0,0,0,0|1,0,2]=4 888 B12R1.49 Cc1ccc(CC(N)=S=O)cc1 Amb28250028 [0,1,0,0,0,0|2,0,1]=4 889 B12R1.49 Cc1ccc(OC(C)C=O)cc1 Amb27827460 [0,1,0,0,0,0|1,0,1]=3 890 B12R1.49 Cc1ccc(O\C(F)=C/Cl)cc1 Amb27407024 [0,1,0,0,0,0|3,0,0]=4 891 B12R1.49 Cc1ccc(O\C(F)=C\Cl)cc1 Amb27865489 [0,1,0,0,0,0|3,0,0]=4 892 B12R1.49 Cc1ccc(SC(C)C=O)cc1 Amb18648416 [0,1,0,0,0,0|1,0,1]=3 893 B12R1.49 Cc1ccc(\C=C(/Cl)C=O)cc1 Amb27751333 [0,1,0,0,0,0|1,0,0]=2 894 B12R1.49 Cc1ccc(\C=C(/F)C=O)cc1 Amb28251072 [0,1,0,0,0,0|1,0,0]=2 895 B12R1.49 Cc1ccc(\C=C(\F)C=O)cc1 Amb27850071 [0,1,0,0,0,0|1,0,0]=2 896 B12R1.49 N#C\C(F)=C\c1ccc(Br)cc1 Amb24053596 [0,1,0,0,0,0|2,0,1]=4 897 B12R1.49 N#C\C(F)=C\c1ccc(Cl)cc1 Amb24053597 [0,1,0,0,0,0|2,0,1]=4 898 B12R1.49 NC(C=O)Cc1ccc(O)cc1 Amb28208235 [0,1,0,0,0,0|1,0,2]=4 899 B12R1.49 O=CC(=O)Cc1ccc(Cl)cc1 Amb27873325 [0,1,0,0,0,0|1,0,1]=3 900 B12R1.49 O=CC(=O)Cc1ccc(F)cc1 Amb28247135 [0,1,0,0,0,0|1,0,1]=3 901 B12R1.49 O=CC(=O)Nc1ccc(O)cc1 Amb27748423 [0,1,0,0,0,0|2,0,0]=3 902 B12R1.49 O=CC(=O)Oc1ccc(O)cc1 Amb27769980 [0,1,0,0,0,0|2,0,0]=3 903 B12R1.49 O=CC(Cl)Cc1ccc(Br)cc1 Amb17204706 [0,1,0,0,0,0|1,0,2]=4 904 B12R1.49 O=CC(Cl)Cc1ccc(Cl)cc1 Amb17204403 [0,1,0,0,0,0|1,0,2]=4 905 B12R1.49 O=CC(Cl)Cc1ccc(F)cc1 Amb17204342 [0,1,0,0,0,0|1,0,2]=4 906 B12R1.49 O=C\C(F)=C\c1ccc(Cl)cc1 Amb28317406 [0,1,0,0,0,0|1,0,0]=2 907 B12R1.49 O=C\C(I)=C/c1ccc(F)cc1 Amb27449860 [0,1,0,0,0,0|1,0,0]=2 908 B12R1.49 O=C\C(O)=C\c1ccc(Cl)cc1 Amb18648698 [0,1,0,0,0,0|1,0,0]=2 909 B12R1.49 O=C\C(O)=C\c1ccc(F)cc1 Amb27769969 [0,1,0,0,0,0|1,0,0]=2 910 B12R1.50 C=CC(=O)Cc1cccc(F)c1 Amb2699673 [0,1,0,0,0,0|2,0,1]=4 911 B12R1.50 C=CC(=O)Nc1cccc(Br)c1 Amb33534001 [0,1,0,0,0,0|3,0,0]=4 912 B12R1.50 C=CC(=O)Nc1cccc(C)c1 Amb6843664 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.50 C=CC(=O)Nc1cccc(Cl)c1 Amb6843674 [0,1,0,0,0,0|3,0,0]=4 914 B12R1.50 C=CC(=O)Nc1cccc(F)c1 Amb6843681 [0,1,0,0,0,0|3,0,0]=4 915 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [0,1,0,0,0,0|3,0,0]=4 916 B12R1.50 C=CC(=O)Nc1cccc(O)c1 Amb6738692 [0,1,0,0,0,0|3,0,0]=4 917 B12R1.50 C=CC(=O)Oc1cccc(Br)c1 Amb27247979 [0,1,0,0,0,0|3,0,0]=4 918 B12R1.50 C=CC(C)Nc1cccc(Cl)c1 Amb27751102 [0,1,0,0,0,0|2,0,1]=4 919 B12R1.50 C=CC(C)Nc1cccc(F)c1 Amb27180321 [0,1,0,0,0,0|2,0,1]=4 920 B12R1.50 C=CC(C)Oc1cccc(Cl)c1 Amb28430371 [0,1,0,0,0,0|2,0,1]=4 921 B12R1.50 C=CC(C)Oc1cccc(N)c1 Amb18990275 [0,1,0,0,0,0|2,0,1]=4 922 B12R1.50 C=CC(C)Sc1cccc(Br)c1 Amb28400602 [0,1,0,0,0,0|2,0,1]=4 923 B12R1.50 C=CC(C)Sc1cccc(Cl)c1 Amb27598315 [0,1,0,0,0,0|2,0,1]=4 924 B12R1.50 C=CC(C)Sc1cccc(F)c1 Amb27456212 [0,1,0,0,0,0|2,0,1]=4 925 B12R1.50 C=CC(C)Sc1cccc(N)c1 Amb27475964 [0,1,0,0,0,0|2,0,1]=4 926 B12R1.50 CC(C=O)Cc1cccc(Br)c1 Amb26348210 [0,1,0,0,0,0|0,0,2]=3 927 B12R1.50 CC(C=O)Cc1cccc(F)c1 Amb25885683 [0,1,0,0,0,0|0,0,2]=3 928 B12R1.50 CC(C=O)Cc1cccc(I)c1 Amb25850018 [0,1,0,0,0,0|0,0,2]=3 929 B12R1.50 CC(C=O)Cc1cccc(N)c1 Amb25251154 [0,1,0,0,0,0|0,0,2]=3 930 B12R1.50 CC(C=O)Cc1cccc(O)c1 Amb27601007 [0,1,0,0,0,0|0,0,2]=3 931 B12R1.50 CC(C=O)Oc1cccc(Br)c1 Amb30020611 [0,1,0,0,0,0|1,0,1]=3 932 B12R1.50 CC(C=O)Oc1cccc(F)c1 Amb30020587 [0,1,0,0,0,0|1,0,1]=3 933 B12R1.50 CC(C=O)Oc1cccc(I)c1 Amb30020616 [0,1,0,0,0,0|1,0,1]=3 934 B12R1.50 CC(C=O)Oc1cncc(Br)c1 Amb30020614 [0,1,0,0,0,0|2,0,1]=4 935 B12R1.50 CC(C=O)Oc1cncc(Cl)c1 Amb30020610 [0,1,0,0,0,0|2,0,1]=4 936 B12R1.50 CC(C=O)Sc1cccc(Br)c1 Amb30020878 [0,1,0,0,0,0|1,0,1]=3 937 B12R1.50 CC(C=O)Sc1cccc(Cl)c1 Amb30020871 [0,1,0,0,0,0|1,0,1]=3 938 B12R1.50 CC(C=O)Sc1cccc(F)c1 Amb30020861 [0,1,0,0,0,0|1,0,1]=3 939 B12R1.50 CN(C=O)Cc1cccc(Cl)c1 Amb27878332 [0,1,0,0,0,0|1,0,1]=3 940 B12R1.50 CN(C=O)Cc1cccc(F)c1 Amb27616765 [0,1,0,0,0,0|1,0,1]=3 941 B12R1.50 CN(Cc1cccc(Cl)c1)N=O Amb25053417 [0,1,0,0,0,0|2,0,1]=4 942 B12R1.50 CN(Cc1cccc(O)c1)N=O Amb27260501 [0,1,0,0,0,0|2,0,1]=4 943 B12R1.50 C\C(=C\c1cccc(Br)c1)CN Amb28134551 [0,1,0,0,0,0|1,0,1]=3 944 B12R1.50 C\C(=C\c1cccc(Br)c1)CO Amb27470680 [0,1,0,0,0,0|0,0,2]=3 945 B12R1.50 C\C(=C\c1cccc(C)c1)CBr Amb28206734 [0,1,0,0,0,0|1,0,1]=3 946 B12R1.50 C\C(=C\c1cccc(Cl)c1)CBr Amb27485239 [0,1,0,0,0,0|1,0,1]=3 947 B12R1.50 C\C(=C\c1cccc(Cl)c1)CCl Amb28320105 [0,1,0,0,0,0|1,0,1]=3 948 B12R1.50 C\C(=C\c1cccc(F)c1)CN Amb27195481 [0,1,0,0,0,0|1,0,1]=3 949 B12R1.50 C\C(=C\c1cccc(I)c1)CO Amb27668599 [0,1,0,0,0,0|0,0,2]=3 950 B12R1.50 C\C(=N\O)Nc1cccc(F)c1 Amb27815133 [0,1,0,0,0,0|2,0,1]=4 951 B12R1.50 C\C(C=O)=C/c1cccc(Br)c1 Amb17343200 [0,1,0,0,0,0|0,0,0]=1 952 B12R1.50 C\C(C=O)=C/c1cccc(C)c1 Amb17334497 [0,1,0,0,0,0|0,0,0]=1 953 B12R1.50 C\C(C=O)=C/c1cccc(Cl)c1 Amb17335456 [0,1,0,0,0,0|0,0,0]=1 954 B12R1.50 C\C(C=O)=C/c1cccc(F)c1 Amb27614503 [0,1,0,0,0,0|0,0,0]=1 955 B12R1.50 C\C(C=O)=C/c1cccc(O)c1 Amb17334558 [0,1,0,0,0,0|0,0,0]=1 956 B12R1.50 C\C(C=O)=C\c1cccc(Br)c1 Amb27748579 [0,1,0,0,0,0|0,0,0]=1 957 B12R1.50 C\C(C=O)=C\c1cccc(O)c1 Amb28046443 [0,1,0,0,0,0|0,0,0]=1 958 B12R1.50 C\C(C=O)=C\c1cncc(Br)c1 Amb27591389 [0,1,0,0,0,0|1,0,0]=2 959 B12R1.50 C\C(Cc1cccc(Br)c1)=N\N Amb28345265 [0,1,0,0,0,0|2,0,1]=4 960 B12R1.50 C\C(Cc1cccc(C)c1)=N\O Amb27492873 [0,1,0,0,0,0|1,0,2]=4 961 B12R1.50 C\C(Cc1cccc(Cl)c1)=N/O Amb6298532 [0,1,0,0,0,0|1,0,2]=4 962 B12R1.50 C\C(Cc1cccc(Cl)c1)=N\O Amb28386417 [0,1,0,0,0,0|1,0,2]=4 963 B12R1.50 C\C(Cc1cccc(F)c1)=N/O Amb6297510 [0,1,0,0,0,0|1,0,2]=4 964 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,1,0,0,0,0|0,0,2]=3 965 B12R1.50 Cc1cccc(CC(Cl)C=O)c1 Amb17204327 [0,1,0,0,0,0|1,0,2]=4 966 B12R1.50 Cc1cccc(CC(F)C=O)c1 Amb28423095 [0,1,0,0,0,0|1,0,2]=4 967 B12R1.50 Cc1cccc(SC(C)C=O)c1 Amb30020857 [0,1,0,0,0,0|1,0,1]=3 968 B12R1.50 Cc1cccc(SC(C)C=O)n1 Amb28243976 [0,1,0,0,0,0|2,0,1]=4 969 B12R1.50 Cc1cccc(\C=C(\F)C=O)c1 Amb27788393 [0,1,0,0,0,0|1,0,0]=2 970 B12R1.50 N#C\C(F)=C\c1cccc(Cl)c1 Amb24053598 [0,1,0,0,0,0|2,0,1]=4 971 B12R1.50 Nc1cccc(O\C(Cl)=C\Cl)c1 Amb28239468 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.50 O=CC(=O)Cc1cccc(Cl)c1 Amb27488179 [0,1,0,0,0,0|1,0,1]=3 973 B12R1.50 O=CC(Cl)Cc1cccc(Br)c1 Amb17204708 [0,1,0,0,0,0|1,0,2]=4 974 B12R1.50 O=CC(Cl)Cc1cccc(Cl)c1 Amb17204402 [0,1,0,0,0,0|1,0,2]=4 975 B12R1.50 O=CC(Cl)Cc1cccc(F)c1 Amb17204343 [0,1,0,0,0,0|1,0,2]=4 976 B12R1.50 O=CC(F)Cc1cccc(F)c1 Amb27595749 [0,1,0,0,0,0|1,0,2]=4 977 B12R1.118 C=CC(CO)Nc1ccccc1 Amb27655109 [0,1,0,0,0,0|2,0,1]=4 978 B12R1.118 C=C\C(=C/c1ccccc1)CO Amb27981982 [0,1,0,0,0,0|1,0,0]=2 979 B12R1.118 CCC(=Cc1ccccc1)CC Amb27807779 [0,1,0,0,0,0|1,0,1]=3 980 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,1,0,0,0,0|2,0,1]=4 981 B12R1.118 CC\C(=C\Cl)Oc1ccccc1 Amb27425338 [0,1,0,0,0,0|2,0,0]=3 982 B12R1.118 CC\C(=C\c1ccccc1)CO Amb27860945 [0,1,0,0,0,0|0,0,2]=3 983 B12R1.118 CC\C(=C\c1ccccn1)CN Amb27871054 [0,1,0,0,0,0|2,0,1]=4 984 B12R1.118 CC\C(=N\C)Nc1ccccc1 Amb27967210 [0,1,0,0,0,0|2,0,1]=4 985 B12R1.118 CC\C(C=O)=C/c1ccccc1 Amb615951 [0,1,0,0,0,0|0,0,0]=1 986 B12R1.118 CC\C(C=O)=C/c1ccccn1 Amb17334523 [0,1,0,0,0,0|1,0,0]=2 987 B12R1.118 CC\C(C=O)=C/c1cccnc1 Amb17334524 [0,1,0,0,0,0|1,0,0]=2 988 B12R1.118 CC\C(C=O)=C/c1ccncc1 Amb17334525 [0,1,0,0,0,0|1,0,0]=2 989 B12R1.118 CC\C(C=O)=C\c1cccnc1 Amb28321082 [0,1,0,0,0,0|1,0,0]=2 990 B12R1.118 CC\C(C=O)=C\c1ccncn1 Amb27869140 [0,1,0,0,0,0|2,0,0]=3 991 B12R1.118 CC\C(C=O)=C\c1cnccn1 Amb35600871 [0,1,0,0,0,0|2,0,0]=3 992 B12R1.118 CC\C(Cc1ccccc1)=N/O Amb27464620 [0,1,0,0,0,0|1,0,2]=4 993 B12R1.118 CN\C(=N\N)Nc1ccccc1 Amb25256907 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [0,1,0,0,0,0|0,0,2]=3 995 B12R1.118 CO\C(=C\c1ccccc1)CO Amb27457627 [0,1,0,0,0,0|0,0,2]=3 996 B12R1.118 CO\C(C=O)=C\c1ccccc1 Amb17594035 [0,1,0,0,0,0|0,0,0]=1 997 B12R1.118 CS\C(=N\c1ccccc1)NN Amb27878880 [0,1,0,0,0,0|3,0,0]=4 998 B12R1.118 CS\C(C#N)=C\c1ccccc1 Amb17594452 [0,1,0,0,0,0|1,0,1]=3 999 B12R1.118 CS\C(C=O)=C/c1ccccc1 Amb27614686 [0,1,0,0,0,0|0,0,0]=1 1000 B12R1.118 C\C=C(/C=O)Cc1ccccc1 Amb25743406 [0,1,0,0,0,0|0,0,1]=2 1001 B12R1.118 C\C=C(\CC)Nc1ccccc1 Amb26457549 [0,1,0,0,0,0|2,0,0]=3 1002 B12R1.118 C\C=C(\CCl)Sc1ccccc1 Amb26439798 [0,1,0,0,0,0|2,0,0]=3 1003 B12R1.118 C\C=C(\CO)Cc1ccccc1 Amb28242441 [0,1,0,0,0,0|1,0,1]=3 1004 B12R1.118 C\N=C(/NN)Nc1ccccc1 Amb32712055 [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.118 C\N=C(/Nc1ccccc1)SC Amb4013158 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.118 Cl\C=C(\CCl)Sc1ccccc1 Amb28057449 [0,1,0,0,0,0|2,0,0]=3 1007 B12R1.118 N#CC(C#N)=Cc1ccccc1 Amb1199354 [0,1,0,0,0,0|1,0,2]=4 1008 B12R1.118 N#C\C(=C/Cl)Sc1ccccc1 Amb27425339 [0,1,0,0,0,0|2,0,1]=4 1009 B12R1.118 N#C\C(=C/c1ccccc1)CCl Amb28290359 [0,1,0,0,0,0|1,0,1]=3 1010 B12R1.118 N#C\C(=C/c1ccccc1)CO Amb28322086 [0,1,0,0,0,0|1,0,1]=3 1011 B12R1.118 NC\C(=C\F)Cc1ccccc1 Amb26531075 [0,1,0,0,0,0|1,0,1]=3 1012 B12R1.118 O=CC(C=O)=Cc1ccccc1 Amb18645276 [0,1,0,0,0,0|0,0,1]=2 1013 B12R1.118 O=CC(Cc1ccccc1)=S=O Amb27972982 [0,1,0,0,0,0|1,0,1]=3 1014 B12R1.118 O=C\C(=C/O)Cc1ccccc1 Amb27630435 [0,1,0,0,0,0|0,0,2]=3 1015 B12R1.118 O=C\C(=C/O)Oc1ccccc1 Amb24625847 [0,1,0,0,0,0|1,0,1]=3 1016 B12R1.118 O=C\C(=C/c1ccccc1)CCl Amb27640646 [0,1,0,0,0,0|0,0,0]=1 1017 B12R1.118 O=C\C(=C\Cl)Cc1ccccc1 Amb27984848 [0,1,0,0,0,0|0,0,2]=3 1018 B12R1.118 O=C\C(=C\c1ccccc1)CO Amb27769967 [0,1,0,0,0,0|0,0,0]=1 1019 B12R1.194 C=CC(C)(C)Nc1ccccc1 Amb27751378 [0,1,0,0,0,0|2,0,1]=4 1020 B12R1.194 C=CC(C)(O)Cc1ccccc1 Amb27876057 [0,1,0,0,0,0|1,0,2]=4 1021 B12R1.194 CC(C)(C=O)Cc1ccccc1 Amb4358578 [0,1,0,0,0,0|0,0,2]=3 1022 B12R1.194 CC(C)(C=O)Cc1ccccn1 Amb27758131 [0,1,0,0,0,0|1,0,2]=4 1023 B12R1.194 CC(C)(C=O)Cc1cccnc1 Amb26481535 [0,1,0,0,0,0|1,0,2]=4 1024 B12R1.194 CC(C)(C=O)Cc1ccncc1 Amb27949144 [0,1,0,0,0,0|1,0,2]=4 1025 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,1,0,0,0,0|1,0,1]=3 1026 B12R1.194 CC(C)(C=O)Sc1ccccc1 Amb2412521 [0,1,0,0,0,0|1,0,1]=3 1027 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,1,0,0,0,0|1,0,2]=4 1028 B12R1.194 CC(O)(C=O)Cc1ccccc1 Amb27399998 [0,1,0,0,0,0|0,0,2]=3 1029 B12R1.194 CC(O)(C=O)Cc1ccccn1 Amb27261274 [0,1,0,0,0,0|1,0,2]=4 1030 B12R1.194 CC(O)(C=O)Cc1ccncc1 Amb27870890 [0,1,0,0,0,0|1,0,2]=4 1031 B12R1.194 C[C@@](O)(C=O)Cc1ccccc1 Amb27748618 [0,1,0,0,0,0|0,0,2]=3 1032 B12R1.194 O=CC(Cl)(Cl)Cc1ccccc1 Amb28129587 [0,1,0,0,0,0|1,0,2]=4 1033 B12R1.371 C=CC(=O)Cc1ccccc1Br Amb28143882 [0,1,0,0,0,0|2,0,1]=4 1034 B12R1.371 C=CC(=O)Cc1ccccc1F Amb2699672 [0,1,0,0,0,0|2,0,1]=4 1035 B12R1.371 C=CC(=O)Nc1ccccc1C Amb6843670 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.371 C=CC(=O)Nc1ccccc1Cl Amb6843675 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.371 C=CC(=O)Nc1ccccc1F Amb6843680 [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.371 C=CC(=O)Nc1ccccc1I Amb9261228 [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.371 C=CC(=O)Oc1ccccc1C Amb28204165 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.371 C=CC(=O)Oc1ccccc1Cl Amb28364728 [0,1,0,0,0,0|3,0,0]=4 1041 B12R1.371 C=CC(C)Oc1ccccc1Cl Amb27949950 [0,1,0,0,0,0|2,0,1]=4 1042 B12R1.371 C=CC(C)Oc1ccccc1F Amb26015971 [0,1,0,0,0,0|2,0,1]=4 1043 B12R1.371 C=CC(C)Oc1ccccc1I Amb27793487 [0,1,0,0,0,0|2,0,1]=4 1044 B12R1.371 C=CC(C)Oc1ccccc1N Amb24100513 [0,1,0,0,0,0|2,0,1]=4 1045 B12R1.371 C=CC(C)Sc1ccccc1Br Amb28400670 [0,1,0,0,0,0|2,0,1]=4 1046 B12R1.371 C=CC(C)Sc1ccccc1O Amb18805139 [0,1,0,0,0,0|2,0,1]=4 1047 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [0,1,0,0,0,0|0,0,2]=3 1048 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [0,1,0,0,0,0|0,0,2]=3 1049 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [0,1,0,0,0,0|0,0,2]=3 1050 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [0,1,0,0,0,0|0,0,2]=3 1051 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [0,1,0,0,0,0|0,0,2]=3 1052 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [0,1,0,0,0,0|0,0,2]=3 1053 B12R1.371 CC(C=O)Oc1ccccc1Br Amb30020613 [0,1,0,0,0,0|1,0,1]=3 1054 B12R1.371 CC(C=O)Oc1ccccc1F Amb35737124 [0,1,0,0,0,0|1,0,1]=3 1055 B12R1.371 CC(C=O)Oc1ccccc1I Amb30020615 [0,1,0,0,0,0|1,0,1]=3 1056 B12R1.371 CC(C=O)Sc1ccccc1Br Amb30020876 [0,1,0,0,0,0|1,0,1]=3 1057 B12R1.371 CC(C=O)Sc1ccccc1Cl Amb30020873 [0,1,0,0,0,0|1,0,1]=3 1058 B12R1.371 CC(C=O)Sc1ccccc1F Amb30020863 [0,1,0,0,0,0|1,0,1]=3 1059 B12R1.371 CC(C=O)Sc1ncccc1Br Amb30020879 [0,1,0,0,0,0|2,0,1]=4 1060 B12R1.371 CC(C=O)Sc1ncccc1Cl Amb30020875 [0,1,0,0,0,0|2,0,1]=4 1061 B12R1.371 CC\C(C)=C/c1ccccc1O Amb28253700 [0,1,0,0,0,0|1,0,1]=3 1062 B12R1.371 CN(C=O)Cc1ccccc1Br Amb27228720 [0,1,0,0,0,0|1,0,1]=3 1063 B12R1.371 C\C(=C\c1ccccc1Br)CBr Amb27254538 [0,1,0,0,0,0|1,0,1]=3 1064 B12R1.371 C\C(=C\c1ccccc1C)CBr Amb27656994 [0,1,0,0,0,0|1,0,1]=3 1065 B12R1.371 C\C(=C\c1ccccc1C)CN Amb28370194 [0,1,0,0,0,0|1,0,1]=3 1066 B12R1.371 C\C(=C\c1ccccc1F)CN Amb27837353 [0,1,0,0,0,0|1,0,1]=3 1067 B12R1.371 C\C(=C\c1ccncc1C)CBr Amb27184524 [0,1,0,0,0,0|2,0,1]=4 1068 B12R1.371 C\C(=C\c1ccncc1C)CCl Amb27184548 [0,1,0,0,0,0|2,0,1]=4 1069 B12R1.371 C\C(=C\c1ccncc1C)CO Amb27842418 [0,1,0,0,0,0|1,0,2]=4 1070 B12R1.371 C\C(=C\c1cnccc1C)CBr Amb27239456 [0,1,0,0,0,0|2,0,1]=4 1071 B12R1.371 C\C(=C\c1cnccc1C)CN Amb27765462 [0,1,0,0,0,0|2,0,1]=4 1072 B12R1.371 C\C(=C\c1cnccc1C)CO Amb27754610 [0,1,0,0,0,0|1,0,2]=4 1073 B12R1.371 C\C(=C\c1ncccc1Br)CN Amb27971049 [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.371 C\C(=N\O)Nc1ccccc1C Amb28251195 [0,1,0,0,0,0|2,0,1]=4 1075 B12R1.371 C\C(C=O)=C/c1ccccc1C Amb17334495 [0,1,0,0,0,0|0,0,0]=1 1076 B12R1.371 C\C(C=O)=C/c1ccccc1Cl Amb17335454 [0,1,0,0,0,0|0,0,0]=1 1077 B12R1.371 C\C(C=O)=C/c1ccccc1F Amb17334598 [0,1,0,0,0,0|0,0,0]=1 1078 B12R1.371 C\C(C=O)=C/c1nccnc1C Amb35600875 [0,1,0,0,0,0|2,0,0]=3 1079 B12R1.371 C\C(C=O)=C\c1ccccc1O Amb28457572 [0,1,0,0,0,0|0,0,0]=1 1080 B12R1.371 C\C(Cc1ccccc1C)=N/O Amb27412995 [0,1,0,0,0,0|1,0,2]=4 1081 B12R1.371 C\C(Cc1ccccc1C)=N\O Amb27843396 [0,1,0,0,0,0|1,0,2]=4 1082 B12R1.371 C\C(Cc1ccccc1Cl)=N/O Amb6296923 [0,1,0,0,0,0|1,0,2]=4 1083 B12R1.371 C\C(Cc1ccccc1F)=N/O Amb26890978 [0,1,0,0,0,0|1,0,2]=4 1084 B12R1.371 C\C(Cc1ccccc1F)=N\N Amb27661961 [0,1,0,0,0,0|2,0,1]=4 1085 B12R1.371 C\C=C(\C)Cc1ccccc1O Amb24380771 [0,1,0,0,0,0|1,0,1]=3 1086 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,1,0,0,0,0|0,0,2]=3 1087 B12R1.371 Cc1ccccc1CC(Cl)C=O Amb17204326 [0,1,0,0,0,0|1,0,2]=4 1088 B12R1.371 Cc1ccccc1CC(F)C=O Amb27251880 [0,1,0,0,0,0|1,0,2]=4 1089 B12R1.371 Cc1ccccc1OC(C)C=O Amb27841630 [0,1,0,0,0,0|1,0,1]=3 1090 B12R1.371 Cc1ccccc1SC(C)C=O Amb30020858 [0,1,0,0,0,0|1,0,1]=3 1091 B12R1.371 Cc1ccccc1\C=C(/F)C=O Amb27851468 [0,1,0,0,0,0|1,0,0]=2 1092 B12R1.371 Cc1cccnc1SC(C)C=O Amb29879909 [0,1,0,0,0,0|2,0,1]=4 1093 B12R1.371 O=CC(Cl)Cc1ccccc1Br Amb17204707 [0,1,0,0,0,0|1,0,2]=4 1094 B12R1.371 O=CC(Cl)Cc1ccccc1Cl Amb17204401 [0,1,0,0,0,0|1,0,2]=4 1095 B12R1.371 O=CC(Cl)Cc1ccccc1F Amb17204341 [0,1,0,0,0,0|1,0,2]=4 1096 B12R1.371 OC\C(Cl)=C/c1ccccc1O Amb27256379 [0,1,0,0,0,0|1,0,2]=4 1097 B10R0.74 C#C\C(C)=C/C=C/C=C/C=O Amb27481676 [0,0,1,0,0,0|2,0,1]=4 1098 B12R2.11 OC1O\C1=C/c2ccccc2 Amb27589709 [0,0,0,1,0,0|1,0,2]=4 1099 B12R2.18 Brc1sc2ccccc2c1Br Amb21858144 [0,0,0,1,0,0|3,0,0]=4 1100 B12R2.18 C=C1C(=O)Nc2ccccc21 Amb17779246 [0,0,0,1,0,0|3,0,0]=4 1101 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,0,0,1,0,0|0,0,2]=3 1102 B12R2.18 CC1=C(C)c2ccccc2C1 Amb21948330 [0,0,0,1,0,0|1,0,1]=3 1103 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,0,0,1,0,0|0,0,2]=3 1104 B12R2.18 CC1=Cc2ccccc2[C@H]1O Amb28319957 [0,0,0,1,0,0|0,0,2]=3 1105 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [0,0,0,1,0,0|0,0,2]=3 1106 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [0,0,0,1,0,0|1,0,1]=3 1107 B12R2.18 CC1Oc2ccccc2C1=O Amb25956002 [0,0,0,1,0,0|1,0,1]=3 1108 B12R2.18 CN1Cc2ccccc2C1=O Amb4006345 [0,0,0,1,0,0|1,0,1]=3 1109 B12R2.18 CN1Cc2cnccc2C1=O Amb28062941 [0,0,0,1,0,0|2,0,1]=4 1110 B12R2.18 CN1Nc2ccccc2C1=N Amb27646089 [0,0,0,1,0,0|3,0,0]=4 1111 B12R2.18 CN1Oc2ccccc2C1=O Amb27760365 [0,0,0,1,0,0|2,0,0]=3 1112 B12R2.18 CN1Sc2ccccc2C1=O Amb27218159 [0,0,0,1,0,0|2,0,0]=3 1113 B12R2.18 CN1Sc2ccccc2C1=S Amb22347590 [0,0,0,1,0,0|2,1,0]=4 1114 B12R2.18 CN1Sc2ccccc2S1=O Amb27878898 [0,0,0,1,0,0|3,0,0]=4 1115 B12R2.18 Cc1c(Br)oc2ccccc12 Amb24451202 [0,0,0,1,0,0|3,0,0]=4 1116 B12R2.18 Cc1c(I)sc2ccccc12 Amb26042872 [0,0,0,1,0,0|3,0,0]=4 1117 B12R2.18 Cc1c(N)oc2ccccc12 Amb18202306 [0,0,0,1,0,0|3,0,0]=4 1118 B12R2.18 Cc1c(O)oc2ccccc12 Amb33310521 [0,0,0,1,0,0|3,0,0]=4 1119 B12R2.18 Cc1c2ccccc2nn1C Amb23437154 [0,0,0,1,0,0|3,0,0]=4 1120 B12R2.18 Cc1cc2ccccc2n1C Amb1934988 [0,0,0,1,0,0|2,0,0]=3 1121 B12R2.18 Cc1cc2ccccc2n1N Amb28457281 [0,0,0,1,0,0|2,0,0]=3 1122 B12R2.18 Cc1cc2ccccn2c1Br Amb18559299 [0,0,0,1,0,0|2,0,0]=3 1123 B12R2.18 Cc1cc2ccccn2c1C Amb26481258 [0,0,0,1,0,0|2,0,0]=3 1124 B12R2.18 Cc1cc2ccccn2c1N Amb18559300 [0,0,0,1,0,0|2,0,0]=3 1125 B12R2.18 Cc1cn2ccccc2[n+]1N Amb2613495 [0,0,0,1,0,0|3,0,0]=4 1126 B12R2.18 Cc1cn2ccccc2c1C Amb27492933 [0,0,0,1,0,0|2,0,0]=3 1127 B12R2.18 Cc1cn2ccccc2c1N Amb18149646 [0,0,0,1,0,0|2,0,0]=3 1128 B12R2.18 Cc1nc2ccccc2n1C Amb6367586 [0,0,0,1,0,0|3,0,0]=4 1129 B12R2.18 Cc1nc2ccccc2n1N Amb1156070 [0,0,0,1,0,0|3,0,0]=4 1130 B12R2.18 Cc1nc2ccccn2c1Br Amb2723331 [0,0,0,1,0,0|3,0,0]=4 1131 B12R2.18 Cc1nc2ccccn2c1I Amb19148758 [0,0,0,1,0,0|3,0,0]=4 1132 B12R2.18 Cc1nc2ccccn2c1N Amb9174424 [0,0,0,1,0,0|3,0,0]=4 1133 B12R2.18 Cc1nn2ccccc2c1Br Amb18175879 [0,0,0,1,0,0|3,0,0]=4 1134 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,0,0,1,0,0|2,0,0]=3 1135 B12R2.18 Cc1oc2ccccc2c1C Amb8516959 [0,0,0,1,0,0|2,0,0]=3 1136 B12R2.18 Cc1oc2ccncc2c1Br Amb23591026 [0,0,0,1,0,0|3,0,0]=4 1137 B12R2.18 Cc1sc2ccccc2[n+]1C Amb2779896 [0,0,0,1,0,0|3,0,0]=4 1138 B12R2.18 Cc1sc2ccccc2[n+]1C Amb4382484 [0,0,0,1,0,0|3,0,0]=4 1139 B12R2.18 Cc1sc2ccccc2[n+]1C Amb4383954 [0,0,0,1,0,0|3,0,0]=4 1140 B12R2.18 Cc1sc2ccccc2[n+]1[O-] Amb27790413 [0,0,0,1,0,0|2,0,1]=4 1141 B12R2.18 Cc1sc2ccccc2c1Br Amb10975969 [0,0,0,1,0,0|2,0,0]=3 1142 B12R2.18 Cc1sc2ccccc2c1I Amb25247275 [0,0,0,1,0,0|2,0,0]=3 1143 B12R2.18 Cc1sc2ccncc2c1Br Amb28369838 [0,0,0,1,0,0|3,0,0]=4 1144 B12R2.18 Cc1sc2cnccc2c1Br Amb25984523 [0,0,0,1,0,0|3,0,0]=4 1145 B12R2.18 Cc1sc2cnccc2c1N Amb22170236 [0,0,0,1,0,0|3,0,0]=4 1146 B12R2.18 Clc1c(Br)oc2ccccc12 Amb28284723 [0,0,0,1,0,0|3,0,0]=4 1147 B12R2.18 Clc1oc2ccccc2c1Br Amb33433284 [0,0,0,1,0,0|3,0,0]=4 1148 B12R2.18 Clc1sc2ccccc2c1Br Amb27792393 [0,0,0,1,0,0|3,0,0]=4 1149 B12R2.18 Clc1sc2ccccc2c1Cl Amb20669291 [0,0,0,1,0,0|3,0,0]=4 1150 B12R2.18 Cn1c(Br)cc2ccccc21 Amb22232574 [0,0,0,1,0,0|3,0,0]=4 1151 B12R2.18 Cn1c(Cl)cc2ccccc21 Amb26587274 [0,0,0,1,0,0|3,0,0]=4 1152 B12R2.18 Cn1c(F)cc2ccccc21 Amb27882722 [0,0,0,1,0,0|3,0,0]=4 1153 B12R2.18 Cn1c(I)cc2ccccc21 Amb24067548 [0,0,0,1,0,0|3,0,0]=4 1154 B12R2.18 Cn1c(N)cc2ccccc21 Amb18644284 [0,0,0,1,0,0|3,0,0]=4 1155 B12R2.18 Cn1c(N)cc2ccccc21 Amb19944548 [0,0,0,1,0,0|3,0,0]=4 1156 B12R2.18 Cn1c(O)cc2ccccc21 Amb3427957 [0,0,0,1,0,0|3,0,0]=4 1157 B12R2.18 Cn1c(S)cc2ccccc21 Amb26845572 [0,0,0,1,0,0|3,0,0]=4 1158 B12R2.18 Cn1nc2ccccc2c1Br Amb25909805 [0,0,0,1,0,0|3,0,0]=4 1159 B12R2.18 Cn1nc2ccccc2c1Cl Amb28434884 [0,0,0,1,0,0|3,0,0]=4 1160 B12R2.18 Cn1nc2ccccc2c1I Amb22494609 [0,0,0,1,0,0|3,0,0]=4 1161 B12R2.18 Cn1nc2ccccc2c1N Amb24084319 [0,0,0,1,0,0|3,0,0]=4 1162 B12R2.18 Cn1nc2ccccc2c1S Amb33310612 [0,0,0,1,0,0|2,1,0]=4 1163 B12R2.18 Fc1sc2ccccc2c1Br Amb28323565 [0,0,0,1,0,0|3,0,0]=4 1164 B12R2.18 N=C1C(=O)Nc2ccccc21 Amb26318567 [0,0,0,1,0,0|3,0,0]=4 1165 B12R2.18 NC1=Nc2ccccc2S1=O Amb27875514 [0,0,0,1,0,0|3,0,0]=4 1166 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [0,0,0,1,0,0|1,0,2]=4 1167 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [0,0,0,1,0,0|1,0,2]=4 1168 B12R2.18 NN1Cc2ccccc2C1=O Amb28652918 [0,0,0,1,0,0|2,0,1]=4 1169 B12R2.18 Nc1c(Br)sc2ccccc12 Amb18135010 [0,0,0,1,0,0|3,0,0]=4 1170 B12R2.18 Nc1sc2ccccc2c1Br Amb18135037 [0,0,0,1,0,0|3,0,0]=4 1171 B12R2.18 Nc1sc2ccccc2c1N Amb27823311 [0,0,0,1,0,0|3,0,0]=4 1172 B12R2.18 O=C1C(=S)Nc2ccccc21 Amb17594053 [0,0,0,1,0,0|2,0,0]=3 1173 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,0,0,1,0,0|1,0,0]=2 1174 B12R2.18 O=C1C(Cl)=Nc2ccccc21 Amb17594117 [0,0,0,1,0,0|2,0,0]=3 1175 B12R2.18 O=C1Cc2ccccc2C1=O Amb2694764 [0,0,0,1,0,0|1,0,1]=3 1176 B12R2.18 O=C1N=C2C=CC=CN2C1=O Amb18528339 [0,0,0,1,0,0|3,0,0]=4 1177 B12R2.18 O=C1Nc2ccccc2C1=O Amb2721711 [0,0,0,1,0,0|2,0,0]=3 1178 B12R2.18 O=C1Nc2ccccc2C1=S Amb9803339 [0,0,0,1,0,0|2,1,0]=4 1179 B12R2.18 O=C1Nc2ncccc2C1=O Amb10976067 [0,0,0,1,0,0|3,0,0]=4 1180 B12R2.18 O=C1Oc2ccccc2C1=O Amb9783305 [0,0,0,1,0,0|2,0,0]=3 1181 B12R2.18 O=C1Sc2ccccc2C1=O Amb2608884 [0,0,0,1,0,0|2,0,0]=3 1182 B12R2.18 O=C1c2ccccc2CC1Br Amb2724122 [0,0,0,1,0,0|1,0,2]=4 1183 B12R2.18 O=C1c2ccccc2CC1Cl Amb4402396 [0,0,0,1,0,0|1,0,2]=4 1184 B12R2.18 O=C1c2ccccc2CC1F Amb17593723 [0,0,0,1,0,0|1,0,2]=4 1185 B12R2.18 O=C1c2ccccc2CC1O Amb25342077 [0,0,0,1,0,0|1,0,2]=4 1186 B12R2.18 Oc1sc2ccccc2c1O Amb27966224 [0,0,0,1,0,0|2,0,1]=4 1187 B12R2.24 BrC1=Cc2ccccc2CC1 Amb25726468 [0,0,0,1,0,0|2,0,1]=4 1188 B12R2.24 BrC1=Cc2ccccc2OC1 Amb27841536 [0,0,0,1,0,0|1,0,2]=4 1189 B12R2.24 Brc1cc2ccccc2cn1 Amb8438943 [0,0,0,1,0,0|3,0,0]=4 1190 B12R2.24 Brc1cc[n+]2ccccc2c1 Amb2613514 [0,0,0,1,0,0|3,0,0]=4 1191 B12R2.24 Brc1ccc2cccc[n+]2c1 Amb24392821 [0,0,0,1,0,0|3,0,0]=4 1192 B12R2.24 Brc1ccc2ccccc2c1 Amb1159157 [0,0,0,1,0,0|2,0,0]=3 1193 B12R2.24 Brc1ccc2ccccc2n1 Amb8397285 [0,0,0,1,0,0|3,0,0]=4 1194 B12R2.24 Brc1ccc2cccnc2c1 Amb8397712 [0,0,0,1,0,0|3,0,0]=4 1195 B12R2.24 Brc1ccc2ccncc2c1 Amb22276934 [0,0,0,1,0,0|3,0,0]=4 1196 B12R2.24 Brc1ccc2ccncc2c1 Amb7101503 [0,0,0,1,0,0|3,0,0]=4 1197 B12R2.24 Brc1ccc2cnccc2c1 Amb33140904 [0,0,0,1,0,0|3,0,0]=4 1198 B12R2.24 Brc1ccc2cnccc2c1 Amb7101488 [0,0,0,1,0,0|3,0,0]=4 1199 B12R2.24 Brc1ccc2ncccc2c1 Amb1033034 [0,0,0,1,0,0|3,0,0]=4 1200 B12R2.24 Brc1ccc2ncccc2c1 Amb19516224 [0,0,0,1,0,0|3,0,0]=4 1201 B12R2.24 Brc1cnc2ccccc2c1 Amb2722485 [0,0,0,1,0,0|2,0,0]=3 1202 B12R2.24 Brc1cnc2ccccc2n1 Amb33538649 [0,0,0,1,0,0|3,0,0]=4 1203 B12R2.24 Brc1cnc2cccnc2c1 Amb19958317 [0,0,0,1,0,0|3,0,0]=4 1204 B12R2.24 Brc1cnc2ccncc2c1 Amb18176152 [0,0,0,1,0,0|3,0,0]=4 1205 B12R2.24 Brc1cnc2cnccc2c1 Amb22500442 [0,0,0,1,0,0|3,0,0]=4 1206 B12R2.24 Brc1cnc2ncccc2c1 Amb2541644 [0,0,0,1,0,0|3,0,0]=4 1207 B12R2.24 CC1=Cc2ccccc2CC1 Amb31292543 [0,0,0,1,0,0|1,0,1]=3 1208 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [0,0,0,1,0,0|2,0,0]=3 1209 B12R2.24 CC1=Cc2ccccc2NC1 Amb18559652 [0,0,0,1,0,0|1,0,1]=3 1210 B12R2.24 CC1=Nc2ccccc2CN1 Amb6892861 [0,0,0,1,0,0|3,0,0]=4 1211 B12R2.24 CC1=Nc2ccccc2CO1 Amb27391671 [0,0,0,1,0,0|3,0,0]=4 1212 B12R2.24 CC1=Nc2ccccc2NC1 Amb27244163 [0,0,0,1,0,0|2,0,1]=4 1213 B12R2.24 CC1=Nc2ccccc2SC1 Amb10976510 [0,0,0,1,0,0|1,1,1]=4 1214 B12R2.24 CC1C=Cc2ccccc2N1 Amb17593644 [0,0,0,1,0,0|2,0,1]=4 1215 B12R2.24 C[n+]1ccc2ccccc2c1 Amb1147460 [0,0,0,1,0,0|2,0,0]=3 1216 B12R2.24 C[n+]1ccc2ccccc2c1 Amb2609709 [0,0,0,1,0,0|2,0,0]=3 1217 B12R2.24 C[n+]1ccc2ncccc2c1 Amb2610099 [0,0,0,1,0,0|3,0,0]=4 1218 B12R2.24 C[n+]1ccc2ncccc2c1 Amb32454864 [0,0,0,1,0,0|3,0,0]=4 1219 B12R2.24 Cc1cc2ccccc2cn1 Amb8395994 [0,0,0,1,0,0|2,0,0]=3 1220 B12R2.24 Cc1cc2ccncc2cn1 Amb28250070 [0,0,0,1,0,0|3,0,0]=4 1221 B12R2.24 Cc1ccc2c(c1)C=CCN2 Amb18062199 [0,0,0,1,0,0|2,0,1]=4 1222 B12R2.24 Cc1ccc2c(c1)C=CCO2 Amb23441455 [0,0,0,1,0,0|2,0,1]=4 1223 B12R2.24 Cc1ccc2c(c1)NCC=C2 Amb18062194 [0,0,0,1,0,0|2,0,1]=4 1224 B12R2.24 Cc1ccc2ccccc2c1 Amb6608830 [0,0,0,1,0,0|1,0,0]=2 1225 B12R2.24 Cc1ccc2ccccc2n1 Amb1151967 [0,0,0,1,0,0|2,0,0]=3 1226 B12R2.24 Cc1ccc2ccccc2n1 Amb33249592 [0,0,0,1,0,0|2,0,0]=3 1227 B12R2.24 Cc1ccc2cccnc2c1 Amb8397711 [0,0,0,1,0,0|2,0,0]=3 1228 B12R2.24 Cc1ccc2cccnc2n1 Amb2793429 [0,0,0,1,0,0|3,0,0]=4 1229 B12R2.24 Cc1ccc2ccncc2c1 Amb33544176 [0,0,0,1,0,0|2,0,0]=3 1230 B12R2.24 Cc1ccc2ccncc2n1 Amb25305156 [0,0,0,1,0,0|3,0,0]=4 1231 B12R2.24 Cc1ccc2cnccc2c1 Amb10071945 [0,0,0,1,0,0|2,0,0]=3 1232 B12R2.24 Cc1ccc2cnccc2n1 Amb23441223 [0,0,0,1,0,0|3,0,0]=4 1233 B12R2.24 Cc1ccc2ncccc2c1 Amb22235973 [0,0,0,1,0,0|2,0,0]=3 1234 B12R2.24 Cc1ccc2ncccc2c1 Amb6892169 [0,0,0,1,0,0|2,0,0]=3 1235 B12R2.24 Cc1ccc2ncccc2n1 Amb15692772 [0,0,0,1,0,0|3,0,0]=4 1236 B12R2.24 Cc1ccc2nccnc2c1 Amb2689687 [0,0,0,1,0,0|3,0,0]=4 1237 B12R2.24 Cc1cnc2ccccc2c1 Amb2447051 [0,0,0,1,0,0|1,0,0]=2 1238 B12R2.24 Cc1cnc2ccccc2n1 Amb4026338 [0,0,0,1,0,0|2,0,0]=3 1239 B12R2.24 Cc1cnc2cccnc2c1 Amb26979817 [0,0,0,1,0,0|2,0,0]=3 1240 B12R2.24 Cc1cnc2ncccc2c1 Amb26074359 [0,0,0,1,0,0|2,0,0]=3 1241 B12R2.24 Cc1nnc2ccccc2n1 Amb9824915 [0,0,0,1,0,0|3,0,0]=4 1242 B12R2.24 Clc1cc2ccccc2cn1 Amb10071462 [0,0,0,1,0,0|3,0,0]=4 1243 B12R2.24 Clc1ccc2ccccc2c1 Amb6365655 [0,0,0,1,0,0|2,0,0]=3 1244 B12R2.24 Clc1ccc2ccccc2n1 Amb2611299 [0,0,0,1,0,0|3,0,0]=4 1245 B12R2.24 Clc1ccc2cccnc2c1 Amb10069239 [0,0,0,1,0,0|3,0,0]=4 1246 B12R2.24 Clc1ccc2ccncc2c1 Amb32663641 [0,0,0,1,0,0|3,0,0]=4 1247 B12R2.24 Clc1ccc2ccncc2c1 Amb4007488 [0,0,0,1,0,0|3,0,0]=4 1248 B12R2.24 Clc1ccc2cnccc2c1 Amb10603859 [0,0,0,1,0,0|3,0,0]=4 1249 B12R2.24 Clc1ccc2ncccc2c1 Amb749944 [0,0,0,1,0,0|3,0,0]=4 1250 B12R2.24 Clc1cnc2ccccc2c1 Amb19515997 [0,0,0,1,0,0|2,0,0]=3 1251 B12R2.24 Clc1cnc2ccccc2n1 Amb2371875 [0,0,0,1,0,0|3,0,0]=4 1252 B12R2.24 Clc1cnc2ccncc2c1 Amb2609880 [0,0,0,1,0,0|3,0,0]=4 1253 B12R2.24 Clc1cnc2ncccc2c1 Amb21864631 [0,0,0,1,0,0|3,0,0]=4 1254 B12R2.24 FC1=Cc2ccccc2CC1 Amb26441264 [0,0,0,1,0,0|2,0,1]=4 1255 B12R2.24 Fc1ccc2ccccc2c1 Amb5544291 [0,0,0,1,0,0|2,0,0]=3 1256 B12R2.24 Fc1ccc2ccccc2n1 Amb20171185 [0,0,0,1,0,0|3,0,0]=4 1257 B12R2.24 Fc1ccc2cccnc2c1 Amb2622129 [0,0,0,1,0,0|3,0,0]=4 1258 B12R2.24 Fc1ccc2ccncc2c1 Amb19100617 [0,0,0,1,0,0|3,0,0]=4 1259 B12R2.24 Fc1ccc2cnccc2c1 Amb19958275 [0,0,0,1,0,0|3,0,0]=4 1260 B12R2.24 Fc1ccc2ncccc2c1 Amb22831215 [0,0,0,1,0,0|3,0,0]=4 1261 B12R2.24 Fc1ccc2ncccc2c1 Amb6892892 [0,0,0,1,0,0|3,0,0]=4 1262 B12R2.24 Fc1cnc2ccccc2c1 Amb22234447 [0,0,0,1,0,0|2,0,0]=3 1263 B12R2.24 Ic1cc2ccccc2cn1 Amb22170100 [0,0,0,1,0,0|3,0,0]=4 1264 B12R2.24 Ic1ccc2ccccc2c1 Amb4013025 [0,0,0,1,0,0|2,0,0]=3 1265 B12R2.24 Ic1ccc2ccccc2n1 Amb10604284 [0,0,0,1,0,0|3,0,0]=4 1266 B12R2.24 Ic1ccc2cccnc2c1 Amb21858708 [0,0,0,1,0,0|3,0,0]=4 1267 B12R2.24 Ic1ccc2ccncc2c1 Amb22170101 [0,0,0,1,0,0|3,0,0]=4 1268 B12R2.24 Ic1ccc2cnccc2c1 Amb10070847 [0,0,0,1,0,0|3,0,0]=4 1269 B12R2.24 Ic1ccc2ncccc2c1 Amb10066910 [0,0,0,1,0,0|3,0,0]=4 1270 B12R2.24 Ic1cnc2ccccc2c1 Amb19373724 [0,0,0,1,0,0|2,0,0]=3 1271 B12R2.24 Ic1cnc2ccccc2n1 Amb24084425 [0,0,0,1,0,0|3,0,0]=4 1272 B12R2.24 Ic1cnc2cccnc2c1 Amb13890060 [0,0,0,1,0,0|3,0,0]=4 1273 B12R2.24 N=C1C=c2ccccc2=NC1 Amb24061571 [0,0,0,1,0,0|2,0,1]=4 1274 B12R2.24 NC1=Cc2ccccc2NC1 Amb25079184 [0,0,0,1,0,0|2,0,1]=4 1275 B12R2.24 Nc1cc2ccccc2cn1 Amb2722858 [0,0,0,1,0,0|3,0,0]=4 1276 B12R2.24 Nc1cc2ccccc2nn1 Amb8438995 [0,0,0,1,0,0|3,0,0]=4 1277 B12R2.24 Nc1ccc2ccccc2c1 Amb22057457 [0,0,0,1,0,0|2,0,0]=3 1278 B12R2.24 Nc1ccc2ccccc2c1 Amb3940108 [0,0,0,1,0,0|2,0,0]=3 1279 B12R2.24 Nc1ccc2ccccc2n1 Amb1152993 [0,0,0,1,0,0|3,0,0]=4 1280 B12R2.24 Nc1ccc2cccnc2c1 Amb24183307 [0,0,0,1,0,0|3,0,0]=4 1281 B12R2.24 Nc1ccc2cccnc2c1 Amb31217512 [0,0,0,1,0,0|3,0,0]=4 1282 B12R2.24 Nc1ccc2cccnc2c1 Amb5717605 [0,0,0,1,0,0|3,0,0]=4 1283 B12R2.24 Nc1ccc2ccncc2c1 Amb33456346 [0,0,0,1,0,0|3,0,0]=4 1284 B12R2.24 Nc1ccc2ccncc2c1 Amb8011457 [0,0,0,1,0,0|3,0,0]=4 1285 B12R2.24 Nc1ccc2cnccc2c1 Amb33527576 [0,0,0,1,0,0|3,0,0]=4 1286 B12R2.24 Nc1ccc2cnccc2c1 Amb8010910 [0,0,0,1,0,0|3,0,0]=4 1287 B12R2.24 Nc1ccc2ncccc2c1 Amb2721017 [0,0,0,1,0,0|3,0,0]=4 1288 B12R2.24 Nc1ccc2ncccc2c1 Amb33536629 [0,0,0,1,0,0|3,0,0]=4 1289 B12R2.24 Nc1cnc2ccccc2c1 Amb534917 [0,0,0,1,0,0|2,0,0]=3 1290 B12R2.24 Nc1cnc2ccccc2n1 Amb4135072 [0,0,0,1,0,0|3,0,0]=4 1291 B12R2.24 Nc1cnc2cccnc2c1 Amb13881251 [0,0,0,1,0,0|3,0,0]=4 1292 B12R2.24 Nc1cnc2ccncc2c1 Amb18831471 [0,0,0,1,0,0|3,0,0]=4 1293 B12R2.24 Nc1cnc2cnccc2c1 Amb24060730 [0,0,0,1,0,0|3,0,0]=4 1294 B12R2.24 Nc1cnc2ncccc2c1 Amb8827554 [0,0,0,1,0,0|3,0,0]=4 1295 B12R2.24 O=C1C=C2C=CC=CC2=CN1 Amb19958596 [0,0,0,1,0,0|3,0,0]=4 1296 B12R2.24 O=C1C=C2C=CC=CC2=NN1 Amb21864850 [0,0,0,1,0,0|3,0,0]=4 1297 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [0,0,0,1,0,0|3,0,0]=4 1298 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [0,0,0,1,0,0|3,0,0]=4 1299 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [0,0,0,1,0,0|3,0,0]=4 1300 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb28991227 [0,0,0,1,0,0|3,0,0]=4 1301 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [0,0,0,1,0,0|3,0,0]=4 1302 B12R2.24 O=c1ccn2ccccc2c1 Amb2609671 [0,0,0,1,0,0|3,0,0]=4 1303 B12R2.24 O=n1ccc2ccccc2c1 Amb20247039 [0,0,0,1,0,0|3,0,0]=4 1304 B12R2.24 Oc1cc2ccccc2cn1 Amb10068513 [0,0,0,1,0,0|3,0,0]=4 1305 B12R2.24 Oc1cc[n+]2ccccc2c1 Amb24309279 [0,0,0,1,0,0|3,0,0]=4 1306 B12R2.24 Oc1ccc2ccccc2c1 Amb2609036 [0,0,0,1,0,0|2,0,0]=3 1307 B12R2.24 Oc1ccc2cccnc2c1 Amb33204453 [0,0,0,1,0,0|3,0,0]=4 1308 B12R2.24 Oc1ccc2cccnc2c1 Amb535010 [0,0,0,1,0,0|3,0,0]=4 1309 B12R2.24 Oc1ccc2ccncc2c1 Amb1152014 [0,0,0,1,0,0|3,0,0]=4 1310 B12R2.24 Oc1ccc2ccncc2c1 Amb19373209 [0,0,0,1,0,0|3,0,0]=4 1311 B12R2.24 Oc1ccc2cnccc2c1 Amb10067627 [0,0,0,1,0,0|3,0,0]=4 1312 B12R2.24 Oc1ccc2cnccc2c1 Amb30325887 [0,0,0,1,0,0|3,0,0]=4 1313 B12R2.24 Oc1ccc2ncccc2c1 Amb2609971 [0,0,0,1,0,0|3,0,0]=4 1314 B12R2.24 Oc1cnc2ccccc2c1 Amb2610757 [0,0,0,1,0,0|2,0,0]=3 1315 B12R2.24 Oc1cnc2ccccc2n1 Amb2603786 [0,0,0,1,0,0|3,0,0]=4 1316 B12R2.24 Oc1cnc2cccnc2c1 Amb13890072 [0,0,0,1,0,0|3,0,0]=4 1317 B12R2.24 Oc1cnc2ccncc2c1 Amb27265400 [0,0,0,1,0,0|3,0,0]=4 1318 B12R2.24 Oc1cnc2ncccc2c1 Amb26616876 [0,0,0,1,0,0|3,0,0]=4 1319 B12R2.24 Oc1cnc2ncccc2c1 Amb32653317 [0,0,0,1,0,0|3,0,0]=4 1320 B12R2.24 S=C1C=Cc2ccccc2N1 Amb18526983 [0,0,0,1,0,0|3,0,0]=4 1321 B12R2.24 S=C1C=Nc2ccccc2N1 Amb18043605 [0,0,0,1,0,0|3,0,0]=4 1322 B12R2.24 SC1=COc2ccccc2N1 Amb28204091 [0,0,0,1,0,0|2,0,1]=4 1323 B12R2.24 Sc1ccc2ccccc2c1 Amb1152959 [0,0,0,1,0,0|2,0,0]=3 1324 B12R2.24 Sc1ccc2ccccc2n1 Amb1151737 [0,0,0,1,0,0|3,0,0]=4 1325 B12R2.24 Sc1ccc2cccnc2c1 Amb25885524 [0,0,0,1,0,0|3,0,0]=4 1326 B12R2.24 Sc1ccc2ncccc2c1 Amb25076144 [0,0,0,1,0,0|3,0,0]=4 1327 B12R2.24 Sc1cnc2ccccc2c1 Amb23440777 [0,0,0,1,0,0|2,0,0]=3 1328 B12R2.24 Sc1cnc2ccccc2n1 Amb837074 [0,0,0,1,0,0|3,0,0]=4 1329 B12R2.24 [Mg+]c1ccc2ccccc2c1 Amb22044011 [0,0,0,1,0,0|2,0,0]=3 1330 B12R2.24 [O-][n+]1ccc2ccccc2c1 Amb2609972 [0,0,0,1,0,0|3,0,0]=4 1331 B12R2.27 C=CC1CC1c2ccccc2 Amb26889126 [0,0,0,1,0,0|1,0,2]=4 1332 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,0,0,1,0,0|0,0,2]=3 1333 B12R2.27 O=CC1CC1c2cccnc2 Amb27872437 [0,0,0,1,0,0|1,0,2]=4 1334 B12R2.27 O=CC1CC1c2ccncc2 Amb6572446 [0,0,0,1,0,0|1,0,2]=4 1335 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,0,0,1,0,0|1,0,1]=3 1336 B12R2.27 O=C[C@@H]1C[C@@H]1c2ccccc2 Amb26433208 [0,0,0,1,0,0|0,0,2]=3 1337 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,0,0,1,0,0|0,0,2]=3 1338 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [0,0,0,1,0,0|1,0,2]=4 1339 B12R2.27 O=C[C@H]1C[C@@H]1c2ccccc2 Amb27421992 [0,0,0,1,0,0|0,0,2]=3 1340 B12R2.27 O=C[C@H]1C[C@H]1c2ccccc2 Amb26548788 [0,0,0,1,0,0|0,0,2]=3 1341 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [0,0,0,1,0,0|1,0,2]=4 1342 B12R2.27 OCC1=C(c2ccccc2)N1 Amb28197190 [0,0,0,1,0,0|1,0,2]=4 1343 B12R2.32 BrCc1cc2ccccc2o1 Amb9175042 [0,0,0,1,0,0|2,0,1]=4 1344 B12R2.32 BrCc1cc2ccccc2s1 Amb25289923 [0,0,0,1,0,0|2,0,1]=4 1345 B12R2.32 C#Cc1cc2ccccc2s1 Amb25312447 [0,0,0,1,0,0|2,0,1]=4 1346 B12R2.32 C=CC1Cc2ccccc2C1 Amb33342617 [0,0,0,1,0,0|1,0,2]=4 1347 B12R2.32 C=CC1Cc2ccccc2N1 Amb28410346 [0,0,0,1,0,0|2,0,1]=4 1348 B12R2.32 C=Cc1cc2ccccc2s1 Amb28186077 [0,0,0,1,0,0|2,0,0]=3 1349 B12R2.32 C=Cc1cc2cccnc2s1 Amb28436507 [0,0,0,1,0,0|3,0,0]=4 1350 B12R2.32 C=Cc1nc2ccccc2o1 Amb24602813 [0,0,0,1,0,0|3,0,0]=4 1351 B12R2.32 C=Cc1nc2ccccc2s1 Amb24085073 [0,0,0,1,0,0|3,0,0]=4 1352 B12R2.32 CCC1=Cc2ccccc2C1 Amb6357923 [0,0,0,1,0,0|1,0,1]=3 1353 B12R2.32 CCc1cc2ccccc2o1 Amb6608886 [0,0,0,1,0,0|2,0,1]=4 1354 B12R2.32 CNc1cc2ccccc2s1 Amb27428924 [0,0,0,1,0,0|3,0,0]=4 1355 B12R2.32 COc1cc2ccccc2o1 Amb27962930 [0,0,0,1,0,0|3,0,0]=4 1356 B12R2.32 ClC=C1Cc2ccccc2C1 Amb8394322 [0,0,0,1,0,0|1,0,1]=3 1357 B12R2.32 ClCc1cc2ccccc2o1 Amb9004317 [0,0,0,1,0,0|2,0,1]=4 1358 B12R2.32 ClCc1cc2ccccc2s1 Amb16187137 [0,0,0,1,0,0|2,0,1]=4 1359 B12R2.32 N#CC1=Cc2ccccc2C1 Amb18643732 [0,0,0,1,0,0|1,0,1]=3 1360 B12R2.32 N#Cc1cc2ccccc2o1 Amb2704399 [0,0,0,1,0,0|2,0,1]=4 1361 B12R2.32 N#Cc1cc2ccccc2s1 Amb8396883 [0,0,0,1,0,0|2,0,1]=4 1362 B12R2.32 NCc1cc2ccccc2o1 Amb6271209 [0,0,0,1,0,0|2,0,1]=4 1363 B12R2.32 NCc1cc2ccccc2o1 Amb9176345 [0,0,0,1,0,0|2,0,1]=4 1364 B12R2.32 NCc1cc2ccccc2s1 Amb1801549 [0,0,0,1,0,0|2,0,1]=4 1365 B12R2.32 NCc1cc2ccccc2s1 Amb6344855 [0,0,0,1,0,0|2,0,1]=4 1366 B12R2.32 O=CC1=CC2C=CC=CC2=C1 Amb28145758 [0,0,0,1,0,0|0,0,2]=3 1367 B12R2.32 O=CC1=Cc2ccccc2C1 Amb18644150 [0,0,0,1,0,0|0,0,0]=1 1368 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [0,0,0,1,0,0|0,0,2]=3 1369 B12R2.32 O=CC1Cc2ccccc2N1 Amb27232668 [0,0,0,1,0,0|1,0,1]=3 1370 B12R2.32 O=CC1Oc2ccccc2O1 Amb27409489 [0,0,0,1,0,0|2,0,1]=4 1371 B12R2.32 O=CN1Cc2ccccc2C1 Amb26325036 [0,0,0,1,0,0|1,0,1]=3 1372 B12R2.32 O=Cc1cc2ccccc2o1 Amb1156936 [0,0,0,1,0,0|1,0,0]=2 1373 B12R2.32 O=Cc1cc2ccccc2s1 Amb2447439 [0,0,0,1,0,0|1,0,0]=2 1374 B12R2.32 O=Cc1cc2ccccn2c1 Amb26954646 [0,0,0,1,0,0|1,0,1]=3 1375 B12R2.32 O=Cc1cc2ccccn2n1 Amb10067626 [0,0,0,1,0,0|2,0,0]=3 1376 B12R2.32 O=Cc1cc2cccnc2o1 Amb18202346 [0,0,0,1,0,0|2,0,0]=3 1377 B12R2.32 O=Cc1cc2cccnc2s1 Amb2723081 [0,0,0,1,0,0|2,0,0]=3 1378 B12R2.32 O=Cc1cc2cccnn2c1 Amb27263695 [0,0,0,1,0,0|2,0,1]=4 1379 B12R2.32 O=Cc1cc2ccncc2s1 Amb13890511 [0,0,0,1,0,0|2,0,0]=3 1380 B12R2.32 O=Cc1cc2cnccc2o1 Amb18124811 [0,0,0,1,0,0|2,0,0]=3 1381 B12R2.32 O=Cc1cc2cnccc2s1 Amb18139393 [0,0,0,1,0,0|2,0,0]=3 1382 B12R2.32 O=Cc1cc2cnccn2c1 Amb18202369 [0,0,0,1,0,0|2,0,1]=4 1383 B12R2.32 O=Cc1cc2cncnc2s1 Amb18828876 [0,0,0,1,0,0|3,0,0]=4 1384 B12R2.32 O=Cc1cc2cnncc2o1 Amb18831405 [0,0,0,1,0,0|3,0,0]=4 1385 B12R2.32 O=Cc1cc2cnncc2s1 Amb18828877 [0,0,0,1,0,0|3,0,0]=4 1386 B12R2.32 O=Cc1cc2ncccc2o1 Amb18124810 [0,0,0,1,0,0|2,0,0]=3 1387 B12R2.32 O=Cc1cc2ncccc2s1 Amb18126370 [0,0,0,1,0,0|2,0,0]=3 1388 B12R2.32 O=Cc1cc2nccnc2o1 Amb18831410 [0,0,0,1,0,0|3,0,0]=4 1389 B12R2.32 O=Cc1cc2nccnc2s1 Amb2723506 [0,0,0,1,0,0|3,0,0]=4 1390 B12R2.32 O=Cc1cc2ncncc2o1 Amb18831403 [0,0,0,1,0,0|3,0,0]=4 1391 B12R2.32 O=Cc1cc2ncncc2s1 Amb18828881 [0,0,0,1,0,0|3,0,0]=4 1392 B12R2.32 O=Cc1cn2ccccc2n1 Amb2723503 [0,0,0,1,0,0|2,0,0]=3 1393 B12R2.32 O=Cc1cn2cccnc2n1 Amb8010289 [0,0,0,1,0,0|3,0,0]=4 1394 B12R2.32 O=Cc1cn2ccncc2n1 Amb8010290 [0,0,0,1,0,0|3,0,0]=4 1395 B12R2.32 O=Cc1cn2ncccc2n1 Amb18831428 [0,0,0,1,0,0|3,0,0]=4 1396 B12R2.32 O=Cc1nc2ccccc2o1 Amb2820047 [0,0,0,1,0,0|2,0,0]=3 1397 B12R2.32 O=Cc1nc2ccccc2s1 Amb2723094 [0,0,0,1,0,0|2,0,0]=3 1398 B12R2.32 O=Cc1nc2ccccn2n1 Amb22500855 [0,0,0,1,0,0|3,0,0]=4 1399 B12R2.32 O=Cc1nc2cccnc2o1 Amb18831406 [0,0,0,1,0,0|3,0,0]=4 1400 B12R2.32 O=Cc1nc2cccnc2s1 Amb18828883 [0,0,0,1,0,0|3,0,0]=4 1401 B12R2.32 O=Cc1nc2ccncc2o1 Amb18831409 [0,0,0,1,0,0|3,0,0]=4 1402 B12R2.32 O=Cc1nc2cnccc2s1 Amb18828882 [0,0,0,1,0,0|3,0,0]=4 1403 B12R2.32 O=Cc1nc2ncccc2s1 Amb18199777 [0,0,0,1,0,0|3,0,0]=4 1404 B12R2.32 OC=C1C=C2C=CC=CC2=C1 Amb27947827 [0,0,0,1,0,0|0,0,2]=3 1405 B12R2.32 OCc1cc2ccccc2o1 Amb1156663 [0,0,0,1,0,0|1,0,2]=4 1406 B12R2.32 OCc1cc2ccccc2s1 Amb2688765 [0,0,0,1,0,0|1,0,2]=4 1407 B12R2.32 ON=C1Cc2ccccc2C1 Amb5718677 [0,0,0,1,0,0|1,0,2]=4 1408 B12R2.32 ONC1=Nc2ccccc2C1 Amb27202201 [0,0,0,1,0,0|2,0,1]=4 1409 B12R2.32 O\C=C1\C=C2C=CC=CC2=N1 Amb26342374 [0,0,0,1,0,0|1,0,1]=3 1410 B12R2.32 SCc1cc2ccccc2o1 Amb32788142 [0,0,0,1,0,0|1,1,1]=4 1411 B12R2.32 SCc1cc2ccccc2s1 Amb26004107 [0,0,0,1,0,0|1,1,1]=4 1412 B12R2.37 CC1=C(c2ccccc2)N1C Amb27602376 [0,0,0,1,0,0|2,0,0]=3 1413 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [0,0,0,1,0,0|0,0,2]=3 1414 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,0,0,1,0,0|0,0,0]=1 1415 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,0,0,1,0,0|1,0,0]=2 1416 B12R2.2051 C=CC1(C)Cc2ccccc21 Amb17778871 [0,0,0,1,0,0|1,0,2]=4 1417 B12R2.2058 C(=C1CNC1)c2cccnc2 Amb33100012 [0,0,0,1,0,0|2,0,1]=4 1418 B10R1.15 Br\C=C(\Br)c1ccccc1 Amb8394126 [0,0,0,0,1,0|2,0,0]=3 1419 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,0,0,1,0|2,0,1]=4 1420 B10R1.15 C#CC(C)c1ccccc1 Amb24106607 [0,0,0,0,1,0|1,0,2]=4 1421 B10R1.15 C=C(C#N)c1ccccc1 Amb17231856 [0,0,0,0,1,0|1,0,2]=4 1422 B10R1.15 C=C(C=O)c1ccccc1 Amb16233227 [0,0,0,0,1,0|0,0,1]=2 1423 B10R1.15 C=C(CBr)c1ccccc1 Amb8391739 [0,0,0,0,1,0|1,0,2]=4 1424 B10R1.15 C=C(CCl)c1ccccc1 Amb26968652 [0,0,0,0,1,0|1,0,2]=4 1425 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [0,0,0,0,1,0|1,0,2]=4 1426 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [0,0,0,0,1,0|1,0,2]=4 1427 B10R1.15 C=C(CO)c1ccccc1 Amb27839071 [0,0,0,0,1,0|0,0,3]=4 1428 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [0,0,0,0,1,0|2,0,1]=4 1429 B10R1.15 C=CC(=C)c1ccccc1 Amb26348162 [0,0,0,0,1,0|1,0,1]=3 1430 B10R1.15 C=CC(=C)c1cccnc1 Amb27591416 [0,0,0,0,1,0|2,0,1]=4 1431 B10R1.15 C=CC(=O)c1ccccc1 Amb33542643 [0,0,0,0,1,0|2,0,0]=3 1432 B10R1.15 C=CC(=O)c1ccccn1 Amb28399382 [0,0,0,0,1,0|3,0,0]=4 1433 B10R1.15 C=CC(=O)c1cccnc1 Amb25776729 [0,0,0,0,1,0|3,0,0]=4 1434 B10R1.15 C=CC(=O)c1ccncc1 Amb24482055 [0,0,0,0,1,0|3,0,0]=4 1435 B10R1.15 C=CC(C)c1ccccc1 Amb26460576 [0,0,0,0,1,0|1,0,1]=3 1436 B10R1.15 C=CC(C)c1ccccn1 Amb27838866 [0,0,0,0,1,0|2,0,1]=4 1437 B10R1.15 C=CC(Cl)c1ccccc1 Amb17943120 [0,0,0,0,1,0|2,0,1]=4 1438 B10R1.15 C=CC(Cl)c1ccccc1 Amb33963194 [0,0,0,0,1,0|2,0,1]=4 1439 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [0,0,0,0,1,0|2,0,1]=4 1440 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [0,0,0,0,1,0|2,0,1]=4 1441 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [0,0,0,0,1,0|2,0,1]=4 1442 B10R1.15 C=CN(C)c1ccccc1 Amb27878913 [0,0,0,0,1,0|2,0,0]=3 1443 B10R1.15 C=CN(C)c1ccncc1 Amb26031722 [0,0,0,0,1,0|3,0,0]=4 1444 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [0,0,0,0,1,0|3,0,0]=4 1445 B10R1.15 C=C[C@@H](N)c1ccccc1 Amb27391592 [0,0,0,0,1,0|2,0,1]=4 1446 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [0,0,0,0,1,0|2,0,1]=4 1447 B10R1.15 C=C[SiH](C)c1ccccc1 Amb8515879 [0,0,0,0,1,0|1,1,0]=3 1448 B10R1.15 CC(C#N)c1ccccc1 Amb2387010 [0,0,0,0,1,0|1,0,2]=4 1449 B10R1.15 CC(C=O)c1ccccc1 Amb2720746 [0,0,0,0,1,0|0,0,1]=2 1450 B10R1.15 CC(C=O)c1ccccn1 Amb29762718 [0,0,0,0,1,0|1,0,1]=3 1451 B10R1.15 CC(C=O)c1cccnc1 Amb24100578 [0,0,0,0,1,0|1,0,1]=3 1452 B10R1.15 CC(C=O)c1ccncc1 Amb33358501 [0,0,0,0,1,0|1,0,1]=3 1453 B10R1.15 CC(C=O)c1ccncn1 Amb33268588 [0,0,0,0,1,0|2,0,1]=4 1454 B10R1.15 CC(C=O)c1cnccn1 Amb33080013 [0,0,0,0,1,0|2,0,1]=4 1455 B10R1.15 CC(C=O)c1cncnc1 Amb33149106 [0,0,0,0,1,0|2,0,1]=4 1456 B10R1.15 CC(C=O)c1ncccn1 Amb26040541 [0,0,0,0,1,0|2,0,1]=4 1457 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [0,0,0,0,1,0|1,0,2]=4 1458 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [0,0,0,0,1,0|1,0,2]=4 1459 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [0,0,0,0,1,0|1,0,2]=4 1460 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [0,0,0,0,1,0|1,0,2]=4 1461 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [0,0,0,0,1,0|1,0,2]=4 1462 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [0,0,0,0,1,0|0,0,3]=4 1463 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [0,0,0,0,1,0|0,1,2]=4 1464 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [0,0,0,0,1,0|2,0,1]=4 1465 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [0,0,0,0,1,0|2,0,1]=4 1466 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [0,0,0,0,1,0|2,0,1]=4 1467 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [0,0,0,0,1,0|1,0,2]=4 1468 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [0,0,0,0,1,0|2,0,1]=4 1469 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,0,0,0,1,0|2,0,1]=4 1470 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [0,0,0,0,1,0|2,0,1]=4 1471 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [0,0,0,0,1,0|1,0,2]=4 1472 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [0,0,0,0,1,0|1,0,2]=4 1473 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [0,0,0,0,1,0|2,0,1]=4 1474 B10R1.15 CN(C=O)c1ccccc1 Amb7969686 [0,0,0,0,1,0|1,0,0]=2 1475 B10R1.15 CN(C=O)c1ccccn1 Amb8396240 [0,0,0,0,1,0|2,0,0]=3 1476 B10R1.15 CN(C=O)c1cccnc1 Amb27262216 [0,0,0,0,1,0|2,0,0]=3 1477 B10R1.15 CN(N=O)c1ccccc1 Amb6308537 [0,0,0,0,1,0|2,0,0]=3 1478 B10R1.15 CN(N=O)c1cccnc1 Amb25254491 [0,0,0,0,1,0|3,0,0]=4 1479 B10R1.15 CN(N=O)c1ccncc1 Amb25736812 [0,0,0,0,1,0|3,0,0]=4 1480 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,0,0,1,0|3,0,0]=4 1481 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [0,0,0,0,1,0|3,0,0]=4 1482 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [0,0,0,0,1,0|3,0,0]=4 1483 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,0,0,1,0|3,0,0]=4 1484 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [0,0,0,0,1,0|2,0,1]=4 1485 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [0,0,0,0,1,0|2,0,1]=4 1486 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [0,0,0,0,1,0|3,0,0]=4 1487 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,0,0,0,1,0|2,0,1]=4 1488 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [0,0,0,0,1,0|2,0,1]=4 1489 B10R1.15 COC(=N)c1ccccc1 Amb4009954 [0,0,0,0,1,0|3,0,0]=4 1490 B10R1.15 COC(=N)c1ccccc1 Amb6366188 [0,0,0,0,1,0|3,0,0]=4 1491 B10R1.15 COC(=O)c1ccccc1 Amb4302710 [0,0,0,0,1,0|3,0,0]=4 1492 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,0,0,1,0|3,0,0]=4 1493 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,0,0,0,1,0|2,0,1]=4 1494 B10R1.15 CP(CO)c1ccccc1 Amb27410449 [0,0,0,0,1,0|1,0,2]=4 1495 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,0,0,1,0|3,0,0]=4 1496 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,0,0,1,0|3,0,0]=4 1497 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [0,0,0,0,1,0|0,0,1]=2 1498 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [0,0,0,0,1,0|1,0,2]=4 1499 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [0,0,0,0,1,0|1,0,2]=4 1500 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [0,0,0,0,1,0|0,0,3]=4 1501 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [0,0,0,0,1,0|2,0,1]=4 1502 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [0,0,0,0,1,0|1,0,2]=4 1503 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [0,0,0,0,1,0|1,0,2]=4 1504 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,0,0,0,1,0|2,0,1]=4 1505 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [0,0,0,0,1,0|2,0,1]=4 1506 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [0,0,0,0,1,0|0,0,1]=2 1507 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [0,0,0,0,1,0|1,0,2]=4 1508 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [0,0,0,0,1,0|0,0,3]=4 1509 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [0,0,0,0,1,0|2,0,1]=4 1510 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [0,0,0,0,1,0|2,0,1]=4 1511 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [0,0,0,0,1,0|2,0,1]=4 1512 B10R1.15 C\C(=C/Br)c1ccccc1 Amb25066105 [0,0,0,0,1,0|1,0,0]=2 1513 B10R1.15 C\C(=C/Cl)c1ccccc1 Amb30621745 [0,0,0,0,1,0|1,0,0]=2 1514 B10R1.15 C\C(=C\Br)c1ccccc1 Amb4035454 [0,0,0,0,1,0|1,0,0]=2 1515 B10R1.15 C\C(=C\Br)c1ccccn1 Amb25248819 [0,0,0,0,1,0|2,0,0]=3 1516 B10R1.15 C\C(=C\Br)c1cccnc1 Amb27471976 [0,0,0,0,1,0|2,0,0]=3 1517 B10R1.15 C\C(=C\Br)c1ccncn1 Amb28245272 [0,0,0,0,1,0|3,0,0]=4 1518 B10R1.15 C\C(=C\Cl)c1ccccc1 Amb26652006 [0,0,0,0,1,0|1,0,0]=2 1519 B10R1.15 C\C(=N/N)c1ccccc1 Amb4016930 [0,0,0,0,1,0|2,0,0]=3 1520 B10R1.15 C\C(=N/N)c1ccccn1 Amb22552431 [0,0,0,0,1,0|3,0,0]=4 1521 B10R1.15 C\C(=N/O)c1ccccc1 Amb2387477 [0,0,0,0,1,0|1,0,1]=3 1522 B10R1.15 C\C(=N/O)c1ccccn1 Amb2780070 [0,0,0,0,1,0|2,0,1]=4 1523 B10R1.15 C\C(=N/O)c1cccnc1 Amb598353 [0,0,0,0,1,0|2,0,1]=4 1524 B10R1.15 C\C(=N/O)c1ccncc1 Amb6336368 [0,0,0,0,1,0|2,0,1]=4 1525 B10R1.15 C\C(=N\O)c1ccccc1 Amb3428046 [0,0,0,0,1,0|1,0,1]=3 1526 B10R1.15 C\C(=N\O)c1ccccn1 Amb598336 [0,0,0,0,1,0|2,0,1]=4 1527 B10R1.15 C\C(=N\O)c1cccnc1 Amb10606945 [0,0,0,0,1,0|2,0,1]=4 1528 B10R1.15 C\C(=N\O)c1ccncc1 Amb2780071 [0,0,0,0,1,0|2,0,1]=4 1529 B10R1.15 C\C(C=O)=C1/C=CCCC1 Amb25366614 [0,0,0,0,1,0|0,0,3]=4 1530 B10R1.15 C\C=C(/C)c1ccccc1 Amb29628341 [0,0,0,0,1,0|1,0,0]=2 1531 B10R1.15 C\C=C(/C)c1ccncc1 Amb24103190 [0,0,0,0,1,0|2,0,0]=3 1532 B10R1.15 C\C=C(/F)c1ccccc1 Amb25881627 [0,0,0,0,1,0|2,0,0]=3 1533 B10R1.15 C\C=C(/N)c1ccccc1 Amb27787637 [0,0,0,0,1,0|2,0,0]=3 1534 B10R1.15 C\C=C(\C)c1ccccc1 Amb26360165 [0,0,0,0,1,0|1,0,0]=2 1535 B10R1.15 C\C=C(\C)c1cccnc1 Amb27260271 [0,0,0,0,1,0|2,0,0]=3 1536 B10R1.15 C\N=C(\C)c1ccccn1 Amb24433259 [0,0,0,0,1,0|3,0,0]=4 1537 B10R1.15 Cl\C=C(\Cl)c1ccccc1 Amb25849275 [0,0,0,0,1,0|2,0,0]=3 1538 B10R1.15 N#CC(=O)c1ccccc1 Amb6893027 [0,0,0,0,1,0|2,0,1]=4 1539 B10R1.15 N=C(NN)c1ccccc1 Amb22234855 [0,0,0,0,1,0|3,0,0]=4 1540 B10R1.15 N=CC(=O)c1ccccc1 Amb27783553 [0,0,0,0,1,0|2,0,0]=3 1541 B10R1.15 NC(=S=O)c1ccccn1 Amb28291302 [0,0,0,0,1,0|3,0,0]=4 1542 B10R1.15 NC(=S=O)c1cccnc1 Amb27791856 [0,0,0,0,1,0|3,0,0]=4 1543 B10R1.15 NC(=S=O)c1ccncc1 Amb28137969 [0,0,0,0,1,0|3,0,0]=4 1544 B10R1.15 NC(C=O)c1ccccc1 Amb27490826 [0,0,0,0,1,0|1,0,1]=3 1545 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,0,0,1,0|2,0,1]=4 1546 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [0,0,0,0,1,0|2,0,1]=4 1547 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,0,0,1,0|3,0,0]=4 1548 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,0,0,1,0|3,0,0]=4 1549 B10R1.15 N\C(=N/O)c1ccccc1 Amb1149046 [0,0,0,0,1,0|2,0,1]=4 1550 B10R1.15 N\C(=N/O)c1ccccc1 Amb6298734 [0,0,0,0,1,0|2,0,1]=4 1551 B10R1.15 N\C(=N\O)c1ccccc1 Amb2226909 [0,0,0,0,1,0|2,0,1]=4 1552 B10R1.15 N\N=C(/Cl)c1ccccc1 Amb27951117 [0,0,0,0,1,0|3,0,0]=4 1553 B10R1.15 N\N=C(/N)c1ccccc1 Amb20407822 [0,0,0,0,1,0|3,0,0]=4 1554 B10R1.15 N\N=C(\Cl)c1ccccc1 Amb27210015 [0,0,0,0,1,0|3,0,0]=4 1555 B10R1.15 O=C(CBr)c1ccccc1 Amb33533065 [0,0,0,0,1,0|2,0,1]=4 1556 B10R1.15 O=C(CCl)c1ccccc1 Amb3940253 [0,0,0,0,1,0|2,0,1]=4 1557 B10R1.15 O=C(CF)c1ccccc1 Amb10603600 [0,0,0,0,1,0|2,0,1]=4 1558 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,0,0,1,0|2,0,1]=4 1559 B10R1.15 O=C(CO)c1ccccc1 Amb3940718 [0,0,0,0,1,0|1,0,2]=4 1560 B10R1.15 O=C(CS)c1ccccc1 Amb16192503 [0,0,0,0,1,0|1,1,1]=4 1561 B10R1.15 O=C(NI)c1ccccc1 Amb27787732 [0,0,0,0,1,0|3,0,0]=4 1562 B10R1.15 O=C(NO)c1ccccc1 Amb1645521 [0,0,0,0,1,0|2,0,1]=4 1563 B10R1.15 O=C(N[O-])c1ccccc1 Amb18800075 [0,0,0,0,1,0|2,0,1]=4 1564 B10R1.15 O=C(N[O-])c1ccccc1 Amb4035742 [0,0,0,0,1,0|2,0,1]=4 1565 B10R1.15 O=CC(=O)c1ccccc1 Amb4338217 [0,0,0,0,1,0|1,0,0]=2 1566 B10R1.15 O=CC(=O)c1ccccc1 Amb8513585 [0,0,0,0,1,0|1,0,0]=2 1567 B10R1.15 O=CC(=O)c1ccccn1 Amb25066902 [0,0,0,0,1,0|2,0,0]=3 1568 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [0,0,0,0,1,0|1,0,1]=3 1569 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [0,0,0,0,1,0|1,0,1]=3 1570 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [0,0,0,0,1,0|1,0,1]=3 1571 B10R1.15 O=CC(O)c1ccccn1 Amb28321322 [0,0,0,0,1,0|2,0,1]=4 1572 B10R1.15 O=C[C@H](F)c1ccccc1 Amb27863823 [0,0,0,0,1,0|1,0,1]=3 1573 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [0,0,0,0,1,0|1,0,1]=3 1574 B10R1.15 O=NN(O)c1ccccc1 Amb17666641 [0,0,0,0,1,0|3,0,0]=4 1575 B10R1.15 O=NN([O-])c1ccccc1 Amb34915564 [0,0,0,0,1,0|3,0,0]=4 1576 B10R1.15 O=NN([O-])c1ccccc1 Amb8514053 [0,0,0,0,1,0|3,0,0]=4 1577 B10R1.15 O\N=C(/Cl)c1ccccc1 Amb32411906 [0,0,0,0,1,0|2,0,1]=4 1578 B10R1.15 O\N=C(\Cl)c1ccccc1 Amb2684308 [0,0,0,0,1,0|2,0,1]=4 1579 B10R1.15 O\N=C(\O)c1ccccc1 Amb17843421 [0,0,0,0,1,0|2,0,1]=4 1580 B10R1.15 S=C(CBr)c1ccccc1 Amb27755078 [0,0,0,0,1,0|2,0,1]=4 1581 B10R1.15 [C-]#[N+]C(C)c1ccccc1 Amb2688979 [0,0,0,0,1,0|2,0,1]=4 1582 B10R1.15 [C-]#[N+][C@@H](C)c1ccccc1 Amb2684311 [0,0,0,0,1,0|2,0,1]=4 1583 B10R1.15 [C-]#[N+][C@H](C)c1ccccc1 Amb2684310 [0,0,0,0,1,0|2,0,1]=4 1584 B10R1.15 [NH3+]CC(=O)c1ccccc1 Amb9787668 [0,0,0,0,1,0|2,0,1]=4 1585 B10R1.27 C#C\C(C)=C\c1ccco1 Amb33311315 [0,0,0,0,1,0|2,0,1]=4 1586 B10R1.27 C=C\C(C)=C/c1ccco1 Amb27440408 [0,0,0,0,1,0|2,0,0]=3 1587 B10R1.27 C=C\C(C)=C\c1ccco1 Amb33359794 [0,0,0,0,1,0|2,0,0]=3 1588 B10R1.27 CC(C=O)Sc1cccs1 Amb30034330 [0,0,0,0,1,0|2,0,1]=4 1589 B10R1.27 CN(C=O)Cc1cccs1 Amb27667566 [0,0,0,0,1,0|2,0,1]=4 1590 B10R1.27 C[C@H](C=O)Cc1ccco1 Amb27861368 [0,0,0,0,1,0|1,0,2]=4 1591 B10R1.27 C\C(=C/c1ccco1)CBr Amb33136397 [0,0,0,0,1,0|2,0,1]=4 1592 B10R1.27 C\C(=C/c1ccco1)CCl Amb33136399 [0,0,0,0,1,0|2,0,1]=4 1593 B10R1.27 C\C(=C/c1ccco1)CN Amb33136395 [0,0,0,0,1,0|2,0,1]=4 1594 B10R1.27 C\C(=C/c1ccco1)CO Amb27185698 [0,0,0,0,1,0|1,0,2]=4 1595 B10R1.27 C\C(=C/c1ccco1)CS Amb33197995 [0,0,0,0,1,0|1,1,1]=4 1596 B10R1.27 C\C(=C\Cl)Cn1cccc1 Amb27272637 [0,0,0,0,1,0|2,0,1]=4 1597 B10R1.27 C\C(=C\c1ccco1)CO Amb28240574 [0,0,0,0,1,0|1,0,2]=4 1598 B10R1.27 C\C(=C\c1cccs1)CBr Amb27262831 [0,0,0,0,1,0|2,0,1]=4 1599 B10R1.27 C\C(=C\c1cccs1)CCl Amb27591691 [0,0,0,0,1,0|2,0,1]=4 1600 B10R1.27 C\C(=C\c1ccoc1)CN Amb27615082 [0,0,0,0,1,0|2,0,1]=4 1601 B10R1.27 C\C(C#N)=C/c1ccco1 Amb18642923 [0,0,0,0,1,0|2,0,1]=4 1602 B10R1.27 C\C(C#N)=C\c1ccco1 Amb27444803 [0,0,0,0,1,0|2,0,1]=4 1603 B10R1.27 C\C(C=O)=C/c1ccco1 Amb3599297 [0,0,0,0,1,0|1,0,0]=2 1604 B10R1.27 C\C(C=O)=C/c1cccs1 Amb17334333 [0,0,0,0,1,0|1,0,0]=2 1605 B10R1.27 C\C(C=O)=C/c1ccns1 Amb35719812 [0,0,0,0,1,0|2,0,0]=3 1606 B10R1.27 C\C(C=O)=C/c1ccsc1 Amb18644530 [0,0,0,0,1,0|1,0,0]=2 1607 B10R1.27 C\C(C=O)=C/c1cncs1 Amb27405461 [0,0,0,0,1,0|2,0,0]=3 1608 B10R1.27 C\C(C=O)=C\c1ccco1 Amb2792767 [0,0,0,0,1,0|1,0,0]=2 1609 B10R1.27 C\C(C=O)=C\c1ccoc1 Amb28050918 [0,0,0,0,1,0|1,0,0]=2 1610 B10R1.27 C\C(C=O)=C\c1ccsc1 Amb27402244 [0,0,0,0,1,0|1,0,0]=2 1611 B10R1.27 C\C(C=O)=C\c1nccs1 Amb27172890 [0,0,0,0,1,0|2,0,0]=3 1612 B10R1.27 O=CC(=O)Cc1ccco1 Amb27180510 [0,0,0,0,1,0|2,0,1]=4 1613 B10R1.27 O=C\C(Cl)=C/c1cccs1 Amb27227152 [0,0,0,0,1,0|2,0,0]=3 1614 B10R1.27 O=C\C(Cl)=C\c1ccco1 Amb27166107 [0,0,0,0,1,0|2,0,0]=3 1615 B10R1.27 O=C\C(F)=C\c1cccs1 Amb27770449 [0,0,0,0,1,0|2,0,0]=3 1616 B12R1.27 C#CC(C)\C=C\c1ccccc1 Amb33080777 [0,0,0,0,0,1|1,0,2]=4 1617 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [0,0,0,0,0,1|1,0,2]=4 1618 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [0,0,0,0,0,1|1,0,2]=4 1619 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [0,0,0,0,0,1|1,0,2]=4 1620 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,0,0,0,0,1|2,0,1]=4 1621 B12R1.27 C=CC(=O)CNc1ccccc1 Amb27840511 [0,0,0,0,0,1|2,0,1]=4 1622 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,0,0,0,0,1|2,0,1]=4 1623 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,0,0,0,0,1|2,0,1]=4 1624 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [0,0,0,0,0,1|2,0,0]=3 1625 B12R1.27 C=CC(O)\C=C\c1ccccc1 Amb27478521 [0,0,0,0,0,1|2,0,1]=4 1626 B12R1.27 C=C[C@@H](C)NCc1ccccc1 Amb27616678 [0,0,0,0,0,1|1,0,2]=4 1627 B12R1.27 CC(=N\O)\N=N\c1ccccc1 Amb27487777 [0,0,0,0,0,1|2,0,1]=4 1628 B12R1.27 CC(C#N)\C=C\c1ccccc1 Amb33081313 [0,0,0,0,0,1|1,0,2]=4 1629 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [0,0,0,0,0,1|0,0,2]=3 1630 B12R1.27 CC(C=O)CSc1ccccc1 Amb17594629 [0,0,0,0,0,1|0,0,2]=3 1631 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,0,0,0,0,1|0,0,2]=3 1632 B12R1.27 CC(C=O)SCc1ccccc1 Amb18648419 [0,0,0,0,0,1|0,0,2]=3 1633 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb33081219 [0,0,0,0,0,1|0,0,1]=2 1634 B12R1.27 CC(\C=C\c1ccccc1)=N/O Amb24101081 [0,0,0,0,0,1|1,0,1]=3 1635 B12R1.27 CC(\C=C\c1ccccc1)=N\O Amb27204245 [0,0,0,0,0,1|1,0,1]=3 1636 B12R1.27 CC(\C=C\c1ccccc1)CBr Amb33080770 [0,0,0,0,0,1|1,0,2]=4 1637 B12R1.27 CC(\C=C\c1ccccc1)CN Amb33081132 [0,0,0,0,0,1|1,0,2]=4 1638 B12R1.27 CC(\C=C\c1ccccc1)ON Amb33080788 [0,0,0,0,0,1|2,0,1]=4 1639 B12R1.27 CC(\C=N\c1ccccc1)CO Amb20248421 [0,0,0,0,0,1|0,0,3]=4 1640 B12R1.27 CC(\N=N\c1ccccc1)=N/O Amb22731704 [0,0,0,0,0,1|2,0,1]=4 1641 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,0,0,0,0,1|2,0,1]=4 1642 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [0,0,0,0,0,1|3,0,0]=4 1643 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [0,0,0,0,0,1|3,0,0]=4 1644 B12R1.27 C[C@@H](C=O)OCc1ccccc1 Amb17609288 [0,0,0,0,0,1|0,0,2]=3 1645 B12R1.27 C[C@@H](CO)\N=C\c1ccccc1 Amb28190372 [0,0,0,0,0,1|0,0,3]=4 1646 B12R1.27 C[C@@H](\C=C\c1ccccc1)CO Amb27642008 [0,0,0,0,0,1|0,0,3]=4 1647 B12R1.27 C[C@H](C=O)ONc1ccccc1 Amb28239490 [0,0,0,0,0,1|1,0,1]=3 1648 B12R1.27 C\C(=C/Cc1ccccc1)CN Amb27402545 [0,0,0,0,0,1|1,0,1]=3 1649 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [0,0,0,0,0,1|0,0,2]=3 1650 B12R1.27 C\C(=C\Cl)CCc1ccccc1 Amb27658993 [0,0,0,0,0,1|1,0,1]=3 1651 B12R1.27 C\C(=C\Cl)CSc1ccccc1 Amb27760378 [0,0,0,0,0,1|1,0,1]=3 1652 B12R1.27 C\C(=N\Cl)NCc1ccccc1 Amb27597670 [0,0,0,0,0,1|2,0,1]=4 1653 B12R1.27 C\C(C#N)=C\Nc1ccccc1 Amb27420007 [0,0,0,0,0,1|1,0,1]=3 1654 B12R1.27 C\C(C=O)=C/Nc1ccccc1 Amb18645511 [0,0,0,0,0,1|0,0,0]=1 1655 B12R1.27 C\C(COc1ccccc1)=N\N Amb35672409 [0,0,0,0,0,1|2,0,1]=4 1656 B12R1.27 C\C(COc1ccccc1)=N\O Amb35672643 [0,0,0,0,0,1|1,0,2]=4 1657 B12R1.27 C\C=C(\C)C#Cc1ccccc1 Amb30621736 [0,0,0,0,0,1|1,0,1]=3 1658 B12R1.27 C\C=C(\C)CNc1cccnc1 Amb27598355 [0,0,0,0,0,1|2,0,1]=4 1659 B12R1.27 C\N=C(\C)OCc1ccccc1 Amb27784725 [0,0,0,0,0,1|2,0,1]=4 1660 B12R1.27 Cl\C=C(\Cl)COc1ccccc1 Amb27228628 [0,0,0,0,0,1|2,0,1]=4 1661 B12R1.27 NC(\C=C\c1ccccc1)=N/O Amb27816576 [0,0,0,0,0,1|2,0,1]=4 1662 B12R1.27 NC(\C=C\c1ccccc1)=N\O Amb25065269 [0,0,0,0,0,1|2,0,1]=4 1663 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [0,0,0,0,0,1|2,0,1]=4 1664 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [0,0,0,0,0,1|3,0,0]=4 1665 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [0,0,0,0,0,1|2,0,1]=4 1666 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [0,0,0,0,0,1|2,0,1]=4 1667 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [0,0,0,0,0,1|2,0,1]=4 1668 B12R1.27 O=CC(=O)OCc1ccccc1 Amb18645967 [0,0,0,0,0,1|1,0,1]=3 1669 B12R1.27 O=C\C(Cl)=C\Nc1ccccc1 Amb25797781 [0,0,0,0,0,1|1,0,0]=2 1670 B12R1.27 O=C\C(Cl)=N\Nc1ccccc1 Amb27797293 [0,0,0,0,0,1|2,0,0]=3 1671 B12R1.27 O=C\C(F)=C\Cc1ccccc1 Amb27166149 [0,0,0,0,0,1|1,0,0]=2 1672 B12R1.27 O=C\C(O)=C/Nc1ccccc1 Amb27476557 [0,0,0,0,0,1|1,0,0]=2 1673 B12R1.27 [C-]#[N+]C(C)\C=C\c1ccccc1 Amb33081337 [0,0,0,0,0,1|2,0,1]=4 1674 B12R1.27 [C-]#[N+]\C(C)=C/Nc1ccccc1 Amb28398147 [0,0,0,0,0,1|2,0,0]=3 1675 B9R0.4 CC(=O)\C=C(C)/C=C/C=O Amb27471937 [1,0,1,0,0,0|1,0,1]=4 1676 B9R0.18 C\C=C\C=C(C)\C=C\C=O Amb27881777 [1,0,1,0,0,0|0,0,2]=4 1677 B9R0.40 C=C\C=C(C#N)\C=C\C=O Amb27164073 [1,0,1,0,0,0|1,0,1]=4 1678 B9R0.40 C=C\C=C(C=O)\C=C\C=O Amb28199113 [1,0,1,0,0,0|1,0,0]=3 1679 B9R0.2 C=C\C=C\C=C\CC(C)=O Amb27823042 [1,0,1,0,0,0|0,0,1]=3 1680 B9R0.2 CC(=O)N\C=C\C=C\C=O Amb27881539 [1,0,1,0,0,0|2,0,0]=4 1681 B9R0.2 CC(=O)\C=C\C=C/C=C=O Amb27839053 [1,0,1,0,0,0|1,0,1]=4 1682 B9R0.2 CC(=O)\C=C\C=C\C=C=O Amb27878921 [1,0,1,0,0,0|1,0,1]=4 1683 B9R0.2 CC(=O)\C=C\C=C\C=C\Cl Amb28125315 [1,0,1,0,0,0|1,0,0]=3 1684 B9R0.2 CC(C)=C\C=C\C=C\C=O Amb28287071 [1,0,1,0,0,0|1,0,1]=4 1685 B9R0.2 C\C=C\C=C\C=C\C(=O)O Amb3987814 [1,0,1,0,0,0|1,0,1]=4 1686 B9R0.2 C\C=C\C=C\C=C\C(N)=O Amb27202742 [1,0,1,0,0,0|1,0,1]=4 1687 B9R0.45 C=C\C=C\C=C\C=C\C=O Amb27841284 [1,0,1,0,0,0|0,0,0]=2 1688 B9R0.45 CC\C=C/C=C\C=C\C=O Amb27223181 [1,0,1,0,0,0|0,0,2]=4 1689 B9R0.45 CC\C=C\C=C/C=C/C=O Amb27244697 [1,0,1,0,0,0|0,0,2]=4 1690 B9R0.45 CC\C=C\C=C\C=C\C=O Amb28458226 [1,0,1,0,0,0|0,0,2]=4 1691 B9R0.45 CO\C=C\C=C\C=C\C=O Amb27169346 [1,0,1,0,0,0|1,0,1]=4 1692 B9R0.45 C\C=C\C=C\C=C\C=C\Br Amb27451756 [1,0,1,0,0,0|1,0,1]=4 1693 B9R0.45 O=C\C=C\C=C\C=C\C=O Amb18643061 [1,0,1,0,0,0|1,0,0]=3 1694 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [2,0,0,0,0,0|1,0,0]=3 1695 B9R1.8 Br\C=C/c1ccccn1 Amb25200984 [2,0,0,0,0,0|2,0,0]=4 1696 B9R1.8 Br\C=C/c1cccnc1 Amb24085678 [2,0,0,0,0,0|2,0,0]=4 1697 B9R1.8 Br\C=C\c1ccccc1 Amb3940204 [2,0,0,0,0,0|1,0,0]=3 1698 B9R1.8 Br\C=C\c1ccccn1 Amb33134753 [2,0,0,0,0,0|2,0,0]=4 1699 B9R1.8 Br\C=C\c1cccnc1 Amb33134788 [2,0,0,0,0,0|2,0,0]=4 1700 B9R1.8 Br\C=C\c1ccncc1 Amb27756767 [2,0,0,0,0,0|2,0,0]=4 1701 B9R1.8 C=CC[n+]1ccccc1 Amb27838939 [2,0,0,0,0,0|1,0,1]=4 1702 B9R1.8 C=CCc1ccccc1 Amb2599341 [2,0,0,0,0,0|0,0,1]=3 1703 B9R1.8 C=CCc1cccnc1 Amb24477831 [2,0,0,0,0,0|1,0,1]=4 1704 B9R1.8 C=COc1ccccc1 Amb10564213 [2,0,0,0,0,0|1,0,0]=3 1705 B9R1.8 C=COc1cccnc1 Amb24085952 [2,0,0,0,0,0|2,0,0]=4 1706 B9R1.8 C=CSc1ccccc1 Amb8387516 [2,0,0,0,0,0|1,0,0]=3 1707 B9R1.8 C=NCc1ccccc1 Amb28256747 [2,0,0,0,0,0|1,0,1]=4 1708 B9R1.8 CC#Cc1ccccc1 Amb8513696 [2,0,0,0,0,0|0,0,2]=4 1709 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,2]=4 1710 B9R1.8 CCNc1ccccc1 Amb3940127 [2,0,0,0,0,0|1,0,1]=4 1711 B9R1.8 CCOc1ccccc1 Amb2842270 [2,0,0,0,0,0|1,0,1]=4 1712 B9R1.8 CCSc1ccccc1 Amb2687929 [2,0,0,0,0,0|1,0,1]=4 1713 B9R1.8 CNCc1ccccc1 Amb3699562 [2,0,0,0,0,0|1,0,1]=4 1714 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|2,0,0]=4 1715 B9R1.8 CNNc1ccccc1 Amb27969267 [2,0,0,0,0,0|2,0,0]=4 1716 B9R1.8 COCc1ccccc1 Amb2782562 [2,0,0,0,0,0|1,0,1]=4 1717 B9R1.8 CSSc1ccccc1 Amb4008371 [2,0,0,0,0,0|2,0,0]=4 1718 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|1,0,1]=4 1719 B9R1.8 C\C=C/c1ccccc1 Amb2690400 [2,0,0,0,0,0|0,0,0]=2 1720 B9R1.8 C\C=C\c1ccccc1 Amb6366726 [2,0,0,0,0,0|0,0,0]=2 1721 B9R1.8 C\C=C\c1cnccn1 Amb27492890 [2,0,0,0,0,0|2,0,0]=4 1722 B9R1.8 C\C=N\c1ccccc1 Amb8392386 [2,0,0,0,0,0|1,0,0]=3 1723 B9R1.8 C\C=N\c1cccnc1 Amb27787691 [2,0,0,0,0,0|2,0,0]=4 1724 B9R1.8 C\N=C\c1ccccc1 Amb8513063 [2,0,0,0,0,0|1,0,0]=3 1725 B9R1.8 C\N=C\c1ccncc1 Amb22330508 [2,0,0,0,0,0|2,0,0]=4 1726 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [2,0,0,0,0,0|1,0,0]=3 1727 B9R1.8 Cl\C=C\c1cccnc1 Amb27435566 [2,0,0,0,0,0|2,0,0]=4 1728 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [2,0,0,0,0,0|1,0,0]=3 1729 B9R1.8 F\C=C\c1ccccn1 Amb27258216 [2,0,0,0,0,0|2,0,0]=4 1730 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [2,0,0,0,0,0|1,0,0]=3 1731 B9R1.8 N\C=C/c1ccccn1 Amb27443779 [2,0,0,0,0,0|2,0,0]=4 1732 B9R1.8 N\C=C/c1cccnc1 Amb28137814 [2,0,0,0,0,0|2,0,0]=4 1733 B9R1.8 N\C=C/c1ccncc1 Amb24068867 [2,0,0,0,0,0|2,0,0]=4 1734 B9R1.8 N\C=C\c1cccnc1 Amb27776892 [2,0,0,0,0,0|2,0,0]=4 1735 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [2,0,0,0,0,0|2,0,0]=4 1736 B9R1.8 N\C=P\c1ccccc1 Amb27643938 [2,0,0,0,0,0|2,0,0]=4 1737 B9R1.8 N\N=C\c1ccccc1 Amb31284503 [2,0,0,0,0,0|2,0,0]=4 1738 B9R1.8 O=C=Cc1cccnc1 Amb27425121 [2,0,0,0,0,0|1,0,1]=4 1739 B9R1.8 O=C=Nc1ccccc1 Amb3939417 [2,0,0,0,0,0|1,0,1]=4 1740 B9R1.8 O=CCc1ccccc1 Amb3939950 [2,0,0,0,0,0|0,0,1]=3 1741 B9R1.8 O=CCc1ccccn1 Amb17089528 [2,0,0,0,0,0|1,0,1]=4 1742 B9R1.8 O=CCc1cccnc1 Amb8011002 [2,0,0,0,0,0|1,0,1]=4 1743 B9R1.8 O=CCc1ccncc1 Amb17089529 [2,0,0,0,0,0|1,0,1]=4 1744 B9R1.8 O=CNc1ccccc1 Amb2613772 [2,0,0,0,0,0|1,0,0]=3 1745 B9R1.8 O=CNc1ccccn1 Amb3319168 [2,0,0,0,0,0|2,0,0]=4 1746 B9R1.8 O=CNc1cccnc1 Amb4019648 [2,0,0,0,0,0|2,0,0]=4 1747 B9R1.8 O=COc1ccccc1 Amb22002710 [2,0,0,0,0,0|1,0,0]=3 1748 B9R1.8 O=C\C=C1/N=CC=CN1 Amb28401450 [2,0,0,0,0,0|2,0,0]=4 1749 B9R1.8 O=C\C=C1\C=CC=CN1 Amb24068319 [2,0,0,0,0,0|1,0,0]=3 1750 B9R1.8 O=C\C=C1\C=CNC=N1 Amb24068339 [2,0,0,0,0,0|2,0,0]=4 1751 B9R1.8 O=S=Nc1ccccc1 Amb2720783 [2,0,0,0,0,0|2,0,0]=4 1752 B9R1.8 O\N=C/c1ccccc1 Amb6298335 [2,0,0,0,0,0|1,0,1]=4 1753 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [2,0,0,0,0,0|1,0,1]=4 1754 B9R1.8 S=CNc1ccccc1 Amb25788857 [2,0,0,0,0,0|1,1,0]=4 1755 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [2,0,0,0,0,0|2,0,0]=4 1756 B11R0.110 C\C=C(C)/C=C(C)/C=C(\C)C=O Amb27440543 [0,1,1,0,0,0|0,0,2]=4 1757 B11R0.106 C\C(C=O)=C/C=C\C=C(/C)C=O Amb18646082 [0,1,1,0,0,0|1,0,0]=3 1758 B11R0.106 C\C(C=O)=C\C=C\C=C(/C)C=O Amb33719427 [0,1,1,0,0,0|1,0,0]=3 1759 B11R1.1 BrC\C=C\c1ccc(Br)cc1 Amb28388511 [1,1,0,0,0,0|1,0,1]=4 1760 B11R1.1 C#C\C=C\c1ccc(F)cc1 Amb33202432 [1,1,0,0,0,0|1,0,1]=4 1761 B11R1.1 C=C\C=C\c1ccc(Cl)cc1 Amb25260911 [1,1,0,0,0,0|1,0,0]=3 1762 B11R1.1 C=C\C=C\c1ccc(F)cc1 Amb26993814 [1,1,0,0,0,0|1,0,0]=3 1763 B11R1.1 CC=C=Cc1ccc(F)cc1 Amb27246329 [1,1,0,0,0,0|1,0,1]=4 1764 B11R1.1 CC\C=C/c1ccc(F)cc1 Amb24725207 [1,1,0,0,0,0|1,0,1]=4 1765 B11R1.1 CC\C=C\c1ccc(Br)cc1 Amb26968483 [1,1,0,0,0,0|1,0,1]=4 1766 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [1,1,0,0,0,0|1,0,1]=4 1767 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [1,1,0,0,0,0|1,0,1]=4 1768 B11R1.1 C\C=C\Oc1ccc(N)cc1 Amb27859329 [1,1,0,0,0,0|2,0,0]=4 1769 B11R1.1 Cc1ccc(CCC=O)cc1 Amb5411454 [1,1,0,0,0,0|0,0,2]=4 1770 B11R1.1 Cc1ccc(CNC=O)cc1 Amb1916037 [1,1,0,0,0,0|1,0,1]=4 1771 B11R1.1 Cc1ccc(NNC=O)cc1 Amb2721110 [1,1,0,0,0,0|2,0,0]=4 1772 B11R1.1 Cc1ccc(OCC=O)cc1 Amb5731821 [1,1,0,0,0,0|1,0,1]=4 1773 B11R1.1 Cc1ccc(O\C=C/Cl)cc1 Amb27400345 [1,1,0,0,0,0|2,0,0]=4 1774 B11R1.1 Cc1ccc(SCC=O)cc1 Amb17082904 [1,1,0,0,0,0|1,0,1]=4 1775 B11R1.1 Cc1ccc(\C=C/C=O)cc1 Amb27268490 [1,1,0,0,0,0|0,0,0]=2 1776 B11R1.1 Cc1ccc(\C=C\C#N)cc1 Amb17231964 [1,1,0,0,0,0|1,0,1]=4 1777 B11R1.1 Cc1ccc(\C=C\C=O)cc1 Amb17232009 [1,1,0,0,0,0|0,0,0]=2 1778 B11R1.1 Cc1ccc(\C=C\C=O)cn1 Amb27845226 [1,1,0,0,0,0|1,0,0]=3 1779 B11R1.1 Cc1ccc(\C=C\C=O)nc1 Amb33448753 [1,1,0,0,0,0|1,0,0]=3 1780 B11R1.1 Cc1ccc(\C=C\CCl)cc1 Amb26620547 [1,1,0,0,0,0|1,0,1]=4 1781 B11R1.1 Cc1ccc(\C=C\CN)cc1 Amb18563249 [1,1,0,0,0,0|1,0,1]=4 1782 B11R1.1 Cc1ccc(\C=C\CO)cc1 Amb23442829 [1,1,0,0,0,0|0,0,2]=4 1783 B11R1.1 Cc1cnc(\C=C\C=O)cn1 Amb33374304 [1,1,0,0,0,0|2,0,0]=4 1784 B11R1.1 Cc1ncc(\C=C/C=O)cn1 Amb27268009 [1,1,0,0,0,0|2,0,0]=4 1785 B11R1.1 ClC\C=C\c1ccc(Br)cc1 Amb21926649 [1,1,0,0,0,0|1,0,1]=4 1786 B11R1.1 Cl\C=C\Oc1ccc(Cl)cc1 Amb27878895 [1,1,0,0,0,0|2,0,0]=4 1787 B11R1.1 Clc1ccc(\C=C\CBr)cc1 Amb22007806 [1,1,0,0,0,0|1,0,1]=4 1788 B11R1.1 Fc1ccc(\C=C\CBr)cc1 Amb25923286 [1,1,0,0,0,0|1,0,1]=4 1789 B11R1.1 Fc1ccc(\C=C\CCl)cc1 Amb25074621 [1,1,0,0,0,0|1,0,1]=4 1790 B11R1.1 Fc1ccc(\C=C\CS)cc1 Amb33201386 [1,1,0,0,0,0|0,1,1]=4 1791 B11R1.1 N#C\C=C\c1ccc(Br)cc1 Amb2708676 [1,1,0,0,0,0|1,0,1]=4 1792 B11R1.1 N#C\C=C\c1ccc(Cl)cc1 Amb1158219 [1,1,0,0,0,0|1,0,1]=4 1793 B11R1.1 N#C\C=C\c1ccc(F)cc1 Amb2688082 [1,1,0,0,0,0|1,0,1]=4 1794 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb18066634 [1,1,0,0,0,0|1,0,1]=4 1795 B11R1.1 NC\C=C\c1ccc(Br)cc1 Amb30584648 [1,1,0,0,0,0|1,0,1]=4 1796 B11R1.1 NC\C=C\c1ccc(Cl)cc1 Amb18563824 [1,1,0,0,0,0|1,0,1]=4 1797 B11R1.1 NC\C=C\c1ccc(F)cc1 Amb18065348 [1,1,0,0,0,0|1,0,1]=4 1798 B11R1.1 NC\C=C\c1ccc(O)cc1 Amb33361954 [1,1,0,0,0,0|1,0,1]=4 1799 B11R1.1 Nc1ccc(CCC=O)cc1 Amb27407356 [1,1,0,0,0,0|0,0,2]=4 1800 B11R1.1 Nc1ccc(C\C=C\Br)cc1 Amb27217330 [1,1,0,0,0,0|1,0,1]=4 1801 B11R1.1 Nc1ccc(NCC=O)cc1 Amb27607100 [1,1,0,0,0,0|1,0,1]=4 1802 B11R1.1 Nc1ccc(SCC=O)cc1 Amb30012112 [1,1,0,0,0,0|1,0,1]=4 1803 B11R1.1 O=CC#Cc1ccc(Br)cc1 Amb18115173 [1,1,0,0,0,0|0,0,2]=4 1804 B11R1.1 O=CC#Cc1ccc(F)cc1 Amb18117287 [1,1,0,0,0,0|0,0,2]=4 1805 B11R1.1 O=CC#Cc1ccc(O)cc1 Amb18117760 [1,1,0,0,0,0|0,0,2]=4 1806 B11R1.1 O=CCCc1ccc(Br)cc1 Amb10602155 [1,1,0,0,0,0|0,0,2]=4 1807 B11R1.1 O=CCCc1ccc(Cl)cc1 Amb33531051 [1,1,0,0,0,0|0,0,2]=4 1808 B11R1.1 O=CCCc1ccc(F)cc1 Amb10602156 [1,1,0,0,0,0|0,0,2]=4 1809 B11R1.1 O=CCCc1ccc(I)cc1 Amb27205783 [1,1,0,0,0,0|0,0,2]=4 1810 B11R1.1 O=CCCc1ccc(O)cc1 Amb17081693 [1,1,0,0,0,0|0,0,2]=4 1811 B11R1.1 O=CCCc1ccc(S)cc1 Amb27192456 [1,1,0,0,0,0|0,0,2]=4 1812 B11R1.1 O=CCOc1ccc(Cl)cc1 Amb5731836 [1,1,0,0,0,0|1,0,1]=4 1813 B11R1.1 O=CCOc1ccc(F)cc1 Amb5731822 [1,1,0,0,0,0|1,0,1]=4 1814 B11R1.1 O=CCOc1ccc(I)cc1 Amb27640919 [1,1,0,0,0,0|1,0,1]=4 1815 B11R1.1 O=CCSc1ccc(Br)cc1 Amb17082907 [1,1,0,0,0,0|1,0,1]=4 1816 B11R1.1 O=CCSc1ccc(Cl)cc1 Amb17082906 [1,1,0,0,0,0|1,0,1]=4 1817 B11R1.1 O=CCSc1ccc(F)cc1 Amb17082905 [1,1,0,0,0,0|1,0,1]=4 1818 B11R1.1 O=CNCc1ccc(Br)cc1 Amb27410847 [1,1,0,0,0,0|1,0,1]=4 1819 B11R1.1 O=CNCc1ccc(Cl)cc1 Amb24486673 [1,1,0,0,0,0|1,0,1]=4 1820 B11R1.1 O=CNNc1ccc(Br)cc1 Amb25147924 [1,1,0,0,0,0|2,0,0]=4 1821 B11R1.1 O=C\C=C\c1ccc(Br)cc1 Amb1787168 [1,1,0,0,0,0|0,0,0]=2 1822 B11R1.1 O=C\C=C\c1ccc(Br)cn1 Amb27245473 [1,1,0,0,0,0|1,0,0]=3 1823 B11R1.1 O=C\C=C\c1ccc(Br)nc1 Amb27796539 [1,1,0,0,0,0|1,0,0]=3 1824 B11R1.1 O=C\C=C\c1ccc(Cl)cc1 Amb34005096 [1,1,0,0,0,0|0,0,0]=2 1825 B11R1.1 O=C\C=C\c1ccc(Cl)cn1 Amb33223968 [1,1,0,0,0,0|1,0,0]=3 1826 B11R1.1 O=C\C=C\c1ccc(Cl)nc1 Amb33220743 [1,1,0,0,0,0|1,0,0]=3 1827 B11R1.1 O=C\C=C\c1ccc(F)cc1 Amb6296447 [1,1,0,0,0,0|0,0,0]=2 1828 B11R1.1 O=C\C=C\c1ccc(F)cn1 Amb33317377 [1,1,0,0,0,0|1,0,0]=3 1829 B11R1.1 O=C\C=C\c1ccc(F)nc1 Amb33425820 [1,1,0,0,0,0|1,0,0]=3 1830 B11R1.1 O=C\C=C\c1ccc(O)cc1 Amb6296905 [1,1,0,0,0,0|0,0,0]=2 1831 B11R1.1 O=C\C=C\c1ncc(Br)cn1 Amb33334786 [1,1,0,0,0,0|2,0,0]=4 1832 B11R1.1 O=C\N=C\c1ccc(O)cc1 Amb26557720 [1,1,0,0,0,0|1,0,0]=3 1833 B11R1.1 OC\C=C\c1ccc(Br)cc1 Amb5559245 [1,1,0,0,0,0|0,0,2]=4 1834 B11R1.1 OC\C=C\c1ccc(Cl)cc1 Amb21964138 [1,1,0,0,0,0|0,0,2]=4 1835 B11R1.1 OC\C=C\c1ccc(F)cc1 Amb23442931 [1,1,0,0,0,0|0,0,2]=4 1836 B11R1.1 OC\C=C\c1ccc(O)cc1 Amb2445151 [1,1,0,0,0,0|0,0,2]=4 1837 B11R1.16 C=C(NC=O)c1ccccc1 Amb28046518 [1,1,0,0,0,0|1,0,0]=3 1838 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [1,1,0,0,0,0|1,0,1]=4 1839 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [1,1,0,0,0,0|2,0,0]=4 1840 B11R1.16 C=C\C=C(\N)c1ccccc1 Amb26578846 [1,1,0,0,0,0|1,0,0]=3 1841 B11R1.16 C=C\C=C(\N)c1ccccn1 Amb24579514 [1,1,0,0,0,0|2,0,0]=4 1842 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [1,1,0,0,0,0|0,0,2]=4 1843 B11R1.16 CC(NC=O)c1ccccc1 Amb4020107 [1,1,0,0,0,0|1,0,1]=4 1844 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [1,1,0,0,0,0|1,0,1]=4 1845 B11R1.16 CC(\C=C\Br)c1ccccc1 Amb33134868 [1,1,0,0,0,0|1,0,1]=4 1846 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [1,1,0,0,0,0|1,0,1]=4 1847 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [1,1,0,0,0,0|1,0,1]=4 1848 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [1,1,0,0,0,0|2,0,0]=4 1849 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [1,1,0,0,0,0|2,0,0]=4 1850 B11R1.16 CP(CC=O)c1ccccc1 Amb28241337 [1,1,0,0,0,0|1,0,1]=4 1851 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [1,1,0,0,0,0|0,0,2]=4 1852 B11R1.16 C\C(=C/C#N)c1ccccc1 Amb32941900 [1,1,0,0,0,0|1,0,1]=4 1853 B11R1.16 C\C(=C/C=O)c1ccccc1 Amb17593660 [1,1,0,0,0,0|0,0,0]=2 1854 B11R1.16 C\C(=C/CBr)c1ccccc1 Amb28384582 [1,1,0,0,0,0|1,0,1]=4 1855 B11R1.16 C\C(=C/CN)c1ccccc1 Amb23555622 [1,1,0,0,0,0|1,0,1]=4 1856 B11R1.16 C\C(=C/CO)c1ccccc1 Amb8392366 [1,1,0,0,0,0|0,0,2]=4 1857 B11R1.16 C\C(=C\C=O)c1ccccn1 Amb27848247 [1,1,0,0,0,0|1,0,0]=3 1858 B11R1.16 C\C(=C\C=O)c1cccnc1 Amb28056958 [1,1,0,0,0,0|1,0,0]=3 1859 B11R1.16 C\C(=C\C=O)c1ccncc1 Amb27855013 [1,1,0,0,0,0|1,0,0]=3 1860 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [1,1,0,0,0,0|1,0,0]=3 1861 B11R1.16 C\C=C\C(=O)c1cccnc1 Amb25712944 [1,1,0,0,0,0|2,0,0]=4 1862 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [1,1,0,0,0,0|1,0,1]=4 1863 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [1,1,0,0,0,0|1,0,1]=4 1864 B11R1.16 N#C\C=C(/Br)c1ccccc1 Amb17595559 [1,1,0,0,0,0|1,0,1]=4 1865 B11R1.16 N#C\C=C(/Cl)c1ccccc1 Amb1107219 [1,1,0,0,0,0|1,0,1]=4 1866 B11R1.16 N#C\C=C(/N)c1ccccc1 Amb2609675 [1,1,0,0,0,0|1,0,1]=4 1867 B11R1.16 N#C\C=C(\Br)c1ccccc1 Amb27492883 [1,1,0,0,0,0|1,0,1]=4 1868 B11R1.16 N#C\C=C(\Cl)c1ccccc1 Amb27601178 [1,1,0,0,0,0|1,0,1]=4 1869 B11R1.16 N#C\C=C(\N)c1ccccc1 Amb25891462 [1,1,0,0,0,0|1,0,1]=4 1870 B11R1.16 N=CNC(=O)c1ccccc1 Amb27961481 [1,1,0,0,0,0|2,0,0]=4 1871 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [1,1,0,0,0,0|0,0,2]=4 1872 B11R1.16 N\N=C\C(=O)c1ccccc1 Amb9824983 [1,1,0,0,0,0|2,0,0]=4 1873 B11R1.16 O=C(C=C=S)c1ccccc1 Amb27227059 [1,1,0,0,0,0|0,1,1]=4 1874 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb17843402 [1,1,0,0,0,0|0,0,1]=3 1875 B11R1.16 O=C(\C=C/[O-])c1ccccc1 Amb2385893 [1,1,0,0,0,0|0,0,1]=3 1876 B11R1.16 O=C(\C=C\Cl)c1ccccc1 Amb17594153 [1,1,0,0,0,0|1,0,0]=3 1877 B11R1.16 O=C(\C=C\Cl)c1ccccn1 Amb35645311 [1,1,0,0,0,0|2,0,0]=4 1878 B11R1.16 O=C(\C=C\Cl)c1cccnc1 Amb35645317 [1,1,0,0,0,0|2,0,0]=4 1879 B11R1.16 O=C(\C=C\Cl)c1ccncc1 Amb35645314 [1,1,0,0,0,0|2,0,0]=4 1880 B11R1.16 O=C(\C=C\[O-])c1ccccc1 Amb22360915 [1,1,0,0,0,0|0,0,1]=3 1881 B11R1.16 O=C(\C=N\O)c1ccccc1 Amb2781112 [1,1,0,0,0,0|1,0,1]=4 1882 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [1,1,0,0,0,0|1,1,0]=4 1883 B11R1.16 O=C=NC(=O)c1ccccc1 Amb3940094 [1,1,0,0,0,0|1,0,1]=4 1884 B11R1.16 O=CCC(=O)c1ccccc1 Amb8394158 [1,1,0,0,0,0|0,0,1]=3 1885 B11R1.16 O=CCC(=O)c1ccccn1 Amb9204927 [1,1,0,0,0,0|1,0,1]=4 1886 B11R1.16 O=CCC(=O)c1cccnc1 Amb9204929 [1,1,0,0,0,0|1,0,1]=4 1887 B11R1.16 O=CCC(=O)c1ccncc1 Amb9204939 [1,1,0,0,0,0|1,0,1]=4 1888 B11R1.16 O=CNC(=O)c1ccccn1 Amb27831529 [1,1,0,0,0,0|2,0,0]=4 1889 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [1,1,0,0,0,0|1,0,0]=3 1890 B11R1.16 O=C[CH-]C(=O)c1ccccc1 Amb24121236 [1,1,0,0,0,0|0,0,1]=3 1891 B11R1.16 O=C[CH-]C(=O)c1cccnc1 Amb27816419 [1,1,0,0,0,0|1,0,1]=4 1892 B11R1.16 O=C\C=C(/Cl)c1ccccc1 Amb17232626 [1,1,0,0,0,0|0,0,0]=2 1893 B11R1.16 O=C\C=C(/Cl)c1cccnc1 Amb24378408 [1,1,0,0,0,0|1,0,0]=3 1894 B11R1.16 OC\C=C(\Br)c1ccccc1 Amb28284946 [1,1,0,0,0,0|0,0,2]=4 1895 B11R1.16 [N-]=[N+]=CC(=O)c1ccccc1 Amb16233231 [1,1,0,0,0,0|2,0,0]=4 1896 B11R1.17 C=C\C=C\c1ccccc1C Amb26953331 [1,1,0,0,0,0|1,0,0]=3 1897 B11R1.17 CC\C=C\c1ccccc1N Amb22751020 [1,1,0,0,0,0|1,0,1]=4 1898 B11R1.17 CC\C=C\c1ccccc1O Amb18124914 [1,1,0,0,0,0|1,0,1]=4 1899 B11R1.17 CO\C=C/c1ccccc1O Amb24485852 [1,1,0,0,0,0|2,0,0]=4 1900 B11R1.17 CO\C=C\c1ccccc1C Amb27804452 [1,1,0,0,0,0|2,0,0]=4 1901 B11R1.17 CO\C=C\c1ccccc1O Amb25715988 [1,1,0,0,0,0|2,0,0]=4 1902 B11R1.17 CS\C=C/c1ccccc1O Amb28351599 [1,1,0,0,0,0|2,0,0]=4 1903 B11R1.17 C\C=C/Oc1ccccc1O Amb28137745 [1,1,0,0,0,0|2,0,0]=4 1904 B11R1.17 C\C=C\Cc1ccccc1O Amb3940146 [1,1,0,0,0,0|1,0,1]=4 1905 B11R1.17 C\C=C\Sc1ccccc1N Amb27234697 [1,1,0,0,0,0|2,0,0]=4 1906 B11R1.17 Cc1ccccc1C#CC=O Amb18635840 [1,1,0,0,0,0|0,0,2]=4 1907 B11R1.17 Cc1ccccc1CCC=O Amb6306217 [1,1,0,0,0,0|0,0,2]=4 1908 B11R1.17 Cc1ccccc1CNC=O Amb21859038 [1,1,0,0,0,0|1,0,1]=4 1909 B11R1.17 Cc1ccccc1COC=O Amb17778964 [1,1,0,0,0,0|1,0,1]=4 1910 B11R1.17 Cc1ccccc1OCC=O Amb5731819 [1,1,0,0,0,0|1,0,1]=4 1911 B11R1.17 Cc1ccccc1SCC=O Amb18183536 [1,1,0,0,0,0|1,0,1]=4 1912 B11R1.17 Cc1ccccc1S\C=C\Cl Amb26481359 [1,1,0,0,0,0|2,0,0]=4 1913 B11R1.17 Cc1ccccc1\C=C\C#N Amb17231962 [1,1,0,0,0,0|1,0,1]=4 1914 B11R1.17 Cc1ccccc1\C=C\C=O Amb17232007 [1,1,0,0,0,0|0,0,0]=2 1915 B11R1.17 Cc1ccccc1\C=C\CCl Amb27831983 [1,1,0,0,0,0|1,0,1]=4 1916 B11R1.17 Cc1ccccc1\C=C\CN Amb18065178 [1,1,0,0,0,0|1,0,1]=4 1917 B11R1.17 Cc1ccccc1\C=C\CO Amb23442935 [1,1,0,0,0,0|0,0,2]=4 1918 B11R1.17 Cc1cccnc1\C=C\C=O Amb33428727 [1,1,0,0,0,0|1,0,0]=3 1919 B11R1.17 Cc1ccncc1\C=C\C=O Amb32953945 [1,1,0,0,0,0|1,0,0]=3 1920 B11R1.17 Cc1cnccc1\C=C\C=O Amb33414326 [1,1,0,0,0,0|1,0,0]=3 1921 B11R1.17 Cc1ncccc1\C=C\C=O Amb32878968 [1,1,0,0,0,0|1,0,0]=3 1922 B11R1.17 Cc1nccnc1\C=C\C=O Amb35600874 [1,1,0,0,0,0|2,0,0]=4 1923 B11R1.17 Cc1ncncc1\C=C\C=O Amb33149152 [1,1,0,0,0,0|2,0,0]=4 1924 B11R1.17 ClC\C=C\c1ccccc1Cl Amb27592206 [1,1,0,0,0,0|1,0,1]=4 1925 B11R1.17 Clc1ccccc1\C=C\CBr Amb8392445 [1,1,0,0,0,0|1,0,1]=4 1926 B11R1.17 Fc1ccccc1\C=C\CCl Amb26495610 [1,1,0,0,0,0|1,0,1]=4 1927 B11R1.17 N#C\C=C/c1ccccc1F Amb28141899 [1,1,0,0,0,0|1,0,1]=4 1928 B11R1.17 N#C\C=C/c1ccccc1O Amb26450429 [1,1,0,0,0,0|1,0,1]=4 1929 B11R1.17 N#C\C=C\c1ccccc1Br Amb17239681 [1,1,0,0,0,0|1,0,1]=4 1930 B11R1.17 N#C\C=C\c1ccccc1Cl Amb17232457 [1,1,0,0,0,0|1,0,1]=4 1931 B11R1.17 N#C\C=C\c1ccccc1F Amb17232025 [1,1,0,0,0,0|1,0,1]=4 1932 B11R1.17 N#C\C=C\c1ccccc1I Amb4015088 [1,1,0,0,0,0|1,0,1]=4 1933 B11R1.17 N=C\C=C\c1ccccc1O Amb27226996 [1,1,0,0,0,0|1,0,0]=3 1934 B11R1.17 NC\C=C\c1ccccc1Br Amb18569373 [1,1,0,0,0,0|1,0,1]=4 1935 B11R1.17 NC\C=C\c1ccccc1Cl Amb18065473 [1,1,0,0,0,0|1,0,1]=4 1936 B11R1.17 NC\C=C\c1ccccc1F Amb18065347 [1,1,0,0,0,0|1,0,1]=4 1937 B11R1.17 NC\C=C\c1ccccc1O Amb27442155 [1,1,0,0,0,0|1,0,1]=4 1938 B11R1.17 Nc1ccccc1\C=C\C=O Amb24538270 [1,1,0,0,0,0|0,0,0]=2 1939 B11R1.17 Nc1ccccc1\C=C\CO Amb34916231 [1,1,0,0,0,0|0,0,2]=4 1940 B11R1.17 Nc1ccncc1\N=C\C=O Amb26637985 [1,1,0,0,0,0|2,0,0]=4 1941 B11R1.17 Nc1cnccc1\N=C\C=O Amb25255524 [1,1,0,0,0,0|2,0,0]=4 1942 B11R1.17 O=CC#Cc1ccccc1F Amb18117458 [1,1,0,0,0,0|0,0,2]=4 1943 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [1,1,0,0,0,0|0,0,2]=4 1944 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [1,1,0,0,0,0|0,0,2]=4 1945 B11R1.17 O=CCCc1ccccc1F Amb10602147 [1,1,0,0,0,0|0,0,2]=4 1946 B11R1.17 O=CCCc1ccccc1O Amb22228954 [1,1,0,0,0,0|0,0,2]=4 1947 B11R1.17 O=CCOc1ccccc1Br Amb17099950 [1,1,0,0,0,0|1,0,1]=4 1948 B11R1.17 O=CCOc1ccccc1Cl Amb5731835 [1,1,0,0,0,0|1,0,1]=4 1949 B11R1.17 O=CCOc1ccccc1F Amb18182892 [1,1,0,0,0,0|1,0,1]=4 1950 B11R1.17 O=CCOc1ccccc1I Amb27871520 [1,1,0,0,0,0|1,0,1]=4 1951 B11R1.17 O=CCOc1ccccc1O Amb27176428 [1,1,0,0,0,0|1,0,1]=4 1952 B11R1.17 O=CCSc1ccccc1Br Amb26008308 [1,1,0,0,0,0|1,0,1]=4 1953 B11R1.17 O=CCSc1ccccc1Cl Amb19075897 [1,1,0,0,0,0|1,0,1]=4 1954 B11R1.17 O=CCSc1ccccc1F Amb18185632 [1,1,0,0,0,0|1,0,1]=4 1955 B11R1.17 O=CNCc1ccccc1Cl Amb19871473 [1,1,0,0,0,0|1,0,1]=4 1956 B11R1.17 O=C\C=C\c1ccccc1Br Amb17240825 [1,1,0,0,0,0|0,0,0]=2 1957 B11R1.17 O=C\C=C\c1ccccc1Cl Amb17232625 [1,1,0,0,0,0|0,0,0]=2 1958 B11R1.17 O=C\C=C\c1ccccc1F Amb17232062 [1,1,0,0,0,0|0,0,0]=2 1959 B11R1.17 O=C\C=C\c1ccccc1O Amb842565 [1,1,0,0,0,0|0,0,0]=2 1960 B11R1.17 O=C\C=C\c1ccccc1S Amb28422741 [1,1,0,0,0,0|0,0,0]=2 1961 B11R1.17 O=C\C=C\c1cccnc1Br Amb33387808 [1,1,0,0,0,0|1,0,0]=3 1962 B11R1.17 O=C\C=C\c1cccnc1Cl Amb33406391 [1,1,0,0,0,0|1,0,0]=3 1963 B11R1.17 O=C\C=C\c1cccnc1F Amb33224035 [1,1,0,0,0,0|1,0,0]=3 1964 B11R1.17 O=C\C=C\c1ccncc1Br Amb33478364 [1,1,0,0,0,0|1,0,0]=3 1965 B11R1.17 O=C\C=C\c1ccncc1Cl Amb33413767 [1,1,0,0,0,0|1,0,0]=3 1966 B11R1.17 O=C\C=C\c1ccncc1F Amb33317172 [1,1,0,0,0,0|1,0,0]=3 1967 B11R1.17 O=C\C=C\c1ncccc1Br Amb33388586 [1,1,0,0,0,0|1,0,0]=3 1968 B11R1.17 O=C\C=C\c1ncccc1F Amb33418874 [1,1,0,0,0,0|1,0,0]=3 1969 B11R1.17 O=C\N=C\c1ccccc1O Amb24422424 [1,1,0,0,0,0|1,0,0]=3 1970 B11R1.17 OC\C=C\c1ccccc1Br Amb25149289 [1,1,0,0,0,0|0,0,2]=4 1971 B11R1.17 OC\C=C\c1ccccc1Cl Amb8392444 [1,1,0,0,0,0|0,0,2]=4 1972 B11R1.17 OC\C=C\c1ccccc1F Amb23442840 [1,1,0,0,0,0|0,0,2]=4 1973 B11R1.17 OC\C=C\c1ccccc1O Amb33450068 [1,1,0,0,0,0|0,0,2]=4 1974 B11R1.17 Oc1ccccc1\C=C/CBr Amb27759396 [1,1,0,0,0,0|1,0,1]=4 1975 B11R1.17 Oc1ccccc1\C=C\CCl Amb27848186 [1,1,0,0,0,0|1,0,1]=4 1976 B11R1.24 BrC\C=C\c1cccc(Br)c1 Amb27401347 [1,1,0,0,0,0|1,0,1]=4 1977 B11R1.24 CC\C=C\c1cccc(O)c1 Amb16231489 [1,1,0,0,0,0|1,0,1]=4 1978 B11R1.24 CO\C=C\c1cccc(Br)c1 Amb27642123 [1,1,0,0,0,0|2,0,0]=4 1979 B11R1.24 CO\C=C\c1cccc(F)c1 Amb27840067 [1,1,0,0,0,0|2,0,0]=4 1980 B11R1.24 Cc1cc(\C=C\C=O)ccn1 Amb33340430 [1,1,0,0,0,0|1,0,0]=3 1981 B11R1.24 Cc1cccc(CCC=O)c1 Amb6306216 [1,1,0,0,0,0|0,0,2]=4 1982 B11R1.24 Cc1cccc(CNC=O)c1 Amb27752387 [1,1,0,0,0,0|1,0,1]=4 1983 B11R1.24 Cc1cccc(OCC=O)c1 Amb5731820 [1,1,0,0,0,0|1,0,1]=4 1984 B11R1.24 Cc1cccc(O\C=C\Cl)c1 Amb27471988 [1,1,0,0,0,0|2,0,0]=4 1985 B11R1.24 Cc1cccc(SCC=O)c1 Amb17082932 [1,1,0,0,0,0|1,0,1]=4 1986 B11R1.24 Cc1cccc(\C=C\C#N)c1 Amb17231963 [1,1,0,0,0,0|1,0,1]=4 1987 B11R1.24 Cc1cccc(\C=C\C=O)c1 Amb17232008 [1,1,0,0,0,0|0,0,0]=2 1988 B11R1.24 Cc1cccc(\C=C\C=O)n1 Amb33449582 [1,1,0,0,0,0|1,0,0]=3 1989 B11R1.24 Cc1cccc(\C=C\CN)c1 Amb18065182 [1,1,0,0,0,0|1,0,1]=4 1990 B11R1.24 Cc1cccc(\C=C\CO)c1 Amb23442940 [1,1,0,0,0,0|0,0,2]=4 1991 B11R1.24 Cc1ccnc(\C=C\C=O)c1 Amb33318077 [1,1,0,0,0,0|1,0,0]=3 1992 B11R1.24 Cc1cncc(\C=C\C=O)c1 Amb33317993 [1,1,0,0,0,0|1,0,0]=3 1993 B11R1.24 N#C\C=C\c1cccc(Br)c1 Amb17239682 [1,1,0,0,0,0|1,0,1]=4 1994 B11R1.24 N#C\C=C\c1cccc(Cl)c1 Amb17232458 [1,1,0,0,0,0|1,0,1]=4 1995 B11R1.24 N#C\C=C\c1cccc(F)c1 Amb32718808 [1,1,0,0,0,0|1,0,1]=4 1996 B11R1.24 N#C\C=C\c1cccc(N)c1 Amb27390243 [1,1,0,0,0,0|1,0,1]=4 1997 B11R1.24 N#C\C=C\c1cccc(S)c1 Amb28287829 [1,1,0,0,0,0|1,0,1]=4 1998 B11R1.24 NC\C=C\c1cccc(Br)c1 Amb18066633 [1,1,0,0,0,0|1,0,1]=4 1999 B11R1.24 NC\C=C\c1cccc(Cl)c1 Amb18065474 [1,1,0,0,0,0|1,0,1]=4 2000 B11R1.24 NC\C=C\c1cccc(F)c1 Amb18065349 [1,1,0,0,0,0|1,0,1]=4 2001 B11R1.24 NC\C=C\c1cccc(O)c1 Amb33474823 [1,1,0,0,0,0|1,0,1]=4 2002 B11R1.24 O=CC#Cc1cccc(Cl)c1 Amb27238485 [1,1,0,0,0,0|0,0,2]=4 2003 B11R1.24 O=CC#Cc1cccc(F)c1 Amb18117776 [1,1,0,0,0,0|0,0,2]=4 2004 B11R1.24 O=CCCc1cccc(Br)c1 Amb17081695 [1,1,0,0,0,0|0,0,2]=4 2005 B11R1.24 O=CCCc1cccc(Cl)c1 Amb6306213 [1,1,0,0,0,0|0,0,2]=4 2006 B11R1.24 O=CCCc1cccc(F)c1 Amb6306215 [1,1,0,0,0,0|0,0,2]=4 2007 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [1,1,0,0,0,0|0,0,2]=4 2008 B11R1.24 O=CCCc1cccc(O)c1 Amb17081694 [1,1,0,0,0,0|0,0,2]=4 2009 B11R1.24 O=CCOc1cccc(Br)c1 Amb17099951 [1,1,0,0,0,0|1,0,1]=4 2010 B11R1.24 O=CCOc1cccc(Cl)c1 Amb18806821 [1,1,0,0,0,0|1,0,1]=4 2011 B11R1.24 O=CCOc1cccc(I)c1 Amb27838178 [1,1,0,0,0,0|1,0,1]=4 2012 B11R1.24 O=CCSc1cccc(Br)c1 Amb25978639 [1,1,0,0,0,0|1,0,1]=4 2013 B11R1.24 O=CCSc1cccc(Cl)c1 Amb17082942 [1,1,0,0,0,0|1,0,1]=4 2014 B11R1.24 O=CCSc1cccc(F)c1 Amb26942694 [1,1,0,0,0,0|1,0,1]=4 2015 B11R1.24 O=CNCc1cccc(Br)c1 Amb27780723 [1,1,0,0,0,0|1,0,1]=4 2016 B11R1.24 O=CNCc1cccc(O)c1 Amb18179387 [1,1,0,0,0,0|1,0,1]=4 2017 B11R1.24 O=C\C=C\c1cc(F)ccn1 Amb33320266 [1,1,0,0,0,0|1,0,0]=3 2018 B11R1.24 O=C\C=C\c1cccc(Br)c1 Amb17240826 [1,1,0,0,0,0|0,0,0]=2 2019 B11R1.24 O=C\C=C\c1cccc(Br)n1 Amb28185081 [1,1,0,0,0,0|1,0,0]=3 2020 B11R1.24 O=C\C=C\c1cccc(Cl)c1 Amb16193215 [1,1,0,0,0,0|0,0,0]=2 2021 B11R1.24 O=C\C=C\c1cccc(Cl)n1 Amb33222389 [1,1,0,0,0,0|1,0,0]=3 2022 B11R1.24 O=C\C=C\c1cccc(F)c1 Amb17232063 [1,1,0,0,0,0|0,0,0]=2 2023 B11R1.24 O=C\C=C\c1cccc(O)c1 Amb17334281 [1,1,0,0,0,0|0,0,0]=2 2024 B11R1.24 O=C\C=C\c1cncc(Br)c1 Amb33450900 [1,1,0,0,0,0|1,0,0]=3 2025 B11R1.24 O=C\C=C\c1cncc(F)c1 Amb33227063 [1,1,0,0,0,0|1,0,0]=3 2026 B11R1.24 OC\C=C\c1cccc(Br)c1 Amb19516160 [1,1,0,0,0,0|0,0,2]=4 2027 B11R1.24 OC\C=C\c1cccc(Cl)c1 Amb23442783 [1,1,0,0,0,0|0,0,2]=4 2028 B11R1.24 OC\C=C\c1cccc(F)c1 Amb23442888 [1,1,0,0,0,0|0,0,2]=4 2029 B11R1.24 OC\C=C\c1cccc(I)c1 Amb28322502 [1,1,0,0,0,0|0,0,2]=4 2030 B11R1.24 OC\C=C\c1cccc(O)c1 Amb33136411 [1,1,0,0,0,0|0,0,2]=4 2031 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [1,1,0,0,0,0|1,0,1]=4 2032 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [1,1,0,0,0,0|1,0,0]=3 2033 B11R1.28 C#CC\C=C\c1ccccc1 Amb33080774 [1,1,0,0,0,0|1,0,1]=4 2034 B11R1.28 C=CC\C=C\c1ccccc1 Amb8393997 [1,1,0,0,0,0|1,0,0]=3 2035 B11R1.28 C=C\C=C\Sc1ccccc1 Amb28284520 [1,1,0,0,0,0|1,0,0]=3 2036 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [1,1,0,0,0,0|1,0,1]=4 2037 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [1,1,0,0,0,0|1,0,1]=4 2038 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|1,0,1]=4 2039 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [1,1,0,0,0,0|1,0,1]=4 2040 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [1,1,0,0,0,0|0,1,1]=4 2041 B11R1.28 C\C=C/N=C/c1cccnc1 Amb24486027 [1,1,0,0,0,0|2,0,0]=4 2042 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [1,1,0,0,0,0|1,0,0]=3 2043 B11R1.28 C\C=C\CCc1ccccc1 Amb17940149 [1,1,0,0,0,0|1,0,1]=4 2044 B11R1.28 C\C=C\CNc1ccccc1 Amb4016349 [1,1,0,0,0,0|1,0,1]=4 2045 B11R1.28 C\C=C\COc1ccccc1 Amb4036065 [1,1,0,0,0,0|1,0,1]=4 2046 B11R1.28 C\C=C\N=C\c1cccnc1 Amb26566876 [1,1,0,0,0,0|2,0,0]=4 2047 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [1,1,0,0,0,0|1,0,1]=4 2048 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [1,1,0,0,0,0|1,0,1]=4 2049 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [1,1,0,0,0,0|1,0,0]=3 2050 B11R1.28 Cl\C=C\CCc1ccccc1 Amb8392473 [1,1,0,0,0,0|1,0,1]=4 2051 B11R1.28 Cl\C=C\COc1ccccc1 Amb27668260 [1,1,0,0,0,0|1,0,1]=4 2052 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [1,1,0,0,0,0|1,0,1]=4 2053 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [1,1,0,0,0,0|1,0,1]=4 2054 B11R1.28 N#CC\C=C\c1ccccc1 Amb6268598 [1,1,0,0,0,0|1,0,1]=4 2055 B11R1.28 N#C\C=C\Cc1ccccc1 Amb28255392 [1,1,0,0,0,0|1,0,1]=4 2056 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [1,1,0,0,0,0|1,0,1]=4 2057 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [1,1,0,0,0,0|1,0,1]=4 2058 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [1,1,0,0,0,0|1,0,1]=4 2059 B11R1.28 NNC\C=C\c1ccccc1 Amb33456723 [1,1,0,0,0,0|1,0,1]=4 2060 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [1,1,0,0,0,0|0,0,2]=4 2061 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [1,1,0,0,0,0|1,0,0]=3 2062 B11R1.28 N\C=C\C=C\c1ccccn1 Amb27961333 [1,1,0,0,0,0|2,0,0]=4 2063 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [1,1,0,0,0,0|1,0,0]=3 2064 B11R1.28 N\N=C\C=C\c1ccccn1 Amb27768304 [1,1,0,0,0,0|2,0,0]=4 2065 B11R1.28 O=C=C\C=C/c1ccccn1 Amb27434448 [1,1,0,0,0,0|1,0,0]=3 2066 B11R1.28 O=C=C\C=C\c1ccccn1 Amb27622513 [1,1,0,0,0,0|1,0,0]=3 2067 B11R1.28 O=CCC#Cc1ccccc1 Amb27390152 [1,1,0,0,0,0|0,0,2]=4 2068 B11R1.28 O=CCCCc1ccccc1 Amb6306225 [1,1,0,0,0,0|0,0,2]=4 2069 B11R1.28 O=CCCOc1ccccc1 Amb5731758 [1,1,0,0,0,0|0,0,2]=4 2070 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [1,1,0,0,0,0|0,0,2]=4 2071 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,1,0,0,0,0|0,0,2]=4 2072 B11R1.28 O=CCOCc1ccccc1 Amb3939958 [1,1,0,0,0,0|0,0,2]=4 2073 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [1,1,0,0,0,0|0,0,2]=4 2074 B11R1.28 O=CNOCc1ccccc1 Amb27805476 [1,1,0,0,0,0|1,0,1]=4 2075 B11R1.28 O=CN\N=C/c1ccccc1 Amb2612268 [1,1,0,0,0,0|1,0,0]=3 2076 B11R1.28 O=COCCc1ccccc1 Amb6357955 [1,1,0,0,0,0|0,0,2]=4 2077 B11R1.28 O=C\C=C/Cc1ccccc1 Amb27861231 [1,1,0,0,0,0|0,0,0]=2 2078 B11R1.28 O=C\C=C\Cc1ccccc1 Amb32954519 [1,1,0,0,0,0|0,0,0]=2 2079 B11R1.28 O=C\C=C\Nc1ccccc1 Amb18124821 [1,1,0,0,0,0|0,0,0]=2 2080 B11R1.28 O=C\C=C\Nc1cccnc1 Amb27445449 [1,1,0,0,0,0|1,0,0]=3 2081 B11R1.28 O=C\C=C\Oc1ccccc1 Amb24585165 [1,1,0,0,0,0|0,0,0]=2 2082 B11R1.28 O=C\C=N\Nc1ccccc1 Amb2417721 [1,1,0,0,0,0|1,0,0]=3 2083 B11R1.28 O=S=CNCc1ccccc1 Amb27166552 [1,1,0,0,0,0|1,0,1]=4 2084 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [1,1,0,0,0,0|0,0,2]=4 2085 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [1,1,0,0,0,0|0,0,2]=4 2086 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [1,1,0,0,0,0|0,0,2]=4 2087 B11R1.28 ONC\C=C\c1ccccc1 Amb33081057 [1,1,0,0,0,0|0,0,2]=4 2088 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [1,1,0,0,0,0|0,0,1]=3 2089 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [1,1,0,0,0,0|0,0,1]=3 2090 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [1,1,0,0,0,0|0,0,1]=3 2091 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [1,1,0,0,0,0|0,1,1]=4 2092 B11R1.28 [C-]#[N+]C\C=C\c1ccccc1 Amb33081342 [1,1,0,0,0,0|1,0,1]=4 2093 B11R1.28 [N-]=[N+]=N\C=C\c1ccccc1 Amb26367041 [1,1,0,0,0,0|2,0,0]=4 2094 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [1,1,0,0,0,0|1,0,0]=3 2095 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [1,1,0,0,0,0|0,0,2]=4 2096 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [1,1,0,0,0,0|0,0,2]=4 2097 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,1,0,0,0,0|1,0,1]=4 2098 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [1,1,0,0,0,0|1,0,1]=4 2099 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [1,1,0,0,0,0|1,0,1]=4 2100 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,1,0,0,0,0|1,0,1]=4 2101 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [1,1,0,0,0,0|2,0,0]=4 2102 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [1,1,0,0,0,0|1,0,1]=4 2103 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [1,1,0,0,0,0|2,0,0]=4 2104 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [1,1,0,0,0,0|1,0,1]=4 2105 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,1,0,0,0,0|0,0,0]=2 2106 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [1,1,0,0,0,0|0,0,0]=2 2107 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,1,0,0,0,0|1,0,0]=3 2108 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [1,1,0,0,0,0|1,0,0]=3 2109 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb33223775 [1,1,0,0,0,0|1,0,0]=3 2110 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb33359225 [1,1,0,0,0,0|1,0,0]=3 2111 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [1,1,0,0,0,0|2,0,0]=4 2112 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [1,1,0,0,0,0|2,0,0]=4 2113 B11R1.91 CC(=O)\C=C\c1cncnc1 Amb32876838 [1,1,0,0,0,0|2,0,0]=4 2114 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [1,1,0,0,0,0|2,0,0]=4 2115 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,1,0,0,0,0|2,0,0]=4 2116 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [1,1,0,0,0,0|1,0,1]=4 2117 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [1,1,0,0,0,0|1,0,1]=4 2118 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [1,1,0,0,0,0|2,0,0]=4 2119 B11R1.91 CC(C)=CSc1ccccc1 Amb27767952 [1,1,0,0,0,0|2,0,0]=4 2120 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [1,1,0,0,0,0|1,0,1]=4 2121 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [1,1,0,0,0,0|1,0,1]=4 2122 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [1,1,0,0,0,0|1,0,1]=4 2123 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [1,1,0,0,0,0|0,0,2]=4 2124 B11R1.91 CS(=O)\N=C\c1ccccc1 Amb35681663 [1,1,0,0,0,0|2,0,0]=4 2125 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [1,1,0,0,0,0|1,0,1]=4 2126 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [1,1,0,0,0,0|0,0,2]=4 2127 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [1,1,0,0,0,0|1,0,1]=4 2128 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [1,1,0,0,0,0|0,0,2]=4 2129 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [1,1,0,0,0,0|1,0,0]=3 2130 B11R1.91 N=C(N)\C=C\c1cccnc1 Amb25992761 [1,1,0,0,0,0|2,0,0]=4 2131 B11R1.91 NC(=O)C#Cc1ccccc1 Amb2778971 [1,1,0,0,0,0|0,0,2]=4 2132 B11R1.91 NC(=O)CCc1ccccc1 Amb2708677 [1,1,0,0,0,0|0,0,2]=4 2133 B11R1.91 NC(=O)CNc1ccccc1 Amb503275 [1,1,0,0,0,0|1,0,1]=4 2134 B11R1.91 NC(=O)COc1ccccc1 Amb6358162 [1,1,0,0,0,0|1,0,1]=4 2135 B11R1.91 NC(=O)CSc1ccccc1 Amb3686107 [1,1,0,0,0,0|1,0,1]=4 2136 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,1,0,0,0,0|1,0,1]=4 2137 B11R1.91 NC(=O)NNc1ccccc1 Amb32409481 [1,1,0,0,0,0|2,0,0]=4 2138 B11R1.91 NC(=O)NSc1ccccc1 Amb27974234 [1,1,0,0,0,0|2,0,0]=4 2139 B11R1.91 NC(=O)OCc1ccccc1 Amb4404204 [1,1,0,0,0,0|1,0,1]=4 2140 B11R1.91 NC(=O)SCc1ccccc1 Amb28342215 [1,1,0,0,0,0|1,0,1]=4 2141 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [1,1,0,0,0,0|0,0,0]=2 2142 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [1,1,0,0,0,0|1,0,0]=3 2143 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [1,1,0,0,0,0|0,0,0]=2 2144 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [1,1,0,0,0,0|0,0,0]=2 2145 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [1,1,0,0,0,0|1,0,0]=3 2146 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [1,1,0,0,0,0|1,0,0]=3 2147 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [1,1,0,0,0,0|1,0,0]=3 2148 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [1,1,0,0,0,0|1,0,0]=3 2149 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [1,1,0,0,0,0|0,1,0]=3 2150 B11R1.91 NC(=S)\C=C\c1ccccn1 Amb27233532 [1,1,0,0,0,0|1,1,0]=4 2151 B11R1.91 NC(=S)\C=C\c1cccnc1 Amb27232946 [1,1,0,0,0,0|1,1,0]=4 2152 B11R1.91 O=C(Cl)CCc1ccccc1 Amb2725506 [1,1,0,0,0,0|0,0,2]=4 2153 B11R1.91 O=C(Cl)COc1ccccc1 Amb844296 [1,1,0,0,0,0|1,0,1]=4 2154 B11R1.91 O=C(Cl)CSc1ccccc1 Amb3939230 [1,1,0,0,0,0|1,0,1]=4 2155 B11R1.91 O=C(Cl)OCc1ccccc1 Amb6296595 [1,1,0,0,0,0|1,0,1]=4 2156 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [1,1,0,0,0,0|0,0,0]=2 2157 B11R1.91 O=C(Cl)\C=C\c1cccnc1 Amb6307270 [1,1,0,0,0,0|1,0,0]=3 2158 B11R1.91 O=C(F)OCc1ccccc1 Amb27879062 [1,1,0,0,0,0|1,0,1]=4 2159 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [1,1,0,0,0,0|0,0,2]=4 2160 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [1,1,0,0,0,0|0,0,2]=4 2161 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [1,1,0,0,0,0|1,0,1]=4 2162 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [1,1,0,0,0,0|1,0,1]=4 2163 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [1,1,0,0,0,0|1,0,1]=4 2164 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [1,1,0,0,0,0|1,0,1]=4 2165 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [1,1,0,0,0,0|0,0,0]=2 2166 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [1,1,0,0,0,0|1,0,0]=3 2167 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [1,1,0,0,0,0|1,0,0]=3 2168 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [1,1,0,0,0,0|1,0,0]=3 2169 B11R1.91 O=C(O)\C=C/c1cncnc1 Amb27975406 [1,1,0,0,0,0|2,0,0]=4 2170 B11R1.91 O=C(O)\C=C\N1C=CC=CC1 Amb22015329 [1,1,0,0,0,0|1,0,1]=4 2171 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [1,1,0,0,0,0|0,0,0]=2 2172 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [1,1,0,0,0,0|0,0,0]=2 2173 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [1,1,0,0,0,0|1,0,0]=3 2174 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [1,1,0,0,0,0|1,0,0]=3 2175 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [1,1,0,0,0,0|1,0,0]=3 2176 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [1,1,0,0,0,0|2,0,0]=4 2177 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [1,1,0,0,0,0|1,0,0]=3 2178 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [1,1,0,0,0,0|2,0,0]=4 2179 B11R1.91 O=C(O)\C=C\c1ccnnc1 Amb18125071 [1,1,0,0,0,0|2,0,0]=4 2180 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [1,1,0,0,0,0|2,0,0]=4 2181 B11R1.91 O=C(O)\C=C\c1cncnc1 Amb9780324 [1,1,0,0,0,0|2,0,0]=4 2182 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [1,1,0,0,0,0|2,0,0]=4 2183 B11R1.91 O=C([O-])CNc1ccccc1 Amb21520409 [1,1,0,0,0,0|1,0,1]=4 2184 B11R1.91 O=C([O-])CNc1ccccc1 Amb33512953 [1,1,0,0,0,0|1,0,1]=4 2185 B11R1.91 O=C([O-])COc1ccccc1 Amb6366707 [1,1,0,0,0,0|1,0,1]=4 2186 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [1,1,0,0,0,0|0,0,0]=2 2187 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [1,1,0,0,0,0|0,0,0]=2 2188 B11R1.91 O=C([O-])\C=C\c1cccnc1 Amb33512942 [1,1,0,0,0,0|1,0,0]=3 2189 B11R1.91 O=C([O-])\N=N\c1ccccc1 Amb26350249 [1,1,0,0,0,0|2,0,0]=4 2190 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [1,1,0,0,0,0|1,0,0]=3 2191 B11R1.91 O=S([O-])\C=C\c1ccccc1 Amb26016414 [1,1,0,0,0,0|1,0,0]=3 2192 B11R1.91 O=[N+]([O-])\C=C/c1ccccc1 Amb4066298 [1,1,0,0,0,0|1,0,0]=3 2193 B11R1.91 O=[N+]([O-])\C=C/c1ccncc1 Amb1054083 [1,1,0,0,0,0|2,0,0]=4 2194 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb33719275 [1,1,0,0,0,0|1,0,0]=3 2195 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb8396046 [1,1,0,0,0,0|1,0,0]=3 2196 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb19373998 [1,1,0,0,0,0|2,0,0]=4 2197 B11R1.91 O=[N+]([O-])\C=C\c1ccccn1 Amb24106744 [1,1,0,0,0,0|2,0,0]=4 2198 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb19515469 [1,1,0,0,0,0|2,0,0]=4 2199 B11R1.91 O=[N+]([O-])\C=C\c1cccnc1 Amb33512945 [1,1,0,0,0,0|2,0,0]=4 2200 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb19374504 [1,1,0,0,0,0|2,0,0]=4 2201 B11R1.91 O=[N+]([O-])\C=C\c1ccncc1 Amb24096963 [1,1,0,0,0,0|2,0,0]=4 2202 B11R1.91 OB(O)\C=C\c1ccccc1 Amb2447227 [1,1,0,0,0,0|1,0,1]=4 2203 B11R1.20 BrC(Br)=Cc1ccc(Br)cc1 Amb25920797 [1,1,0,0,0,0|2,0,0]=4 2204 B11R1.20 BrC(Br)=Cc1ccc(I)cc1 Amb28365692 [1,1,0,0,0,0|2,0,0]=4 2205 B11R1.20 C=C(Br)Cc1ccc(Cl)cc1 Amb6298981 [1,1,0,0,0,0|1,0,1]=4 2206 B11R1.20 C=C(Br)Cc1ccc(O)cc1 Amb28239311 [1,1,0,0,0,0|1,0,1]=4 2207 B11R1.20 C=C(C)Cc1ccc(O)cc1 Amb26357975 [1,1,0,0,0,0|0,0,1]=3 2208 B11R1.20 C=C(Cl)Cc1ccc(Br)cc1 Amb6298957 [1,1,0,0,0,0|1,0,1]=4 2209 B11R1.20 C=C(Cl)Cc1ccc(N)cc1 Amb27482491 [1,1,0,0,0,0|1,0,1]=4 2210 B11R1.20 C=C(Cl)Cc1ccc(O)cc1 Amb26985761 [1,1,0,0,0,0|1,0,1]=4 2211 B11R1.20 CC(=N)Nc1ccc(Cl)cc1 Amb24477671 [1,1,0,0,0,0|2,0,0]=4 2212 B11R1.20 CC(=N)Nc1ccc(O)cc1 Amb26560528 [1,1,0,0,0,0|2,0,0]=4 2213 B11R1.20 CC(=O)CN1C=CC(=S)C=C1 Amb28201050 [1,1,0,0,0,0|1,0,1]=4 2214 B11R1.20 CC(=O)Cc1ccc(Br)cc1 Amb3941014 [1,1,0,0,0,0|0,0,1]=3 2215 B11R1.20 CC(=O)Cc1ccc(Br)nc1 Amb26040163 [1,1,0,0,0,0|1,0,1]=4 2216 B11R1.20 CC(=O)Cc1ccc(C)cc1 Amb2689597 [1,1,0,0,0,0|0,0,1]=3 2217 B11R1.20 CC(=O)Cc1ccc(C)cn1 Amb10607335 [1,1,0,0,0,0|1,0,1]=4 2218 B11R1.20 CC(=O)Cc1ccc(C)nc1 Amb33344778 [1,1,0,0,0,0|1,0,1]=4 2219 B11R1.20 CC(=O)Cc1ccc(Cl)cc1 Amb2686315 [1,1,0,0,0,0|0,0,1]=3 2220 B11R1.20 CC(=O)Cc1ccc(Cl)cn1 Amb23437495 [1,1,0,0,0,0|1,0,1]=4 2221 B11R1.20 CC(=O)Cc1ccc(Cl)nc1 Amb10976126 [1,1,0,0,0,0|1,0,1]=4 2222 B11R1.20 CC(=O)Cc1ccc(F)cc1 Amb2688303 [1,1,0,0,0,0|0,0,1]=3 2223 B11R1.20 CC(=O)Cc1ccc(F)cn1 Amb33080277 [1,1,0,0,0,0|1,0,1]=4 2224 B11R1.20 CC(=O)Cc1ccc(F)nc1 Amb25733918 [1,1,0,0,0,0|1,0,1]=4 2225 B11R1.20 CC(=O)Cc1ccc(N)cc1 Amb6298618 [1,1,0,0,0,0|0,0,1]=3 2226 B11R1.20 CC(=O)Cc1ccc(N)nc1 Amb18201937 [1,1,0,0,0,0|1,0,1]=4 2227 B11R1.20 CC(=O)Cc1ccc(O)cc1 Amb6296288 [1,1,0,0,0,0|0,0,1]=3 2228 B11R1.20 CC(=O)N=C1C=CC(=O)C=C1 Amb10071635 [1,1,0,0,0,0|1,0,0]=3 2229 B11R1.20 CC(=O)Nc1ccc(Br)cc1 Amb2696018 [1,1,0,0,0,0|1,0,0]=3 2230 B11R1.20 CC(=O)Nc1ccc(Br)cn1 Amb2611333 [1,1,0,0,0,0|2,0,0]=4 2231 B11R1.20 CC(=O)Nc1ccc(Br)nc1 Amb10071320 [1,1,0,0,0,0|2,0,0]=4 2232 B11R1.20 CC(=O)Nc1ccc(C)cc1 Amb6355390 [1,1,0,0,0,0|1,0,0]=3 2233 B11R1.20 CC(=O)Nc1ccc(C)cn1 Amb2611612 [1,1,0,0,0,0|2,0,0]=4 2234 B11R1.20 CC(=O)Nc1ccc(Cl)cc1 Amb2696090 [1,1,0,0,0,0|1,0,0]=3 2235 B11R1.20 CC(=O)Nc1ccc(Cl)cn1 Amb1808922 [1,1,0,0,0,0|2,0,0]=4 2236 B11R1.20 CC(=O)Nc1ccc(Cl)nc1 Amb24121741 [1,1,0,0,0,0|2,0,0]=4 2237 B11R1.20 CC(=O)Nc1ccc(F)cc1 Amb2724263 [1,1,0,0,0,0|1,0,0]=3 2238 B11R1.20 CC(=O)Nc1ccc(F)cn1 Amb8396920 [1,1,0,0,0,0|2,0,0]=4 2239 B11R1.20 CC(=O)Nc1ccc(I)cc1 Amb2759244 [1,1,0,0,0,0|1,0,0]=3 2240 B11R1.20 CC(=O)Nc1ccc(I)cn1 Amb2054963 [1,1,0,0,0,0|2,0,0]=4 2241 B11R1.20 CC(=O)Nc1ccc(N)cc1 Amb1208563 [1,1,0,0,0,0|1,0,0]=3 2242 B11R1.20 CC(=O)Nc1ccc(N)cn1 Amb2684196 [1,1,0,0,0,0|2,0,0]=4 2243 B11R1.20 CC(=O)Nc1ccc(N)nc1 Amb18949287 [1,1,0,0,0,0|2,0,0]=4 2244 B11R1.20 CC(=O)Nc1ccc(O)cc1 Amb1209347 [1,1,0,0,0,0|1,0,0]=3 2245 B11R1.20 CC(=O)Nc1ccc(O)cn1 Amb22002364 [1,1,0,0,0,0|2,0,0]=4 2246 B11R1.20 CC(=O)Nc1ccc(O)nc1 Amb22752688 [1,1,0,0,0,0|2,0,0]=4 2247 B11R1.20 CC(=O)Nc1ccc(S)cc1 Amb2720233 [1,1,0,0,0,0|1,0,0]=3 2248 B11R1.20 CC(=O)Nc1ccc(S)nc1 Amb10569732 [1,1,0,0,0,0|2,0,0]=4 2249 B11R1.20 CC(=O)Nc1ccc([NH3+])cc1 Amb24113861 [1,1,0,0,0,0|1,0,0]=3 2250 B11R1.20 CC(=O)OC1=CNC(=O)C=C1 Amb27964993 [1,1,0,0,0,0|2,0,0]=4 2251 B11R1.20 CC(=O)Oc1ccc(Br)cc1 Amb3123035 [1,1,0,0,0,0|1,0,0]=3 2252 B11R1.20 CC(=O)Oc1ccc(Br)nc1 Amb20617838 [1,1,0,0,0,0|2,0,0]=4 2253 B11R1.20 CC(=O)Oc1ccc(Cl)cc1 Amb4379779 [1,1,0,0,0,0|1,0,0]=3 2254 B11R1.20 CC(=O)Oc1ccc(Cl)nc1 Amb2612449 [1,1,0,0,0,0|2,0,0]=4 2255 B11R1.20 CC(=O)Oc1ccc(F)cc1 Amb2684206 [1,1,0,0,0,0|1,0,0]=3 2256 B11R1.20 CC(=O)Oc1ccc(I)cc1 Amb25330825 [1,1,0,0,0,0|1,0,0]=3 2257 B11R1.20 CC(=O)Oc1ccc(N)cc1 Amb18125232 [1,1,0,0,0,0|1,0,0]=3 2258 B11R1.20 CC(=O)Oc1ccc(N)cc1 Amb34891685 [1,1,0,0,0,0|1,0,0]=3 2259 B11R1.20 CC(=O)Oc1ccc(O)cc1 Amb10843589 [1,1,0,0,0,0|1,0,0]=3 2260 B11R1.20 CC(=O)Sc1ccc(Br)cc1 Amb1394995 [1,1,0,0,0,0|1,0,0]=3 2261 B11R1.20 CC(=O)Sc1ccc(C)cc1 Amb17741675 [1,1,0,0,0,0|1,0,0]=3 2262 B11R1.20 CC(=O)Sc1ccc(Cl)cc1 Amb24433357 [1,1,0,0,0,0|1,0,0]=3 2263 B11R1.20 CC(=O)Sc1ccc(F)cc1 Amb25348487 [1,1,0,0,0,0|1,0,0]=3 2264 B11R1.20 CC(=O)Sc1ccc(I)cc1 Amb22344406 [1,1,0,0,0,0|1,0,0]=3 2265 B11R1.20 CC(=S)Nc1ccc(C)cc1 Amb2553853 [1,1,0,0,0,0|1,1,0]=4 2266 B11R1.20 CC(=S)Nc1ccc(F)cc1 Amb2373818 [1,1,0,0,0,0|1,1,0]=4 2267 B11R1.20 CC(C)=Cc1ccc(Cl)cc1 Amb4036427 [1,1,0,0,0,0|0,0,1]=3 2268 B11R1.20 CS(=O)Cc1ccc(N)cc1 Amb18952403 [1,1,0,0,0,0|1,0,1]=4 2269 B11R1.20 CS(=O)Cc1ccc(O)cc1 Amb27599442 [1,1,0,0,0,0|1,0,1]=4 2270 B11R1.20 C\C(N)=N\c1ccc(Br)cc1 Amb24311042 [1,1,0,0,0,0|2,0,0]=4 2271 B11R1.20 C\C(S)=N\c1ccc(Br)cc1 Amb26851599 [1,1,0,0,0,0|1,1,0]=4 2272 B11R1.20 C\[N+]([O-])=C\c1ccc(Br)cc1 Amb1350472 [1,1,0,0,0,0|1,0,1]=4 2273 B11R1.20 Cc1ccc(C=C(Br)Br)cc1 Amb18117913 [1,1,0,0,0,0|2,0,0]=4 2274 B11R1.20 Cc1ccc(CC(=O)Cl)cc1 Amb2690620 [1,1,0,0,0,0|1,0,1]=4 2275 B11R1.20 Cc1ccc(CC(=O)O)cc1 Amb22434999 [1,1,0,0,0,0|1,0,1]=4 2276 B11R1.20 Cc1ccc(CC(=O)O)cc1 Amb843203 [1,1,0,0,0,0|1,0,1]=4 2277 B11R1.20 Cc1ccc(CC(=O)[O-])cc1 Amb33512947 [1,1,0,0,0,0|1,0,1]=4 2278 B11R1.20 Cc1ccc(CC(N)=O)cc1 Amb3447317 [1,1,0,0,0,0|1,0,1]=4 2279 B11R1.20 Cc1ccc(NC(N)=O)cc1 Amb1195893 [1,1,0,0,0,0|2,0,0]=4 2280 B11R1.20 Cc1ccc(OC(=O)Cl)cc1 Amb8515454 [1,1,0,0,0,0|2,0,0]=4 2281 B11R1.20 Cc1ccc(SC(=O)Cl)cc1 Amb2689603 [1,1,0,0,0,0|2,0,0]=4 2282 B11R1.20 Cc1ccc(SC(=O)O)cc1 Amb27227871 [1,1,0,0,0,0|2,0,0]=4 2283 B11R1.20 Cc1ccc(\C=[N+](\C)[O-])cc1 Amb2425090 [1,1,0,0,0,0|1,0,1]=4 2284 B11R1.20 Clc1ccc(C=C(Br)Br)cc1 Amb10575986 [1,1,0,0,0,0|2,0,0]=4 2285 B11R1.20 F\C(Br)=C/c1ccc(F)cc1 Amb32680147 [1,1,0,0,0,0|2,0,0]=4 2286 B11R1.20 F\C(Br)=C\c1ccc(Br)cc1 Amb24053591 [1,1,0,0,0,0|2,0,0]=4 2287 B11R1.20 F\C(Br)=C\c1ccc(Cl)cc1 Amb24053592 [1,1,0,0,0,0|2,0,0]=4 2288 B11R1.20 Fc1ccc(C=C(Br)Br)cc1 Amb18115317 [1,1,0,0,0,0|2,0,0]=4 2289 B11R1.20 NC(=O)Cc1ccc(Br)cc1 Amb6348337 [1,1,0,0,0,0|1,0,1]=4 2290 B11R1.20 NC(=O)Cc1ccc(Cl)cc1 Amb3886693 [1,1,0,0,0,0|1,0,1]=4 2291 B11R1.20 NC(=O)Cc1ccc(F)cc1 Amb6394603 [1,1,0,0,0,0|1,0,1]=4 2292 B11R1.20 NC(=O)Cc1ccc(I)cc1 Amb25877669 [1,1,0,0,0,0|1,0,1]=4 2293 B11R1.20 NC(=O)Cc1ccc(N)cc1 Amb1121163 [1,1,0,0,0,0|1,0,1]=4 2294 B11R1.20 NC(=O)Cc1ccc(O)cc1 Amb2725568 [1,1,0,0,0,0|1,0,1]=4 2295 B11R1.20 NC(=O)Nc1ccc(Br)cc1 Amb1215049 [1,1,0,0,0,0|2,0,0]=4 2296 B11R1.20 NC(=O)Nc1ccc(Cl)cc1 Amb1195894 [1,1,0,0,0,0|2,0,0]=4 2297 B11R1.20 NC(=O)Nc1ccc(F)cc1 Amb1130731 [1,1,0,0,0,0|2,0,0]=4 2298 B11R1.20 NC(=O)Nc1ccc(I)cc1 Amb1144373 [1,1,0,0,0,0|2,0,0]=4 2299 B11R1.20 NC(=O)Nc1ccc(N)cc1 Amb33536628 [1,1,0,0,0,0|2,0,0]=4 2300 B11R1.20 NC(=O)Oc1ccc(F)cc1 Amb27777176 [1,1,0,0,0,0|2,0,0]=4 2301 B11R1.20 NC(=O)Oc1ccc(N)cc1 Amb27669017 [1,1,0,0,0,0|2,0,0]=4 2302 B11R1.20 NC(=O)Oc1ccc(O)cc1 Amb28396613 [1,1,0,0,0,0|2,0,0]=4 2303 B11R1.20 NC(=O)Sc1ccc(Cl)cc1 Amb27659345 [1,1,0,0,0,0|2,0,0]=4 2304 B11R1.20 NC(=O)Sc1ccc(O)cc1 Amb28137774 [1,1,0,0,0,0|2,0,0]=4 2305 B11R1.20 Nc1ccc(C=C(F)F)cc1 Amb23570652 [1,1,0,0,0,0|2,0,0]=4 2306 B11R1.20 Nc1ccc(CC(=O)O)cc1 Amb532928 [1,1,0,0,0,0|1,0,1]=4 2307 B11R1.20 Nc1ccc(OC(=O)F)cc1 Amb28066648 [1,1,0,0,0,0|2,0,0]=4 2308 B11R1.20 O=C(Br)Cc1ccc(F)cc1 Amb25130669 [1,1,0,0,0,0|1,0,1]=4 2309 B11R1.20 O=C(Br)Nc1ccc(Br)cc1 Amb4008202 [1,1,0,0,0,0|2,0,0]=4 2310 B11R1.20 O=C(Cl)Cc1ccc(Br)cc1 Amb33528392 [1,1,0,0,0,0|1,0,1]=4 2311 B11R1.20 O=C(Cl)Cc1ccc(Cl)cc1 Amb1680103 [1,1,0,0,0,0|1,0,1]=4 2312 B11R1.20 O=C(Cl)Cc1ccc(F)cc1 Amb2688305 [1,1,0,0,0,0|1,0,1]=4 2313 B11R1.20 O=C(Cl)Cc1ccc(I)cc1 Amb24693364 [1,1,0,0,0,0|1,0,1]=4 2314 B11R1.20 O=C(Cl)Nc1ccc(Br)cc1 Amb35636932 [1,1,0,0,0,0|2,0,0]=4 2315 B11R1.20 O=C(Cl)Nc1ccc(F)cc1 Amb27176352 [1,1,0,0,0,0|2,0,0]=4 2316 B11R1.20 O=C(Cl)Nc1ccc(I)cc1 Amb35637047 [1,1,0,0,0,0|2,0,0]=4 2317 B11R1.20 O=C(Cl)Oc1ccc(Br)cc1 Amb21618685 [1,1,0,0,0,0|2,0,0]=4 2318 B11R1.20 O=C(Cl)Oc1ccc(Cl)cc1 Amb10068923 [1,1,0,0,0,0|2,0,0]=4 2319 B11R1.20 O=C(Cl)Oc1ccc(F)cc1 Amb8515375 [1,1,0,0,0,0|2,0,0]=4 2320 B11R1.20 O=C(Cl)Oc1ccc(I)cc1 Amb25775700 [1,1,0,0,0,0|2,0,0]=4 2321 B11R1.20 O=C(Cl)Sc1ccc(Br)cc1 Amb2685405 [1,1,0,0,0,0|2,0,0]=4 2322 B11R1.20 O=C(Cl)Sc1ccc(Cl)cc1 Amb4006610 [1,1,0,0,0,0|2,0,0]=4 2323 B11R1.20 O=C(Cl)Sc1ccc(F)cc1 Amb2688335 [1,1,0,0,0,0|2,0,0]=4 2324 B11R1.20 O=C(O)Cc1ccc(Br)cc1 Amb1140645 [1,1,0,0,0,0|1,0,1]=4 2325 B11R1.20 O=C(O)Cc1ccc(Cl)cc1 Amb843205 [1,1,0,0,0,0|1,0,1]=4 2326 B11R1.20 O=C(O)Cc1ccc(F)cc1 Amb535686 [1,1,0,0,0,0|1,0,1]=4 2327 B11R1.20 O=C(O)Cc1ccc(I)cc1 Amb3792687 [1,1,0,0,0,0|1,0,1]=4 2328 B11R1.20 O=C(O)Cc1ccc(O)cc1 Amb1214964 [1,1,0,0,0,0|1,0,1]=4 2329 B11R1.20 O=C(O)Cc1ccc(S)cc1 Amb10808003 [1,1,0,0,0,0|1,0,1]=4 2330 B11R1.20 Oc1ccc(C=C(Br)Br)cc1 Amb18635918 [1,1,0,0,0,0|2,0,0]=4 2331 B11R1.20 Oc1ccc(C=C(Cl)Cl)cc1 Amb22480456 [1,1,0,0,0,0|2,0,0]=4 2332 B11R1.20 Oc1ccc(C=C(F)F)cc1 Amb28351389 [1,1,0,0,0,0|2,0,0]=4 2333 B11R1.36 BrC(Br)=C(Br)c1ccccc1 Amb20246913 [1,1,0,0,0,0|2,0,0]=4 2334 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [1,1,0,0,0,0|1,0,0]=3 2335 B11R1.36 C=C(C(=O)O)c1ccccc1 Amb8628277 [1,1,0,0,0,0|1,0,0]=3 2336 B11R1.36 C=C(C(=O)O)c1cccnc1 Amb24578705 [1,1,0,0,0,0|2,0,0]=4 2337 B11R1.36 C=C(C(=O)O)c1ccncc1 Amb26880206 [1,1,0,0,0,0|2,0,0]=4 2338 B11R1.36 C=C(C(C)=O)c1ccncc1 Amb27955060 [1,1,0,0,0,0|1,0,0]=3 2339 B11R1.36 C=C(C)C(=O)c1ccccc1 Amb17593661 [1,1,0,0,0,0|0,0,0]=2 2340 B11R1.36 C=C(C)C(=O)c1ccccn1 Amb27648526 [1,1,0,0,0,0|1,0,0]=3 2341 B11R1.36 C=C(C)C(=O)c1cccnc1 Amb25139926 [1,1,0,0,0,0|1,0,0]=3 2342 B11R1.36 C=C(C)C(=O)c1ccncc1 Amb24413658 [1,1,0,0,0,0|1,0,0]=3 2343 B11R1.36 C=C(C)C(=O)c1cnccn1 Amb27602119 [1,1,0,0,0,0|2,0,0]=4 2344 B11R1.36 C=C(C)C(=O)c1ncccn1 Amb27601285 [1,1,0,0,0,0|2,0,0]=4 2345 B11R1.36 C=C(C)C(C)c1ccccc1 Amb27633476 [1,1,0,0,0,0|0,0,1]=3 2346 B11R1.36 C=C(C)C(O)c1ccccc1 Amb10807411 [1,1,0,0,0,0|0,0,1]=3 2347 B11R1.36 C=C(C)C(O)c1ccccn1 Amb27490582 [1,1,0,0,0,0|1,0,1]=4 2348 B11R1.36 C=C(C)[C@@H](O)c1ccncc1 Amb27775472 [1,1,0,0,0,0|1,0,1]=4 2349 B11R1.36 C=C(C)[C@H](O)c1ccccc1 Amb27486178 [1,1,0,0,0,0|0,0,1]=3 2350 B11R1.36 C=C(C)[C@H](O)c1ccncc1 Amb28249157 [1,1,0,0,0,0|1,0,1]=4 2351 B11R1.36 C=C(Cl)C(=O)c1ccccc1 Amb28075337 [1,1,0,0,0,0|1,0,0]=3 2352 B11R1.36 C=C(Cl)C(O)c1ccccc1 Amb27801522 [1,1,0,0,0,0|1,0,1]=4 2353 B11R1.36 C=C(Cl)N(C)c1ccccc1 Amb28284494 [1,1,0,0,0,0|2,0,0]=4 2354 B11R1.36 C=C(c1ccccc1)C(C)C Amb27803525 [1,1,0,0,0,0|0,0,2]=4 2355 B11R1.36 C=C(c1ccccc1)C(C)Cl Amb27407746 [1,1,0,0,0,0|1,0,1]=4 2356 B11R1.36 C=C(c1ccccc1)[N+](=O)[O-] Amb27787298 [1,1,0,0,0,0|2,0,0]=4 2357 B11R1.36 CC(=O)C(=O)c1ccccc1 Amb2099500 [1,1,0,0,0,0|0,0,0]=2 2358 B11R1.36 CC(=O)C(=O)c1ccccn1 Amb26880304 [1,1,0,0,0,0|1,0,0]=3 2359 B11R1.36 CC(=O)C(=O)c1cccnc1 Amb25152863 [1,1,0,0,0,0|1,0,0]=3 2360 B11R1.36 CC(=O)C(=O)c1ccncc1 Amb26074229 [1,1,0,0,0,0|1,0,0]=3 2361 B11R1.36 CC(=O)C(Br)c1ccccc1 Amb16234147 [1,1,0,0,0,0|0,0,1]=3 2362 B11R1.36 CC(=O)C(Br)c1ccccn1 Amb31193103 [1,1,0,0,0,0|1,0,1]=4 2363 B11R1.36 CC(=O)C(Br)c1cccnc1 Amb31193104 [1,1,0,0,0,0|1,0,1]=4 2364 B11R1.36 CC(=O)C(Br)c1ccncc1 Amb31193105 [1,1,0,0,0,0|1,0,1]=4 2365 B11R1.36 CC(=O)C(C)c1ccccc1 Amb17593697 [1,1,0,0,0,0|0,0,1]=3 2366 B11R1.36 CC(=O)C(C)c1ccccn1 Amb17593714 [1,1,0,0,0,0|1,0,1]=4 2367 B11R1.36 CC(=O)C(Cl)c1ccccc1 Amb387177 [1,1,0,0,0,0|0,0,1]=3 2368 B11R1.36 CC(=O)C(Cl)c1ccccn1 Amb17477809 [1,1,0,0,0,0|1,0,1]=4 2369 B11R1.36 CC(=O)C(Cl)c1cccnc1 Amb17477811 [1,1,0,0,0,0|1,0,1]=4 2370 B11R1.36 CC(=O)C(Cl)c1ccncc1 Amb17477810 [1,1,0,0,0,0|1,0,1]=4 2371 B11R1.36 CC(=O)C(F)c1ccccc1 Amb26477979 [1,1,0,0,0,0|0,0,1]=3 2372 B11R1.36 CC(=O)C(F)c1ccccn1 Amb28200147 [1,1,0,0,0,0|1,0,1]=4 2373 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,1,0,0,0,0|0,0,1]=3 2374 B11R1.36 CC(=O)C(N)c1ccccc1 Amb2725723 [1,1,0,0,0,0|0,0,1]=3 2375 B11R1.36 CC(=O)C(N)c1ccncc1 Amb27596048 [1,1,0,0,0,0|1,0,1]=4 2376 B11R1.36 CC(=O)C(O)c1ccccc1 Amb17593725 [1,1,0,0,0,0|0,0,1]=3 2377 B11R1.36 CC(=O)C(O)c1ccccn1 Amb24392468 [1,1,0,0,0,0|1,0,1]=4 2378 B11R1.36 CC(=O)C(O)c1cccnc1 Amb24486339 [1,1,0,0,0,0|1,0,1]=4 2379 B11R1.36 CC(=O)C(O)c1ccncc1 Amb26321275 [1,1,0,0,0,0|1,0,1]=4 2380 B11R1.36 CC(=O)C(S)c1ccccc1 Amb17594139 [1,1,0,0,0,0|0,0,1]=3 2381 B11R1.36 CC(=O)N(C)c1ccccc1 Amb2610164 [1,1,0,0,0,0|1,0,0]=3 2382 B11R1.36 CC(=O)N(C)c1ccccn1 Amb33544322 [1,1,0,0,0,0|2,0,0]=4 2383 B11R1.36 CC(=O)N(C)c1cccnc1 Amb2759618 [1,1,0,0,0,0|2,0,0]=4 2384 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [1,1,0,0,0,0|1,0,0]=3 2385 B11R1.36 CC(=O)N(N)c1ccccc1 Amb4018565 [1,1,0,0,0,0|1,0,0]=3 2386 B11R1.36 CC(=O)N(N)c1ccccn1 Amb33191442 [1,1,0,0,0,0|2,0,0]=4 2387 B11R1.36 CC(=O)N(O)c1ccccc1 Amb9786754 [1,1,0,0,0,0|1,0,0]=3 2388 B11R1.36 CC(=O)[C@@H](Br)c1ccccc1 Amb27176478 [1,1,0,0,0,0|0,0,1]=3 2389 B11R1.36 CC(=O)[C@@H](O)c1ccccc1 Amb17619252 [1,1,0,0,0,0|0,0,1]=3 2390 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,1,0,0,0,0|0,0,1]=3 2391 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [1,1,0,0,0,0|1,0,1]=4 2392 B11R1.36 CC(C(=O)O)c1ccccc1 Amb2720839 [1,1,0,0,0,0|1,0,1]=4 2393 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,1,0,0,0,0|1,0,1]=4 2394 B11R1.36 CC(C)=C(C)c1ccccc1 Amb2780673 [1,1,0,0,0,0|0,0,1]=3 2395 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [1,1,0,0,0,0|0,0,2]=4 2396 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [1,1,0,0,0,0|1,0,1]=4 2397 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [1,1,0,0,0,0|1,0,1]=4 2398 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [1,1,0,0,0,0|1,0,1]=4 2399 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,1,0,0,0,0|0,0,2]=4 2400 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,1,0,0,0,0|0,1,1]=4 2401 B11R1.36 CN(C(=O)Cl)c1ccccc1 Amb8516708 [1,1,0,0,0,0|2,0,0]=4 2402 B11R1.36 CN(C(N)=O)c1ccccc1 Amb1137584 [1,1,0,0,0,0|2,0,0]=4 2403 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,1,0,0,0,0|1,0,1]=4 2404 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [1,1,0,0,0,0|1,0,1]=4 2405 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [1,1,0,0,0,0|1,0,1]=4 2406 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [1,1,0,0,0,0|1,0,1]=4 2407 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [1,1,0,0,0,0|2,0,0]=4 2408 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,1,0,0,0,0|2,0,0]=4 2409 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [1,1,0,0,0,0|2,0,0]=4 2410 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [1,1,0,0,0,0|1,0,1]=4 2411 B11R1.36 CS(=O)[C@@H](Cl)c1ccccc1 Amb27401935 [1,1,0,0,0,0|1,0,1]=4 2412 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [1,1,0,0,0,0|1,0,1]=4 2413 B11R1.36 C[C@@H](C(=O)O)c1ccccc1 Amb8514913 [1,1,0,0,0,0|1,0,1]=4 2414 B11R1.36 C[C@@H](C(N)=O)c1ccccc1 Amb4166308 [1,1,0,0,0,0|1,0,1]=4 2415 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,1,0,0,0,0|1,0,1]=4 2416 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,1,0,0,0,0|1,0,1]=4 2417 B11R1.36 C[C@H](C(=O)O)c1ccccc1 Amb3938973 [1,1,0,0,0,0|1,0,1]=4 2418 B11R1.36 C[C@H](C(N)=O)c1ccccc1 Amb4166312 [1,1,0,0,0,0|1,0,1]=4 2419 B11R1.36 C\C(Br)=C(/C)c1ccccc1 Amb4035425 [1,1,0,0,0,0|1,0,0]=3 2420 B11R1.36 C\[N+]([O-])=C(/N)c1ccccc1 Amb27949093 [1,1,0,0,0,0|1,0,1]=4 2421 B11R1.36 C\[N+]([O-])=C(\N)c1ccccc1 Amb33621249 [1,1,0,0,0,0|1,0,1]=4 2422 B11R1.36 FC(F)=C(Br)c1ccccc1 Amb22008100 [1,1,0,0,0,0|2,0,0]=4 2423 B11R1.36 FC(F)=C(F)c1ccccc1 Amb10839818 [1,1,0,0,0,0|2,0,0]=4 2424 B11R1.36 F\C(Cl)=C(/F)c1ccccc1 Amb13952905 [1,1,0,0,0,0|2,0,0]=4 2425 B11R1.36 N=C(N)C(=O)c1ccccc1 Amb27654024 [1,1,0,0,0,0|2,0,0]=4 2426 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [1,1,0,0,0,0|1,0,0]=3 2427 B11R1.36 NC(=O)C(=O)c1cccnc1 Amb18063199 [1,1,0,0,0,0|2,0,0]=4 2428 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,1,0,0,0,0|1,0,1]=4 2429 B11R1.36 NC(=O)C(Cl)c1ccccc1 Amb1678054 [1,1,0,0,0,0|1,0,1]=4 2430 B11R1.36 NC(=O)C(N)c1ccccc1 Amb13951330 [1,1,0,0,0,0|1,0,1]=4 2431 B11R1.36 NC(=O)C(N)c1ccccc1 Amb9720012 [1,1,0,0,0,0|1,0,1]=4 2432 B11R1.36 NC(=O)C(O)c1ccccc1 Amb2611605 [1,1,0,0,0,0|1,0,1]=4 2433 B11R1.36 NC(=O)C(S)c1ccccc1 Amb27823310 [1,1,0,0,0,0|1,0,1]=4 2434 B11R1.36 NC(=O)[C@@H](Cl)c1ccccc1 Amb28244737 [1,1,0,0,0,0|1,0,1]=4 2435 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb10603128 [1,1,0,0,0,0|1,0,1]=4 2436 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,1,0,0,0,0|1,0,1]=4 2437 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,1,0,0,0,0|1,0,1]=4 2438 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,1,0,0,0,0|1,0,1]=4 2439 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb8392882 [1,1,0,0,0,0|1,0,1]=4 2440 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,1,0,0,0,0|1,0,1]=4 2441 B11R1.36 NC(=S)C(=O)c1ccccc1 Amb6892994 [1,1,0,0,0,0|1,1,0]=4 2442 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [1,1,0,0,0,0|1,0,1]=4 2443 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb533254 [1,1,0,0,0,0|1,0,1]=4 2444 B11R1.36 NC(C(=O)O)c1ccccc1 Amb1869285 [1,1,0,0,0,0|1,0,1]=4 2445 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [1,1,0,0,0,0|1,0,1]=4 2446 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 Amb22745585 [1,1,0,0,0,0|1,0,1]=4 2447 B11R1.36 N[C@@H](C(=O)O)c1ccccc1 Amb2747967 [1,1,0,0,0,0|1,0,1]=4 2448 B11R1.36 N[C@H](C(=O)O)c1ccccc1 Amb533283 [1,1,0,0,0,0|1,0,1]=4 2449 B11R1.36 O=C(Cl)C(=O)c1ccccn1 Amb27954072 [1,1,0,0,0,0|2,0,0]=4 2450 B11R1.36 O=C(Cl)C(Br)c1ccccc1 Amb27597409 [1,1,0,0,0,0|1,0,1]=4 2451 B11R1.36 O=C(Cl)C(Cl)c1ccccc1 Amb9703183 [1,1,0,0,0,0|1,0,1]=4 2452 B11R1.36 O=C(Cl)C(F)c1ccccc1 Amb27617426 [1,1,0,0,0,0|1,0,1]=4 2453 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb2611302 [1,1,0,0,0,0|1,0,0]=3 2454 B11R1.36 O=C(O)C(=O)c1ccccc1 Amb33204525 [1,1,0,0,0,0|1,0,0]=3 2455 B11R1.36 O=C(O)C(=O)c1ccccn1 Amb18831273 [1,1,0,0,0,0|2,0,0]=4 2456 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb15701278 [1,1,0,0,0,0|2,0,0]=4 2457 B11R1.36 O=C(O)C(=O)c1cccnc1 Amb22492371 [1,1,0,0,0,0|2,0,0]=4 2458 B11R1.36 O=C(O)C(Br)c1ccccc1 Amb2720724 [1,1,0,0,0,0|1,0,1]=4 2459 B11R1.36 O=C(O)C(Cl)c1ccccc1 Amb518006 [1,1,0,0,0,0|1,0,1]=4 2460 B11R1.36 O=C(O)C(F)c1ccccc1 Amb2688302 [1,1,0,0,0,0|1,0,1]=4 2461 B11R1.36 O=C(O)C(O)c1ccccc1 Amb4018578 [1,1,0,0,0,0|1,0,1]=4 2462 B11R1.36 O=C(O)C(O)c1ccccc1 Amb9703097 [1,1,0,0,0,0|1,0,1]=4 2463 B11R1.36 O=C(O)C(S)c1ccccc1 Amb6753823 [1,1,0,0,0,0|1,0,1]=4 2464 B11R1.36 O=C(O)[C@@H](Br)c1ccccc1 Amb25056175 [1,1,0,0,0,0|1,0,1]=4 2465 B11R1.36 O=C(O)[C@@H](Cl)c1ccccc1 Amb27413742 [1,1,0,0,0,0|1,0,1]=4 2466 B11R1.36 O=C(O)[C@@H](F)c1ccccc1 Amb27632458 [1,1,0,0,0,0|1,0,1]=4 2467 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 Amb6354582 [1,1,0,0,0,0|1,0,1]=4 2468 B11R1.36 O=C(O)[C@H](Br)c1ccccc1 Amb27176517 [1,1,0,0,0,0|1,0,1]=4 2469 B11R1.36 O=C(O)[C@H](F)c1ccccc1 Amb27955206 [1,1,0,0,0,0|1,0,1]=4 2470 B11R1.36 O=C(O)[C@H](O)c1ccccc1 Amb3428495 [1,1,0,0,0,0|1,0,1]=4 2471 B11R1.36 O=C([O-])C(=O)c1ccccc1 Amb33204524 [1,1,0,0,0,0|1,0,0]=3 2472 B11R1.36 O=C([O-])C(F)c1ccccc1 Amb33512978 [1,1,0,0,0,0|1,0,1]=4 2473 B11R1.36 [NH3+]C(C(=O)O)c1ccccc1 Amb22641589 [1,1,0,0,0,0|1,0,1]=4 2474 B11R1.86 BrC(Br)=Cc1ccccc1Br Amb24074060 [1,1,0,0,0,0|2,0,0]=4 2475 B11R1.86 C=C(C)Cc1ccccc1N Amb18124844 [1,1,0,0,0,0|0,0,1]=3 2476 B11R1.86 C=C(C)Cc1cccnc1C Amb28245734 [1,1,0,0,0,0|1,0,1]=4 2477 B11R1.86 C=C(C)Cc1cccnc1N Amb27251284 [1,1,0,0,0,0|1,0,1]=4 2478 B11R1.86 C=C(C)Cc1cnccc1N Amb27245483 [1,1,0,0,0,0|1,0,1]=4 2479 B11R1.86 C=C(C)Cc1ncccc1Br Amb27165908 [1,1,0,0,0,0|1,0,1]=4 2480 B11R1.86 C=C(C)Oc1ccccc1Cl Amb26611218 [1,1,0,0,0,0|1,0,0]=3 2481 B11R1.86 C=C(C)Sc1ccccc1O Amb18646620 [1,1,0,0,0,0|1,0,0]=3 2482 B11R1.86 CC(=N)Nc1ccccc1Br Amb28249813 [1,1,0,0,0,0|2,0,0]=4 2483 B11R1.86 CC(=N)Nc1ccccc1C Amb27644968 [1,1,0,0,0,0|2,0,0]=4 2484 B11R1.86 CC(=O)CN1C=CC=CC1=O Amb18177167 [1,1,0,0,0,0|1,0,1]=4 2485 B11R1.86 CC(=O)CN1C=CC=CC1=O Amb28652828 [1,1,0,0,0,0|1,0,1]=4 2486 B11R1.86 CC(=O)C[n+]1ccccc1C Amb2587647 [1,1,0,0,0,0|1,0,1]=4 2487 B11R1.86 CC(=O)Cc1ccccc1Br Amb6365737 [1,1,0,0,0,0|0,0,1]=3 2488 B11R1.86 CC(=O)Cc1ccccc1C Amb5751053 [1,1,0,0,0,0|0,0,1]=3 2489 B11R1.86 CC(=O)Cc1ccccc1Cl Amb2724208 [1,1,0,0,0,0|0,0,1]=3 2490 B11R1.86 CC(=O)Cc1ccccc1F Amb5751055 [1,1,0,0,0,0|0,0,1]=3 2491 B11R1.86 CC(=O)Cc1ccccc1I Amb24431271 [1,1,0,0,0,0|0,0,1]=3 2492 B11R1.86 CC(=O)Cc1ccccc1N Amb8439140 [1,1,0,0,0,0|0,0,1]=3 2493 B11R1.86 CC(=O)Cc1ccccc1O Amb18041942 [1,1,0,0,0,0|0,0,1]=3 2494 B11R1.86 CC(=O)Cc1cccnc1Br Amb33387404 [1,1,0,0,0,0|1,0,1]=4 2495 B11R1.86 CC(=O)Cc1cccnc1C Amb32880144 [1,1,0,0,0,0|1,0,1]=4 2496 B11R1.86 CC(=O)Cc1cccnc1Cl Amb26498947 [1,1,0,0,0,0|1,0,1]=4 2497 B11R1.86 CC(=O)Cc1cccnc1F Amb33378646 [1,1,0,0,0,0|1,0,1]=4 2498 B11R1.86 CC(=O)Cc1ccncc1Br Amb33451972 [1,1,0,0,0,0|1,0,1]=4 2499 B11R1.86 CC(=O)Cc1ccncc1C Amb33172422 [1,1,0,0,0,0|1,0,1]=4 2500 B11R1.86 CC(=O)Cc1ccncc1Cl Amb27640776 [1,1,0,0,0,0|1,0,1]=4 2501 B11R1.86 CC(=O)Cc1ccncc1F Amb25152854 [1,1,0,0,0,0|1,0,1]=4 2502 B11R1.86 CC(=O)Cc1cnccc1C Amb33376248 [1,1,0,0,0,0|1,0,1]=4 2503 B11R1.86 CC(=O)Cc1ncccc1Br Amb26622459 [1,1,0,0,0,0|1,0,1]=4 2504 B11R1.86 CC(=O)Cc1ncccc1C Amb1995156 [1,1,0,0,0,0|1,0,1]=4 2505 B11R1.86 CC(=O)Cc1ncccc1Cl Amb25169236 [1,1,0,0,0,0|1,0,1]=4 2506 B11R1.86 CC(=O)Cc1ncccc1F Amb23402724 [1,1,0,0,0,0|1,0,1]=4 2507 B11R1.86 CC(=O)NC1=CC=CNC1=O Amb22747067 [1,1,0,0,0,0|2,0,0]=4 2508 B11R1.86 CC(=O)NC1=CC=CNC1=S Amb25322217 [1,1,0,0,0,0|2,0,0]=4 2509 B11R1.86 CC(=O)Nc1cccc[n+]1[O-] Amb2609603 [1,1,0,0,0,0|2,0,0]=4 2510 B11R1.86 CC(=O)Nc1ccccc1Br Amb2611397 [1,1,0,0,0,0|1,0,0]=3 2511 B11R1.86 CC(=O)Nc1ccccc1C Amb6346350 [1,1,0,0,0,0|1,0,0]=3 2512 B11R1.86 CC(=O)Nc1ccccc1Cl Amb6349758 [1,1,0,0,0,0|1,0,0]=3 2513 B11R1.86 CC(=O)Nc1ccccc1F Amb2444091 [1,1,0,0,0,0|1,0,0]=3 2514 B11R1.86 CC(=O)Nc1ccccc1I Amb2652722 [1,1,0,0,0,0|1,0,0]=3 2515 B11R1.86 CC(=O)Nc1ccccc1N Amb1121033 [1,1,0,0,0,0|1,0,0]=3 2516 B11R1.86 CC(=O)Nc1ccccc1O Amb1212257 [1,1,0,0,0,0|1,0,0]=3 2517 B11R1.86 CC(=O)Nc1ccccc1S Amb16186713 [1,1,0,0,0,0|1,0,0]=3 2518 B11R1.86 CC(=O)Nc1cccnc1Br Amb2611773 [1,1,0,0,0,0|2,0,0]=4 2519 B11R1.86 CC(=O)Nc1cccnc1C Amb22750736 [1,1,0,0,0,0|2,0,0]=4 2520 B11R1.86 CC(=O)Nc1cccnc1Cl Amb6512902 [1,1,0,0,0,0|2,0,0]=4 2521 B11R1.86 CC(=O)Nc1cccnc1F Amb30018366 [1,1,0,0,0,0|2,0,0]=4 2522 B11R1.86 CC(=O)Nc1cccnc1N Amb28291490 [1,1,0,0,0,0|2,0,0]=4 2523 B11R1.86 CC(=O)Nc1cccnc1N Amb32718785 [1,1,0,0,0,0|2,0,0]=4 2524 B11R1.86 CC(=O)Nc1ccncc1Br Amb6752536 [1,1,0,0,0,0|2,0,0]=4 2525 B11R1.86 CC(=O)Nc1ccncc1C Amb20248230 [1,1,0,0,0,0|2,0,0]=4 2526 B11R1.86 CC(=O)Nc1ccncc1I Amb28454772 [1,1,0,0,0,0|2,0,0]=4 2527 B11R1.86 CC(=O)Nc1ccncc1N Amb16230402 [1,1,0,0,0,0|2,0,0]=4 2528 B11R1.86 CC(=O)Nc1ccncc1O Amb13889918 [1,1,0,0,0,0|2,0,0]=4 2529 B11R1.86 CC(=O)Nc1ccncc1S Amb27762378 [1,1,0,0,0,0|2,0,0]=4 2530 B11R1.86 CC(=O)Nc1cnccc1C Amb5492735 [1,1,0,0,0,0|2,0,0]=4 2531 B11R1.86 CC(=O)Nc1cnccc1Cl Amb22495899 [1,1,0,0,0,0|2,0,0]=4 2532 B11R1.86 CC(=O)Nc1cnccc1I Amb27223562 [1,1,0,0,0,0|2,0,0]=4 2533 B11R1.86 CC(=O)Nc1cnccc1N Amb20247153 [1,1,0,0,0,0|2,0,0]=4 2534 B11R1.86 CC(=O)Nc1cnccc1N Amb24083708 [1,1,0,0,0,0|2,0,0]=4 2535 B11R1.86 CC(=O)Nc1cnccc1O Amb13889919 [1,1,0,0,0,0|2,0,0]=4 2536 B11R1.86 CC(=O)Nc1ncccc1Br Amb2867378 [1,1,0,0,0,0|2,0,0]=4 2537 B11R1.86 CC(=O)Nc1ncccc1C Amb3361417 [1,1,0,0,0,0|2,0,0]=4 2538 B11R1.86 CC(=O)Nc1ncccc1F Amb23401859 [1,1,0,0,0,0|2,0,0]=4 2539 B11R1.86 CC(=O)Nc1ncccc1N Amb18125264 [1,1,0,0,0,0|2,0,0]=4 2540 B11R1.86 CC(=O)Nc1ncccc1O Amb8630319 [1,1,0,0,0,0|2,0,0]=4 2541 B11R1.86 CC(=O)Oc1cccc[n+]1[O-] Amb27661878 [1,1,0,0,0,0|2,0,0]=4 2542 B11R1.86 CC(=O)Oc1ccccc1Br Amb20242519 [1,1,0,0,0,0|1,0,0]=3 2543 B11R1.86 CC(=O)Oc1ccccc1Cl Amb3123033 [1,1,0,0,0,0|1,0,0]=3 2544 B11R1.86 CC(=O)Oc1ccccc1F Amb10605688 [1,1,0,0,0,0|1,0,0]=3 2545 B11R1.86 CC(=O)Oc1ccccc1I Amb10975213 [1,1,0,0,0,0|1,0,0]=3 2546 B11R1.86 CC(=O)Oc1ccccc1O Amb18125344 [1,1,0,0,0,0|1,0,0]=3 2547 B11R1.86 CC(=O)Oc1cccnc1Br Amb4017668 [1,1,0,0,0,0|2,0,0]=4 2548 B11R1.86 CC(=O)Oc1cccnc1Cl Amb28188019 [1,1,0,0,0,0|2,0,0]=4 2549 B11R1.86 CC(=O)Oc1cccnc1I Amb2405507 [1,1,0,0,0,0|2,0,0]=4 2550 B11R1.86 CC(=O)Oc1cnccc1Br Amb23412302 [1,1,0,0,0,0|2,0,0]=4 2551 B11R1.86 CC(=O)Oc1cnccc1I Amb28052820 [1,1,0,0,0,0|2,0,0]=4 2552 B11R1.86 CC(=O)Oc1ncccc1Cl Amb27869965 [1,1,0,0,0,0|2,0,0]=4 2553 B11R1.86 CC(=O)Sc1ccccc1C Amb25189277 [1,1,0,0,0,0|1,0,0]=3 2554 B11R1.86 CC(=S)Nc1ccccc1C Amb26568449 [1,1,0,0,0,0|1,1,0]=4 2555 B11R1.86 CC(=S)Nc1ccccc1Cl Amb24640250 [1,1,0,0,0,0|1,1,0]=4 2556 B11R1.86 CC(=S)Nc1ccccc1F Amb25742786 [1,1,0,0,0,0|1,1,0]=4 2557 B11R1.86 CC(=S)Nc1ccccc1I Amb27213753 [1,1,0,0,0,0|1,1,0]=4 2558 B11R1.86 CC(C)=Cc1cccc[n+]1[O-] Amb10553706 [1,1,0,0,0,0|1,0,1]=4 2559 B11R1.86 CC(C)=Cc1ccccc1Br Amb27395335 [1,1,0,0,0,0|0,0,1]=3 2560 B11R1.86 CC(C)=Cc1ccncc1Br Amb25071786 [1,1,0,0,0,0|1,0,1]=4 2561 B11R1.86 CS(=O)Cc1ccccc1N Amb18282229 [1,1,0,0,0,0|1,0,1]=4 2562 B11R1.86 C\C(Br)=C\c1ccccc1N Amb27643490 [1,1,0,0,0,0|1,0,0]=3 2563 B11R1.86 C\C(Cl)=N\c1ccccc1N Amb25893020 [1,1,0,0,0,0|2,0,0]=4 2564 B11R1.86 C\[N+]([O-])=C/c1ccccc1Cl Amb2441920 [1,1,0,0,0,0|1,0,1]=4 2565 B11R1.86 C\[N+]([O-])=C\c1ccccc1F Amb24441067 [1,1,0,0,0,0|1,0,1]=4 2566 B11R1.86 Cc1ccccc1CC(=O)Cl Amb2690618 [1,1,0,0,0,0|1,0,1]=4 2567 B11R1.86 Cc1ccccc1CC(=O)O Amb2609430 [1,1,0,0,0,0|1,0,1]=4 2568 B11R1.86 Cc1ccccc1CC(N)=O Amb2107849 [1,1,0,0,0,0|1,0,1]=4 2569 B11R1.86 Cc1ccccc1CS(C)=O Amb27261207 [1,1,0,0,0,0|1,0,1]=4 2570 B11R1.86 Cc1ccccc1NC(N)=O Amb6357971 [1,1,0,0,0,0|2,0,0]=4 2571 B11R1.86 Cc1ccccc1OC(=O)Cl Amb24055454 [1,1,0,0,0,0|2,0,0]=4 2572 B11R1.86 Cc1ccccc1SC(N)=O Amb27951930 [1,1,0,0,0,0|2,0,0]=4 2573 B11R1.86 F\C(Br)=C/c1ccccc1F Amb32680149 [1,1,0,0,0,0|2,0,0]=4 2574 B11R1.86 Fc1ccccc1C=C(Br)Br Amb18115341 [1,1,0,0,0,0|2,0,0]=4 2575 B11R1.86 NC(=O)Cc1ccccc1Br Amb2754651 [1,1,0,0,0,0|1,0,1]=4 2576 B11R1.86 NC(=O)Cc1ccccc1Cl Amb33551592 [1,1,0,0,0,0|1,0,1]=4 2577 B11R1.86 NC(=O)Cc1ccccc1F Amb33551560 [1,1,0,0,0,0|1,0,1]=4 2578 B11R1.86 NC(=O)Cc1ccccc1I Amb24685113 [1,1,0,0,0,0|1,0,1]=4 2579 B11R1.86 NC(=O)Cc1ccccc1N Amb1116123 [1,1,0,0,0,0|1,0,1]=4 2580 B11R1.86 NC(=O)Cc1ccccc1O Amb4020853 [1,1,0,0,0,0|1,0,1]=4 2581 B11R1.86 NC(=O)Nc1ccccc1Br Amb1140530 [1,1,0,0,0,0|2,0,0]=4 2582 B11R1.86 NC(=O)Nc1ccccc1Cl Amb1131193 [1,1,0,0,0,0|2,0,0]=4 2583 B11R1.86 NC(=O)Nc1ccccc1F Amb1211836 [1,1,0,0,0,0|2,0,0]=4 2584 B11R1.86 NC(=O)Nc1ccccc1N Amb1114330 [1,1,0,0,0,0|2,0,0]=4 2585 B11R1.86 NC(=O)Nc1ccccc1O Amb18125361 [1,1,0,0,0,0|2,0,0]=4 2586 B11R1.86 NC(=O)Oc1ccccc1O Amb27148270 [1,1,0,0,0,0|2,0,0]=4 2587 B11R1.86 Nc1ccccc1CC(=O)O Amb5519014 [1,1,0,0,0,0|1,0,1]=4 2588 B11R1.86 O=C(Cl)Cc1ccccc1Br Amb3939380 [1,1,0,0,0,0|1,0,1]=4 2589 B11R1.86 O=C(Cl)Cc1ccccc1Cl Amb6743385 [1,1,0,0,0,0|1,0,1]=4 2590 B11R1.86 O=C(Cl)Cc1ccccc1F Amb2608188 [1,1,0,0,0,0|1,0,1]=4 2591 B11R1.86 O=C(Cl)Cc1ccccc1I Amb28368335 [1,1,0,0,0,0|1,0,1]=4 2592 B11R1.86 O=C(Cl)Cc1ccccc1O Amb27477566 [1,1,0,0,0,0|1,0,1]=4 2593 B11R1.86 O=C(Cl)Nc1ccccc1Br Amb35636931 [1,1,0,0,0,0|2,0,0]=4 2594 B11R1.86 O=C(Cl)Nc1ccccc1Cl Amb27653292 [1,1,0,0,0,0|2,0,0]=4 2595 B11R1.86 O=C(Cl)Nc1ccccc1F Amb35637035 [1,1,0,0,0,0|2,0,0]=4 2596 B11R1.86 O=C(Cl)Nc1ccccc1I Amb35637031 [1,1,0,0,0,0|2,0,0]=4 2597 B11R1.86 O=C(Cl)Oc1ccccc1Br Amb28365355 [1,1,0,0,0,0|2,0,0]=4 2598 B11R1.86 O=C(Cl)Oc1ccccc1Cl Amb10844668 [1,1,0,0,0,0|2,0,0]=4 2599 B11R1.86 O=C(Cl)Oc1ccccc1F Amb26641132 [1,1,0,0,0,0|2,0,0]=4 2600 B11R1.86 O=C(Cl)Oc1ccccc1I Amb28313136 [1,1,0,0,0,0|2,0,0]=4 2601 B11R1.86 O=C(Cl)Sc1ccccc1Cl Amb32679650 [1,1,0,0,0,0|2,0,0]=4 2602 B11R1.86 O=C(Cl)Sc1ccccc1F Amb2688333 [1,1,0,0,0,0|2,0,0]=4 2603 B11R1.86 O=C(O)Cc1ccccc1Br Amb1139894 [1,1,0,0,0,0|1,0,1]=4 2604 B11R1.86 O=C(O)Cc1ccccc1Cl Amb6365808 [1,1,0,0,0,0|1,0,1]=4 2605 B11R1.86 O=C(O)Cc1ccccc1F Amb2688300 [1,1,0,0,0,0|1,0,1]=4 2606 B11R1.86 O=C(O)Cc1ccccc1I Amb2754650 [1,1,0,0,0,0|1,0,1]=4 2607 B11R1.86 O=C(O)Cc1ccccc1O Amb2388914 [1,1,0,0,0,0|1,0,1]=4 2608 B11R1.86 O=C(O)Cc1ccccc1S Amb17616851 [1,1,0,0,0,0|1,0,1]=4 2609 B11R1.86 Oc1ccccc1C=C(Br)Br Amb28077279 [1,1,0,0,0,0|2,0,0]=4 2610 B11R1.157 BrC(Br)=Cc1cccc(Br)c1 Amb26010765 [1,1,0,0,0,0|2,0,0]=4 2611 B11R1.157 BrC(Br)=Cc1cccc(I)c1 Amb27989203 [1,1,0,0,0,0|2,0,0]=4 2612 B11R1.157 C=C(Br)Cc1cccc(F)c1 Amb2685248 [1,1,0,0,0,0|1,0,1]=4 2613 B11R1.157 C=C(C)Cc1cccc(F)c1 Amb6299102 [1,1,0,0,0,0|0,0,1]=3 2614 B11R1.157 C=C(C)Cc1cccc(O)c1 Amb24388029 [1,1,0,0,0,0|0,0,1]=3 2615 B11R1.157 C=C(C)Cc1cncc(C)c1 Amb27759150 [1,1,0,0,0,0|1,0,1]=4 2616 B11R1.157 CC(=N)Nc1cccc(Cl)c1 Amb19884067 [1,1,0,0,0,0|2,0,0]=4 2617 B11R1.157 CC(=N)Nc1cccc(F)c1 Amb27878149 [1,1,0,0,0,0|2,0,0]=4 2618 B11R1.157 CC(=O)Cc1cc(C)ccn1 Amb1995157 [1,1,0,0,0,0|1,0,1]=4 2619 B11R1.157 CC(=O)Cc1cc(Cl)ccn1 Amb25808767 [1,1,0,0,0,0|1,0,1]=4 2620 B11R1.157 CC(=O)Cc1cc(F)ccn1 Amb33415315 [1,1,0,0,0,0|1,0,1]=4 2621 B11R1.157 CC(=O)Cc1cccc(Br)c1 Amb2720459 [1,1,0,0,0,0|0,0,1]=3 2622 B11R1.157 CC(=O)Cc1cccc(Br)n1 Amb33451630 [1,1,0,0,0,0|1,0,1]=4 2623 B11R1.157 CC(=O)Cc1cccc(C)c1 Amb5751054 [1,1,0,0,0,0|0,0,1]=3 2624 B11R1.157 CC(=O)Cc1cccc(C)n1 Amb1995166 [1,1,0,0,0,0|1,0,1]=4 2625 B11R1.157 CC(=O)Cc1cccc(Cl)c1 Amb2720462 [1,1,0,0,0,0|0,0,1]=3 2626 B11R1.157 CC(=O)Cc1cccc(Cl)n1 Amb25074053 [1,1,0,0,0,0|1,0,1]=4 2627 B11R1.157 CC(=O)Cc1cccc(F)c1 Amb6296723 [1,1,0,0,0,0|0,0,1]=3 2628 B11R1.157 CC(=O)Cc1cccc(I)c1 Amb6298715 [1,1,0,0,0,0|0,0,1]=3 2629 B11R1.157 CC(=O)Cc1cccc(N)c1 Amb17477728 [1,1,0,0,0,0|0,0,1]=3 2630 B11R1.157 CC(=O)Cc1cccc(O)c1 Amb16192704 [1,1,0,0,0,0|0,0,1]=3 2631 B11R1.157 CC(=O)Cc1ccnc(C)c1 Amb33268653 [1,1,0,0,0,0|1,0,1]=4 2632 B11R1.157 CC(=O)Cc1ccnc(Cl)c1 Amb25301796 [1,1,0,0,0,0|1,0,1]=4 2633 B11R1.157 CC(=O)Cc1cncc(Br)c1 Amb24080127 [1,1,0,0,0,0|1,0,1]=4 2634 B11R1.157 CC(=O)Cc1cncc(C)c1 Amb33226951 [1,1,0,0,0,0|1,0,1]=4 2635 B11R1.157 CC(=O)Cc1cncc(Cl)c1 Amb28291452 [1,1,0,0,0,0|1,0,1]=4 2636 B11R1.157 CC(=O)Cc1cncc(F)c1 Amb26451413 [1,1,0,0,0,0|1,0,1]=4 2637 B11R1.157 CC(=O)NC1=CC(=O)NC=C1 Amb22752689 [1,1,0,0,0,0|2,0,0]=4 2638 B11R1.157 CC(=O)Nc1cc(Br)ccn1 Amb21857697 [1,1,0,0,0,0|2,0,0]=4 2639 B11R1.157 CC(=O)Nc1cc(C)ccn1 Amb2609640 [1,1,0,0,0,0|2,0,0]=4 2640 B11R1.157 CC(=O)Nc1cc(Cl)ccn1 Amb15690612 [1,1,0,0,0,0|2,0,0]=4 2641 B11R1.157 CC(=O)Nc1cc(N)ccn1 Amb18644458 [1,1,0,0,0,0|2,0,0]=4 2642 B11R1.157 CC(=O)Nc1cccc(Br)c1 Amb1019639 [1,1,0,0,0,0|1,0,0]=3 2643 B11R1.157 CC(=O)Nc1cccc(Br)n1 Amb8630362 [1,1,0,0,0,0|2,0,0]=4 2644 B11R1.157 CC(=O)Nc1cccc(C)c1 Amb1934773 [1,1,0,0,0,0|1,0,0]=3 2645 B11R1.157 CC(=O)Nc1cccc(C)n1 Amb1244208 [1,1,0,0,0,0|2,0,0]=4 2646 B11R1.157 CC(=O)Nc1cccc(Cl)c1 Amb2613344 [1,1,0,0,0,0|1,0,0]=3 2647 B11R1.157 CC(=O)Nc1cccc(F)c1 Amb2688004 [1,1,0,0,0,0|1,0,0]=3 2648 B11R1.157 CC(=O)Nc1cccc(I)c1 Amb2974878 [1,1,0,0,0,0|1,0,0]=3 2649 B11R1.157 CC(=O)Nc1cccc(N)c1 Amb2720166 [1,1,0,0,0,0|1,0,0]=3 2650 B11R1.157 CC(=O)Nc1cccc(N)c1 Amb6335837 [1,1,0,0,0,0|1,0,0]=3 2651 B11R1.157 CC(=O)Nc1cccc(N)n1 Amb8438991 [1,1,0,0,0,0|2,0,0]=4 2652 B11R1.157 CC(=O)Nc1cccc(O)c1 Amb1208498 [1,1,0,0,0,0|1,0,0]=3 2653 B11R1.157 CC(=O)Nc1cccc(S)c1 Amb27446574 [1,1,0,0,0,0|1,0,0]=3 2654 B11R1.157 CC(=O)Nc1cccn(=O)c1 Amb17749043 [1,1,0,0,0,0|2,0,0]=4 2655 B11R1.157 CC(=O)Nc1ccnc(Br)c1 Amb28071902 [1,1,0,0,0,0|2,0,0]=4 2656 B11R1.157 CC(=O)Nc1ccnc(Cl)c1 Amb1257630 [1,1,0,0,0,0|2,0,0]=4 2657 B11R1.157 CC(=O)Nc1ccnc(N)c1 Amb20670782 [1,1,0,0,0,0|2,0,0]=4 2658 B11R1.157 CC(=O)Nc1cncc(Br)c1 Amb20242024 [1,1,0,0,0,0|2,0,0]=4 2659 B11R1.157 CC(=O)Nc1cncc(C)c1 Amb27752244 [1,1,0,0,0,0|2,0,0]=4 2660 B11R1.157 CC(=O)Nc1cncc(N)c1 Amb25130782 [1,1,0,0,0,0|2,0,0]=4 2661 B11R1.157 CC(=O)Nc1cncc(O)c1 Amb18125366 [1,1,0,0,0,0|2,0,0]=4 2662 B11R1.157 CC(=O)Oc1cccc(Br)c1 Amb21858014 [1,1,0,0,0,0|1,0,0]=3 2663 B11R1.157 CC(=O)Oc1cccc(Br)n1 Amb20617565 [1,1,0,0,0,0|2,0,0]=4 2664 B11R1.157 CC(=O)Oc1cccc(C)c1 Amb4036635 [1,1,0,0,0,0|1,0,0]=3 2665 B11R1.157 CC(=O)Oc1cccc(Cl)n1 Amb8383355 [1,1,0,0,0,0|2,0,0]=4 2666 B11R1.157 CC(=O)Oc1cccc(F)c1 Amb8515094 [1,1,0,0,0,0|1,0,0]=3 2667 B11R1.157 CC(=O)Oc1cccc(I)c1 Amb8388215 [1,1,0,0,0,0|1,0,0]=3 2668 B11R1.157 CC(=O)Oc1cccc(O)c1 Amb3941494 [1,1,0,0,0,0|1,0,0]=3 2669 B11R1.157 CC(=O)Oc1ccnc(Br)c1 Amb20617577 [1,1,0,0,0,0|2,0,0]=4 2670 B11R1.157 CC(=O)Oc1cncc(C)c1 Amb28429832 [1,1,0,0,0,0|2,0,0]=4 2671 B11R1.157 CC(=O)Sc1cccc(Cl)c1 Amb27483012 [1,1,0,0,0,0|1,0,0]=3 2672 B11R1.157 CC(=S)Nc1cccc(Br)c1 Amb26493437 [1,1,0,0,0,0|1,1,0]=4 2673 B11R1.157 CC(=S)Nc1cccc(C)c1 Amb28285002 [1,1,0,0,0,0|1,1,0]=4 2674 B11R1.157 CC(=S)Nc1cccc(Cl)c1 Amb26610050 [1,1,0,0,0,0|1,1,0]=4 2675 B11R1.157 CC(=S)Nc1cccc(F)c1 Amb25352399 [1,1,0,0,0,0|1,1,0]=4 2676 B11R1.157 CC(C)=Cc1cccc(N)c1 Amb28437291 [1,1,0,0,0,0|0,0,1]=3 2677 B11R1.157 CS(=O)Cc1cccc(N)c1 Amb18954301 [1,1,0,0,0,0|1,0,1]=4 2678 B11R1.157 C\[N+]([O-])=C\c1cccc(F)c1 Amb24565861 [1,1,0,0,0,0|1,0,1]=4 2679 B11R1.157 Cc1cccc(C=C(Br)Br)c1 Amb18635919 [1,1,0,0,0,0|2,0,0]=4 2680 B11R1.157 Cc1cccc(CC(=O)Cl)c1 Amb2690619 [1,1,0,0,0,0|1,0,1]=4 2681 B11R1.157 Cc1cccc(CC(=O)O)c1 Amb2690617 [1,1,0,0,0,0|1,0,1]=4 2682 B11R1.157 Cc1cccc(CC(N)=O)c1 Amb2107850 [1,1,0,0,0,0|1,0,1]=4 2683 B11R1.157 Cc1cccc(NC(=O)Cl)c1 Amb27230507 [1,1,0,0,0,0|2,0,0]=4 2684 B11R1.157 Cc1cccc(NC(N)=O)c1 Amb1139814 [1,1,0,0,0,0|2,0,0]=4 2685 B11R1.157 Cc1cccc(OC(=O)Cl)c1 Amb33542810 [1,1,0,0,0,0|2,0,0]=4 2686 B11R1.157 Clc1cccc(C=C(Br)Br)c1 Amb24355244 [1,1,0,0,0,0|2,0,0]=4 2687 B11R1.157 FC(F)=Cc1cccc(Br)c1 Amb22229231 [1,1,0,0,0,0|2,0,0]=4 2688 B11R1.157 F\C(Br)=C\c1cccc(Cl)c1 Amb24053593 [1,1,0,0,0,0|2,0,0]=4 2689 B11R1.157 Fc1cccc(C=C(Br)Br)c1 Amb18114971 [1,1,0,0,0,0|2,0,0]=4 2690 B11R1.157 NC(=O)Cc1cccc(Br)c1 Amb2447571 [1,1,0,0,0,0|1,0,1]=4 2691 B11R1.157 NC(=O)Cc1cccc(Cl)c1 Amb17400312 [1,1,0,0,0,0|1,0,1]=4 2692 B11R1.157 NC(=O)Cc1cccc(F)c1 Amb8050208 [1,1,0,0,0,0|1,0,1]=4 2693 B11R1.157 NC(=O)Cc1cccc(I)c1 Amb25750996 [1,1,0,0,0,0|1,0,1]=4 2694 B11R1.157 NC(=O)Cc1cccc(N)c1 Amb8426825 [1,1,0,0,0,0|1,0,1]=4 2695 B11R1.157 NC(=O)Cc1cccc(O)c1 Amb6297142 [1,1,0,0,0,0|1,0,1]=4 2696 B11R1.157 NC(=O)Nc1cccc(Br)c1 Amb1130078 [1,1,0,0,0,0|2,0,0]=4 2697 B11R1.157 NC(=O)Nc1cccc(Cl)c1 Amb1132008 [1,1,0,0,0,0|2,0,0]=4 2698 B11R1.157 NC(=O)Nc1cccc(F)c1 Amb1133367 [1,1,0,0,0,0|2,0,0]=4 2699 B11R1.157 NC(=O)Nc1cccc(I)c1 Amb7761980 [1,1,0,0,0,0|2,0,0]=4 2700 B11R1.157 NC(=O)Nc1cccc(N)c1 Amb1116839 [1,1,0,0,0,0|2,0,0]=4 2701 B11R1.157 NC(=O)Nc1cccc(O)c1 Amb6600565 [1,1,0,0,0,0|2,0,0]=4 2702 B11R1.157 NC(=O)Oc1cccc(O)c1 Amb35726795 [1,1,0,0,0,0|2,0,0]=4 2703 B11R1.157 Nc1cccc(C=C(F)F)c1 Amb32415017 [1,1,0,0,0,0|2,0,0]=4 2704 B11R1.157 Nc1cccc(CC(=O)O)c1 Amb19373490 [1,1,0,0,0,0|1,0,1]=4 2705 B11R1.157 Nc1cccc(CC(=O)O)c1 Amb3941543 [1,1,0,0,0,0|1,0,1]=4 2706 B11R1.157 O=C(Cl)Cc1cccc(Br)c1 Amb18284226 [1,1,0,0,0,0|1,0,1]=4 2707 B11R1.157 O=C(Cl)Cc1cccc(Cl)c1 Amb18286412 [1,1,0,0,0,0|1,0,1]=4 2708 B11R1.157 O=C(Cl)Cc1cccc(F)c1 Amb33528396 [1,1,0,0,0,0|1,0,1]=4 2709 B11R1.157 O=C(Cl)Cc1cccc(I)c1 Amb25322405 [1,1,0,0,0,0|1,0,1]=4 2710 B11R1.157 O=C(Cl)Cc1cccc(O)c1 Amb18177959 [1,1,0,0,0,0|1,0,1]=4 2711 B11R1.157 O=C(Cl)Nc1cccc(Br)c1 Amb35636933 [1,1,0,0,0,0|2,0,0]=4 2712 B11R1.157 O=C(Cl)Nc1cccc(F)c1 Amb35636942 [1,1,0,0,0,0|2,0,0]=4 2713 B11R1.157 O=C(Cl)Nc1cccc(I)c1 Amb35637087 [1,1,0,0,0,0|2,0,0]=4 2714 B11R1.157 O=C(Cl)Oc1cccc(Br)c1 Amb25863215 [1,1,0,0,0,0|2,0,0]=4 2715 B11R1.157 O=C(Cl)Oc1cccc(Cl)c1 Amb24455216 [1,1,0,0,0,0|2,0,0]=4 2716 B11R1.157 O=C(Cl)Oc1cccc(F)c1 Amb25049826 [1,1,0,0,0,0|2,0,0]=4 2717 B11R1.157 O=C(Cl)Oc1cccc(I)c1 Amb26631011 [1,1,0,0,0,0|2,0,0]=4 2718 B11R1.157 O=C(Cl)Sc1cccc(Br)c1 Amb2685404 [1,1,0,0,0,0|2,0,0]=4 2719 B11R1.157 O=C(Cl)Sc1cccc(F)c1 Amb2688334 [1,1,0,0,0,0|2,0,0]=4 2720 B11R1.157 O=C(O)Cc1cccc(Br)c1 Amb1134647 [1,1,0,0,0,0|1,0,1]=4 2721 B11R1.157 O=C(O)Cc1cccc(Cl)c1 Amb3939860 [1,1,0,0,0,0|1,0,1]=4 2722 B11R1.157 O=C(O)Cc1cccc(F)c1 Amb2688301 [1,1,0,0,0,0|1,0,1]=4 2723 B11R1.157 O=C(O)Cc1cccc(I)c1 Amb3792688 [1,1,0,0,0,0|1,0,1]=4 2724 B11R1.157 O=C(O)Cc1cccc(O)c1 Amb3940110 [1,1,0,0,0,0|1,0,1]=4 2725 B11R1.509 CS(=N)(=O)Cc1ccccc1 Amb33999209 [1,1,0,0,0,0|1,0,1]=4 2726 B11R1.509 CS(=N)(=O)Nc1ccccc1 Amb29851204 [1,1,0,0,0,0|2,0,0]=4 2727 B11R1.509 CS(=N)(=O)Nc1ccccc1 Amb35789606 [1,1,0,0,0,0|2,0,0]=4 2728 B11R1.509 CS(=O)(=O)Cc1ccccc1 Amb2684639 [1,1,0,0,0,0|1,0,1]=4 2729 B11R1.509 CS(=O)(=O)Nc1ccccc1 Amb2610659 [1,1,0,0,0,0|2,0,0]=4 2730 B11R1.509 CS(=O)(=O)Oc1ccccc1 Amb2227587 [1,1,0,0,0,0|2,0,0]=4 2731 B11R1.509 CS(=O)(=O)Sc1ccccc1 Amb17619349 [1,1,0,0,0,0|2,0,0]=4 2732 B11R1.509 CS(C)(=O)=Nc1ccccc1 Amb31282111 [1,1,0,0,0,0|2,0,0]=4 2733 B11R1.7 C=CC(C)(C)c1ccccc1 Amb24476101 [0,1,0,0,1,0|1,0,1]=4 2734 B11R1.7 C=CP(C)(=O)c1ccccc1 Amb8392603 [0,1,0,0,1,0|2,0,0]=4 2735 B11R1.7 C=C[C@@](C)(N)c1ccccc1 Amb27784091 [0,1,0,0,1,0|1,0,1]=4 2736 B11R1.7 C=C[Si](C)(C)c1ccccc1 Amb19894173 [0,1,0,0,1,0|1,1,0]=4 2737 B11R1.7 C=C[Si](C)(Cl)c1ccccc1 Amb19894009 [0,1,0,0,1,0|1,1,0]=4 2738 B11R1.7 CC(C)(C=O)c1ccccc1 Amb17232040 [0,1,0,0,1,0|0,0,1]=3 2739 B11R1.7 CC(C)(C=O)c1ccccn1 Amb26464040 [0,1,0,0,1,0|1,0,1]=4 2740 B11R1.7 CC(C)(C=O)c1cccnc1 Amb24084633 [0,1,0,0,1,0|1,0,1]=4 2741 B11R1.7 CC(C)(C=O)c1ccncc1 Amb32937715 [0,1,0,0,1,0|1,0,1]=4 2742 B11R1.7 CC(Cl)(C=O)c1ccccc1 Amb18126588 [0,1,0,0,1,0|0,0,1]=3 2743 B11R1.7 CC(F)(C=O)c1ccccc1 Amb27176350 [0,1,0,0,1,0|0,0,1]=3 2744 B11R1.7 CC(O)(C=O)c1ccccc1 Amb17593726 [0,1,0,0,1,0|0,0,1]=3 2745 B11R1.7 C[C@@](F)(C=O)c1ccccc1 Amb27176339 [0,1,0,0,1,0|0,0,1]=3 2746 B11R1.7 C[C@@](O)(C=O)c1ccccc1 Amb27176382 [0,1,0,0,1,0|0,0,1]=3 2747 B11R1.7 C[C@](O)(C=O)c1ccccc1 Amb27176325 [0,1,0,0,1,0|0,0,1]=3 2748 B11R1.7 O=CC(O)(O)c1ccccc1 Amb27799743 [0,1,0,0,1,0|1,0,1]=4 2749 B11R1.12 C=C=C(CBr)c1ccccc1 Amb27792952 [0,1,0,0,1,0|1,0,1]=4 2750 B11R1.12 C=CC(CC)c1ccccc1 Amb24485761 [0,1,0,0,1,0|1,0,1]=4 2751 B11R1.12 C=CC(CO)c1ccccc1 Amb27839855 [0,1,0,0,1,0|1,0,1]=4 2752 B11R1.12 C=C[C@H](CCl)c1ccccc1 Amb27494109 [0,1,0,0,1,0|1,0,1]=4 2753 B11R1.12 C=C\C(=N/O)c1ccccc1 Amb5718393 [0,1,0,0,1,0|2,0,0]=4 2754 B11R1.12 CCC(=C=O)c1ccccn1 Amb26359789 [0,1,0,0,1,0|1,0,1]=4 2755 B11R1.12 CCC(C=O)c1ccccc1 Amb17138422 [0,1,0,0,1,0|0,0,1]=3 2756 B11R1.12 CCC(C=O)c1ccccn1 Amb26423415 [0,1,0,0,1,0|1,0,1]=4 2757 B11R1.12 CCC(C=O)c1cccnc1 Amb27631428 [0,1,0,0,1,0|1,0,1]=4 2758 B11R1.12 CCC(C=O)c1ccncc1 Amb27198828 [0,1,0,0,1,0|1,0,1]=4 2759 B11R1.12 CCN(N=O)c1ccccc1 Amb17618581 [0,1,0,0,1,0|2,0,0]=4 2760 B11R1.12 CC[C@@H](C=O)c1ccccc1 Amb27169433 [0,1,0,0,1,0|0,0,1]=3 2761 B11R1.12 CC\C(=N/O)c1ccccc1 Amb3367838 [0,1,0,0,1,0|1,0,1]=4 2762 B11R1.12 COC(C=O)c1cccnc1 Amb27665895 [0,1,0,0,1,0|1,0,1]=4 2763 B11R1.12 COC(C=O)c1ccncc1 Amb28368633 [0,1,0,0,1,0|1,0,1]=4 2764 B11R1.12 CO[C@H](C=O)c1ccccc1 Amb27455008 [0,1,0,0,1,0|0,0,1]=3 2765 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [0,1,0,0,1,0|0,0,1]=3 2766 B11R1.12 C\C=C(/C#N)c1ccccc1 Amb17231965 [0,1,0,0,1,0|1,0,1]=4 2767 B11R1.12 C\C=C(/C=O)c1ccncc1 Amb24418258 [0,1,0,0,1,0|1,0,0]=3 2768 B11R1.12 C\C=C(/CC)c1ccccc1 Amb26588977 [0,1,0,0,1,0|1,0,0]=3 2769 B11R1.12 C\C=C(/CC)c1ccccn1 Amb24101962 [0,1,0,0,1,0|2,0,0]=4 2770 B11R1.12 C\C=C(\CC)c1ccccc1 Amb26421595 [0,1,0,0,1,0|1,0,0]=3 2771 B11R1.12 C\C=C(\CCl)c1ccccc1 Amb27413555 [0,1,0,0,1,0|1,0,0]=3 2772 B11R1.12 C\N=C(/NC)c1ccccc1 Amb8487310 [0,1,0,0,1,0|2,0,0]=4 2773 B11R1.12 C\N=C(/SC)c1ccccc1 Amb32718735 [0,1,0,0,1,0|2,0,0]=4 2774 B11R1.12 F\C=C(\CBr)c1ccccc1 Amb27486280 [0,1,0,0,1,0|1,0,0]=3 2775 B11R1.12 N#CC(C=O)c1ccccc1 Amb1902648 [0,1,0,0,1,0|0,0,2]=4 2776 B11R1.12 N#C[C-](C=O)c1ccccc1 Amb27487366 [0,1,0,0,1,0|0,0,2]=4 2777 B11R1.12 N#C\C(=C/N)c1ccccc1 Amb24403322 [0,1,0,0,1,0|1,0,1]=4 2778 B11R1.12 N#C\C(=C/O)c1ccccc1 Amb2417622 [0,1,0,0,1,0|0,0,2]=4 2779 B11R1.12 N#C\C(=C/[O-])c1ccccc1 Amb19747722 [0,1,0,0,1,0|0,0,2]=4 2780 B11R1.12 N=C\C(=C\O)c1ccccc1 Amb27397057 [0,1,0,0,1,0|0,0,2]=4 2781 B11R1.12 NCC(C=O)c1ccccc1 Amb28282628 [0,1,0,0,1,0|0,0,1]=3 2782 B11R1.12 NC\C(=C/Cl)c1ccccc1 Amb34005133 [0,1,0,0,1,0|1,0,0]=3 2783 B11R1.12 NC\C(=C\Br)c1ccccc1 Amb28319127 [0,1,0,0,1,0|1,0,0]=3 2784 B11R1.12 NC\C(=N\O)c1ccccc1 Amb25368564 [0,1,0,0,1,0|1,0,1]=4 2785 B11R1.12 O=C=C(C=O)c1ccccc1 Amb27643622 [0,1,0,0,1,0|0,0,1]=3 2786 B11R1.12 O=CC(C=O)c1ccccc1 Amb5627398 [0,1,0,0,1,0|0,0,2]=4 2787 B11R1.12 O=CC(CO)c1ccccc1 Amb27488286 [0,1,0,0,1,0|0,0,1]=3 2788 B11R1.12 O=C\C(=C/O)c1ccccc1 Amb10576572 [0,1,0,0,1,0|0,0,1]=3 2789 B11R1.12 O=C\C(=C/O)c1ccncc1 Amb1101998 [0,1,0,0,1,0|1,0,1]=4 2790 B11R1.12 O=C\C(=C\Br)c1ccccc1 Amb24634608 [0,1,0,0,1,0|0,0,1]=3 2791 B11R1.12 O=C\C(=C\Cl)c1ccccc1 Amb17594154 [0,1,0,0,1,0|0,0,1]=3 2792 B11R1.12 O=C\C(=C\O)c1ccccc1 Amb25092916 [0,1,0,0,1,0|0,0,1]=3 2793 B11R1.12 O=C\C(=C\O)c1ccncc1 Amb1019561 [0,1,0,0,1,0|1,0,1]=4 2794 B11R1.12 O=C\C(=C\S)c1ccccc1 Amb27622186 [0,1,0,0,1,0|0,0,1]=3 2795 B11R1.12 O=C\C(=N/O)c1ccccc1 Amb28345218 [0,1,0,0,1,0|1,0,0]=3 2796 B11R1.12 O=C\C(=N\O)c1ccccc1 Amb26580467 [0,1,0,0,1,0|1,0,0]=3 2797 B11R1.12 OC\C(=C\F)c1ccccc1 Amb27972253 [0,1,0,0,1,0|1,0,0]=3 2798 B11R1.12 O\N=C(/CBr)c1ccccc1 Amb1047358 [0,1,0,0,1,0|1,0,1]=4 2799 B11R1.12 O\N=C(\CBr)c1ccccc1 Amb22489773 [0,1,0,0,1,0|1,0,1]=4 2800 B11R1.12 O\N=C(\CCl)c1ccccc1 Amb10569199 [0,1,0,0,1,0|1,0,1]=4 2801 B11R1.12 O\N=C(\CF)c1ccccc1 Amb7969465 [0,1,0,0,1,0|1,0,1]=4 2802 B11R1.22 C=C(C=O)c1ccc(Br)cc1 Amb27242760 [0,1,0,0,1,0|0,0,1]=3 2803 B11R1.22 C=C(C=O)c1ccc(C)cc1 Amb27211883 [0,1,0,0,1,0|0,0,1]=3 2804 B11R1.22 C=CC(=C)c1ccc(F)cc1 Amb27829498 [0,1,0,0,1,0|1,0,1]=4 2805 B11R1.22 C=CC(=C)c1ccc(N)cc1 Amb26319157 [0,1,0,0,1,0|1,0,1]=4 2806 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [0,1,0,0,1,0|2,0,0]=4 2807 B11R1.22 C=CC(=O)c1ccc(C)cc1 Amb18063916 [0,1,0,0,1,0|2,0,0]=4 2808 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [0,1,0,0,1,0|2,0,0]=4 2809 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [0,1,0,0,1,0|2,0,0]=4 2810 B11R1.22 C=CC(=O)c1ccc(N)cc1 Amb27253822 [0,1,0,0,1,0|2,0,0]=4 2811 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [0,1,0,0,1,0|2,0,0]=4 2812 B11R1.22 C=CC(C)c1ccc(F)cc1 Amb33273695 [0,1,0,0,1,0|1,0,1]=4 2813 B11R1.22 CC(C=O)c1ccc(Br)cc1 Amb17140753 [0,1,0,0,1,0|0,0,1]=3 2814 B11R1.22 CC(C=O)c1ccc(Br)cn1 Amb33477413 [0,1,0,0,1,0|1,0,1]=4 2815 B11R1.22 CC(C=O)c1ccc(Br)nc1 Amb33388405 [0,1,0,0,1,0|1,0,1]=4 2816 B11R1.22 CC(C=O)c1ccc(Cl)cc1 Amb33544215 [0,1,0,0,1,0|0,0,1]=3 2817 B11R1.22 CC(C=O)c1ccc(Cl)cn1 Amb33058805 [0,1,0,0,1,0|1,0,1]=4 2818 B11R1.22 CC(C=O)c1ccc(Cl)nc1 Amb27793600 [0,1,0,0,1,0|1,0,1]=4 2819 B11R1.22 CC(C=O)c1ccc(F)cc1 Amb17138438 [0,1,0,0,1,0|0,0,1]=3 2820 B11R1.22 CC(C=O)c1ccc(F)cn1 Amb25788282 [0,1,0,0,1,0|1,0,1]=4 2821 B11R1.22 CC(C=O)c1ccc(F)nc1 Amb33426170 [0,1,0,0,1,0|1,0,1]=4 2822 B11R1.22 CC(C=O)c1ccc(N)cc1 Amb27443133 [0,1,0,0,1,0|0,0,1]=3 2823 B11R1.22 CC(C=O)c1ccc(O)cc1 Amb18125109 [0,1,0,0,1,0|0,0,1]=3 2824 B11R1.22 CN(C=O)c1ccc(Cl)cc1 Amb22731030 [0,1,0,0,1,0|1,0,0]=3 2825 B11R1.22 CN(N=O)c1ccc(Br)cc1 Amb27642164 [0,1,0,0,1,0|2,0,0]=4 2826 B11R1.22 CN(N=O)c1ccc(O)cc1 Amb28253699 [0,1,0,0,1,0|2,0,0]=4 2827 B11R1.22 C[C@@H](C=O)c1ccc(Cl)cc1 Amb27176338 [0,1,0,0,1,0|0,0,1]=3 2828 B11R1.22 C[C@H](C=O)c1ccc(Cl)cc1 Amb27224785 [0,1,0,0,1,0|0,0,1]=3 2829 B11R1.22 C\C(=C\Cl)c1ccc(C)cc1 Amb27478018 [0,1,0,0,1,0|1,0,0]=3 2830 B11R1.22 C\C(=N/N)c1ccc(C)cc1 Amb4019900 [0,1,0,0,1,0|2,0,0]=4 2831 B11R1.22 C\C(=N/N)c1ccc(N)cc1 Amb27225960 [0,1,0,0,1,0|2,0,0]=4 2832 B11R1.22 C\C(=N/O)c1ccc(Br)cc1 Amb6388233 [0,1,0,0,1,0|1,0,1]=4 2833 B11R1.22 C\C(=N/O)c1ccc(C)cc1 Amb6346454 [0,1,0,0,1,0|1,0,1]=4 2834 B11R1.22 C\C(=N/O)c1ccc(F)cc1 Amb928420 [0,1,0,0,1,0|1,0,1]=4 2835 B11R1.22 C\C(=N/O)c1ccc(I)cc1 Amb27171022 [0,1,0,0,1,0|1,0,1]=4 2836 B11R1.22 C\C(=N/O)c1ccc(O)cc1 Amb24324955 [0,1,0,0,1,0|1,0,1]=4 2837 B11R1.22 C\C(=N\N)c1ccc(Br)cc1 Amb10552972 [0,1,0,0,1,0|2,0,0]=4 2838 B11R1.22 C\C(=N\N)c1ccc(C)cc1 Amb27840228 [0,1,0,0,1,0|2,0,0]=4 2839 B11R1.22 C\C(=N\O)c1ccc(C)cc1 Amb4020197 [0,1,0,0,1,0|1,0,1]=4 2840 B11R1.22 C\C(=N\O)c1ccc(Cl)cc1 Amb19767547 [0,1,0,0,1,0|1,0,1]=4 2841 B11R1.22 C\C(=N\O)c1ccc(F)cc1 Amb22735392 [0,1,0,0,1,0|1,0,1]=4 2842 B11R1.22 C\C(=N\O)c1ccc(I)cc1 Amb27595013 [0,1,0,0,1,0|1,0,1]=4 2843 B11R1.22 C\C(=N\O)c1ccc(N)cc1 Amb8503907 [0,1,0,0,1,0|1,0,1]=4 2844 B11R1.22 C\C(=N\O)c1ccc(O)cc1 Amb27451236 [0,1,0,0,1,0|1,0,1]=4 2845 B11R1.22 C\C=C(/O)c1ccc(F)cc1 Amb24100278 [0,1,0,0,1,0|2,0,0]=4 2846 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb10067935 [0,1,0,0,1,0|1,0,0]=3 2847 B11R1.22 Cc1ccc(C(=O)C=O)cc1 Amb2609863 [0,1,0,0,1,0|1,0,0]=3 2848 B11R1.22 Cc1ccc(C(C)C=O)cc1 Amb10844730 [0,1,0,0,1,0|0,0,1]=3 2849 B11R1.22 Cc1ccc(C(C)C=O)cn1 Amb27636470 [0,1,0,0,1,0|1,0,1]=4 2850 B11R1.22 Cc1ccc(C(C)C=O)nc1 Amb33198460 [0,1,0,0,1,0|1,0,1]=4 2851 B11R1.22 Cc1ccc(C(O)C=O)cc1 Amb27458161 [0,1,0,0,1,0|1,0,1]=4 2852 B11R1.22 Cc1ccc(N(C)C=O)cc1 Amb24323385 [0,1,0,0,1,0|1,0,0]=3 2853 B11R1.22 Cc1ccc([C@@H](C)C=O)cc1 Amb27635261 [0,1,0,0,1,0|0,0,1]=3 2854 B11R1.22 Cc1ccc([C@H](C)C=O)cc1 Amb27176434 [0,1,0,0,1,0|0,0,1]=3 2855 B11R1.22 Cc1ccc(\C(Cl)=C\Cl)cc1 Amb27233657 [0,1,0,0,1,0|2,0,0]=4 2856 B11R1.22 Nc1ccc(C(=O)C=O)cc1 Amb28341792 [0,1,0,0,1,0|1,0,0]=3 2857 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb10067934 [0,1,0,0,1,0|1,0,0]=3 2858 B11R1.22 O=CC(=O)c1ccc(Br)cc1 Amb8391398 [0,1,0,0,1,0|1,0,0]=3 2859 B11R1.22 O=CC(=O)c1ccc(Br)cn1 Amb35676741 [0,1,0,0,1,0|2,0,0]=4 2860 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb10067933 [0,1,0,0,1,0|1,0,0]=3 2861 B11R1.22 O=CC(=O)c1ccc(Cl)cc1 Amb4479326 [0,1,0,0,1,0|1,0,0]=3 2862 B11R1.22 O=CC(=O)c1ccc(Cl)cn1 Amb35676738 [0,1,0,0,1,0|2,0,0]=4 2863 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb2688344 [0,1,0,0,1,0|1,0,0]=3 2864 B11R1.22 O=CC(=O)c1ccc(F)cc1 Amb9826943 [0,1,0,0,1,0|1,0,0]=3 2865 B11R1.22 O=CC(=O)c1ccc(I)cc1 Amb28455510 [0,1,0,0,1,0|1,0,0]=3 2866 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb10069044 [0,1,0,0,1,0|1,0,0]=3 2867 B11R1.22 O=CC(=O)c1ccc(O)cc1 Amb6373643 [0,1,0,0,1,0|1,0,0]=3 2868 B11R1.22 O=CC(O)c1ccc(Br)cc1 Amb35614518 [0,1,0,0,1,0|1,0,1]=4 2869 B11R1.22 O=CC(O)c1ccc(O)cc1 Amb18125348 [0,1,0,0,1,0|1,0,1]=4 2870 B11R1.22 O=CN(O)c1ccc(F)cc1 Amb27626910 [0,1,0,0,1,0|2,0,0]=4 2871 B11R1.23 C=CC(=C)c1cccc(O)c1 Amb27599406 [0,1,0,0,1,0|1,0,1]=4 2872 B11R1.23 C=CC(=O)c1cccc(Br)c1 Amb26372631 [0,1,0,0,1,0|2,0,0]=4 2873 B11R1.23 C=CC(=O)c1cccc(C)c1 Amb25861091 [0,1,0,0,1,0|2,0,0]=4 2874 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [0,1,0,0,1,0|2,0,0]=4 2875 B11R1.23 C=CC(=O)c1cccc(F)c1 Amb26460816 [0,1,0,0,1,0|2,0,0]=4 2876 B11R1.23 C=CC(=O)c1cccc(I)c1 Amb28136092 [0,1,0,0,1,0|2,0,0]=4 2877 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [0,1,0,0,1,0|2,0,0]=4 2878 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [0,1,0,0,1,0|2,0,0]=4 2879 B11R1.23 CC(C=O)c1cc(F)ccn1 Amb33320276 [0,1,0,0,1,0|1,0,1]=4 2880 B11R1.23 CC(C=O)c1cccc(Br)c1 Amb18657407 [0,1,0,0,1,0|0,0,1]=3 2881 B11R1.23 CC(C=O)c1cccc(Br)n1 Amb33433182 [0,1,0,0,1,0|1,0,1]=4 2882 B11R1.23 CC(C=O)c1cccc(Cl)c1 Amb22059526 [0,1,0,0,1,0|0,0,1]=3 2883 B11R1.23 CC(C=O)c1cccc(Cl)n1 Amb33222662 [0,1,0,0,1,0|1,0,1]=4 2884 B11R1.23 CC(C=O)c1cccc(F)c1 Amb24100538 [0,1,0,0,1,0|0,0,1]=3 2885 B11R1.23 CC(C=O)c1cccc(I)c1 Amb27208613 [0,1,0,0,1,0|0,0,1]=3 2886 B11R1.23 CC(C=O)c1cccc(O)c1 Amb18125118 [0,1,0,0,1,0|0,0,1]=3 2887 B11R1.23 CC(C=O)c1cncc(Br)c1 Amb33389105 [0,1,0,0,1,0|1,0,1]=4 2888 B11R1.23 CC(C=O)c1cncc(F)c1 Amb33480690 [0,1,0,0,1,0|1,0,1]=4 2889 B11R1.23 C\C(=N/N)c1cccc(O)c1 Amb24484530 [0,1,0,0,1,0|2,0,0]=4 2890 B11R1.23 C\C(=N/O)c1cccc(Br)c1 Amb2752469 [0,1,0,0,1,0|1,0,1]=4 2891 B11R1.23 C\C(=N/O)c1cccc(Cl)c1 Amb25187132 [0,1,0,0,1,0|1,0,1]=4 2892 B11R1.23 C\C(=N/O)c1cccc(F)c1 Amb29844581 [0,1,0,0,1,0|1,0,1]=4 2893 B11R1.23 C\C(=N/O)c1cccc(O)c1 Amb27948502 [0,1,0,0,1,0|1,0,1]=4 2894 B11R1.23 C\C(=N\N)c1cccc(Cl)c1 Amb27425260 [0,1,0,0,1,0|2,0,0]=4 2895 B11R1.23 C\C(=N\O)c1cccc(Br)c1 Amb22261517 [0,1,0,0,1,0|1,0,1]=4 2896 B11R1.23 C\C(=N\O)c1cccc(N)c1 Amb25992663 [0,1,0,0,1,0|1,0,1]=4 2897 B11R1.23 C\C(=N\O)c1cccc(O)c1 Amb26624798 [0,1,0,0,1,0|1,0,1]=4 2898 B11R1.23 C\C=C(/C)c1cccc(C)n1 Amb24101959 [0,1,0,0,1,0|2,0,0]=4 2899 B11R1.23 C\C=C(/C)c1cccc(F)c1 Amb25837290 [0,1,0,0,1,0|1,0,0]=3 2900 B11R1.23 C\C=C(/C)c1cccc(O)c1 Amb28074810 [0,1,0,0,1,0|1,0,0]=3 2901 B11R1.23 C\C=C(\C)c1cccc(C)n1 Amb28207337 [0,1,0,0,1,0|2,0,0]=4 2902 B11R1.23 C\C=C(\C)c1cccc(F)c1 Amb26422978 [0,1,0,0,1,0|1,0,0]=3 2903 B11R1.23 Cc1cc(C(C)C=O)ccn1 Amb32732935 [0,1,0,0,1,0|1,0,1]=4 2904 B11R1.23 Cc1cccc(C(=O)C=O)c1 Amb24055227 [0,1,0,0,1,0|1,0,0]=3 2905 B11R1.23 Cc1cccc(C(C)C=O)c1 Amb24380067 [0,1,0,0,1,0|0,0,1]=3 2906 B11R1.23 Cc1cccc(C(C)C=O)n1 Amb33199924 [0,1,0,0,1,0|1,0,1]=4 2907 B11R1.23 Cc1ccnc(C(C)C=O)c1 Amb33318100 [0,1,0,0,1,0|1,0,1]=4 2908 B11R1.23 Cc1cncc(C(C)C=O)c1 Amb33318002 [0,1,0,0,1,0|1,0,1]=4 2909 B11R1.23 Nc1cccc(\C(Cl)=C\Cl)c1 Amb27444450 [0,1,0,0,1,0|2,0,0]=4 2910 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb10067951 [0,1,0,0,1,0|1,0,0]=3 2911 B11R1.23 O=CC(=O)c1cccc(Br)c1 Amb20671217 [0,1,0,0,1,0|1,0,0]=3 2912 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb10067952 [0,1,0,0,1,0|1,0,0]=3 2913 B11R1.23 O=CC(=O)c1cccc(Cl)c1 Amb18126569 [0,1,0,0,1,0|1,0,0]=3 2914 B11R1.23 O=CC(=O)c1cccc(Cl)n1 Amb27486123 [0,1,0,0,1,0|2,0,0]=4 2915 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10605526 [0,1,0,0,1,0|1,0,0]=3 2916 B11R1.23 O=CC(=O)c1cccc(F)c1 Amb10982490 [0,1,0,0,1,0|1,0,0]=3 2917 B11R1.23 O=CC(=O)c1cccc(O)c1 Amb18125054 [0,1,0,0,1,0|1,0,0]=3 2918 B11R1.23 O=CC(=O)c1cncc(Br)c1 Amb35676740 [0,1,0,0,1,0|2,0,0]=4 2919 B11R1.23 O=CC(Cl)c1cccc(Cl)c1 Amb27955266 [0,1,0,0,1,0|1,0,1]=4 2920 B11R1.23 O=CC(F)c1cccc(Cl)c1 Amb28057690 [0,1,0,0,1,0|1,0,1]=4 2921 B11R1.23 O=CC(O)c1cccc(Br)c1 Amb35591756 [0,1,0,0,1,0|1,0,1]=4 2922 B11R1.222 C=CC(=O)c1ccccc1Br Amb26333627 [0,1,0,0,1,0|2,0,0]=4 2923 B11R1.222 C=CC(=O)c1ccccc1C Amb28144593 [0,1,0,0,1,0|2,0,0]=4 2924 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,1,0,0,1,0|2,0,0]=4 2925 B11R1.222 C=CC(=O)c1ccccc1F Amb27883395 [0,1,0,0,1,0|2,0,0]=4 2926 B11R1.222 C=CC(=O)c1ccccc1N Amb26987473 [0,1,0,0,1,0|2,0,0]=4 2927 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,1,0,0,1,0|2,0,0]=4 2928 B11R1.222 C=CC(C)c1ccccc1N Amb18124835 [0,1,0,0,1,0|1,0,1]=4 2929 B11R1.222 C=C\C(C)=C1\C=CC=CC1=O Amb27184121 [0,1,0,0,1,0|1,0,0]=3 2930 B11R1.222 CC(C=O)c1ccccc1Cl Amb27661607 [0,1,0,0,1,0|0,0,1]=3 2931 B11R1.222 CC(C=O)c1ccccc1F Amb24070131 [0,1,0,0,1,0|0,0,1]=3 2932 B11R1.222 CC(C=O)c1ccccc1I Amb25990503 [0,1,0,0,1,0|0,0,1]=3 2933 B11R1.222 CC(C=O)c1ccccc1N Amb26880158 [0,1,0,0,1,0|0,0,1]=3 2934 B11R1.222 CC(C=O)c1ccccc1O Amb18125106 [0,1,0,0,1,0|0,0,1]=3 2935 B11R1.222 CC(C=O)c1cccnc1Br Amb33111876 [0,1,0,0,1,0|1,0,1]=4 2936 B11R1.222 CC(C=O)c1cccnc1Cl Amb33257282 [0,1,0,0,1,0|1,0,1]=4 2937 B11R1.222 CC(C=O)c1cccnc1F Amb33377653 [0,1,0,0,1,0|1,0,1]=4 2938 B11R1.222 CC(C=O)c1ccncc1Br Amb33388282 [0,1,0,0,1,0|1,0,1]=4 2939 B11R1.222 CC(C=O)c1ccncc1Cl Amb33413576 [0,1,0,0,1,0|1,0,1]=4 2940 B11R1.222 CC(C=O)c1ccncc1F Amb33317181 [0,1,0,0,1,0|1,0,1]=4 2941 B11R1.222 CC(C=O)c1ncccc1Br Amb33336009 [0,1,0,0,1,0|1,0,1]=4 2942 B11R1.222 CC(C=O)c1ncccc1F Amb33418786 [0,1,0,0,1,0|1,0,1]=4 2943 B11R1.222 C\C(=C\Cl)c1ccccc1N Amb27985390 [0,1,0,0,1,0|1,0,0]=3 2944 B11R1.222 C\C(=C\Cl)c1ncccc1Cl Amb28291574 [0,1,0,0,1,0|2,0,0]=4 2945 B11R1.222 C\C(=N/O)c1ccccc1Cl Amb2752474 [0,1,0,0,1,0|1,0,1]=4 2946 B11R1.222 C\C(=N/O)c1ccccc1F Amb18799449 [0,1,0,0,1,0|1,0,1]=4 2947 B11R1.222 C\C(=N/O)c1ccccc1N Amb24059902 [0,1,0,0,1,0|1,0,1]=4 2948 B11R1.222 C\C(=N/O)c1ccccc1O Amb2436546 [0,1,0,0,1,0|1,0,1]=4 2949 B11R1.222 C\C(=N\Cl)c1ccccc1O Amb27818155 [0,1,0,0,1,0|2,0,0]=4 2950 B11R1.222 C\C(=N\O)c1ccccc1Br Amb2611267 [0,1,0,0,1,0|1,0,1]=4 2951 B11R1.222 C\C(=N\O)c1ccccc1O Amb5837374 [0,1,0,0,1,0|1,0,1]=4 2952 B11R1.222 C\C(NO)=C1\C=CC=CC1=O Amb33512951 [0,1,0,0,1,0|1,0,1]=4 2953 B11R1.222 C\C=C(/C)c1ccccc1N Amb18124838 [0,1,0,0,1,0|1,0,0]=3 2954 B11R1.222 C\C=C(/C)c1ccccc1O Amb18124922 [0,1,0,0,1,0|1,0,0]=3 2955 B11R1.222 C\C=C(/C)c1ncccc1C Amb24101957 [0,1,0,0,1,0|2,0,0]=4 2956 B11R1.222 C\C=C(\C)c1ccccc1N Amb28422952 [0,1,0,0,1,0|1,0,0]=3 2957 B11R1.222 C\N=C(/C)c1ccccc1O Amb27591596 [0,1,0,0,1,0|2,0,0]=4 2958 B11R1.222 C\N=C(\C)c1ccccc1O Amb27426431 [0,1,0,0,1,0|2,0,0]=4 2959 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,1,0,0,1,0|1,0,0]=3 2960 B11R1.222 Cc1ccccc1C(C)C=O Amb18124932 [0,1,0,0,1,0|0,0,1]=3 2961 B11R1.222 Cc1ccccc1N(C)C=O Amb24323384 [0,1,0,0,1,0|1,0,0]=3 2962 B11R1.222 Cc1cccnc1C(C)C=O Amb33428744 [0,1,0,0,1,0|1,0,1]=4 2963 B11R1.222 Cc1ccncc1C(C)C=O Amb33376687 [0,1,0,0,1,0|1,0,1]=4 2964 B11R1.222 Cc1cnccc1C(C)C=O Amb33424624 [0,1,0,0,1,0|1,0,1]=4 2965 B11R1.222 Cc1ncccc1C(C)C=O Amb32878977 [0,1,0,0,1,0|1,0,1]=4 2966 B11R1.222 N\C(=C\O)c1ccccc1Cl Amb28043985 [0,1,0,0,1,0|1,0,1]=4 2967 B11R1.222 O=CC(=O)C1=CC=CCC1=S Amb28245416 [0,1,0,0,1,0|1,0,1]=4 2968 B11R1.222 O=CC(=O)c1ccccc1Br Amb18131520 [0,1,0,0,1,0|1,0,0]=3 2969 B11R1.222 O=CC(=O)c1ccccc1Cl Amb18126568 [0,1,0,0,1,0|1,0,0]=3 2970 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,1,0,0,1,0|1,0,0]=3 2971 B11R1.222 O=CC(=O)c1ccccc1F Amb22011841 [0,1,0,0,1,0|1,0,0]=3 2972 B11R1.222 O=CC(=O)c1ccccc1O Amb25269559 [0,1,0,0,1,0|1,0,0]=3 2973 B11R1.222 O=CC(O)c1ccccc1Cl Amb27779531 [0,1,0,0,1,0|1,0,1]=4 2974 B11R1.222 O=CC(O)c1ccccc1O Amb27401134 [0,1,0,0,1,0|1,0,1]=4 2975 B11R1.222 O=C[C@H](O)c1ccccc1F Amb28365534 [0,1,0,0,1,0|1,0,1]=4 2976 B11R1.30 C\C(=C/c1ccco1)CC=O Amb33311310 [0,1,0,0,1,0|1,0,0]=3 2977 B11R1.31 CC(C=O)C(=O)c1ccco1 Amb18181706 [0,1,0,0,1,0|1,0,1]=4 2978 B11R1.31 CC(C=O)C(=O)c1cccs1 Amb18788808 [0,1,0,0,1,0|1,0,1]=4 2979 B11R1.31 CC(C=O)C(=O)c1ccsc1 Amb25263440 [0,1,0,0,1,0|1,0,1]=4 2980 B11R1.31 C\C(=C\[O-])C(=O)c1ccco1 Amb27225761 [0,1,0,0,1,0|1,0,1]=4 2981 B11R1.31 C\C(C=O)=C(/Cl)c1cccs1 Amb20670063 [0,1,0,0,1,0|1,0,0]=3 2982 B11R1.31 C\C(C=O)=C(\Cl)c1cccs1 Amb20670062 [0,1,0,0,1,0|1,0,0]=3 2983 B11R1.31 N=C(C=O)C(=O)c1cccs1 Amb28201032 [0,1,0,0,1,0|2,0,0]=4 2984 B11R1.35 CC(=O)\C(C)=C\c1ccco1 Amb33079023 [0,1,0,0,1,0|1,0,0]=3 2985 B11R1.35 CC(=O)\C(C)=C\c1ccns1 Amb35720407 [0,1,0,0,1,0|2,0,0]=4 2986 B11R1.35 CC(=O)\C(C)=C\c1ccoc1 Amb27985419 [0,1,0,0,1,0|1,0,0]=3 2987 B11R1.35 CC(=O)\C(C)=C\c1ccsc1 Amb24434611 [0,1,0,0,1,0|1,0,0]=3 2988 B11R1.35 C\C(=C/c1ccco1)C(=N)N Amb32953924 [0,1,0,0,1,0|2,0,0]=4 2989 B11R1.35 C\C(=C/c1ccco1)C(=O)O Amb5743924 [0,1,0,0,1,0|1,0,0]=3 2990 B11R1.35 C\C(=C/c1ccco1)C(N)=O Amb27231811 [0,1,0,0,1,0|1,0,0]=3 2991 B11R1.35 C\C(=C/c1ccco1)C(N)=S Amb33197985 [0,1,0,0,1,0|1,1,0]=4 2992 B11R1.35 C\C(=C/c1ccco1)[N+](=O)[O-] Amb31267735 [0,1,0,0,1,0|2,0,0]=4 2993 B11R1.35 C\C(=C/c1cccs1)C(=O)O Amb5743925 [0,1,0,0,1,0|1,0,0]=3 2994 B11R1.35 C\C(=C/c1cccs1)[N+](=O)[O-] Amb2609400 [0,1,0,0,1,0|2,0,0]=4 2995 B11R1.35 C\C(=C/c1ccns1)C(=O)O Amb30013782 [0,1,0,0,1,0|2,0,0]=4 2996 B11R1.35 C\C(=C/c1ccoc1)C(=O)O Amb27975673 [0,1,0,0,1,0|1,0,0]=3 2997 B11R1.35 C\C(=C/c1cncs1)C(=O)O Amb27803283 [0,1,0,0,1,0|2,0,0]=4 2998 B11R1.35 C\C(=C/c1cscn1)C(=O)O Amb27453159 [0,1,0,0,1,0|2,0,0]=4 2999 B11R1.35 C\C(=C\c1ccco1)C(=N)N Amb27789869 [0,1,0,0,1,0|2,0,0]=4 3000 B11R1.35 C\C(=C\c1ccco1)C(=O)O Amb4010273 [0,1,0,0,1,0|1,0,0]=3 3001 B11R1.35 C\C(=C\c1ccco1)[N+](=O)[O-] Amb6374135 [0,1,0,0,1,0|2,0,0]=4 3002 B11R1.35 C\C(=C\c1cccs1)C(=O)Cl Amb27952877 [0,1,0,0,1,0|1,0,0]=3 3003 B11R1.35 C\C(=C\c1cccs1)[N+](=O)[O-] Amb26359545 [0,1,0,0,1,0|2,0,0]=4 3004 B11R1.35 C\C(=C\c1ccoc1)[N+](=O)[O-] Amb27491483 [0,1,0,0,1,0|2,0,0]=4 3005 B11R1.35 C\C(=C\c1ccsc1)C(=O)O Amb28069074 [0,1,0,0,1,0|1,0,0]=3 3006 B11R1.35 C\C(=C\c1ccsc1)[N+](=O)[O-] Amb2609398 [0,1,0,0,1,0|2,0,0]=4 3007 B11R1.35 C\C(=C\c1nccs1)C(=O)O Amb27250230 [0,1,0,0,1,0|2,0,0]=4 3008 B11R1.35 N\C(=C\c1ccco1)C(=O)O Amb27493744 [0,1,0,0,1,0|2,0,0]=4 3009 B11R1.35 O=C(O)\C(F)=C\c1cccs1 Amb27470240 [0,1,0,0,1,0|2,0,0]=4 3010 B11R1.39 C\C(C=O)=C/c1cc(C)no1 Amb27808055 [0,1,0,0,1,0|2,0,0]=4 3011 B11R1.39 C\C(C=O)=C/c1cc(C)ns1 Amb35719816 [0,1,0,0,1,0|2,0,0]=4 3012 B11R1.39 C\C(C=O)=C/c1ccc(Br)s1 Amb32655890 [0,1,0,0,1,0|1,0,0]=3 3013 B11R1.39 C\C(C=O)=C/c1ccc(Cl)s1 Amb32655885 [0,1,0,0,1,0|1,0,0]=3 3014 B11R1.39 C\C(C=O)=C/c1cn(C)cn1 Amb27404773 [0,1,0,0,1,0|2,0,0]=4 3015 B11R1.39 C\C(C=O)=C/c1cnc(C)s1 Amb28251837 [0,1,0,0,1,0|2,0,0]=4 3016 B11R1.39 C\C(C=O)=C/c1cnn(C)c1 Amb27872931 [0,1,0,0,1,0|2,0,0]=4 3017 B11R1.39 C\C(C=O)=C/c1coc(C)n1 Amb8384847 [0,1,0,0,1,0|2,0,0]=4 3018 B11R1.39 C\C(C=O)=C/c1csc(Br)c1 Amb28454438 [0,1,0,0,1,0|1,0,0]=3 3019 B11R1.39 C\C(C=O)=C/c1csc(C)c1 Amb28062026 [0,1,0,0,1,0|1,0,0]=3 3020 B11R1.39 C\C(C=O)=C\c1csc(C)n1 Amb27432576 [0,1,0,0,1,0|2,0,0]=4 3021 B11R1.39 C\C(C=O)=C\c1ncc(C)s1 Amb27475282 [0,1,0,0,1,0|2,0,0]=4 3022 B11R1.39 C\C(C=O)=C\c1ncc(I)s1 Amb28119379 [0,1,0,0,1,0|2,0,0]=4 3023 B11R1.84 CC\C(C=O)=C/c1ccco1 Amb17334296 [0,1,0,0,1,0|1,0,0]=3 3024 B11R1.84 CC\C(C=O)=C/c1cccs1 Amb17334687 [0,1,0,0,1,0|1,0,0]=3 3025 B11R1.84 CC\C(C=O)=C/c1ccns1 Amb35719813 [0,1,0,0,1,0|2,0,0]=4 3026 B11R1.84 CC\C(C=O)=C/c1ccsc1 Amb32656159 [0,1,0,0,1,0|1,0,0]=3 3027 B11R1.84 CC\C(C=O)=C/c1cscn1 Amb27170549 [0,1,0,0,1,0|2,0,0]=4 3028 B11R1.84 CC\C(C=O)=C\c1ccoc1 Amb28320938 [0,1,0,0,1,0|1,0,0]=3 3029 B11R1.84 N#C\C(C=O)=C/c1ccco1 Amb3429788 [0,1,0,0,1,0|1,0,1]=4 3030 B11R1.84 N#C\C(C=O)=C/c1cccs1 Amb22339606 [0,1,0,0,1,0|1,0,1]=4 3031 B11R1.84 O=CC(C=O)=Cc1cccs1 Amb18126436 [0,1,0,0,1,0|1,0,1]=4 3032 B11R1.228 C\C(C=O)=C/c1cncn1C Amb27208832 [0,1,0,0,1,0|2,0,0]=4 3033 B11R1.228 C\C(C=O)=C\c1ccoc1C Amb27666282 [0,1,0,0,1,0|1,0,0]=3 3034 B11R1.228 C\C(C=O)=C\c1ccsc1C Amb28347813 [0,1,0,0,1,0|1,0,0]=3 3035 B11R1.228 C\C(C=O)=C\c1ccsc1Cl Amb27472447 [0,1,0,0,1,0|1,0,0]=3 3036 B11R1.228 C\C(C=O)=C\c1cscc1Br Amb27768352 [0,1,0,0,1,0|1,0,0]=3 3037 B11R1.228 C\C(C=O)=C\c1occc1Br Amb27594912 [0,1,0,0,1,0|1,0,0]=3 3038 B11R1.228 C\C(C=O)=C\c1sccc1C Amb27647200 [0,1,0,0,1,0|1,0,0]=3 3039 B13R1.11 C=C(\C=C(\C)C=O)c1ccccc1 Amb28052708 [0,1,0,0,0,1|0,0,0]=2 3040 B13R1.11 C=CC(=O)\C=C(\N)c1ccccc1 Amb27984681 [0,1,0,0,0,1|2,0,0]=4 3041 B13R1.11 C=C[C@@H](C)NC(=O)c1ccccc1 Amb27799733 [0,1,0,0,0,1|1,0,1]=4 3042 B13R1.11 C=C[C@H](C)NC(=O)c1ccccc1 Amb27408534 [0,1,0,0,0,1|1,0,1]=4 3043 B13R1.11 C=C\C(C)=C/C(=O)c1ccccc1 Amb27256419 [0,1,0,0,0,1|1,0,0]=3 3044 B13R1.11 CC(=C=C(C)c1ccccc1)CO Amb17594413 [0,1,0,0,0,1|0,0,2]=4 3045 B13R1.11 CN(\C=C(\O)C=O)c1ccccc1 Amb28285657 [0,1,0,0,0,1|1,0,0]=3 3046 B13R1.11 CN\C(C)=C/C(=S)c1ccccc1 Amb27667972 [0,1,0,0,0,1|2,0,0]=4 3047 B13R1.11 CO\C(C)=C\C(=O)c1ccccc1 Amb25988190 [0,1,0,0,0,1|2,0,0]=4 3048 B13R1.11 C[C@@H](C=O)NC(=O)c1ccccc1 Amb27215399 [0,1,0,0,0,1|0,0,1]=3 3049 B13R1.11 C[C@H](NC(=O)C=O)c1ccccc1 Amb27832008 [0,1,0,0,0,1|1,0,1]=4 3050 B13R1.11 C\C(=C/C(=O)c1ccccc1)CCl Amb28044413 [0,1,0,0,0,1|1,0,1]=4 3051 B13R1.11 C\C(=C\C(C)c1ccccc1)CN Amb27391934 [0,1,0,0,0,1|1,0,1]=4 3052 B13R1.11 C\C(=C\C(O)c1ccccc1)CO Amb27457898 [0,1,0,0,0,1|0,0,2]=4 3053 B13R1.11 C\C(C=O)=C/C(C)c1ccccc1 Amb18647861 [0,1,0,0,0,1|0,0,0]=2 3054 B13R1.11 C\C(CC(=O)c1ccccc1)=N\O Amb27164559 [0,1,0,0,0,1|1,0,1]=4 3055 B13R1.14 C=CC(=O)\C=C\c1ccc(Br)cc1 Amb33503229 [0,1,0,0,0,1|2,0,0]=4 3056 B13R1.14 C=CC(=O)\C=C\c1ccc(C)cc1 Amb33503115 [0,1,0,0,0,1|2,0,0]=4 3057 B13R1.14 C=CC(=O)\C=C\c1ccc(Cl)cc1 Amb20248598 [0,1,0,0,0,1|2,0,0]=4 3058 B13R1.14 C=CC(=O)\C=C\c1ccc(F)cc1 Amb33503230 [0,1,0,0,0,1|2,0,0]=4 3059 B13R1.14 CC(=C=Cc1ccc(Cl)cc1)CO Amb27394812 [0,1,0,0,0,1|0,0,2]=4 3060 B13R1.14 CC(C=O)CCc1ccc(Br)cc1 Amb33451835 [0,1,0,0,0,1|0,0,2]=4 3061 B13R1.14 CC(C=O)CCc1ccc(F)cc1 Amb33172044 [0,1,0,0,0,1|0,0,2]=4 3062 B13R1.14 CC(C=O)SCc1ccc(Cl)cc1 Amb32682548 [0,1,0,0,0,1|0,0,2]=4 3063 B13R1.14 CC(C=O)\C=C\c1ccc(F)cc1 Amb33202427 [0,1,0,0,0,1|0,0,1]=3 3064 B13R1.14 C\C(=C/Cl)COc1ccc(C)cc1 Amb6369294 [0,1,0,0,0,1|1,0,1]=4 3065 B13R1.14 C\C(=C\Cc1ccc(O)cc1)CO Amb28052328 [0,1,0,0,0,1|0,0,2]=4 3066 B13R1.14 C\C(=C\Cl)COc1ccc(F)cc1 Amb27780969 [0,1,0,0,0,1|1,0,1]=4 3067 B13R1.14 C\C(=C\Cl)COc1ccc(O)cc1 Amb27165518 [0,1,0,0,0,1|1,0,1]=4 3068 B13R1.14 C\C(C=O)=C\Nc1ccc(Cl)cc1 Amb27463203 [0,1,0,0,0,1|0,0,0]=2 3069 B13R1.14 C\C(C=O)=N/Nc1ccc(C)cc1 Amb28239502 [0,1,0,0,0,1|1,0,0]=3 3070 B13R1.14 C\C(C=O)=N\Nc1ccc(C)cc1 Amb28436740 [0,1,0,0,0,1|1,0,0]=3 3071 B13R1.14 Cc1ccc(N\N=C(/Cl)C=O)cc1 Amb27257882 [0,1,0,0,0,1|2,0,0]=4 3072 B13R1.14 Cc1ccc(N\N=C(\Cl)C=O)cc1 Amb27841142 [0,1,0,0,0,1|2,0,0]=4 3073 B13R1.14 O=CC(=O)\C=C\c1ccc(Cl)cc1 Amb25212273 [0,1,0,0,0,1|1,0,0]=3 3074 B13R1.14 O=C\C(Cl)=N/Nc1ccc(Br)cc1 Amb28075181 [0,1,0,0,0,1|2,0,0]=4 3075 B13R1.14 O=C\C(Cl)=N\Nc1ccc(Br)cc1 Amb22432453 [0,1,0,0,0,1|2,0,0]=4 3076 B13R1.14 O=C\C(O)=C/Nc1ccc(Cl)cc1 Amb27875099 [0,1,0,0,0,1|1,0,0]=3 3077 B13R1.14 O=C\C(O)=C/Nc1ccc(O)cc1 Amb27984998 [0,1,0,0,0,1|1,0,0]=3 3078 B13R1.15 C=CC(=O)\C=C\c1cccc(Br)c1 Amb33503220 [0,1,0,0,0,1|2,0,0]=4 3079 B13R1.15 C=CC(=O)\C=C\c1cccc(C)c1 Amb33503234 [0,1,0,0,0,1|2,0,0]=4 3080 B13R1.15 C=CC(=O)\C=C\c1cccc(Cl)c1 Amb33503240 [0,1,0,0,0,1|2,0,0]=4 3081 B13R1.15 C=CC(=O)\C=C\c1cccc(F)c1 Amb33503227 [0,1,0,0,0,1|2,0,0]=4 3082 B13R1.15 CC(C=O)CCc1cccc(Br)c1 Amb33452090 [0,1,0,0,0,1|0,0,2]=4 3083 B13R1.15 C\C(=C\Cl)CNc1cccc(Br)c1 Amb27243464 [0,1,0,0,0,1|1,0,1]=4 3084 B13R1.15 C\C(=C\Cl)CNc1cccc(C)c1 Amb27490501 [0,1,0,0,0,1|1,0,1]=4 3085 B13R1.15 C\C(=C\Cl)COc1cccc(N)c1 Amb27455717 [0,1,0,0,0,1|1,0,1]=4 3086 B13R1.15 Cc1cccc(CSC(C)C=O)c1 Amb32682551 [0,1,0,0,0,1|0,0,2]=4 3087 B13R1.42 C=CNC(=O)\C=C\c1ccccc1 Amb26908425 [0,1,0,0,0,1|2,0,0]=4 3088 B13R1.42 CC(=C\C#N)\N=N\c1ccccc1 Amb2384516 [0,1,0,0,0,1|2,0,0]=4 3089 B13R1.42 CC(=C\C=O)\N=C\c1ccccc1 Amb27848993 [0,1,0,0,0,1|0,0,0]=2 3090 B13R1.42 CC(C#Cc1ccccc1)CC=O Amb27238581 [0,1,0,0,0,1|0,0,2]=4 3091 B13R1.42 CC(\C=C\Cl)=N\Nc1ccccc1 Amb28421900 [0,1,0,0,0,1|2,0,0]=4 3092 B13R1.42 CC(\C=C\c1ccccc1)N=C=O Amb33081322 [0,1,0,0,0,1|0,0,2]=4 3093 B13R1.42 C[C@H](CC=O)OCc1ccccc1 Amb27755041 [0,1,0,0,0,1|0,0,2]=4 3094 B13R1.42 C\C(=C/C#N)CCc1ccccc1 Amb534860 [0,1,0,0,0,1|1,0,1]=4 3095 B13R1.42 C\C(=C/C#N)NCc1ccccc1 Amb27239911 [0,1,0,0,0,1|1,0,1]=4 3096 B13R1.42 C\C(=C\C#N)CCc1ccccc1 Amb612962 [0,1,0,0,0,1|1,0,1]=4 3097 B13R1.42 C\C(=C\C#N)COc1ccccc1 Amb35672478 [0,1,0,0,0,1|1,0,1]=4 3098 B13R1.42 C\C(=C\C#N)NCc1ccccc1 Amb27228218 [0,1,0,0,0,1|1,0,1]=4 3099 B13R1.42 C\C(=C\CN)CNc1ccccc1 Amb35604343 [0,1,0,0,0,1|1,0,1]=4 3100 B13R1.42 C\C(=C\Sc1ccccc1)N=C=O Amb27634377 [0,1,0,0,0,1|0,0,1]=3 3101 B13R1.42 C\C=C\C(=O)\C=C\c1ccccc1 Amb28074660 [0,1,0,0,0,1|2,0,0]=4 3102 B13R1.42 N\C=C\C(=O)\C=C\c1ccccc1 Amb28385592 [0,1,0,0,0,1|2,0,0]=4 3103 B13R1.42 O=C(\C=C/O)\C=C\c1ccccc1 Amb27750264 [0,1,0,0,0,1|1,0,1]=4 3104 B13R1.42 O=C(\C=C\c1ccccc1)\C=N\O Amb25065153 [0,1,0,0,0,1|1,0,1]=4 3105 B13R1.42 O=C=NC(=S)\C=C\c1ccccc1 Amb27238559 [0,1,0,0,0,1|1,0,1]=4 3106 B13R1.42 O=CCC(=O)OCc1ccccc1 Amb18128117 [0,1,0,0,0,1|1,0,1]=4 3107 B13R1.42 O=CNC(=O)OCc1ccccc1 Amb26572606 [0,1,0,0,0,1|1,0,1]=4 3108 B13R1.42 O=C\C=C(Cl)\C=C\c1ccccc1 Amb27643648 [0,1,0,0,0,1|1,0,0]=3 3109 B13R1.42 [N-]=[N+]=CC(=O)\C=C\c1ccccc1 Amb20248597 [0,1,0,0,0,1|2,0,0]=4 3110 B13R1.135 C=CC(=O)\C(C)=C\c1ccccc1 Amb33081532 [0,1,0,0,0,1|2,0,0]=4 3111 B13R1.135 CN(C=N)C(=S)Nc1ccccc1 Amb27868477 [0,1,0,0,0,1|2,0,0]=4 3112 B13R1.135 CN(N=O)C(=O)Nc1ccccc1 Amb28057772 [0,1,0,0,0,1|2,0,0]=4 3113 B13R1.135 C\C(=C/c1ccccc1)C(C)C=O Amb33082084 [0,1,0,0,0,1|0,0,1]=3 3114 B13R1.135 C\C(=C\O)C(=O)Oc1ccccc1 Amb28190324 [0,1,0,0,0,1|0,0,1]=3 3115 B13R1.135 C\C(CCl)=C(\C)Cc1ccccc1 Amb28059035 [0,1,0,0,0,1|1,0,1]=4 3116 B13R1.135 C\C(CO)=C(\C)Cc1ccccc1 Amb27651727 [0,1,0,0,0,1|0,0,2]=4 3117 B13R1.135 C\C(Sc1ccccc1)=C(\F)C=O Amb26362004 [0,1,0,0,0,1|1,0,0]=3 3118 B13R1.135 C\C=C(\C)C(=O)Nc1ccccc1 Amb27604243 [0,1,0,0,0,1|1,0,0]=3 3119 B13R1.135 C\C=C(\C)C(=O)Oc1ccccc1 Amb28126464 [0,1,0,0,0,1|1,0,0]=3 3120 B13R1.135 C\C=C(\C)C(=O)Oc1cccnc1 Amb27806023 [0,1,0,0,0,1|2,0,0]=4 3121 B13R1.135 O=C(Nc1ccccc1)\C(Cl)=C/O Amb27755040 [0,1,0,0,0,1|1,0,1]=4 3122 B13R1.254 CC(C)(C=O)CCc1ccccc1 Amb33042812 [0,1,0,0,0,1|0,0,2]=4 3123 B13R1.254 CC(C)(C=O)OCc1ccccc1 Amb24529611 [0,1,0,0,0,1|0,0,2]=4 3124 B13R1.254 CC(C)(C=O)SNc1ccccc1 Amb27592981 [0,1,0,0,0,1|1,0,1]=4 3125 B13R1.254 CC(C)(C=O)\C=C\c1ccccc1 Amb32952080 [0,1,0,0,0,1|0,0,1]=3 3126 B13R1.351 C=C(CCc1ccccc1)C(=O)O Amb18127719 [0,1,0,0,0,1|0,0,2]=4 3127 B13R1.351 C=C(\C=C\c1ccccc1)C(=O)O Amb33081816 [0,1,0,0,0,1|0,0,1]=3 3128 B13R1.351 C=C(\C=C\c1ccccc1)C(C)=O Amb27205181 [0,1,0,0,0,1|0,0,1]=3 3129 B13R1.351 CC(=O)C(=O)NCc1ccccc1 Amb17400597 [0,1,0,0,0,1|1,0,1]=4 3130 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,1,0,0,0,1|1,0,1]=4 3131 B13R1.351 CC(=O)C(C)OCc1ccccc1 Amb16231123 [0,1,0,0,0,1|0,0,2]=4 3132 B13R1.351 CC(=O)C(C)SCc1ccccc1 Amb9216163 [0,1,0,0,0,1|0,0,2]=4 3133 B13R1.351 CC(=O)C(O)\C=C\c1ccccc1 Amb27861376 [0,1,0,0,0,1|1,0,1]=4 3134 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,1,0,0,0,1|0,0,2]=4 3135 B13R1.351 CC(=O)\C(C)=C/Nc1ccccc1 Amb17778142 [0,1,0,0,0,1|0,0,0]=2 3136 B13R1.351 CC(=O)\C(C)=N/Nc1ccccc1 Amb3987265 [0,1,0,0,0,1|1,0,0]=3 3137 B13R1.351 CC(=O)\C(C)=N\Cc1ccccc1 Amb25130600 [0,1,0,0,0,1|0,0,1]=3 3138 B13R1.351 CC(=O)\C(C)=N\Nc1ccccc1 Amb8479546 [0,1,0,0,0,1|1,0,0]=3 3139 B13R1.351 CC(=O)\C(Cl)=C\Nc1ccccc1 Amb28290344 [0,1,0,0,0,1|1,0,0]=3 3140 B13R1.351 CC(=O)\C(Cl)=N/Nc1ccccc1 Amb1980993 [0,1,0,0,0,1|2,0,0]=4 3141 B13R1.351 CC(=O)\C(Cl)=N\Nc1ccccc1 Amb4004716 [0,1,0,0,0,1|2,0,0]=4 3142 B13R1.351 CC(=O)\C(N)=N\Nc1ccccc1 Amb2622246 [0,1,0,0,0,1|2,0,0]=4 3143 B13R1.351 CC(CCc1ccccc1)C(=O)O Amb4011190 [0,1,0,0,0,1|0,0,2]=4 3144 B13R1.351 CC(CNc1ccccc1)C(=O)O Amb9400301 [0,1,0,0,0,1|0,0,2]=4 3145 B13R1.351 CC(CNc1ccccc1)C(N)=O Amb8944556 [0,1,0,0,0,1|0,0,2]=4 3146 B13R1.351 CC(COc1ccccc1)C(=O)O Amb9394526 [0,1,0,0,0,1|0,0,2]=4 3147 B13R1.351 CC(COc1ccccc1)C(N)=O Amb17233540 [0,1,0,0,0,1|0,0,2]=4 3148 B13R1.351 CC(CSc1ccccc1)C(=O)O Amb9400034 [0,1,0,0,0,1|0,0,2]=4 3149 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb10199880 [0,1,0,0,0,1|0,0,2]=4 3150 B13R1.351 CC(NCc1ccccc1)C(=O)O Amb9704488 [0,1,0,0,0,1|0,0,2]=4 3151 B13R1.351 CC(NNc1ccccc1)C(N)=O Amb27845438 [0,1,0,0,0,1|1,0,1]=4 3152 B13R1.351 CC(OCc1ccccc1)C(=O)O Amb6280663 [0,1,0,0,0,1|0,0,2]=4 3153 B13R1.351 CC(OCc1ccccc1)C(N)=O Amb9004024 [0,1,0,0,0,1|0,0,2]=4 3154 B13R1.351 CC(SCc1ccccc1)C(=O)O Amb9710523 [0,1,0,0,0,1|0,0,2]=4 3155 B13R1.351 CC(\C=C\c1ccccc1)C(=O)O Amb18127714 [0,1,0,0,0,1|0,0,1]=3 3156 B13R1.351 CC(\N=C\c1ccncc1)C(=O)O Amb28396599 [0,1,0,0,0,1|1,0,1]=4 3157 B13R1.351 CN(CCc1ccccc1)C(=O)Cl Amb33620302 [0,1,0,0,0,1|1,0,1]=4 3158 B13R1.351 CN(OCc1ccccc1)C(N)=O Amb28122231 [0,1,0,0,0,1|1,0,1]=4 3159 B13R1.351 CN(\N=C\c1ccccc1)C(=N)N Amb22434918 [0,1,0,0,0,1|2,0,0]=4 3160 B13R1.351 CN(\N=C\c1ccccc1)C(N)=O Amb27444991 [0,1,0,0,0,1|1,0,0]=3 3161 B13R1.351 CN(\N=C\c1ccccc1)C(N)=S Amb27858722 [0,1,0,0,0,1|1,1,0]=4 3162 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)O Amb16185448 [0,1,0,0,0,1|0,0,2]=4 3163 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)O Amb6357814 [0,1,0,0,0,1|0,0,2]=4 3164 B13R1.351 C[C@@H](\C=C\c1ccccc1)C(=O)O Amb27592192 [0,1,0,0,0,1|0,0,1]=3 3165 B13R1.351 C[C@@H](\N=C\c1ccccc1)C(=O)[O-] Amb27639352 [0,1,0,0,0,1|0,0,1]=3 3166 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O Amb26326642 [0,1,0,0,0,1|0,0,2]=4 3167 B13R1.351 C[C@H](OCc1ccccc1)C(=O)O Amb25072743 [0,1,0,0,0,1|0,0,2]=4 3168 B13R1.351 C[C@H](OCc1ccccc1)C(N)=O Amb27411933 [0,1,0,0,0,1|0,0,2]=4 3169 B13R1.351 C[C@H](\C=C\c1ccccc1)C(=O)O Amb27179112 [0,1,0,0,0,1|0,0,1]=3 3170 B13R1.351 C\C(=C/Sc1ccccc1)C(C)O Amb27653063 [0,1,0,0,0,1|0,0,2]=4 3171 B13R1.351 C\C(=C/Sc1ccccc1)[C@@H](C)O Amb27593921 [0,1,0,0,0,1|0,0,2]=4 3172 B13R1.351 C\C(=N/Nc1ccccc1)C(=O)O Amb6487380 [0,1,0,0,0,1|1,0,0]=3 3173 B13R1.351 C\C(=N/Nc1ccccc1)C(N)=O Amb4019440 [0,1,0,0,0,1|1,0,0]=3 3174 B13R1.351 C\C(=N/Nc1cccnc1)C(=O)O Amb27608651 [0,1,0,0,0,1|2,0,0]=4 3175 B13R1.351 N=C(NNc1ccccc1)C(N)=O Amb6843468 [0,1,0,0,0,1|2,0,0]=4 3176 B13R1.351 NC(=O)C(=O)NNc1ccccc1 Amb27415736 [0,1,0,0,0,1|2,0,0]=4 3177 B13R1.351 NC(=O)C(=O)OCc1ccccc1 Amb27608591 [0,1,0,0,0,1|1,0,1]=4 3178 B13R1.351 N[C@@H](\C=C\c1ccccc1)C(=O)O Amb2694855 [0,1,0,0,0,1|1,0,1]=4 3179 B13R1.351 N\C(=C\Cc1cccnc1)C(=O)O Amb28370348 [0,1,0,0,0,1|2,0,0]=4 3180 B13R1.351 O=C(Cl)C(=O)OCc1ccccc1 Amb24687217 [0,1,0,0,0,1|1,0,1]=4 3181 B13R1.351 O=C(O)C(=O)CCc1ccccc1 Amb8391159 [0,1,0,0,0,1|1,0,1]=4 3182 B13R1.351 O=C(O)C(=O)NCc1ccccc1 Amb838961 [0,1,0,0,0,1|1,0,1]=4 3183 B13R1.351 O=C(O)C(=O)NNc1ccccc1 Amb18128574 [0,1,0,0,0,1|2,0,0]=4 3184 B13R1.351 O=C(O)C(=O)OCc1ccccc1 Amb18128558 [0,1,0,0,0,1|1,0,1]=4 3185 B13R1.351 O=C(O)C(=O)\C=C/c1ccccc1 Amb27628477 [0,1,0,0,0,1|1,0,0]=3 3186 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb16192457 [0,1,0,0,0,1|1,0,0]=3 3187 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb4477338 [0,1,0,0,0,1|1,0,0]=3 3188 B13R1.351 O=C(O)C(=O)\C=C\c1ccccn1 Amb17470558 [0,1,0,0,0,1|2,0,0]=4 3189 B13R1.351 O=C(O)C(=O)\C=C\c1cccnc1 Amb17470559 [0,1,0,0,0,1|2,0,0]=4 3190 B13R1.351 O=C(O)C(=O)\C=C\c1ccncc1 Amb17470560 [0,1,0,0,0,1|2,0,0]=4 3191 B13R1.351 O=C(O)C(=S)NCc1ccccc1 Amb27645460 [0,1,0,0,0,1|1,0,1]=4 3192 B13R1.351 O=C(O)C(O)\C=C\c1ccccc1 Amb17594531 [0,1,0,0,0,1|1,0,1]=4 3193 B13R1.351 O=C(O)[C@H](O)\C=C\c1ccccc1 Amb26621099 [0,1,0,0,0,1|1,0,1]=4 3194 B13R1.351 O=C(O)\C(Cl)=N\Nc1ccccc1 Amb27232838 [0,1,0,0,0,1|2,0,0]=4 3195 B13R1.351 O=C([O-])C(=O)CCc1ccccc1 Amb32662535 [0,1,0,0,0,1|1,0,1]=4 3196 B13R1.417 CC[C@H](C=O)OCc1ccccc1 Amb27667119 [0,1,0,0,0,1|0,0,2]=4 3197 B13R1.417 CC\C(C=O)=C/Nc1ccccc1 Amb18127492 [0,1,0,0,0,1|0,0,0]=2 3198 B13R1.417 CN\C(=C\Cc1ccccc1)OC Amb27947297 [0,1,0,0,0,1|2,0,0]=4 3199 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [0,1,0,0,0,1|2,0,0]=4 3200 B13R1.417 COC(\C=C\c1ccccc1)=C\Cl Amb27601252 [0,1,0,0,0,1|1,0,0]=3 3201 B13R1.417 C\N=C(/N=C/c1ccccc1)NC Amb27633166 [0,1,0,0,0,1|2,0,0]=4 3202 B13R1.417 N#CC(=C/Cl)\N=C\c1ccccc1 Amb27165717 [0,1,0,0,0,1|1,0,1]=4 3203 B13R1.417 O=CC(C=O)=CNc1ccccc1 Amb27393211 [0,1,0,0,0,1|0,0,1]=3 3204 B13R1.417 O=CC(C=O)=CNc1ccncc1 Amb27268295 [0,1,0,0,0,1|1,0,1]=4 3205 B13R1.417 O=CC(C=O)=NNc1ccccc1 Amb27964520 [0,1,0,0,0,1|1,0,1]=4 3206 B13R1.417 O=CC(CO)NCc1ccccc1 Amb27794409 [0,1,0,0,0,1|0,0,2]=4 3207 B13R1.417 O=CC(CO)OCc1ccccc1 Amb16231873 [0,1,0,0,0,1|0,0,2]=4 3208 B13R1.417 O=CC(\C=N\c1ccncc1)=C\O Amb27881811 [0,1,0,0,0,1|1,0,1]=4 3209 B13R1.417 O=C[C@H](CO)OCc1ccccc1 Amb19930161 [0,1,0,0,0,1|0,0,2]=4 3210 B13R1.417 OCC(=C=Cc1ccccc1)CO Amb27753005 [0,1,0,0,0,1|0,0,2]=4 3211 B13R1.528 C=CC(=O)\C=C\c1ccccc1Br Amb33503232 [0,1,0,0,0,1|2,0,0]=4 3212 B13R1.528 C=CC(=O)\C=C\c1ccccc1C Amb33503233 [0,1,0,0,0,1|2,0,0]=4 3213 B13R1.528 C=CC(=O)\C=C\c1ccccc1Cl Amb33503120 [0,1,0,0,0,1|2,0,0]=4 3214 B13R1.528 C=CC(=O)\C=C\c1ccccc1F Amb33503119 [0,1,0,0,0,1|2,0,0]=4 3215 B13R1.528 CC(C=O)SCc1ccccc1Cl Amb32682547 [0,1,0,0,0,1|0,0,2]=4 3216 B13R1.528 C\C(=C/Cc1ccccc1O)CO Amb17594552 [0,1,0,0,0,1|0,0,2]=4 3217 B13R1.528 C\C(=C\Cl)COc1ccccc1C Amb27249213 [0,1,0,0,0,1|1,0,1]=4 3218 B13R1.528 C\C(=C\Cl)COc1ccccc1Cl Amb28324793 [0,1,0,0,0,1|1,0,1]=4 3219 B13R1.528 C\C(=C\Cl)COc1ccccc1O Amb27954906 [0,1,0,0,0,1|1,0,1]=4 3220 B13R1.528 C\C(=C\Cl)CSc1ccccc1O Amb27401544 [0,1,0,0,0,1|1,0,1]=4 3221 B13R1.528 C\C(C=O)=C\Nc1ccccc1N Amb27751221 [0,1,0,0,0,1|0,0,0]=2 3222 B13R1.528 Cc1ccccc1CSC(C)C=O Amb32682552 [0,1,0,0,0,1|0,0,2]=4 3223 B13R1.528 Cc1ccccc1N\C=C(/O)C=O Amb28129816 [0,1,0,0,0,1|1,0,0]=3 3224 B13R1.528 O=C\C(O)=C/Nc1ccccc1O Amb27185973 [0,1,0,0,0,1|1,0,0]=3 3225 B13R1.528 O\C=C(O)/C=N/c1ccccc1Cl Amb27207733 [0,1,0,0,0,1|1,0,1]=4 3226 B13R1.528 O\C=C(O)/C=N/c1ccccc1O Amb27626923 [0,1,0,0,0,1|1,0,1]=4 3227 B13R1.19 CNC\C(C)=C\c1ccc(F)cc1 Amb28204433 [0,2,0,0,0,0|1,0,1]=4 3228 B13R1.19 CNC\C(C)=C\c1ccc(I)cc1 Amb27169997 [0,2,0,0,0,0|1,0,1]=4 3229 B13R1.19 C\C(=C/C=O)Nc1ccc(C)cc1 Amb18127487 [0,2,0,0,0,0|1,0,0]=3 3230 B13R1.19 C\C(=C/CCl)Cc1ccc(Cl)cc1 Amb28285572 [0,2,0,0,0,0|1,0,1]=4 3231 B13R1.19 C\C(=C\C#N)Cc1ccc(Br)cc1 Amb27807899 [0,2,0,0,0,0|1,0,1]=4 3232 B13R1.19 C\C(=C\C#N)Cc1ccc(Cl)cc1 Amb28079321 [0,2,0,0,0,0|1,0,1]=4 3233 B13R1.19 C\C(=C\C#N)Cc1ccc(F)cc1 Amb27431088 [0,2,0,0,0,0|1,0,1]=4 3234 B13R1.19 C\C(=C\C#N)Nc1ccc(C)cc1 Amb2637372 [0,2,0,0,0,0|2,0,0]=4 3235 B13R1.19 C\C(=C\C#N)Nc1ccc(O)cc1 Amb28350026 [0,2,0,0,0,0|2,0,0]=4 3236 B13R1.19 C\C(=C\CCl)Cc1ccc(Cl)cc1 Amb27205126 [0,2,0,0,0,0|1,0,1]=4 3237 B13R1.19 C\C(=C\CN)Cc1ccc(Br)cc1 Amb27223681 [0,2,0,0,0,0|1,0,1]=4 3238 B13R1.19 C\C(=C\CN)Cc1ccc(Cl)cc1 Amb27597825 [0,2,0,0,0,0|1,0,1]=4 3239 B13R1.20 CC(Cc1cccc(Cl)c1)NC=O Amb28204606 [0,2,0,0,0,0|0,0,2]=4 3240 B13R1.20 CC(Cc1cccc(N)c1)NC=O Amb27841417 [0,2,0,0,0,0|0,0,2]=4 3241 B13R1.20 CNC\C(C)=C\c1cccc(C)c1 Amb27761052 [0,2,0,0,0,0|1,0,1]=4 3242 B13R1.20 CNC\C(C)=C\c1cccc(Cl)c1 Amb27224650 [0,2,0,0,0,0|1,0,1]=4 3243 B13R1.20 CNC\C(C)=C\c1cccc(F)c1 Amb28070114 [0,2,0,0,0,0|1,0,1]=4 3244 B13R1.20 C\C(=C\C#N)Nc1cccc(Cl)c1 Amb27592983 [0,2,0,0,0,0|2,0,0]=4 3245 B13R1.20 C\C(=C\C=O)Nc1cccc(Cl)c1 Amb27841328 [0,2,0,0,0,0|1,0,0]=3 3246 B13R1.20 C\C(=C\CN)Cc1cccc(F)c1 Amb27798046 [0,2,0,0,0,0|1,0,1]=4 3247 B13R1.44 C#CCC\C(C)=C\c1ccccc1 Amb33381227 [0,2,0,0,0,0|1,0,1]=4 3248 B13R1.44 CC(=C\c1ccccc1)\C=C\CCl Amb27955281 [0,2,0,0,0,0|1,0,0]=3 3249 B13R1.44 CC(\C=C\C=O)=C/c1ccccc1 Amb27793091 [0,2,0,0,0,0|0,0,0]=2 3250 B13R1.44 CC(\C=C\CN)=C/c1ccccc1 Amb33380902 [0,2,0,0,0,0|1,0,0]=3 3251 B13R1.44 CC(\C=C\CO)=C/c1ccccc1 Amb32954083 [0,2,0,0,0,0|0,0,1]=3 3252 B13R1.44 CNCC\C(C)=C\c1ccccc1 Amb33476406 [0,2,0,0,0,0|1,0,1]=4 3253 B13R1.44 C\C(=C/c1ccccc1)CCC#N Amb33476436 [0,2,0,0,0,0|1,0,1]=4 3254 B13R1.44 C\C(=C/c1ccccc1)CCC=O Amb32954206 [0,2,0,0,0,0|0,0,0]=2 3255 B13R1.44 C\C(=C/c1ccccc1)CCCBr Amb33381474 [0,2,0,0,0,0|1,0,1]=4 3256 B13R1.44 C\C(=C/c1ccccc1)CCCN Amb32951765 [0,2,0,0,0,0|1,0,1]=4 3257 B13R1.44 C\C(=C/c1ccccc1)CCCO Amb33081745 [0,2,0,0,0,0|0,0,2]=4 3258 B13R1.44 C\C(=C/c1ccccc1)CCCS Amb33381252 [0,2,0,0,0,0|0,1,1]=4 3259 B13R1.44 C\C(=C/c1ccccc1)CCON Amb33476438 [0,2,0,0,0,0|0,0,2]=4 3260 B13R1.44 C\C(=C/c1ccccc1)CN=C=O Amb33476145 [0,2,0,0,0,0|0,0,1]=3 3261 B13R1.44 C\C(=C/c1ccccc1)CN=[N+]=[N-] Amb27607759 [0,2,0,0,0,0|1,0,1]=4 3262 B13R1.44 O=CCNC(=O)Cc1ccccc1 Amb17102089 [0,2,0,0,0,0|1,0,1]=4 3263 B13R1.44 O=CNNC(=O)Nc1ccccc1 Amb22227960 [0,2,0,0,0,0|2,0,0]=4 3264 B13R1.44 O=CNNC(=S)Nc1ccccc1 Amb6555091 [0,2,0,0,0,0|2,0,0]=4 3265 B13R1.44 O=C\C=N\C(=O)Nc1ccccc1 Amb26012474 [0,2,0,0,0,0|2,0,0]=4 3266 B13R1.44 [C-]#[N+]CC\C(C)=C\c1ccccc1 Amb33476429 [0,2,0,0,0,0|1,0,1]=4 3267 B13R1.47 CC(\C=N\O)C(=O)c1ccccc1 Amb25833623 [0,2,0,0,0,0|0,0,2]=4 3268 B13R1.47 CC=C=C(C)C(O)c1ccccc1 Amb17594415 [0,2,0,0,0,0|1,0,1]=4 3269 B13R1.47 CC\C=C(/C)C(O)c1ccccc1 Amb22546638 [0,2,0,0,0,0|1,0,1]=4 3270 B13R1.47 CC\C=C(\C)C(=O)c1ccccc1 Amb27252342 [0,2,0,0,0,0|1,0,0]=3 3271 B13R1.47 CC\C=C(\C)C(O)c1ccccc1 Amb28294233 [0,2,0,0,0,0|1,0,1]=4 3272 B13R1.47 CC\C=C(\Cl)C(=O)c1ccccc1 Amb26442043 [0,2,0,0,0,0|2,0,0]=4 3273 B13R1.47 CC\C=C(\F)C(=O)c1ccccc1 Amb26420849 [0,2,0,0,0,0|2,0,0]=4 3274 B13R1.47 CN(CC=O)C(=O)c1ccccc1 Amb17080681 [0,2,0,0,0,0|1,0,0]=3 3275 B13R1.47 CN(CC=O)C(=O)c1cccnc1 Amb17080721 [0,2,0,0,0,0|2,0,0]=4 3276 B13R1.47 CO\C=C(\C)C(=O)c1ccccc1 Amb28253745 [0,2,0,0,0,0|0,0,1]=3 3277 B13R1.47 CO\N=C(\C)C(=O)c1ccccc1 Amb26925146 [0,2,0,0,0,0|1,0,1]=4 3278 B13R1.47 C[C@@H](NC=O)[C@H](O)c1ccccc1 Amb27401045 [0,2,0,0,0,0|0,0,2]=4 3279 B13R1.47 C[C@H](NC=O)C(=O)c1ccccc1 Amb27859073 [0,2,0,0,0,0|0,0,1]=3 3280 B13R1.47 C\C(=C/CO)C(O)c1ccccc1 Amb22547006 [0,2,0,0,0,0|0,0,2]=4 3281 B13R1.47 C\C(=C\CN)C(O)c1ccccc1 Amb27803981 [0,2,0,0,0,0|1,0,1]=4 3282 B13R1.47 C\C(=C\CO)C(=O)c1ccccc1 Amb25956498 [0,2,0,0,0,0|0,0,1]=3 3283 B13R1.47 C\C(=C\CO)C(O)c1ccccc1 Amb22547016 [0,2,0,0,0,0|0,0,2]=4 3284 B13R1.47 C\C(=C\CO)[C@H](O)c1ccccc1 Amb27605421 [0,2,0,0,0,0|0,0,2]=4 3285 B13R1.47 C\C=C\C(C)C(=O)c1ccccc1 Amb24492785 [0,2,0,0,0,0|1,0,1]=4 3286 B13R1.47 N#C\C=C(/N)C(=O)c1ccccc1 Amb18126894 [0,2,0,0,0,0|2,0,0]=4 3287 B13R1.47 O=C=N\C(Cl)=C(/Cl)c1ccccc1 Amb25898053 [0,2,0,0,0,0|1,0,1]=4 3288 B13R1.47 O=C\C=C(/Cl)C(=O)c1ccccc1 Amb27827819 [0,2,0,0,0,0|1,0,0]=3 3289 B13R1.79 CC=C=C(CO)Cc1ccccc1 Amb27978448 [0,2,0,0,0,0|1,0,1]=4 3290 B13R1.79 CCC(=C\c1ccccc1)\C=N\O Amb27191649 [0,2,0,0,0,0|0,0,1]=3 3291 B13R1.79 CCN(CC=O)Cc1ccccc1 Amb18186091 [0,2,0,0,0,0|1,0,1]=4 3292 B13R1.79 CCO\C(C=O)=C/c1ccccc1 Amb22546895 [0,2,0,0,0,0|0,0,0]=2 3293 B13R1.79 COC\C(C#N)=C\c1ccccc1 Amb26900028 [0,2,0,0,0,0|1,0,1]=4 3294 B13R1.79 N#C\C(=C/c1ccccc1)CCO Amb18647732 [0,2,0,0,0,0|1,0,1]=4 3295 B13R1.79 N#C\C(=C/c1ccccc1)N=C=O Amb24743354 [0,2,0,0,0,0|0,0,2]=4 3296 B13R1.79 NCCN(C=O)Cc1ccccc1 Amb27967868 [0,2,0,0,0,0|1,0,1]=4 3297 B13R1.79 O=CN(CCO)Cc1ccccc1 Amb18796127 [0,2,0,0,0,0|1,0,1]=4 3298 B13R1.79 [N-]=[N+]=N\C(C=O)=C\c1ccccc1 Amb27863758 [0,2,0,0,0,0|1,0,0]=3 3299 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 Amb15692856 [0,2,0,0,0,0|1,0,1]=4 3300 B13R1.348 CC(=O)CC(=O)Nc1ccccc1 Amb1210069 [0,2,0,0,0,0|2,0,0]=4 3301 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,2,0,0,0,0|2,0,0]=4 3302 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [0,2,0,0,0,0|2,0,0]=4 3303 B13R1.348 CC(=O)CC(C)Sc1ccccc1 Amb32683051 [0,2,0,0,0,0|1,0,1]=4 3304 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,2,0,0,0,0|1,0,1]=4 3305 B13R1.348 CC(=O)C\C(C)=C\c1ccccc1 Amb17778970 [0,2,0,0,0,0|0,0,0]=2 3306 B13R1.348 CC(=O)C\C(C)=N/c1ccccc1 Amb2610547 [0,2,0,0,0,0|1,0,0]=3 3307 B13R1.348 CC(=O)NC(=O)Nc1ccccc1 Amb4017470 [0,2,0,0,0,0|2,0,0]=4 3308 B13R1.348 CC(=O)NC(=O)Oc1ccccc1 Amb28366948 [0,2,0,0,0,0|2,0,0]=4 3309 B13R1.348 CC(=O)NC(=S)Nc1ccccc1 Amb2456399 [0,2,0,0,0,0|2,0,0]=4 3310 B13R1.348 CC(=O)NC(C)Cc1ccccc1 Amb8503527 [0,2,0,0,0,0|0,0,2]=4 3311 B13R1.348 CC(=O)N\C(Cl)=C/c1ccccc1 Amb27442451 [0,2,0,0,0,0|1,0,0]=3 3312 B13R1.348 CC(=O)\C=C(/C)Cc1ccccc1 Amb17778969 [0,2,0,0,0,0|0,0,1]=3 3313 B13R1.348 CC(=O)\C=C(/C)Nc1ccccc1 Amb20672001 [0,2,0,0,0,0|1,0,0]=3 3314 B13R1.348 CC(=O)\C=C(/Cl)Sc1ccccc1 Amb17595760 [0,2,0,0,0,0|2,0,0]=4 3315 B13R1.348 CC(=O)\C=C(\C)Nc1ccccc1 Amb2386561 [0,2,0,0,0,0|1,0,0]=3 3316 B13R1.348 CC(=O)\C=C(\N)Nc1ccccc1 Amb27876049 [0,2,0,0,0,0|2,0,0]=4 3317 B13R1.348 CC(C)=C\C(C)=C/c1ccccc1 Amb10606581 [0,2,0,0,0,0|1,0,0]=3 3318 B13R1.348 CC(C)=C\C(C)=C\c1ccccc1 Amb10842055 [0,2,0,0,0,0|1,0,0]=3 3319 B13R1.348 CC(C)=C\C(C)=N\c1ccccc1 Amb8392389 [0,2,0,0,0,0|2,0,0]=4 3320 B13R1.348 CC(CC(=O)O)Cc1ccccc1 Amb17233403 [0,2,0,0,0,0|0,0,2]=4 3321 B13R1.348 CC(CC(=O)O)Nc1ccccc1 Amb9398389 [0,2,0,0,0,0|1,0,1]=4 3322 B13R1.348 CC(CC(=O)O)Oc1ccccc1 Amb9397751 [0,2,0,0,0,0|1,0,1]=4 3323 B13R1.348 CC(CC(N)=O)Nc1ccccc1 Amb17233441 [0,2,0,0,0,0|1,0,1]=4 3324 B13R1.348 CC(CC(N)=O)Oc1ccccc1 Amb17233539 [0,2,0,0,0,0|1,0,1]=4 3325 B13R1.348 CC(Cc1ccccc1)NC(=O)Cl Amb35625792 [0,2,0,0,0,0|0,0,2]=4 3326 B13R1.348 CC(Cc1ccccc1)OC(=O)Cl Amb33297088 [0,2,0,0,0,0|0,0,2]=4 3327 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb33551957 [0,2,0,0,0,0|1,0,1]=4 3328 B13R1.348 CN(CC(=O)O)Cc1ccccc1 Amb5768759 [0,2,0,0,0,0|1,0,1]=4 3329 B13R1.348 C[C@@H](CC(=O)O)Nc1ccccc1 Amb26519867 [0,2,0,0,0,0|1,0,1]=4 3330 B13R1.348 C[C@H](CC(=O)O)Nc1ccccc1 Amb8397199 [0,2,0,0,0,0|1,0,1]=4 3331 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,2,0,0,0,0|0,0,2]=4 3332 B13R1.348 C\C(=C/C(=O)O)Cc1ccccc1 Amb17233183 [0,2,0,0,0,0|0,0,1]=3 3333 B13R1.348 C\C(=C/C(=O)O)Sc1ccccc1 Amb18130094 [0,2,0,0,0,0|1,0,0]=3 3334 B13R1.348 C\C(=C/C(C)N)Cc1ccccc1 Amb28187105 [0,2,0,0,0,0|1,0,1]=4 3335 B13R1.348 C\C(=C/C(N)=O)Sc1ccccc1 Amb27433878 [0,2,0,0,0,0|1,0,0]=3 3336 B13R1.348 C\C(=C/c1ccccc1)CC(=N)N Amb33381495 [0,2,0,0,0,0|1,0,0]=3 3337 B13R1.348 C\C(=C/c1ccccc1)CC(=O)O Amb17594482 [0,2,0,0,0,0|0,0,0]=2 3338 B13R1.348 C\C(=C/c1ccccc1)CC(C)Br Amb33476750 [0,2,0,0,0,0|1,0,1]=4 3339 B13R1.348 C\C(=C/c1ccccc1)CC(C)O Amb28190232 [0,2,0,0,0,0|0,0,2]=4 3340 B13R1.348 C\C(=C/c1ccccc1)CC(N)=O Amb33513125 [0,2,0,0,0,0|0,0,0]=2 3341 B13R1.348 C\C(=C/c1ccccc1)CC(N)=S Amb33381499 [0,2,0,0,0,0|0,1,0]=3 3342 B13R1.348 C\C(=C/c1ccccc1)CN(C)O Amb33476414 [0,2,0,0,0,0|0,0,2]=4 3343 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)N Amb33476743 [0,2,0,0,0,0|1,0,1]=4 3344 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)O Amb32954504 [0,2,0,0,0,0|0,0,2]=4 3345 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)N Amb33476746 [0,2,0,0,0,0|1,0,1]=4 3346 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)O Amb32953325 [0,2,0,0,0,0|0,0,2]=4 3347 B13R1.348 C\C(=C/c1ccccc1)C[N+](=O)[O-] Amb33380907 [0,2,0,0,0,0|0,0,1]=3 3348 B13R1.348 C\C(=C\C(C)C)Nc1ccccc1 Amb27411239 [0,2,0,0,0,0|2,0,0]=4 3349 B13R1.348 C\C(=C\C(N)=O)Nc1ccccc1 Amb26563719 [0,2,0,0,0,0|1,0,0]=3 3350 B13R1.348 C\C(=C\c1ccccc1)NC(N)=O Amb26490847 [0,2,0,0,0,0|0,0,0]=2 3351 B13R1.348 C\C(Cc1ccccc1)=N\S(C)=O Amb35692915 [0,2,0,0,0,0|1,0,1]=4 3352 B13R1.348 N=C(Cc1ccccc1)NC(N)=O Amb27954665 [0,2,0,0,0,0|1,0,1]=4 3353 B13R1.348 NC(=O)NC(=O)Cc1ccccc1 Amb8513476 [0,2,0,0,0,0|1,0,1]=4 3354 B13R1.348 NC(=O)NC(=O)Nc1ccccc1 Amb2222030 [0,2,0,0,0,0|2,0,0]=4 3355 B13R1.348 NC(=O)NC(=S)Nc1ccccc1 Amb4010079 [0,2,0,0,0,0|2,0,0]=4 3356 B13R1.348 O=C(Cl)CC(=O)Nc1ccccc1 Amb27631237 [0,2,0,0,0,0|2,0,0]=4 3357 B13R1.348 O=C(Cl)NC(=O)Cc1ccccc1 Amb27169467 [0,2,0,0,0,0|1,0,1]=4 3358 B13R1.348 O=C(O)CC(=O)Nc1ccccc1 Amb2436726 [0,2,0,0,0,0|2,0,0]=4 3359 B13R1.348 O=C([O-])CC(=O)Oc1ccccc1 Amb33513155 [0,2,0,0,0,0|2,0,0]=4 3360 B13R1.470 C=CC\C(C)=C\c1ccccc1O Amb27256535 [0,2,0,0,0,0|1,0,0]=3 3361 B13R1.470 CNC\C(C)=C\c1ccccc1C Amb27828991 [0,2,0,0,0,0|1,0,1]=4 3362 B13R1.470 C\C(=C\C#N)Nc1ccccc1C Amb28428578 [0,2,0,0,0,0|2,0,0]=4 3363 B13R1.1327 CC(C)(CC=O)Nc1ccccc1 Amb8392387 [0,2,0,0,0,0|1,0,1]=4 3364 B13R1.1327 CC(C)(CC=O)Sc1ccccc1 Amb18130120 [0,2,0,0,0,0|1,0,1]=4 3365 B13R1.21 C=CC(C)C(=O)c1ccc(C)cc1 Amb27854300 [0,2,0,0,0,0|1,0,1]=4 3366 B13R1.21 CC(C=O)C(=O)c1ccc(F)cc1 Amb25959438 [0,2,0,0,0,0|0,0,1]=3 3367 B13R1.21 CC(C=O)C(=O)c1ccc(F)cn1 Amb24701731 [0,2,0,0,0,0|1,0,1]=4 3368 B13R1.21 CC(C=O)C(C)c1ccc(F)cc1 Amb33273696 [0,2,0,0,0,0|0,0,2]=4 3369 B13R1.21 CC(C=O)S(=O)c1ccc(Br)cc1 Amb35647234 [0,2,0,0,0,0|1,0,1]=4 3370 B13R1.21 CC(C=O)S(=O)c1ccc(Cl)cc1 Amb35647231 [0,2,0,0,0,0|1,0,1]=4 3371 B13R1.21 CC(C=O)S(=O)c1ccc(F)cc1 Amb35640879 [0,2,0,0,0,0|1,0,1]=4 3372 B13R1.21 CC(c1ccc(Cl)cc1)N(C)C=O Amb27857086 [0,2,0,0,0,0|1,0,1]=4 3373 B13R1.21 CN(C(=O)C=O)c1ccc(Cl)cc1 Amb27873495 [0,2,0,0,0,0|2,0,0]=4 3374 B13R1.21 CN(C(=O)C=O)c1ccc(F)cc1 Amb28208456 [0,2,0,0,0,0|2,0,0]=4 3375 B13R1.21 C\C(=C\O)C(=O)c1ccc(Cl)cc1 Amb28190347 [0,2,0,0,0,0|0,0,1]=3 3376 B13R1.21 C\C(=N/O)C(=O)c1ccc(Br)cc1 Amb3467084 [0,2,0,0,0,0|1,0,1]=4 3377 B13R1.21 C\C(=N/O)C(=O)c1ccc(C)cc1 Amb1670413 [0,2,0,0,0,0|1,0,1]=4 3378 B13R1.21 C\C(=N/O)C(=O)c1ccc(Cl)cc1 Amb1670414 [0,2,0,0,0,0|1,0,1]=4 3379 B13R1.21 C\C(=N\O)C(=O)c1ccc(C)cc1 Amb24271283 [0,2,0,0,0,0|1,0,1]=4 3380 B13R1.21 C\C(=N\O)C(=O)c1ccc(Cl)cc1 Amb24271272 [0,2,0,0,0,0|1,0,1]=4 3381 B13R1.21 C\C(=N\O)C(=O)c1ccc(F)cc1 Amb27645669 [0,2,0,0,0,0|1,0,1]=4 3382 B13R1.21 C\C(C#N)=C(\Cl)c1ccc(Cl)cc1 Amb27414501 [0,2,0,0,0,0|1,0,1]=4 3383 B13R1.21 C\C(C#N)=C(\Cl)c1ccc(I)cc1 Amb27406197 [0,2,0,0,0,0|1,0,1]=4 3384 B13R1.21 C\C(C#N)=C(\N)c1ccc(Br)cc1 Amb27480638 [0,2,0,0,0,0|1,0,1]=4 3385 B13R1.21 C\C(C#N)=C(\N)c1ccc(O)cc1 Amb26467929 [0,2,0,0,0,0|1,0,1]=4 3386 B13R1.21 C\C(C=O)=C(\Cl)c1ccc(Br)cc1 Amb27608873 [0,2,0,0,0,0|0,0,0]=2 3387 B13R1.21 C\C(C=O)=C(\Cl)c1ccc(C)cc1 Amb25793245 [0,2,0,0,0,0|0,0,0]=2 3388 B13R1.21 C\C(CO)=C(\C)c1ccc(C)cc1 Amb27970841 [0,2,0,0,0,0|0,0,2]=4 3389 B13R1.21 C\C(CO)=C(\C)c1ccc(Cl)cc1 Amb27766626 [0,2,0,0,0,0|0,0,2]=4 3390 B13R1.21 C\C=C(/C)C(=O)c1ccc(C)cc1 Amb28122474 [0,2,0,0,0,0|1,0,0]=3 3391 B13R1.21 C\C=C(\O)C(=O)c1ccc(C)cc1 Amb28131964 [0,2,0,0,0,0|2,0,0]=4 3392 B13R1.21 Cc1ccc(C(=O)C([Na])C=O)cc1 Amb27875490 [0,2,0,0,0,0|1,0,1]=4 3393 B13R1.21 Cc1ccc(C(=O)\C(F)=C\O)cc1 Amb27956140 [0,2,0,0,0,0|1,0,1]=4 3394 B13R1.21 Cc1ccc(\C(F)=C(/F)C=O)cc1 Amb18128967 [0,2,0,0,0,0|1,0,0]=3 3395 B13R1.21 N=C(C=O)C(=O)c1ccc(Cl)cc1 Amb27972953 [0,2,0,0,0,0|1,0,0]=3 3396 B13R1.22 C=C(C=O)C(O)c1cccc(Cl)c1 Amb27752306 [0,2,0,0,0,0|0,0,2]=4 3397 B13R1.22 CC(C=O)C(=O)c1cccc(Br)c1 Amb27448169 [0,2,0,0,0,0|0,0,1]=3 3398 B13R1.22 CC(C=O)C(O)c1cccc(Cl)c1 Amb27972525 [0,2,0,0,0,0|0,0,2]=4 3399 B13R1.22 CC(C=O)S(=O)c1cccc(Br)c1 Amb35647214 [0,2,0,0,0,0|1,0,1]=4 3400 B13R1.22 CC(C=O)S(=O)c1cccc(Cl)c1 Amb35647232 [0,2,0,0,0,0|1,0,1]=4 3401 B13R1.22 CC(C=O)S(=O)c1cccc(F)c1 Amb35646658 [0,2,0,0,0,0|1,0,1]=4 3402 B13R1.22 C\C(=N/O)C(=O)c1cccc(Cl)c1 Amb22054708 [0,2,0,0,0,0|1,0,1]=4 3403 B13R1.22 C\C(=N/O)C(=O)c1cccc(O)c1 Amb24686470 [0,2,0,0,0,0|1,0,1]=4 3404 B13R1.22 C\C(=N\O)C(=O)c1cccc(C)c1 Amb25358865 [0,2,0,0,0,0|1,0,1]=4 3405 B13R1.22 C\C(C#N)=C(\Cl)c1cccc(Br)c1 Amb27223221 [0,2,0,0,0,0|1,0,1]=4 3406 B13R1.22 C\C(C#N)=C(\Cl)c1cccc(C)c1 Amb28061072 [0,2,0,0,0,0|1,0,1]=4 3407 B13R1.22 C\C(C#N)=C(\Cl)c1cccc(Cl)c1 Amb27406198 [0,2,0,0,0,0|1,0,1]=4 3408 B13R1.22 C\C(C#N)=C(\N)c1cccc(C)c1 Amb28457145 [0,2,0,0,0,0|1,0,1]=4 3409 B13R1.22 C\C(C#N)=C(\N)c1cccc(F)c1 Amb28044696 [0,2,0,0,0,0|1,0,1]=4 3410 B13R1.22 C\C(C=O)=C(\Cl)c1cccc(Br)c1 Amb27946855 [0,2,0,0,0,0|0,0,0]=2 3411 B13R1.22 Cc1cccc(S(=O)C(C)C=O)c1 Amb35646450 [0,2,0,0,0,0|1,0,1]=4 3412 B13R1.86 C=C(\C(C=O)=C/O)c1ccccc1 Amb27841151 [0,2,0,0,0,0|0,0,1]=3 3413 B13R1.86 CC\C(=C/O)C(=O)c1ccccc1 Amb27954228 [0,2,0,0,0,0|0,0,1]=3 3414 B13R1.86 CC\C(=C\Cl)C(=O)c1ccccc1 Amb27974273 [0,2,0,0,0,0|1,0,0]=3 3415 B13R1.86 CC\C(C#N)=C(\N)c1ccccc1 Amb27607709 [0,2,0,0,0,0|1,0,1]=4 3416 B13R1.86 CC\C(C=O)=C(\C)c1ccccc1 Amb18127296 [0,2,0,0,0,0|0,0,0]=2 3417 B13R1.86 CC\C(C=O)=C(\Cl)c1ccccc1 Amb26030945 [0,2,0,0,0,0|0,0,0]=2 3418 B13R1.86 CC\C(CCl)=C(/Cl)c1ccccc1 Amb27258991 [0,2,0,0,0,0|1,0,1]=4 3419 B13R1.86 CC\C(CCl)=C(\Cl)c1ccccc1 Amb28248077 [0,2,0,0,0,0|1,0,1]=4 3420 B13R1.86 CC\C(CO)=C(\C)c1ccccc1 Amb27588987 [0,2,0,0,0,0|0,0,2]=4 3421 B13R1.86 C\C=C(/C#N)C(=O)c1ccccc1 Amb28144127 [0,2,0,0,0,0|1,0,1]=4 3422 B13R1.86 C\C=C(/CC)C(=O)c1ccccc1 Amb28322030 [0,2,0,0,0,0|1,0,0]=3 3423 B13R1.86 C\C=C(\CO)C(O)c1ccccc1 Amb27484745 [0,2,0,0,0,0|1,0,1]=4 3424 B13R1.86 N#C\C(C=O)=C(/N)c1ccccc1 Amb27444122 [0,2,0,0,0,0|0,0,1]=3 3425 B13R1.86 N#C\C(C=S)=C(/N)c1ccccc1 Amb28244723 [0,2,0,0,0,0|0,1,1]=4 3426 B13R1.86 O=C\C(CCl)=C(/Cl)c1ccccc1 Amb28388773 [0,2,0,0,0,0|0,0,0]=2 3427 B13R1.86 O=C\C(CCl)=C(\Cl)c1ccccc1 Amb27216060 [0,2,0,0,0,0|0,0,0]=2 3428 B13R1.152 C=C(C(=C)c1ccccc1)C(=O)O Amb27760436 [0,2,0,0,0,0|0,0,1]=3 3429 B13R1.152 C=C(C(=O)O)C(C)c1ccccc1 Amb24634053 [0,2,0,0,0,0|0,0,2]=4 3430 B13R1.152 C=C(C(=O)O)C(O)c1ccccc1 Amb27477832 [0,2,0,0,0,0|0,0,2]=4 3431 B13R1.152 C=C(C(C)=O)C(=O)c1ccccc1 Amb17594383 [0,2,0,0,0,0|0,0,1]=3 3432 B13R1.152 C=C(C(C)=O)C(N)c1ccccc1 Amb27647520 [0,2,0,0,0,0|0,0,2]=4 3433 B13R1.152 C=C(C(C)=O)C(O)c1ccccc1 Amb6537578 [0,2,0,0,0,0|0,0,2]=4 3434 B13R1.152 C=C(C(C)=O)[C@@H](N)c1ccccc1 Amb28429564 [0,2,0,0,0,0|0,0,2]=4 3435 B13R1.152 C=C(C(N)=O)C(N)c1ccccc1 Amb27882833 [0,2,0,0,0,0|0,0,2]=4 3436 B13R1.152 C=C(C(N)=O)[C@@H](N)c1ccccc1 Amb28365000 [0,2,0,0,0,0|0,0,2]=4 3437 B13R1.152 C=C(C(N)=O)[C@H](O)c1ccccc1 Amb28397965 [0,2,0,0,0,0|0,0,2]=4 3438 B13R1.152 C=C(c1ccccc1)C(C)C(=O)O Amb18127713 [0,2,0,0,0,0|0,0,1]=3 3439 B13R1.152 CC(=O)C(=O)N(C)c1ccccc1 Amb2424343 [0,2,0,0,0,0|2,0,0]=4 3440 B13R1.152 CC(=O)C(Br)C(=O)c1ccccc1 Amb28317159 [0,2,0,0,0,0|1,0,1]=4 3441 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 Amb8394273 [0,2,0,0,0,0|0,0,1]=3 3442 B13R1.152 CC(=O)C(C)C(=O)c1ccccn1 Amb25986406 [0,2,0,0,0,0|1,0,1]=4 3443 B13R1.152 CC(=O)C(C)C(=O)c1cccnc1 Amb24643875 [0,2,0,0,0,0|1,0,1]=4 3444 B13R1.152 CC(=O)C(C)C(=O)c1ccncc1 Amb25331084 [0,2,0,0,0,0|1,0,1]=4 3445 B13R1.152 CC(=O)N(C)N(C)c1ccccc1 Amb28321341 [0,2,0,0,0,0|2,0,0]=4 3446 B13R1.152 CC(=O)\C(C)=C(/O)c1ccccc1 Amb17594481 [0,2,0,0,0,0|0,0,0]=2 3447 B13R1.152 CC(=O)\C(C)=C(\N)c1ccccc1 Amb27966823 [0,2,0,0,0,0|0,0,0]=2 3448 B13R1.152 CC(C(=N)c1ccccc1)C(N)=S Amb27434426 [0,2,0,0,0,0|0,1,1]=4 3449 B13R1.152 CC(C(=O)C(=O)O)c1ccccc1 Amb18648106 [0,2,0,0,0,0|1,0,1]=4 3450 B13R1.152 CC(C(=O)C(N)=O)c1ccccc1 Amb27984702 [0,2,0,0,0,0|1,0,1]=4 3451 B13R1.152 CC(C(=O)O)C(C)c1ccccc1 Amb6360544 [0,2,0,0,0,0|0,0,2]=4 3452 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb17470593 [0,2,0,0,0,0|0,0,2]=4 3453 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb19375481 [0,2,0,0,0,0|0,0,2]=4 3454 B13R1.152 CC(C(=O)O)C(O)c1ccccc1 Amb3430442 [0,2,0,0,0,0|0,0,2]=4 3455 B13R1.152 CC(C(=O)O)N(C)c1ccccc1 Amb5762145 [0,2,0,0,0,0|1,0,1]=4 3456 B13R1.152 CC(C(=O)O)S(=O)c1ccccc1 Amb18292847 [0,2,0,0,0,0|1,0,1]=4 3457 B13R1.152 CC(C(=S)C(=O)O)c1ccccc1 Amb27409058 [0,2,0,0,0,0|1,0,1]=4 3458 B13R1.152 CC(C(N)=O)C(=O)c1ccccc1 Amb17594504 [0,2,0,0,0,0|0,0,1]=3 3459 B13R1.152 CC(C(N)=O)C(=O)c1ccncc1 Amb32675463 [0,2,0,0,0,0|1,0,1]=4 3460 B13R1.152 CC(C(N)=O)C(N)c1ccccc1 Amb27585479 [0,2,0,0,0,0|0,0,2]=4 3461 B13R1.152 CC(C)=C(C)C(=O)c1ccccc1 Amb27972933 [0,2,0,0,0,0|1,0,0]=3 3462 B13R1.152 CC(c1ccccc1)N(C)C(N)=O Amb28293855 [0,2,0,0,0,0|1,0,1]=4 3463 B13R1.152 CC(c1ccccc1)[C@@H](C)C(=O)O Amb33744674 [0,2,0,0,0,0|0,0,2]=4 3464 B13R1.152 CC(c1ccccc1)[C@H](C)C(=O)O Amb33744350 [0,2,0,0,0,0|0,0,2]=4 3465 B13R1.152 CN(C(=O)C(=O)O)c1ccccc1 Amb9303801 [0,2,0,0,0,0|2,0,0]=4 3466 B13R1.152 CN(C(=O)C(N)=O)c1ccccc1 Amb27834347 [0,2,0,0,0,0|2,0,0]=4 3467 B13R1.152 CN(C(N)=O)C(=O)c1ccccc1 Amb28127605 [0,2,0,0,0,0|1,0,0]=3 3468 B13R1.152 C[C@@H](C(=O)O)[C@@H](C)c1ccccc1 Amb27407054 [0,2,0,0,0,0|0,0,2]=4 3469 B13R1.152 C[C@@H](C(=O)O)[C@H](O)c1ccccc1 Amb28239779 [0,2,0,0,0,0|0,0,2]=4 3470 B13R1.152 C[C@H](C(=O)O)C(O)c1ccccc1 Amb27408977 [0,2,0,0,0,0|0,0,2]=4 3471 B13R1.152 C[C@H](C(=O)O)N(C)c1ccccc1 Amb27234440 [0,2,0,0,0,0|1,0,1]=4 3472 B13R1.152 C[C@H](C(=O)O)S(=O)c1ccccc1 Amb27848039 [0,2,0,0,0,0|1,0,1]=4 3473 B13R1.152 C[C@H](C(=O)O)[C@@H](N)c1ccccc1 Amb27392248 [0,2,0,0,0,0|0,0,2]=4 3474 B13R1.152 C[C@H](C(=O)O)[C@H](C)c1ccccc1 Amb28244756 [0,2,0,0,0,0|0,0,2]=4 3475 B13R1.152 C\C(=C(/C)C(C)O)c1ccccc1 Amb28292145 [0,2,0,0,0,0|0,0,2]=4 3476 B13R1.152 C\C(=C(\F)C(=O)O)c1ccccc1 Amb18128594 [0,2,0,0,0,0|1,0,0]=3 3477 B13R1.152 C\C(C(=O)O)=C(\C)c1ccccc1 Amb18127724 [0,2,0,0,0,0|0,0,0]=2 3478 B13R1.152 C\C(C(=O)O)=C(\C)c1ccncc1 Amb27485139 [0,2,0,0,0,0|1,0,0]=3 3479 B13R1.152 C\C(C(=O)O)=C(\C)c1cnccn1 Amb27485138 [0,2,0,0,0,0|2,0,0]=4 3480 B13R1.152 C\C(C(N)=S)=C(\N)c1ccccc1 Amb27469737 [0,2,0,0,0,0|0,1,0]=3 3481 B13R1.152 C\C(F)=C(\F)C(=O)c1ccccc1 Amb27803645 [0,2,0,0,0,0|2,0,0]=4 3482 B13R1.152 C\C(N)=C(\C)C(=O)c1ccccc1 Amb28071213 [0,2,0,0,0,0|1,0,0]=3 3483 B13R1.152 C\C(O)=C(\C)C(=O)c1ccccc1 Amb24378973 [0,2,0,0,0,0|0,0,1]=3 3484 B13R1.152 NC(=O)C(=O)C(Cl)c1ccccc1 Amb27878632 [0,2,0,0,0,0|1,0,1]=4 3485 B13R1.152 O=C(O)C(=O)C(=O)c1ccccc1 Amb31096952 [0,2,0,0,0,0|1,0,0]=3 3486 B13R1.152 O=C(O)C(=O)C(=O)c1ccccn1 Amb31096954 [0,2,0,0,0,0|2,0,0]=4 3487 B13R1.152 O=C(O)C(=O)C(=O)c1cccnc1 Amb31096955 [0,2,0,0,0,0|2,0,0]=4 3488 B13R1.152 O=C(O)C(=O)C(=O)c1ccncc1 Amb31096956 [0,2,0,0,0,0|2,0,0]=4 3489 B13R1.152 O=C(O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,2,0,0,0,0|1,0,1]=4 3490 B13R1.152 O=C(O)C(=O)C(F)c1ccccc1 Amb27179146 [0,2,0,0,0,0|1,0,1]=4 3491 B13R1.152 O=C(O)C(=O)C(O)c1ccccc1 Amb27400378 [0,2,0,0,0,0|1,0,1]=4 3492 B13R1.152 O=C(O)\C(Br)=C(/Br)c1ccccc1 Amb28240921 [0,2,0,0,0,0|1,0,0]=3 3493 B13R1.152 O=C(O)\C(Br)=C(\Br)c1ccccc1 Amb4013024 [0,2,0,0,0,0|1,0,0]=3 3494 B13R1.152 O=C(O)\C(Cl)=C(\F)c1ccccc1 Amb26913366 [0,2,0,0,0,0|1,0,0]=3 3495 B13R1.263 C=CC(C)(Cl)C(=O)c1ccccc1 Amb24673896 [0,2,0,0,0,0|1,0,1]=4 3496 B13R1.263 CC(C)(C=O)C(=O)c1ccccc1 Amb18127703 [0,2,0,0,0,0|0,0,1]=3 3497 B13R1.263 CC(C)(C=O)[C@@H](O)c1ccccc1 Amb28388613 [0,2,0,0,0,0|0,0,2]=4 3498 B13R1.263 CC(C)(C=O)[C@H](O)c1ccccc1 Amb28239495 [0,2,0,0,0,0|0,0,2]=4 3499 B13R1.263 CC(C)(N=O)C(=O)c1ccccc1 Amb27954126 [0,2,0,0,0,0|1,0,1]=4 3500 B13R1.263 CC(c1ccccc1)C(C)(C)C=O Amb25125280 [0,2,0,0,0,0|0,0,2]=4 3501 B13R1.263 CN(c1ccccc1)C(C)(C)C=O Amb27190555 [0,2,0,0,0,0|1,0,1]=4 3502 B13R1.263 O=CC(Cl)(Cl)C(=O)c1ccccc1 Amb26849172 [0,2,0,0,0,0|1,0,1]=4 3503 B13R1.532 CC\C(=C(\C)C=O)c1ccccc1 Amb24724060 [0,2,0,0,0,0|0,0,0]=2 3504 B13R1.532 CC\C(C)=C(/C=O)c1ccccc1 Amb27166148 [0,2,0,0,0,0|1,0,1]=4 3505 B13R1.532 CC\C(C)=C(\C=O)c1ccccc1 Amb25725942 [0,2,0,0,0,0|1,0,1]=4 3506 B13R1.532 C\C=C(C(/C)=N\O)\c1ccccc1 Amb2778966 [0,2,0,0,0,0|1,0,1]=4 3507 B13R1.696 C=CC(C)C(=O)c1ccccc1C Amb27854666 [0,2,0,0,0,0|1,0,1]=4 3508 B13R1.696 CC(C=O)C(=O)c1ccccc1F Amb24464837 [0,2,0,0,0,0|0,0,1]=3 3509 B13R1.696 CC(C=O)S(=O)c1ccccc1Br Amb35647215 [0,2,0,0,0,0|1,0,1]=4 3510 B13R1.696 CC(C=O)S(=O)c1ccccc1Cl Amb35647233 [0,2,0,0,0,0|1,0,1]=4 3511 B13R1.696 CC(C=O)S(=O)c1ccccc1F Amb35646966 [0,2,0,0,0,0|1,0,1]=4 3512 B13R1.696 C[C@H](C=O)[C@H](O)c1ccccc1Cl Amb27966675 [0,2,0,0,0,0|0,0,2]=4 3513 B13R1.696 C\C(=N\O)C(=O)c1ccccc1O Amb27630493 [0,2,0,0,0,0|1,0,1]=4 3514 B13R1.696 C\C(C#N)=C(\Cl)c1ccccc1Cl Amb27235379 [0,2,0,0,0,0|1,0,1]=4 3515 B13R1.696 C\C(C#N)=C(\Cl)c1ccccc1F Amb27961279 [0,2,0,0,0,0|1,0,1]=4 3516 B13R1.696 C\C(C=O)=C(\Cl)c1ccccc1F Amb25192511 [0,2,0,0,0,0|0,0,0]=2 3517 B13R1.696 C\C=C(/C)C(=O)c1ccccc1C Amb28324416 [0,2,0,0,0,0|1,0,0]=3 3518 B13R1.696 Cc1ccccc1S(=O)C(C)C=O Amb35646244 [0,2,0,0,0,0|1,0,1]=4 3519 B13R1.708 CC(C=O)C(C)(C)c1ccccc1 Amb27949663 [0,2,0,0,0,0|0,0,2]=4 3520 B13R1.708 CC(C=O)C(F)(F)c1ccccc1 Amb33082207 [0,2,0,0,0,0|0,0,2]=4 3521 B13R1.133 C=C(Cc1ccc(Br)cc1)C(=O)O Amb27648751 [0,2,0,0,0,0|0,0,2]=4 3522 B13R1.133 C=C(Cc1ccc(F)cc1)C(=O)O Amb27232941 [0,2,0,0,0,0|0,0,2]=4 3523 B13R1.133 CC(=O)C(=O)Cc1ccc(Br)cc1 Amb23603629 [0,2,0,0,0,0|1,0,1]=4 3524 B13R1.133 CC(=O)C(=O)Cc1ccc(C)cc1 Amb23603620 [0,2,0,0,0,0|1,0,1]=4 3525 B13R1.133 CC(=O)C(=O)Cc1ccc(Cl)cc1 Amb23603627 [0,2,0,0,0,0|1,0,1]=4 3526 B13R1.133 CC(=O)C(=O)Cc1ccc(F)cc1 Amb23603622 [0,2,0,0,0,0|1,0,1]=4 3527 B13R1.133 CC(=O)C(=O)Nc1ccc(Br)cc1 Amb2383840 [0,2,0,0,0,0|2,0,0]=4 3528 B13R1.133 CC(=O)C(=O)Nc1ccc(C)cc1 Amb17400600 [0,2,0,0,0,0|2,0,0]=4 3529 B13R1.133 CC(=O)C(=O)Nc1ccc(Cl)cc1 Amb2421104 [0,2,0,0,0,0|2,0,0]=4 3530 B13R1.133 CC(=O)C(=O)Nc1ccc(F)cc1 Amb17400856 [0,2,0,0,0,0|2,0,0]=4 3531 B13R1.133 CC(=O)C(=O)Nc1ccc(I)cc1 Amb21949004 [0,2,0,0,0,0|2,0,0]=4 3532 B13R1.133 CC(=O)C(=S)Nc1ccc(Br)cc1 Amb21949008 [0,2,0,0,0,0|2,0,0]=4 3533 B13R1.133 CC(=O)C(=S)Nc1ccc(C)cc1 Amb21949011 [0,2,0,0,0,0|2,0,0]=4 3534 B13R1.133 CC(=O)C(=S)Nc1ccc(Cl)cc1 Amb21949007 [0,2,0,0,0,0|2,0,0]=4 3535 B13R1.133 CC(=O)C(=S)Nc1ccc(I)cc1 Amb21949009 [0,2,0,0,0,0|2,0,0]=4 3536 B13R1.133 CC(=O)C(C)Cc1ccc(Br)cc1 Amb17255483 [0,2,0,0,0,0|0,0,2]=4 3537 B13R1.133 CC(=O)C(C)Cc1ccc(C)cc1 Amb17233205 [0,2,0,0,0,0|0,0,2]=4 3538 B13R1.133 CC(=O)C(C)Cc1ccc(Cl)cc1 Amb17236509 [0,2,0,0,0,0|0,0,2]=4 3539 B13R1.133 CC(=O)C(C)Cc1ccc(F)cc1 Amb17233679 [0,2,0,0,0,0|0,0,2]=4 3540 B13R1.133 CC(=O)C(C)Nc1ccc(Cl)cc1 Amb27411971 [0,2,0,0,0,0|1,0,1]=4 3541 B13R1.133 CC(=O)C(C)Oc1ccc(C)cc1 Amb2412522 [0,2,0,0,0,0|1,0,1]=4 3542 B13R1.133 CC(=O)C(C)Oc1ccc(Cl)cc1 Amb2436605 [0,2,0,0,0,0|1,0,1]=4 3543 B13R1.133 CC(=O)C(C)Oc1ccc(F)cc1 Amb2437262 [0,2,0,0,0,0|1,0,1]=4 3544 B13R1.133 CC(=O)C(C)Oc1ccc(N)cc1 Amb17110086 [0,2,0,0,0,0|1,0,1]=4 3545 B13R1.133 CC(=O)C(C)Sc1ccc(Br)cc1 Amb9269198 [0,2,0,0,0,0|1,0,1]=4 3546 B13R1.133 CC(=O)C(C)Sc1ccc(C)cc1 Amb9216218 [0,2,0,0,0,0|1,0,1]=4 3547 B13R1.133 CC(=O)C(C)Sc1ccc(Cl)cc1 Amb9269646 [0,2,0,0,0,0|1,0,1]=4 3548 B13R1.133 CC(=O)C(C)Sc1ccc(F)cc1 Amb9268276 [0,2,0,0,0,0|1,0,1]=4 3549 B13R1.133 CC(=O)N(C)Cc1ccc(N)cc1 Amb2693405 [0,2,0,0,0,0|1,0,1]=4 3550 B13R1.133 CC(=O)N(C)Cc1ccc(O)cc1 Amb2692177 [0,2,0,0,0,0|1,0,1]=4 3551 B13R1.133 CC(=O)[C@@H](C)Cc1ccc(Cl)cc1 Amb27232652 [0,2,0,0,0,0|0,0,2]=4 3552 B13R1.133 CC(=O)[C@H](C)Cc1ccc(C)cc1 Amb28386629 [0,2,0,0,0,0|0,0,2]=4 3553 B13R1.133 CC(=O)\C(Br)=C\c1ccc(Cl)cc1 Amb2433257 [0,2,0,0,0,0|1,0,0]=3 3554 B13R1.133 CC(=O)\C(C)=C\c1ccc(Br)cc1 Amb27636305 [0,2,0,0,0,0|0,0,0]=2 3555 B13R1.133 CC(=O)\C(C)=C\c1ccc(Br)cn1 Amb27411612 [0,2,0,0,0,0|1,0,0]=3 3556 B13R1.133 CC(=O)\C(C)=C\c1ccc(C)nc1 Amb28388249 [0,2,0,0,0,0|1,0,0]=3 3557 B13R1.133 CC(=O)\C(C)=C\c1ccc(Cl)cc1 Amb27617723 [0,2,0,0,0,0|0,0,0]=2 3558 B13R1.133 CC(Cc1ccc(Br)cc1)C(=O)Cl Amb27585400 [0,2,0,0,0,0|0,0,2]=4 3559 B13R1.133 CC(Cc1ccc(Br)cc1)C(=O)O Amb16185778 [0,2,0,0,0,0|0,0,2]=4 3560 B13R1.133 CC(Cc1ccc(Br)cc1)C(N)=O Amb24271353 [0,2,0,0,0,0|0,0,2]=4 3561 B13R1.133 CC(Cc1ccc(Cl)cc1)C(=O)O Amb2785266 [0,2,0,0,0,0|0,0,2]=4 3562 B13R1.133 CC(Cc1ccc(F)cc1)C(=O)Cl Amb5744103 [0,2,0,0,0,0|0,0,2]=4 3563 B13R1.133 CC(Cc1ccc(F)cc1)C(=O)O Amb33534946 [0,2,0,0,0,0|0,0,2]=4 3564 B13R1.133 CC(Cc1ccc(N)cc1)C(=O)O Amb26304191 [0,2,0,0,0,0|0,0,2]=4 3565 B13R1.133 CC(Cc1ccc(O)cc1)C(=O)O Amb25798442 [0,2,0,0,0,0|0,0,2]=4 3566 B13R1.133 CC(Nc1ccc(Br)cc1)C(=O)O Amb840565 [0,2,0,0,0,0|1,0,1]=4 3567 B13R1.133 CC(Nc1ccc(Br)cc1)C(N)=O Amb7067404 [0,2,0,0,0,0|1,0,1]=4 3568 B13R1.133 CC(Nc1ccc(Cl)cc1)C(=O)O Amb840562 [0,2,0,0,0,0|1,0,1]=4 3569 B13R1.133 CC(Nc1ccc(F)cc1)C(=O)O Amb9702106 [0,2,0,0,0,0|1,0,1]=4 3570 B13R1.133 CC(Nc1ccc(N)cc1)C(=O)O Amb25850201 [0,2,0,0,0,0|1,0,1]=4 3571 B13R1.133 CC(Nc1ccc(N)cc1)C(N)=O Amb9407516 [0,2,0,0,0,0|1,0,1]=4 3572 B13R1.133 CC(Nc1ccc(O)cc1)C(=O)O Amb27771791 [0,2,0,0,0,0|1,0,1]=4 3573 B13R1.133 CC(Oc1ccc(Br)cc1)C(=O)Cl Amb16230063 [0,2,0,0,0,0|1,0,1]=4 3574 B13R1.133 CC(Oc1ccc(Br)cc1)C(=O)O Amb1215354 [0,2,0,0,0,0|1,0,1]=4 3575 B13R1.133 CC(Oc1ccc(Br)cc1)C(N)=O Amb6430257 [0,2,0,0,0,0|1,0,1]=4 3576 B13R1.133 CC(Oc1ccc(Cl)cc1)C(=O)Cl Amb17143747 [0,2,0,0,0,0|1,0,1]=4 3577 B13R1.133 CC(Oc1ccc(Cl)cc1)C(=O)O Amb6336455 [0,2,0,0,0,0|1,0,1]=4 3578 B13R1.133 CC(Oc1ccc(F)cc1)C(=O)Cl Amb16230027 [0,2,0,0,0,0|1,0,1]=4 3579 B13R1.133 CC(Oc1ccc(F)cc1)C(=O)O Amb9702439 [0,2,0,0,0,0|1,0,1]=4 3580 B13R1.133 CC(Oc1ccc(I)cc1)C(=O)O Amb8831575 [0,2,0,0,0,0|1,0,1]=4 3581 B13R1.133 CC(Oc1ccc(N)cc1)C(=O)O Amb839766 [0,2,0,0,0,0|1,0,1]=4 3582 B13R1.133 CC(Oc1ccc(O)cc1)C(=O)O Amb2720531 [0,2,0,0,0,0|1,0,1]=4 3583 B13R1.133 CC(Oc1ccc(O)cc1)C(N)=O Amb8837184 [0,2,0,0,0,0|1,0,1]=4 3584 B13R1.133 CC(Oc1ccc(S)cc1)C(=O)O Amb27863432 [0,2,0,0,0,0|1,0,1]=4 3585 B13R1.133 CC(Sc1ccc(Br)cc1)C(=O)O Amb1115989 [0,2,0,0,0,0|1,0,1]=4 3586 B13R1.133 CC(Sc1ccc(Cl)cc1)C(=O)Cl Amb17144558 [0,2,0,0,0,0|1,0,1]=4 3587 B13R1.133 CC(Sc1ccc(Cl)cc1)C(=O)O Amb9745731 [0,2,0,0,0,0|1,0,1]=4 3588 B13R1.133 CC(Sc1ccc(Cl)cc1)C(N)=O Amb3608224 [0,2,0,0,0,0|1,0,1]=4 3589 B13R1.133 CC(Sc1ccc(F)cc1)C(=O)O Amb1115911 [0,2,0,0,0,0|1,0,1]=4 3590 B13R1.133 CC(Sc1ccc(N)cc1)C(=O)O Amb18975670 [0,2,0,0,0,0|1,0,1]=4 3591 B13R1.133 CC(Sc1ccc(N)cc1)C(=O)O Amb32652412 [0,2,0,0,0,0|1,0,1]=4 3592 B13R1.133 CC(Sc1ccc(O)cc1)C(=O)O Amb19000448 [0,2,0,0,0,0|1,0,1]=4 3593 B13R1.133 CN(Cc1ccc(Cl)cc1)C(=O)Cl Amb27618266 [0,2,0,0,0,0|1,0,1]=4 3594 B13R1.133 CN(Cc1ccc(Cl)cc1)C(N)=O Amb18332178 [0,2,0,0,0,0|1,0,1]=4 3595 B13R1.133 CS(=O)\C(Cl)=C\c1ccc(Br)cc1 Amb26995745 [0,2,0,0,0,0|2,0,0]=4 3596 B13R1.133 C[C@@H](Cc1ccc(Br)cc1)C(=O)O Amb10844183 [0,2,0,0,0,0|0,0,2]=4 3597 B13R1.133 C[C@@H](Cc1ccc(F)cc1)C(=O)O Amb10844187 [0,2,0,0,0,0|0,0,2]=4 3598 B13R1.133 C[C@@H](Nc1ccc(Cl)cc1)C(=O)O Amb24626586 [0,2,0,0,0,0|1,0,1]=4 3599 B13R1.133 C[C@@H](Oc1ccc(Br)cc1)C(N)=O Amb27411967 [0,2,0,0,0,0|1,0,1]=4 3600 B13R1.133 C[C@@H](Oc1ccc(Cl)cc1)C(=O)O Amb27947480 [0,2,0,0,0,0|1,0,1]=4 3601 B13R1.133 C[C@@H](Oc1ccc(O)cc1)C(=O)Cl Amb27772103 [0,2,0,0,0,0|1,0,1]=4 3602 B13R1.133 C[C@@H](Oc1ccc(O)cc1)C(=O)O Amb4038211 [0,2,0,0,0,0|1,0,1]=4 3603 B13R1.133 C[C@@H](Sc1ccc(Cl)cc1)C(=O)O Amb27798366 [0,2,0,0,0,0|1,0,1]=4 3604 B13R1.133 C[C@H](Cc1ccc(F)cc1)C(=O)O Amb10844186 [0,2,0,0,0,0|0,0,2]=4 3605 B13R1.133 C[C@H](Cc1ccc(N)cc1)C(=O)O Amb10844177 [0,2,0,0,0,0|0,0,2]=4 3606 B13R1.133 C[C@H](Nc1ccc(Cl)cc1)C(=O)O Amb26032182 [0,2,0,0,0,0|1,0,1]=4 3607 B13R1.133 C[C@H](Nc1ccc(F)cc1)C(=O)O Amb24375534 [0,2,0,0,0,0|1,0,1]=4 3608 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(=O)O Amb24471254 [0,2,0,0,0,0|1,0,1]=4 3609 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(N)=O Amb28187771 [0,2,0,0,0,0|1,0,1]=4 3610 B13R1.133 C[C@H](Oc1ccc(Cl)cc1)C(=O)O Amb26618695 [0,2,0,0,0,0|1,0,1]=4 3611 B13R1.133 C[C@H](Oc1ccc(I)cc1)C(=O)O Amb24623054 [0,2,0,0,0,0|1,0,1]=4 3612 B13R1.133 C[C@H](Oc1ccc(O)cc1)C(=O)Cl Amb27256346 [0,2,0,0,0,0|1,0,1]=4 3613 B13R1.133 C[C@H](Oc1ccc(O)cc1)C(=O)O Amb28313704 [0,2,0,0,0,0|1,0,1]=4 3614 B13R1.133 C[C@H](Sc1ccc(Cl)cc1)C(=O)O Amb27751301 [0,2,0,0,0,0|1,0,1]=4 3615 B13R1.133 C\C(=C/c1cc[n+]([O-])cc1)C(=O)O Amb27857680 [0,2,0,0,0,0|1,0,0]=3 3616 B13R1.133 C\C(=C/c1ccc(Br)cc1)C(=O)O Amb25696415 [0,2,0,0,0,0|0,0,0]=2 3617 B13R1.133 C\C(=C/c1ccc(Br)cc1)C(C)N Amb27593335 [0,2,0,0,0,0|1,0,1]=4 3618 B13R1.133 C\C(=C/c1ccc(Br)cc1)C(C)O Amb27834557 [0,2,0,0,0,0|0,0,2]=4 3619 B13R1.133 C\C(=C/c1ccc(Br)cc1)[N+](=O)[O-] Amb18041943 [0,2,0,0,0,0|1,0,0]=3 3620 B13R1.133 C\C(=C/c1ccc(C)cc1)C(=O)O Amb4007782 [0,2,0,0,0,0|0,0,0]=2 3621 B13R1.133 C\C(=C/c1ccc(C)cc1)C(C)N Amb28136324 [0,2,0,0,0,0|1,0,1]=4 3622 B13R1.133 C\C(=C/c1ccc(C)nc1)C(=O)O Amb27165831 [0,2,0,0,0,0|1,0,0]=3 3623 B13R1.133 C\C(=C/c1ccc(Cl)cc1)C(=O)O Amb33800051 [0,2,0,0,0,0|0,0,0]=2 3624 B13R1.133 C\C(=C/c1ccc(Cl)cc1)C(C)Cl Amb27596348 [0,2,0,0,0,0|1,0,1]=4 3625 B13R1.133 C\C(=C/c1ccc(Cl)cc1)[N+](=O)[O-] Amb6572983 [0,2,0,0,0,0|1,0,0]=3 3626 B13R1.133 C\C(=C/c1ccc(F)cc1)C(=O)O Amb32835535 [0,2,0,0,0,0|0,0,0]=2 3627 B13R1.133 C\C(=C/c1ccc(F)cc1)C(C)N Amb27759801 [0,2,0,0,0,0|1,0,1]=4 3628 B13R1.133 C\C(=C/c1ccc(F)cc1)C(C)O Amb27840922 [0,2,0,0,0,0|0,0,2]=4 3629 B13R1.133 C\C(=C/c1ccc(F)cc1)[N+](=O)[O-] Amb2725411 [0,2,0,0,0,0|1,0,0]=3 3630 B13R1.133 C\C(=C/c1ccc(I)cc1)C(=O)O Amb17844105 [0,2,0,0,0,0|0,0,0]=2 3631 B13R1.133 C\C(=C/c1ccc(I)cc1)C(C)O Amb28344729 [0,2,0,0,0,0|0,0,2]=4 3632 B13R1.133 C\C(=C/c1ccc(I)cc1)[N+](=O)[O-] Amb6297634 [0,2,0,0,0,0|1,0,0]=3 3633 B13R1.133 C\C(=C/c1ccc(O)cc1)C(=O)O Amb18128066 [0,2,0,0,0,0|0,0,0]=2 3634 B13R1.133 C\C(=C/c1ccc(O)cc1)C(C)O Amb27456911 [0,2,0,0,0,0|0,0,2]=4 3635 B13R1.133 C\C(=C/c1ccc(O)cc1)[N+](=O)[O-] Amb4078945 [0,2,0,0,0,0|1,0,0]=3 3636 B13R1.133 C\C(=C/c1ccc(S)cc1)C(=O)O Amb27607664 [0,2,0,0,0,0|0,0,0]=2 3637 B13R1.133 C\C(=C\c1ccc(Br)cc1)C(=O)O Amb28042216 [0,2,0,0,0,0|0,0,0]=2 3638 B13R1.133 C\C(=C\c1ccc(Br)cc1)[N+](=O)[O-] Amb22641030 [0,2,0,0,0,0|1,0,0]=3 3639 B13R1.133 C\C(=C\c1ccc(Br)cn1)C(=O)O Amb27815482 [0,2,0,0,0,0|1,0,0]=3 3640 B13R1.133 C\C(=C\c1ccc(C)cc1)[N+](=O)[O-] Amb2689520 [0,2,0,0,0,0|1,0,0]=3 3641 B13R1.133 C\C(=C\c1ccc(C)cn1)C(=O)O Amb27254577 [0,2,0,0,0,0|1,0,0]=3 3642 B13R1.133 C\C(=C\c1ccc(C)nc1)C(=O)O Amb27597711 [0,2,0,0,0,0|1,0,0]=3 3643 B13R1.133 C\C(=C\c1ccc(Cl)cc1)C(=O)O Amb4010035 [0,2,0,0,0,0|0,0,0]=2 3644 B13R1.133 C\C(=C\c1ccc(F)cc1)[N+](=O)[O-] Amb26331846 [0,2,0,0,0,0|1,0,0]=3 3645 B13R1.133 C\C(=C\c1ccc(I)cc1)C(=O)O Amb28186320 [0,2,0,0,0,0|0,0,0]=2 3646 B13R1.133 C\C(=C\c1ccc(I)cc1)[N+](=O)[O-] Amb27188922 [0,2,0,0,0,0|1,0,0]=3 3647 B13R1.133 C\C(=C\c1ccc(N)nc1)C(=O)O Amb27637678 [0,2,0,0,0,0|1,0,0]=3 3648 B13R1.133 C\C(=C\c1ccc(O)cc1)C(=O)O Amb28186661 [0,2,0,0,0,0|0,0,0]=2 3649 B13R1.133 C\C(=C\c1ccc(O)cc1)[N+](=O)[O-] Amb24449182 [0,2,0,0,0,0|1,0,0]=3 3650 B13R1.133 Cc1ccc(CC(=O)C(=O)O)cc1 Amb1140634 [0,2,0,0,0,0|1,0,1]=4 3651 B13R1.133 Cc1ccc(CC(C)C(=O)Cl)cc1 Amb5744101 [0,2,0,0,0,0|0,0,2]=4 3652 B13R1.133 Cc1ccc(CC(C)C(=O)O)cc1 Amb4009798 [0,2,0,0,0,0|0,0,2]=4 3653 B13R1.133 Cc1ccc(CN(C)C(N)=O)cc1 Amb6749995 [0,2,0,0,0,0|1,0,1]=4 3654 B13R1.133 Cc1ccc(C[C@@H](C)C(=O)O)cc1 Amb10844190 [0,2,0,0,0,0|0,0,2]=4 3655 B13R1.133 Cc1ccc(C[C@H](C)C(=O)O)cc1 Amb10844191 [0,2,0,0,0,0|0,0,2]=4 3656 B13R1.133 Cc1ccc(NC(=O)C(=O)O)cc1 Amb838974 [0,2,0,0,0,0|2,0,0]=4 3657 B13R1.133 Cc1ccc(NC(=S)C(N)=O)cc1 Amb6865800 [0,2,0,0,0,0|2,0,0]=4 3658 B13R1.133 Cc1ccc(NC(C)C(=O)O)cc1 Amb840549 [0,2,0,0,0,0|1,0,1]=4 3659 B13R1.133 Cc1ccc(N[C@@H](C)C(=O)O)cc1 Amb27453592 [0,2,0,0,0,0|1,0,1]=4 3660 B13R1.133 Cc1ccc(OC(C)C(=O)Cl)cc1 Amb16230059 [0,2,0,0,0,0|1,0,1]=4 3661 B13R1.133 Cc1ccc(OC(C)C(=O)O)cc1 Amb9702459 [0,2,0,0,0,0|1,0,1]=4 3662 B13R1.133 Cc1ccc(SC(=O)C(=O)O)cc1 Amb28366039 [0,2,0,0,0,0|2,0,0]=4 3663 B13R1.133 Cc1ccc(SC(C)C(=O)O)cc1 Amb9745733 [0,2,0,0,0,0|1,0,1]=4 3664 B13R1.133 Cc1ccc(\C=C(/F)C(=O)O)cc1 Amb18128596 [0,2,0,0,0,0|1,0,0]=3 3665 B13R1.133 Cc1ccc(\C=C(\Br)C(=O)O)cc1 Amb28042378 [0,2,0,0,0,0|1,0,0]=3 3666 B13R1.133 Cc1ccc(\C=C(\S)C(=O)O)cc1 Amb25950062 [0,2,0,0,0,0|1,0,0]=3 3667 B13R1.133 NC(=O)C(=O)Nc1ccc(Cl)cc1 Amb1831097 [0,2,0,0,0,0|2,0,0]=4 3668 B13R1.133 NC(=O)C(=O)Nc1ccc(F)cc1 Amb3613977 [0,2,0,0,0,0|2,0,0]=4 3669 B13R1.133 NC(=O)C(=O)Nc1ccc(O)cc1 Amb18128559 [0,2,0,0,0,0|2,0,0]=4 3670 B13R1.133 NC(=O)C(=S)Nc1ccc(Br)cc1 Amb6875689 [0,2,0,0,0,0|2,0,0]=4 3671 B13R1.133 NC(=O)C(=S)Nc1ccc(Cl)cc1 Amb6875687 [0,2,0,0,0,0|2,0,0]=4 3672 B13R1.133 NC(=O)C(=S)Nc1ccc(N)cc1 Amb27650589 [0,2,0,0,0,0|2,0,0]=4 3673 B13R1.133 N\C(=C\c1ccc(Br)cc1)C(=O)O Amb29883100 [0,2,0,0,0,0|1,0,0]=3 3674 B13R1.133 N\C(=C\c1ccc(Br)cn1)C(=O)O Amb35644575 [0,2,0,0,0,0|2,0,0]=4 3675 B13R1.133 N\C(=C\c1ccc(Cl)cc1)C(=O)O Amb27399082 [0,2,0,0,0,0|1,0,0]=3 3676 B13R1.133 Nc1ccc(CC(=O)C(=O)O)cc1 Amb24433983 [0,2,0,0,0,0|1,0,1]=4 3677 B13R1.133 Nc1ccc(NC(=O)C(=O)O)cc1 Amb1348301 [0,2,0,0,0,0|2,0,0]=4 3678 B13R1.133 Nc1ccc(NC(=S)C(=O)O)cc1 Amb27858852 [0,2,0,0,0,0|2,0,0]=4 3679 B13R1.133 Nc1ccc(\C=C(\F)C(=O)O)cc1 Amb27659003 [0,2,0,0,0,0|1,0,0]=3 3680 B13R1.133 O=C(O)C(=O)Cc1ccc(Br)cc1 Amb1140012 [0,2,0,0,0,0|1,0,1]=4 3681 B13R1.133 O=C(O)C(=O)Cc1ccc(Cl)cc1 Amb1141688 [0,2,0,0,0,0|1,0,1]=4 3682 B13R1.133 O=C(O)C(=O)Cc1ccc(F)cc1 Amb1130482 [0,2,0,0,0,0|1,0,1]=4 3683 B13R1.133 O=C(O)C(=O)Cc1ccc(I)cc1 Amb26533898 [0,2,0,0,0,0|1,0,1]=4 3684 B13R1.133 O=C(O)C(=O)Cc1ccc(O)cc1 Amb1124591 [0,2,0,0,0,0|1,0,1]=4 3685 B13R1.133 O=C(O)C(=O)Nc1ccc(Br)cc1 Amb838965 [0,2,0,0,0,0|2,0,0]=4 3686 B13R1.133 O=C(O)C(=O)Nc1ccc(Cl)cc1 Amb2371148 [0,2,0,0,0,0|2,0,0]=4 3687 B13R1.133 O=C(O)C(=O)Nc1ccc(F)cc1 Amb9303980 [0,2,0,0,0,0|2,0,0]=4 3688 B13R1.133 O=C(O)C(=O)Nc1ccc(I)cc1 Amb9303921 [0,2,0,0,0,0|2,0,0]=4 3689 B13R1.133 O=C(O)\C(F)=C\c1ccc(Br)cc1 Amb27415963 [0,2,0,0,0,0|1,0,0]=3 3690 B13R1.133 O=C(O)\C(F)=C\c1ccc(Cl)cc1 Amb25209028 [0,2,0,0,0,0|1,0,0]=3 3691 B13R1.133 O=C(O)\C(F)=C\c1ccc(F)cc1 Amb25858140 [0,2,0,0,0,0|1,0,0]=3 3692 B13R1.133 O=C(O)\C(O)=C\c1ccc(F)cc1 Amb22549399 [0,2,0,0,0,0|1,0,0]=3 3693 B13R1.133 O=C(O)\C(S)=C/c1ccc(Cl)cc1 Amb2550970 [0,2,0,0,0,0|1,0,0]=3 3694 B13R1.133 O=C(O)\C(S)=C\c1ccc(Br)cc1 Amb1250113 [0,2,0,0,0,0|1,0,0]=3 3695 B13R1.133 O=C(O)\C(S)=C\c1ccc(F)cc1 Amb1250112 [0,2,0,0,0,0|1,0,0]=3 3696 B13R1.133 O=C(O)\C(S)=C\c1ccc(I)cc1 Amb24400252 [0,2,0,0,0,0|1,0,0]=3 3697 B13R1.133 O=[N+]([O-])\C(Br)=C/c1ccc(Br)cc1 Amb6374147 [0,2,0,0,0,0|2,0,0]=4 3698 B13R1.133 O=[N+]([O-])\C(Br)=C\c1ccc(Br)cc1 Amb6825701 [0,2,0,0,0,0|2,0,0]=4 3699 B13R1.133 O=[N+]([O-])\C(F)=C\c1ccc(Cl)cc1 Amb27843540 [0,2,0,0,0,0|2,0,0]=4 3700 B13R1.148 C=C(Cc1cccc(O)c1)C(=O)O Amb28291558 [0,2,0,0,0,0|0,0,2]=4 3701 B13R1.148 CC(=O)C(=O)Cc1cccc(Br)c1 Amb23603630 [0,2,0,0,0,0|1,0,1]=4 3702 B13R1.148 CC(=O)C(=O)Cc1cccc(C)c1 Amb23603621 [0,2,0,0,0,0|1,0,1]=4 3703 B13R1.148 CC(=O)C(=O)Cc1cccc(Cl)c1 Amb23603628 [0,2,0,0,0,0|1,0,1]=4 3704 B13R1.148 CC(=O)C(=O)Cc1cccc(F)c1 Amb23603623 [0,2,0,0,0,0|1,0,1]=4 3705 B13R1.148 CC(=O)C(=O)Nc1cccc(Br)c1 Amb17410540 [0,2,0,0,0,0|2,0,0]=4 3706 B13R1.148 CC(=O)C(=O)Nc1cccc(C)c1 Amb17400599 [0,2,0,0,0,0|2,0,0]=4 3707 B13R1.148 CC(=O)C(=O)Nc1cccc(Cl)c1 Amb17402223 [0,2,0,0,0,0|2,0,0]=4 3708 B13R1.148 CC(=O)C(=O)Nc1cccc(F)c1 Amb17400857 [0,2,0,0,0,0|2,0,0]=4 3709 B13R1.148 CC(=O)C(C)Cc1cccc(Br)c1 Amb17255482 [0,2,0,0,0,0|0,0,2]=4 3710 B13R1.148 CC(=O)C(C)Cc1cccc(C)c1 Amb17233204 [0,2,0,0,0,0|0,0,2]=4 3711 B13R1.148 CC(=O)C(C)Cc1cccc(Cl)c1 Amb17236508 [0,2,0,0,0,0|0,0,2]=4 3712 B13R1.148 CC(=O)C(C)Oc1cccc(C)c1 Amb2412509 [0,2,0,0,0,0|1,0,1]=4 3713 B13R1.148 CC(=O)C(C)Oc1cccc(Cl)c1 Amb2415403 [0,2,0,0,0,0|1,0,1]=4 3714 B13R1.148 CC(=O)C(C)Oc1cccc(F)c1 Amb2412534 [0,2,0,0,0,0|1,0,1]=4 3715 B13R1.148 CC(=O)C(C)Oc1cccc(N)c1 Amb17110087 [0,2,0,0,0,0|1,0,1]=4 3716 B13R1.148 CC(=O)C(C)Sc1cccc(Br)c1 Amb27157551 [0,2,0,0,0,0|1,0,1]=4 3717 B13R1.148 CC(=O)C(C)Sc1cccc(C)c1 Amb18317877 [0,2,0,0,0,0|1,0,1]=4 3718 B13R1.148 CC(=O)C(C)Sc1cccc(Cl)c1 Amb24434266 [0,2,0,0,0,0|1,0,1]=4 3719 B13R1.148 CC(=O)C(C)Sc1cccc(F)c1 Amb25801589 [0,2,0,0,0,0|1,0,1]=4 3720 B13R1.148 CC(=O)N(C)Cc1cccc(Br)c1 Amb28435612 [0,2,0,0,0,0|1,0,1]=4 3721 B13R1.148 CC(=O)N(C)Cc1cccc(C)c1 Amb27260794 [0,2,0,0,0,0|1,0,1]=4 3722 B13R1.148 CC(=O)N(C)Cc1cccc(N)c1 Amb6893122 [0,2,0,0,0,0|1,0,1]=4 3723 B13R1.148 CC(=O)[C@@H](C)Cc1cccc(Cl)c1 Amb28188801 [0,2,0,0,0,0|0,0,2]=4 3724 B13R1.148 CC(=O)\C(C)=C\c1cccc(Br)c1 Amb28240585 [0,2,0,0,0,0|0,0,0]=2 3725 B13R1.148 CC(=O)\C(C)=C\c1cccc(Cl)c1 Amb27454684 [0,2,0,0,0,0|0,0,0]=2 3726 B13R1.148 CC(=O)\C(C)=C\c1cccc(F)c1 Amb26542885 [0,2,0,0,0,0|0,0,0]=2 3727 B13R1.148 CC(=O)\C(C)=C\c1cccc(I)c1 Amb28045755 [0,2,0,0,0,0|0,0,0]=2 3728 B13R1.148 CC(=O)\C(C)=C\c1ccnc(C)n1 Amb27203859 [0,2,0,0,0,0|2,0,0]=4 3729 B13R1.148 CC(=O)\C(C)=N\c1cccc(C)c1 Amb27440422 [0,2,0,0,0,0|1,0,0]=3 3730 B13R1.148 CC(Cc1cccc(Br)c1)C(=O)O Amb25923971 [0,2,0,0,0,0|0,0,2]=4 3731 B13R1.148 CC(Cc1cccc(Cl)c1)C(=O)O Amb2785265 [0,2,0,0,0,0|0,0,2]=4 3732 B13R1.148 CC(Cc1cccc(F)c1)C(=O)O Amb13951302 [0,2,0,0,0,0|0,0,2]=4 3733 B13R1.148 CC(Cc1cccc(N)c1)C(=O)O Amb24693893 [0,2,0,0,0,0|0,0,2]=4 3734 B13R1.148 CC(Cc1cccc(O)c1)C(=O)O Amb10844220 [0,2,0,0,0,0|0,0,2]=4 3735 B13R1.148 CC(Nc1cccc(Br)c1)C(=O)O Amb840564 [0,2,0,0,0,0|1,0,1]=4 3736 B13R1.148 CC(Nc1cccc(Cl)c1)C(=O)O Amb840561 [0,2,0,0,0,0|1,0,1]=4 3737 B13R1.148 CC(Nc1cccc(F)c1)C(=O)O Amb840558 [0,2,0,0,0,0|1,0,1]=4 3738 B13R1.148 CC(Nc1cccc(N)c1)C(=O)O Amb27608588 [0,2,0,0,0,0|1,0,1]=4 3739 B13R1.148 CC(Oc1cccc(Br)c1)C(=O)Cl Amb16230148 [0,2,0,0,0,0|1,0,1]=4 3740 B13R1.148 CC(Oc1cccc(Br)c1)C(=O)O Amb2556137 [0,2,0,0,0,0|1,0,1]=4 3741 B13R1.148 CC(Oc1cccc(Br)c1)C(N)=O Amb2085822 [0,2,0,0,0,0|1,0,1]=4 3742 B13R1.148 CC(Oc1cccc(Cl)c1)C(=O)Cl Amb20224027 [0,2,0,0,0,0|1,0,1]=4 3743 B13R1.148 CC(Oc1cccc(Cl)c1)C(=O)O Amb9745694 [0,2,0,0,0,0|1,0,1]=4 3744 B13R1.148 CC(Oc1cccc(F)c1)C(=O)O Amb1116562 [0,2,0,0,0,0|1,0,1]=4 3745 B13R1.148 CC(Oc1cccc(F)c1)C(N)=O Amb8997636 [0,2,0,0,0,0|1,0,1]=4 3746 B13R1.148 CC(Oc1cccc(I)c1)C(=O)O Amb8838601 [0,2,0,0,0,0|1,0,1]=4 3747 B13R1.148 CC(Oc1cccc(N)c1)C(=O)O Amb28465284 [0,2,0,0,0,0|1,0,1]=4 3748 B13R1.148 CC(Oc1cccc(N)c1)C(=O)O Amb839768 [0,2,0,0,0,0|1,0,1]=4 3749 B13R1.148 CC(Oc1cccc(O)c1)C(=O)O Amb18192781 [0,2,0,0,0,0|1,0,1]=4 3750 B13R1.148 CC(Oc1cccc(O)c1)C(N)=O Amb9210987 [0,2,0,0,0,0|1,0,1]=4 3751 B13R1.148 CC(Sc1cccc(Cl)c1)C(=O)Cl Amb17144557 [0,2,0,0,0,0|1,0,1]=4 3752 B13R1.148 CC(Sc1cccc(Cl)c1)C(=O)O Amb5774993 [0,2,0,0,0,0|1,0,1]=4 3753 B13R1.148 CC(Sc1cccc(Cl)c1)C(N)=O Amb17143658 [0,2,0,0,0,0|1,0,1]=4 3754 B13R1.148 CC(Sc1cccc(O)c1)C(N)=O Amb28196233 [0,2,0,0,0,0|1,0,1]=4 3755 B13R1.148 CN(Cc1cccc(F)c1)C(=O)Cl Amb25785989 [0,2,0,0,0,0|1,0,1]=4 3756 B13R1.148 C[C@@H](Oc1cccc(Br)c1)C(N)=O Amb27814216 [0,2,0,0,0,0|1,0,1]=4 3757 B13R1.148 C[C@@H](Oc1cccc(I)c1)C(=O)O Amb27601305 [0,2,0,0,0,0|1,0,1]=4 3758 B13R1.148 C[C@H](Cc1cccc(Cl)c1)C(=O)O Amb10844155 [0,2,0,0,0,0|0,0,2]=4 3759 B13R1.148 C[C@H](Cc1cccc(N)c1)C(=O)O Amb27179116 [0,2,0,0,0,0|0,0,2]=4 3760 B13R1.148 C[C@H](Cc1cccc(O)c1)C(=O)O Amb27179117 [0,2,0,0,0,0|0,0,2]=4 3761 B13R1.148 C[C@H](Nc1cccc(F)c1)C(=O)O Amb24495647 [0,2,0,0,0,0|1,0,1]=4 3762 B13R1.148 C[C@H](Oc1cccc(Br)c1)C(=O)O Amb27410285 [0,2,0,0,0,0|1,0,1]=4 3763 B13R1.148 C[C@H](Oc1cccc(F)c1)C(=O)O Amb27760496 [0,2,0,0,0,0|1,0,1]=4 3764 B13R1.148 C\C(=C/c1cc(C)ccn1)C(=O)O Amb28137941 [0,2,0,0,0,0|1,0,0]=3 3765 B13R1.148 C\C(=C/c1cccc(Br)c1)C(=O)O Amb22339395 [0,2,0,0,0,0|0,0,0]=2 3766 B13R1.148 C\C(=C/c1cccc(Br)c1)C(C)N Amb27881292 [0,2,0,0,0,0|1,0,1]=4 3767 B13R1.148 C\C(=C/c1cccc(Br)c1)C(C)O Amb27840919 [0,2,0,0,0,0|0,0,2]=4 3768 B13R1.148 C\C(=C/c1cccc(Br)c1)[N+](=O)[O-] Amb4078947 [0,2,0,0,0,0|1,0,0]=3 3769 B13R1.148 C\C(=C/c1cccc(C)c1)C(=O)O Amb4009520 [0,2,0,0,0,0|0,0,0]=2 3770 B13R1.148 C\C(=C/c1cccc(C)c1)C(C)Cl Amb27589903 [0,2,0,0,0,0|1,0,1]=4 3771 B13R1.148 C\C(=C/c1cccc(Cl)c1)C(=O)O Amb4007781 [0,2,0,0,0,0|0,0,0]=2 3772 B13R1.148 C\C(=C/c1cccc(Cl)c1)C(C)N Amb27881294 [0,2,0,0,0,0|1,0,1]=4 3773 B13R1.148 C\C(=C/c1cccc(Cl)c1)C(C)O Amb28204414 [0,2,0,0,0,0|0,0,2]=4 3774 B13R1.148 C\C(=C/c1cccc(Cl)c1)[N+](=O)[O-] Amb18041945 [0,2,0,0,0,0|1,0,0]=3 3775 B13R1.148 C\C(=C/c1cccc(F)c1)C(=O)O Amb24745620 [0,2,0,0,0,0|0,0,0]=2 3776 B13R1.148 C\C(=C/c1cccc(F)c1)C(C)Br Amb27262110 [0,2,0,0,0,0|1,0,1]=4 3777 B13R1.148 C\C(=C/c1cccc(I)c1)C(=O)O Amb27393743 [0,2,0,0,0,0|0,0,0]=2 3778 B13R1.148 C\C(=C/c1cccc(I)c1)C(C)Br Amb27813084 [0,2,0,0,0,0|1,0,1]=4 3779 B13R1.148 C\C(=C/c1cccc(I)c1)C(C)Cl Amb27415305 [0,2,0,0,0,0|1,0,1]=4 3780 B13R1.148 C\C(=C/c1cccc(O)c1)C(C)N Amb27391050 [0,2,0,0,0,0|1,0,1]=4 3781 B13R1.148 C\C(=C\c1cccc(C)c1)[N+](=O)[O-] Amb22904187 [0,2,0,0,0,0|1,0,0]=3 3782 B13R1.148 C\C(=C\c1cccc(Cl)c1)[N+](=O)[O-] Amb28123395 [0,2,0,0,0,0|1,0,0]=3 3783 B13R1.148 C\C(=C\c1cccc(F)c1)[N+](=O)[O-] Amb25979468 [0,2,0,0,0,0|1,0,0]=3 3784 B13R1.148 C\C(=C\c1cccc(I)c1)[N+](=O)[O-] Amb27223449 [0,2,0,0,0,0|1,0,0]=3 3785 B13R1.148 C\C(=C\c1cccc(O)c1)[N+](=O)[O-] Amb24370379 [0,2,0,0,0,0|1,0,0]=3 3786 B13R1.148 C\C(=C\c1ccnc(Br)c1)C(=O)O Amb27951843 [0,2,0,0,0,0|1,0,0]=3 3787 B13R1.148 C\C(=C\c1cncc(Br)c1)[N+](=O)[O-] Amb27414717 [0,2,0,0,0,0|2,0,0]=4 3788 B13R1.148 Cc1cccc(CC(=O)C(=O)O)c1 Amb1131949 [0,2,0,0,0,0|1,0,1]=4 3789 B13R1.148 Cc1cccc(CC(C)C(=O)Cl)c1 Amb5744100 [0,2,0,0,0,0|0,0,2]=4 3790 B13R1.148 Cc1cccc(CC(C)C(=O)O)c1 Amb5744012 [0,2,0,0,0,0|0,0,2]=4 3791 B13R1.148 Cc1cccc(CN(C)C(=O)Cl)c1 Amb27618265 [0,2,0,0,0,0|1,0,1]=4 3792 B13R1.148 Cc1cccc(C[C@@H](C)C(=O)O)c1 Amb10844168 [0,2,0,0,0,0|0,0,2]=4 3793 B13R1.148 Cc1cccc(C[C@H](C)C(=O)O)c1 Amb10844169 [0,2,0,0,0,0|0,0,2]=4 3794 B13R1.148 Cc1cccc(NC(=O)C(=O)O)c1 Amb838988 [0,2,0,0,0,0|2,0,0]=4 3795 B13R1.148 Cc1cccc(NC(=O)C(N)=O)c1 Amb3439140 [0,2,0,0,0,0|2,0,0]=4 3796 B13R1.148 Cc1cccc(NC(=S)C(=O)O)c1 Amb27985884 [0,2,0,0,0,0|2,0,0]=4 3797 B13R1.148 Cc1cccc(NC(=S)C(N)=O)c1 Amb6875688 [0,2,0,0,0,0|2,0,0]=4 3798 B13R1.148 Cc1cccc(NC(C)C(=O)O)c1 Amb840548 [0,2,0,0,0,0|1,0,1]=4 3799 B13R1.148 Cc1cccc(N[C@@H](C)C(=O)O)c1 Amb16231733 [0,2,0,0,0,0|1,0,1]=4 3800 B13R1.148 Cc1cccc(OC(C)C(=O)Cl)c1 Amb16230058 [0,2,0,0,0,0|1,0,1]=4 3801 B13R1.148 Cc1cccc(OC(C)C(=O)O)c1 Amb9702048 [0,2,0,0,0,0|1,0,1]=4 3802 B13R1.148 Cc1cccc(OC(C)C(N)=O)c1 Amb5288107 [0,2,0,0,0,0|1,0,1]=4 3803 B13R1.148 Cc1cccc(O[C@@H](C)C(=O)O)c1 Amb24310391 [0,2,0,0,0,0|1,0,1]=4 3804 B13R1.148 Cc1cccc(SC(C)C(=O)Cl)c1 Amb17143634 [0,2,0,0,0,0|1,0,1]=4 3805 B13R1.148 Cc1cccc(SC(C)C(=O)O)c1 Amb5769096 [0,2,0,0,0,0|1,0,1]=4 3806 B13R1.148 Cc1cccc(SC(C)C(N)=O)c1 Amb17143161 [0,2,0,0,0,0|1,0,1]=4 3807 B13R1.148 Cc1cccc(\C=C(/F)C(=O)O)c1 Amb32677835 [0,2,0,0,0,0|1,0,0]=3 3808 B13R1.148 NC(=O)C(=O)Nc1cccc(F)c1 Amb27765660 [0,2,0,0,0,0|2,0,0]=4 3809 B13R1.148 NC(=O)C(=O)Nc1cccc(N)c1 Amb25129171 [0,2,0,0,0,0|2,0,0]=4 3810 B13R1.148 NC(=O)C(=O)Nc1cccc(O)c1 Amb13781379 [0,2,0,0,0,0|2,0,0]=4 3811 B13R1.148 NC(=O)C(=S)Nc1cccc(F)c1 Amb27641474 [0,2,0,0,0,0|2,0,0]=4 3812 B13R1.148 N\C(=C\c1cccc(Br)c1)C(=O)O Amb29883096 [0,2,0,0,0,0|1,0,0]=3 3813 B13R1.148 O=C(O)C(=O)Cc1cccc(Br)c1 Amb1137720 [0,2,0,0,0,0|1,0,1]=4 3814 B13R1.148 O=C(O)C(=O)Cc1cccc(Cl)c1 Amb1135307 [0,2,0,0,0,0|1,0,1]=4 3815 B13R1.148 O=C(O)C(=O)Cc1cccc(F)c1 Amb1126816 [0,2,0,0,0,0|1,0,1]=4 3816 B13R1.148 O=C(O)C(=O)Cc1cccc(I)c1 Amb27768916 [0,2,0,0,0,0|1,0,1]=4 3817 B13R1.148 O=C(O)C(=O)Cc1cccc(O)c1 Amb1141341 [0,2,0,0,0,0|1,0,1]=4 3818 B13R1.148 O=C(O)C(=O)Nc1cccc(Br)c1 Amb838964 [0,2,0,0,0,0|2,0,0]=4 3819 B13R1.148 O=C(O)C(=O)Nc1cccc(Cl)c1 Amb838963 [0,2,0,0,0,0|2,0,0]=4 3820 B13R1.148 O=C(O)C(=O)Nc1cccc(F)c1 Amb9303976 [0,2,0,0,0,0|2,0,0]=4 3821 B13R1.148 O=C(O)C(=S)Cc1cccc(Cl)c1 Amb27798340 [0,2,0,0,0,0|1,0,1]=4 3822 B13R1.148 O=C(O)\C(Br)=C\c1cccc(Cl)c1 Amb2794050 [0,2,0,0,0,0|1,0,0]=3 3823 B13R1.148 O=C(O)\C(Cl)=C/c1cccc(Cl)c1 Amb27427070 [0,2,0,0,0,0|1,0,0]=3 3824 B13R1.148 O=C(O)\C(F)=C\c1cccc(Br)c1 Amb24520960 [0,2,0,0,0,0|1,0,0]=3 3825 B13R1.148 O=C(O)\C(F)=C\c1cccc(Cl)c1 Amb25085473 [0,2,0,0,0,0|1,0,0]=3 3826 B13R1.148 O=C(O)\C(F)=C\c1cccc(F)c1 Amb27162615 [0,2,0,0,0,0|1,0,0]=3 3827 B13R1.148 O=C(O)\C(F)=C\c1cccc(O)c1 Amb26474923 [0,2,0,0,0,0|1,0,0]=3 3828 B13R1.148 O=C(O)\C(S)=C\c1cccc(Cl)c1 Amb4036384 [0,2,0,0,0,0|1,0,0]=3 3829 B13R1.202 C=C(Cc1ccccc1C)C(=O)O Amb27401861 [0,2,0,0,0,0|0,0,2]=4 3830 B13R1.202 C=C(Oc1ccccc1O)C(N)=O Amb18648219 [0,2,0,0,0,0|1,0,1]=4 3831 B13R1.202 CC(=O)C(=O)Cc1ccccc1Br Amb27241132 [0,2,0,0,0,0|1,0,1]=4 3832 B13R1.202 CC(=O)C(=O)Cc1ccccc1C Amb25158383 [0,2,0,0,0,0|1,0,1]=4 3833 B13R1.202 CC(=O)C(=O)Cc1ccccc1Cl Amb26452970 [0,2,0,0,0,0|1,0,1]=4 3834 B13R1.202 CC(=O)C(=O)Cc1ccccc1F Amb23603624 [0,2,0,0,0,0|1,0,1]=4 3835 B13R1.202 CC(=O)C(=O)Nc1ccccc1Br Amb17410539 [0,2,0,0,0,0|2,0,0]=4 3836 B13R1.202 CC(=O)C(=O)Nc1ccccc1C Amb17400598 [0,2,0,0,0,0|2,0,0]=4 3837 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl Amb17402222 [0,2,0,0,0,0|2,0,0]=4 3838 B13R1.202 CC(=O)C(=O)Nc1ccccc1F Amb17400855 [0,2,0,0,0,0|2,0,0]=4 3839 B13R1.202 CC(=O)C(C)Cc1ccccc1C Amb17233203 [0,2,0,0,0,0|0,0,2]=4 3840 B13R1.202 CC(=O)C(C)Cc1ccccc1Cl Amb17236507 [0,2,0,0,0,0|0,0,2]=4 3841 B13R1.202 CC(=O)C(C)Cc1ccccc1F Amb17233678 [0,2,0,0,0,0|0,0,2]=4 3842 B13R1.202 CC(=O)C(C)Oc1ccccc1Cl Amb2412507 [0,2,0,0,0,0|1,0,1]=4 3843 B13R1.202 CC(=O)C(C)Oc1ccccc1F Amb2412550 [0,2,0,0,0,0|1,0,1]=4 3844 B13R1.202 CC(=O)C(C)Oc1ccccc1N Amb17110088 [0,2,0,0,0,0|1,0,1]=4 3845 B13R1.202 CC(=O)C(C)Oc1ccccc1O Amb2418519 [0,2,0,0,0,0|1,0,1]=4 3846 B13R1.202 CC(=O)C(C)Sc1ccccc1Br Amb9230774 [0,2,0,0,0,0|1,0,1]=4 3847 B13R1.202 CC(=O)C(C)Sc1ccccc1C Amb19051953 [0,2,0,0,0,0|1,0,1]=4 3848 B13R1.202 CC(=O)C(C)Sc1ccccc1Cl Amb9268764 [0,2,0,0,0,0|1,0,1]=4 3849 B13R1.202 CC(=O)C(C)Sc1ccccc1F Amb9268570 [0,2,0,0,0,0|1,0,1]=4 3850 B13R1.202 CC(=O)N(C)Cc1ccccc1N Amb6892986 [0,2,0,0,0,0|1,0,1]=4 3851 B13R1.202 CC(=O)\C(C)=C\c1cnccc1C Amb27610193 [0,2,0,0,0,0|1,0,0]=3 3852 B13R1.202 CC(=O)\C(C)=C\c1nccnc1C Amb35601039 [0,2,0,0,0,0|2,0,0]=4 3853 B13R1.202 CC(Cc1ccccc1Br)C(=O)O Amb17605816 [0,2,0,0,0,0|0,0,2]=4 3854 B13R1.202 CC(Cc1ccccc1Cl)C(=O)Cl Amb5744108 [0,2,0,0,0,0|0,0,2]=4 3855 B13R1.202 CC(Cc1ccccc1Cl)C(=O)O Amb2785264 [0,2,0,0,0,0|0,0,2]=4 3856 B13R1.202 CC(Cc1ccccc1F)C(=O)O Amb5744013 [0,2,0,0,0,0|0,0,2]=4 3857 B13R1.202 CC(Cc1ccccc1O)C(=O)O Amb10844200 [0,2,0,0,0,0|0,0,2]=4 3858 B13R1.202 CC(Nc1ccccc1Br)C(=O)O Amb840563 [0,2,0,0,0,0|1,0,1]=4 3859 B13R1.202 CC(Nc1ccccc1Cl)C(=O)O Amb840560 [0,2,0,0,0,0|1,0,1]=4 3860 B13R1.202 CC(Nc1ccccc1F)C(=O)O Amb840557 [0,2,0,0,0,0|1,0,1]=4 3861 B13R1.202 CC(Nc1ccccc1I)C(=O)O Amb27657485 [0,2,0,0,0,0|1,0,1]=4 3862 B13R1.202 CC(Oc1ccccc1Br)C(=O)Cl Amb16230147 [0,2,0,0,0,0|1,0,1]=4 3863 B13R1.202 CC(Oc1ccccc1Br)C(=O)O Amb9704262 [0,2,0,0,0,0|1,0,1]=4 3864 B13R1.202 CC(Oc1ccccc1Br)C(N)=O Amb7752959 [0,2,0,0,0,0|1,0,1]=4 3865 B13R1.202 CC(Oc1ccccc1Cl)C(=O)Cl Amb16230065 [0,2,0,0,0,0|1,0,1]=4 3866 B13R1.202 CC(Oc1ccccc1Cl)C(=O)O Amb9704614 [0,2,0,0,0,0|1,0,1]=4 3867 B13R1.202 CC(Oc1ccccc1Cl)C(N)=O Amb8342103 [0,2,0,0,0,0|1,0,1]=4 3868 B13R1.202 CC(Oc1ccccc1F)C(=O)O Amb9702562 [0,2,0,0,0,0|1,0,1]=4 3869 B13R1.202 CC(Oc1ccccc1I)C(=O)O Amb9339551 [0,2,0,0,0,0|1,0,1]=4 3870 B13R1.202 CC(Oc1ccccc1N)C(=O)O Amb17110011 [0,2,0,0,0,0|1,0,1]=4 3871 B13R1.202 CC(Sc1ccccc1Cl)C(=O)O Amb1126189 [0,2,0,0,0,0|1,0,1]=4 3872 B13R1.202 CC(Sc1ccccc1F)C(N)=O Amb10665503 [0,2,0,0,0,0|1,0,1]=4 3873 B13R1.202 CC(Sc1ccccc1O)C(=O)O Amb18984793 [0,2,0,0,0,0|1,0,1]=4 3874 B13R1.202 CC(Sc1ccccc1O)C(N)=O Amb18318228 [0,2,0,0,0,0|1,0,1]=4 3875 B13R1.202 CN(Cc1ccccc1N)C(N)=O Amb9318044 [0,2,0,0,0,0|1,0,1]=4 3876 B13R1.202 C[C@@H](Cc1ccccc1Cl)C(=O)O Amb10844213 [0,2,0,0,0,0|0,0,2]=4 3877 B13R1.202 C[C@@H](Cc1ccccc1F)C(=O)O Amb10844134 [0,2,0,0,0,0|0,0,2]=4 3878 B13R1.202 C[C@H](Cc1ccccc1Cl)C(=O)O Amb10844130 [0,2,0,0,0,0|0,0,2]=4 3879 B13R1.202 C[C@H](Cc1ccccc1F)C(=O)O Amb10844133 [0,2,0,0,0,0|0,0,2]=4 3880 B13R1.202 C[C@H](Nc1ccccc1Cl)C(=O)O Amb28121138 [0,2,0,0,0,0|1,0,1]=4 3881 B13R1.202 C\C(=C/c1ccccc1Br)C(=O)O Amb27181049 [0,2,0,0,0,0|0,0,0]=2 3882 B13R1.202 C\C(=C/c1ccccc1Br)C(C)Cl Amb27591025 [0,2,0,0,0,0|1,0,1]=4 3883 B13R1.202 C\C(=C/c1ccccc1Br)C(C)N Amb27655078 [0,2,0,0,0,0|1,0,1]=4 3884 B13R1.202 C\C(=C/c1ccccc1C)C(=O)O Amb4013359 [0,2,0,0,0,0|0,0,0]=2 3885 B13R1.202 C\C(=C/c1ccccc1C)C(C)Br Amb27415306 [0,2,0,0,0,0|1,0,1]=4 3886 B13R1.202 C\C(=C/c1ccccc1C)C(C)Cl Amb27415242 [0,2,0,0,0,0|1,0,1]=4 3887 B13R1.202 C\C(=C/c1ccccc1C)[N+](=O)[O-] Amb24060081 [0,2,0,0,0,0|1,0,0]=3 3888 B13R1.202 C\C(=C/c1ccccc1Cl)C(=O)O Amb4005937 [0,2,0,0,0,0|0,0,0]=2 3889 B13R1.202 C\C(=C/c1ccccc1Cl)C(C)Cl Amb27415174 [0,2,0,0,0,0|1,0,1]=4 3890 B13R1.202 C\C(=C/c1ccccc1F)C(=O)O Amb5743929 [0,2,0,0,0,0|0,0,0]=2 3891 B13R1.202 C\C(=C/c1ccccc1O)C(=O)O Amb27881651 [0,2,0,0,0,0|0,0,0]=2 3892 B13R1.202 C\C(=C/c1ccccc1O)[N+](=O)[O-] Amb4078946 [0,2,0,0,0,0|1,0,0]=3 3893 B13R1.202 C\C(=C/c1nccnc1C)C(=O)O Amb35600948 [0,2,0,0,0,0|2,0,0]=4 3894 B13R1.202 C\C(=C\c1ccccc1Br)C(=O)O Amb28128655 [0,2,0,0,0,0|0,0,0]=2 3895 B13R1.202 C\C(=C\c1ccccc1C)[N+](=O)[O-] Amb24661463 [0,2,0,0,0,0|1,0,0]=3 3896 B13R1.202 C\C(=C\c1ccccc1F)C(=O)O Amb27403871 [0,2,0,0,0,0|0,0,0]=2 3897 B13R1.202 C\C(=C\c1ccccc1F)[N+](=O)[O-] Amb27973334 [0,2,0,0,0,0|1,0,0]=3 3898 B13R1.202 C\C(=C\c1ccccc1N)C(=O)O Amb28436850 [0,2,0,0,0,0|0,0,0]=2 3899 B13R1.202 C\C(=N/c1ccccc1C)C(=O)O Amb27415502 [0,2,0,0,0,0|1,0,0]=3 3900 B13R1.202 Cc1ccccc1CC(=O)C(=O)O Amb1125804 [0,2,0,0,0,0|1,0,1]=4 3901 B13R1.202 Cc1ccccc1CC(C)C(=O)Cl Amb5744099 [0,2,0,0,0,0|0,0,2]=4 3902 B13R1.202 Cc1ccccc1CC(C)C(=O)O Amb5744011 [0,2,0,0,0,0|0,0,2]=4 3903 B13R1.202 Cc1ccccc1CN(C)C(=O)Cl Amb27154131 [0,2,0,0,0,0|1,0,1]=4 3904 B13R1.202 Cc1ccccc1CN(C)C(N)=O Amb18186203 [0,2,0,0,0,0|1,0,1]=4 3905 B13R1.202 Cc1ccccc1C[C@@H](C)C(=O)O Amb10844135 [0,2,0,0,0,0|0,0,2]=4 3906 B13R1.202 Cc1ccccc1C[C@H](C)C(=O)O Amb10844136 [0,2,0,0,0,0|0,0,2]=4 3907 B13R1.202 Cc1ccccc1NC(=O)C(=O)O Amb838973 [0,2,0,0,0,0|2,0,0]=4 3908 B13R1.202 Cc1ccccc1NC(C)C(=O)O Amb840547 [0,2,0,0,0,0|1,0,1]=4 3909 B13R1.202 Cc1ccccc1N[C@@H](C)C(=O)O Amb16231747 [0,2,0,0,0,0|1,0,1]=4 3910 B13R1.202 Cc1ccccc1OC(C)C(=O)Cl Amb16230057 [0,2,0,0,0,0|1,0,1]=4 3911 B13R1.202 Cc1ccccc1OC(C)C(=O)O Amb9704479 [0,2,0,0,0,0|1,0,1]=4 3912 B13R1.202 Cc1ccccc1OC(C)C(N)=O Amb5288275 [0,2,0,0,0,0|1,0,1]=4 3913 B13R1.202 Cc1ccccc1\C=C(/F)C(=O)O Amb32677834 [0,2,0,0,0,0|1,0,0]=3 3914 B13R1.202 Cc1ccccc1\C=C(/S)C(=O)O Amb24115487 [0,2,0,0,0,0|1,0,0]=3 3915 B13R1.202 Cc1ccccc1\C=C(\N)C(=O)O Amb28078042 [0,2,0,0,0,0|1,0,0]=3 3916 B13R1.202 Cc1ccccc1\C=C(\S)C(=O)O Amb27650601 [0,2,0,0,0,0|1,0,0]=3 3917 B13R1.202 Cc1ccncc1\C=C(\N)C(=O)O Amb27664554 [0,2,0,0,0,0|2,0,0]=4 3918 B13R1.202 N=C(Nc1ccccc1Cl)C(=O)O Amb27876025 [0,2,0,0,0,0|2,0,0]=4 3919 B13R1.202 NC(=O)C(=O)Nc1ccccc1Br Amb27604038 [0,2,0,0,0,0|2,0,0]=4 3920 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl Amb1014777 [0,2,0,0,0,0|2,0,0]=4 3921 B13R1.202 NC(=O)C(=O)Nc1ccccc1F Amb3613983 [0,2,0,0,0,0|2,0,0]=4 3922 B13R1.202 NC(=O)C(=O)Nc1ccccc1I Amb28047939 [0,2,0,0,0,0|2,0,0]=4 3923 B13R1.202 NC(=O)C(=S)Nc1ccccc1N Amb27471763 [0,2,0,0,0,0|2,0,0]=4 3924 B13R1.202 N\C(=C\c1ccccc1Cl)C(=O)O Amb28456914 [0,2,0,0,0,0|1,0,0]=3 3925 B13R1.202 Nc1ccccc1CC(=S)C(=O)O Amb27415505 [0,2,0,0,0,0|1,0,1]=4 3926 B13R1.202 O=C(O)C(=O)Cc1ccccc1Br Amb6261503 [0,2,0,0,0,0|1,0,1]=4 3927 B13R1.202 O=C(O)C(=O)Cc1ccccc1Cl Amb1135873 [0,2,0,0,0,0|1,0,1]=4 3928 B13R1.202 O=C(O)C(=O)Cc1ccccc1F Amb6249101 [0,2,0,0,0,0|1,0,1]=4 3929 B13R1.202 O=C(O)C(=O)Cc1ccccc1O Amb26601164 [0,2,0,0,0,0|1,0,1]=4 3930 B13R1.202 O=C(O)C(=O)Nc1ccccc1Br Amb9238892 [0,2,0,0,0,0|2,0,0]=4 3931 B13R1.202 O=C(O)C(=O)Nc1ccccc1Cl Amb9303981 [0,2,0,0,0,0|2,0,0]=4 3932 B13R1.202 O=C(O)C(=O)Nc1ccccc1F Amb9303984 [0,2,0,0,0,0|2,0,0]=4 3933 B13R1.202 O=C(O)C(=O)Nc1ccccc1O Amb18128783 [0,2,0,0,0,0|2,0,0]=4 3934 B13R1.202 O=C(O)C(=S)Cc1ccccc1Cl Amb26316839 [0,2,0,0,0,0|1,0,1]=4 3935 B13R1.202 O=C(O)C(=S)Cc1ccccc1O Amb28044414 [0,2,0,0,0,0|1,0,1]=4 3936 B13R1.202 O=C(O)\C(F)=C\c1ccccc1Br Amb27415913 [0,2,0,0,0,0|1,0,0]=3 3937 B13R1.202 O=C(O)\C(F)=C\c1ccccc1Cl Amb25256125 [0,2,0,0,0,0|1,0,0]=3 3938 B13R1.202 O=C(O)\C(F)=C\c1ccccc1F Amb27812349 [0,2,0,0,0,0|1,0,0]=3 3939 B13R1.202 O=C(O)\C(S)=C/c1ccccc1Cl Amb2550971 [0,2,0,0,0,0|1,0,0]=3 3940 B13R1.353 C\C(=C/c1ccccc1)C(C)(C)N Amb33506931 [0,2,0,0,0,0|1,0,1]=4 3941 B13R1.353 C\C(=C/c1ccccc1)C(C)(C)O Amb33476397 [0,2,0,0,0,0|0,0,2]=4 3942 B13R1.353 C\C(=C\c1ccccc1)S(=O)(=O)Cl Amb27493389 [0,2,0,0,0,0|1,0,0]=3 3943 B13R1.418 C=C\C(=C\c1ccccc1)C(C)=O Amb27486089 [0,2,0,0,0,0|0,0,1]=3 3944 B13R1.418 CC(=O)C(CN)Cc1ccccc1 Amb33447075 [0,2,0,0,0,0|0,0,2]=4 3945 B13R1.418 CC(=O)C(Cc1ccccc1)=[N+]=[N-] Amb17594403 [0,2,0,0,0,0|1,0,1]=4 3946 B13R1.418 CC(=O)N(CCl)Cc1ccccc1 Amb27659293 [0,2,0,0,0,0|1,0,1]=4 3947 B13R1.418 CC(=O)N(CO)Cc1ccccc1 Amb27662432 [0,2,0,0,0,0|1,0,1]=4 3948 B13R1.418 CC(=O)\C(=C/N)Cc1ccccc1 Amb17777847 [0,2,0,0,0,0|0,0,2]=4 3949 B13R1.418 CC(=O)\C(=C/O)Cc1ccccc1 Amb27260481 [0,2,0,0,0,0|0,0,2]=4 3950 B13R1.418 CC(=O)\C(=C/[O-])Cc1ccccc1 Amb21947890 [0,2,0,0,0,0|0,0,2]=4 3951 B13R1.418 CC(=O)\C(=C/[O-])Cc1ccccc1 Amb21947891 [0,2,0,0,0,0|0,0,2]=4 3952 B13R1.418 CC(=O)\C(=C\N)Sc1ccccc1 Amb26873942 [0,2,0,0,0,0|1,0,1]=4 3953 B13R1.418 CC(=O)\C(=C\c1ccccc1)CCl Amb27252370 [0,2,0,0,0,0|0,0,0]=2 3954 B13R1.418 CC(=O)\C(Cc1ccccc1)=N/O Amb28202239 [0,2,0,0,0,0|1,0,1]=4 3955 B13R1.418 CC(C)\C(C=O)=C/c1ccccc1 Amb17334988 [0,2,0,0,0,0|0,0,0]=2 3956 B13R1.418 CC(C)\C(C=O)=C/c1ccccn1 Amb17335048 [0,2,0,0,0,0|1,0,0]=3 3957 B13R1.418 CC(C)\C(C=O)=C/c1cccnc1 Amb17335049 [0,2,0,0,0,0|1,0,0]=3 3958 B13R1.418 CC(C)\C(C=O)=C/c1ccncc1 Amb17335050 [0,2,0,0,0,0|1,0,0]=3 3959 B13R1.418 CC(C)\C(C=O)=C\c1ccncc1 Amb28397121 [0,2,0,0,0,0|1,0,0]=3 3960 B13R1.418 CC(C)\C(C=O)=C\c1cnccn1 Amb35600872 [0,2,0,0,0,0|2,0,0]=4 3961 B13R1.418 CC(O)\C(C#N)=C\c1ccccc1 Amb18127057 [0,2,0,0,0,0|1,0,1]=4 3962 B13R1.418 CCC(Cc1ccccc1)C(=O)O Amb5744036 [0,2,0,0,0,0|0,0,2]=4 3963 B13R1.418 CCC(Cc1ccccc1)C(C)=O Amb17233201 [0,2,0,0,0,0|0,0,2]=4 3964 B13R1.418 CCC(Nc1ccccc1)C(=O)O Amb9702181 [0,2,0,0,0,0|1,0,1]=4 3965 B13R1.418 CCC(Nc1ccccc1)C(C)=O Amb27244645 [0,2,0,0,0,0|1,0,1]=4 3966 B13R1.418 CCC(Nc1ccccc1)C(N)=O Amb19007446 [0,2,0,0,0,0|1,0,1]=4 3967 B13R1.418 CCC(Oc1ccccc1)C(=O)Cl Amb22274837 [0,2,0,0,0,0|1,0,1]=4 3968 B13R1.418 CCC(Oc1ccccc1)C(=O)O Amb6334837 [0,2,0,0,0,0|1,0,1]=4 3969 B13R1.418 CCC(Sc1ccccc1)C(=O)O Amb5721598 [0,2,0,0,0,0|1,0,1]=4 3970 B13R1.418 CCC(Sc1ccccc1)C(C)=O Amb32682580 [0,2,0,0,0,0|1,0,1]=4 3971 B13R1.418 CCN(Cc1ccccc1)C(=O)Cl Amb17563084 [0,2,0,0,0,0|1,0,1]=4 3972 B13R1.418 CCN(Cc1ccccc1)C(C)=O Amb6338885 [0,2,0,0,0,0|1,0,1]=4 3973 B13R1.418 CCN(Cc1ccccc1)C(N)=O Amb7761977 [0,2,0,0,0,0|1,0,1]=4 3974 B13R1.418 CC[C@@H](Nc1ccccc1)C(=O)O Amb33347517 [0,2,0,0,0,0|1,0,1]=4 3975 B13R1.418 CC[C@H](Nc1ccccc1)C(=O)O Amb33347515 [0,2,0,0,0,0|1,0,1]=4 3976 B13R1.418 CC[C@H](Nc1ccccc1)C(C)=O Amb28070936 [0,2,0,0,0,0|1,0,1]=4 3977 B13R1.418 CC\C(=C/c1ccccc1)C(=O)O Amb4021410 [0,2,0,0,0,0|0,0,0]=2 3978 B13R1.418 CC\C(=C/c1ccccc1)C(C)=O Amb25285770 [0,2,0,0,0,0|0,0,0]=2 3979 B13R1.418 CC\C(=C/c1ccccn1)C(=O)O Amb5743950 [0,2,0,0,0,0|1,0,0]=3 3980 B13R1.418 CC\C(=C/c1ccccn1)C(C)=O Amb28199981 [0,2,0,0,0,0|1,0,0]=3 3981 B13R1.418 CC\C(=C/c1cccnc1)C(=O)O Amb5743951 [0,2,0,0,0,0|1,0,0]=3 3982 B13R1.418 CC\C(=C/c1ccncc1)C(=O)O Amb5743952 [0,2,0,0,0,0|1,0,0]=3 3983 B13R1.418 CC\C(=C/c1ccncn1)C(=O)O Amb32682115 [0,2,0,0,0,0|2,0,0]=4 3984 B13R1.418 CC\C(=C/c1cnccn1)C(=O)O Amb32682271 [0,2,0,0,0,0|2,0,0]=4 3985 B13R1.418 CC\C(=C/c1cncnc1)C(=O)O Amb32682140 [0,2,0,0,0,0|2,0,0]=4 3986 B13R1.418 CC\C(=C\c1ccccn1)C(C)=O Amb28054425 [0,2,0,0,0,0|1,0,0]=3 3987 B13R1.418 CC\C(=C\c1cccnc1)C(=O)O Amb28321006 [0,2,0,0,0,0|1,0,0]=3 3988 B13R1.418 CC\C(=C\c1cccnc1)C(C)=O Amb27844143 [0,2,0,0,0,0|1,0,0]=3 3989 B13R1.418 CC\C(=C\c1ccncc1)[N+](=O)[O-] Amb27647892 [0,2,0,0,0,0|2,0,0]=4 3990 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb33983942 [0,2,0,0,0,0|0,0,2]=4 3991 B13R1.418 CNC(Cc1ccccc1)C(=O)O Amb9619791 [0,2,0,0,0,0|0,0,2]=4 3992 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb10604038 [0,2,0,0,0,0|0,0,2]=4 3993 B13R1.418 CN[C@@H](Cc1ccccc1)C(=O)O Amb22744994 [0,2,0,0,0,0|0,0,2]=4 3994 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb16183857 [0,2,0,0,0,0|0,0,2]=4 3995 B13R1.418 CN[C@H](Cc1ccccc1)C(=O)O Amb33801550 [0,2,0,0,0,0|0,0,2]=4 3996 B13R1.418 COC(Cc1ccccc1)C(=O)O Amb18128650 [0,2,0,0,0,0|0,0,2]=4 3997 B13R1.418 CON(Oc1ccccc1)C(C)=O Amb24096701 [0,2,0,0,0,0|2,0,0]=4 3998 B13R1.418 CO\C(=C/c1ccccc1)C(=O)O Amb1945718 [0,2,0,0,0,0|0,0,0]=2 3999 B13R1.418 CO\C(=C\c1ccccc1)C(=O)O Amb28242324 [0,2,0,0,0,0|0,0,0]=2 4000 B13R1.418 CO\C(=C\c1ccncc1)C(C)=O Amb28201155 [0,2,0,0,0,0|1,0,0]=3 4001 B13R1.418 CS\C(=C/c1ccccn1)C(=O)O Amb1761007 [0,2,0,0,0,0|1,0,0]=3 4002 B13R1.418 CS\C(=C/c1cccnc1)C(=O)O Amb1761008 [0,2,0,0,0,0|1,0,0]=3 4003 B13R1.418 CS\C(=C/c1ccncc1)C(=O)O Amb1761006 [0,2,0,0,0,0|1,0,0]=3 4004 B13R1.418 CS\C(=C\c1ccccc1)C(=O)O Amb18130097 [0,2,0,0,0,0|0,0,0]=2 4005 B13R1.418 C\C=C(\Sc1ccccc1)C(C)O Amb28207312 [0,2,0,0,0,0|2,0,0]=4 4006 B13R1.418 C\C=C(\Sc1ccccc1)C(N)=O Amb27955834 [0,2,0,0,0,0|1,0,0]=3 4007 B13R1.418 N#C\C(=C/c1ccccc1)C(=O)Cl Amb17143094 [0,2,0,0,0,0|0,0,1]=3 4008 B13R1.418 N#C\C(=C/c1ccccc1)C(=O)O Amb17224284 [0,2,0,0,0,0|0,0,1]=3 4009 B13R1.418 N#C\C(=C/c1ccccc1)C(N)=O Amb2222555 [0,2,0,0,0,0|0,0,1]=3 4010 B13R1.418 N#C\C(=C/c1ccccc1)C(N)=S Amb26060151 [0,2,0,0,0,0|0,1,1]=4 4011 B13R1.418 N#C\C(=C/c1ccccn1)C(=O)O Amb6245649 [0,2,0,0,0,0|1,0,1]=4 4012 B13R1.418 N#C\C(=C/c1cccnc1)C(=O)O Amb1133348 [0,2,0,0,0,0|1,0,1]=4 4013 B13R1.418 N#C\C(=C/c1cccnc1)C(=O)[O-] Amb33513112 [0,2,0,0,0,0|1,0,1]=4 4014 B13R1.418 N#C\C(=C/c1ccncc1)C(=O)O Amb1125727 [0,2,0,0,0,0|1,0,1]=4 4015 B13R1.418 N#C\C(=C/c1ccncc1)C(N)=O Amb2411609 [0,2,0,0,0,0|1,0,1]=4 4016 B13R1.418 N#C\C(=C\c1ccccc1)C(=O)O Amb4015026 [0,2,0,0,0,0|0,0,1]=3 4017 B13R1.418 N#C\C(=C\c1ccccc1)C(N)=O Amb4074010 [0,2,0,0,0,0|0,0,1]=3 4018 B13R1.418 N#C\C(=C\c1ccccc1)C(N)=S Amb2437989 [0,2,0,0,0,0|0,1,1]=4 4019 B13R1.418 N#C\C(=C\c1cccnc1)C(=O)O Amb10068989 [0,2,0,0,0,0|1,0,1]=4 4020 B13R1.418 N#C\C(=C\c1ccncc1)C(=O)O Amb32416243 [0,2,0,0,0,0|1,0,1]=4 4021 B13R1.418 NC(=O)C(CO)Nc1ccccc1 Amb27180189 [0,2,0,0,0,0|1,0,1]=4 4022 B13R1.418 NC(=O)\C(=C\O)Sc1ccccc1 Amb27630458 [0,2,0,0,0,0|1,0,1]=4 4023 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb2697356 [0,2,0,0,0,0|0,0,2]=4 4024 B13R1.418 NCC(Cc1ccccc1)C(=O)O Amb33547962 [0,2,0,0,0,0|0,0,2]=4 4025 B13R1.418 NCC(Oc1ccccc1)C(=O)O Amb32651876 [0,2,0,0,0,0|1,0,1]=4 4026 B13R1.418 NCC(Oc1ccccc1)C(=O)O Amb32651877 [0,2,0,0,0,0|1,0,1]=4 4027 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745974 [0,2,0,0,0,0|0,0,2]=4 4028 B13R1.418 NC[C@@H](Cc1ccccc1)C(=O)O Amb22745975 [0,2,0,0,0,0|0,0,2]=4 4029 B13R1.418 NC[C@@H](Oc1ccccc1)C(=O)O Amb32652164 [0,2,0,0,0,0|1,0,1]=4 4030 B13R1.418 NC[C@@H](Oc1ccccc1)C(=O)O Amb32652167 [0,2,0,0,0,0|1,0,1]=4 4031 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33329263 [0,2,0,0,0,0|0,0,2]=4 4032 B13R1.418 NC[C@H](Cc1ccccc1)C(=O)O Amb33457755 [0,2,0,0,0,0|0,0,2]=4 4033 B13R1.418 NC[C@H](Oc1ccccc1)C(=O)O Amb32652288 [0,2,0,0,0,0|1,0,1]=4 4034 B13R1.418 NC[C@H](Oc1ccccc1)C(=O)O Amb32652289 [0,2,0,0,0,0|1,0,1]=4 4035 B13R1.418 NC\C(=C/c1cccnc1)C(=O)O Amb27232796 [0,2,0,0,0,0|1,0,0]=3 4036 B13R1.418 NC\C(=C\c1cccnc1)C(=O)O Amb27477995 [0,2,0,0,0,0|1,0,0]=3 4037 B13R1.418 N\N=C(\Cc1ccccc1)C(=O)O Amb27409024 [0,2,0,0,0,0|1,0,1]=4 4038 B13R1.418 O=C(O)C(CO)Cc1ccccc1 Amb31291631 [0,2,0,0,0,0|0,0,2]=4 4039 B13R1.418 O=C(O)[C@@H](CS)Nc1ccccc1 Amb27415495 [0,2,0,0,0,0|1,0,1]=4 4040 B13R1.418 O=C(O)[C@H](CO)Nc1ccccc1 Amb28243263 [0,2,0,0,0,0|1,0,1]=4 4041 B13R1.418 O=C(O)\C(=C/O)Nc1ccccc1 Amb27440517 [0,2,0,0,0,0|1,0,1]=4 4042 B13R1.418 O=C(O)\C(=C/c1ccccc1)CO Amb20671516 [0,2,0,0,0,0|0,0,0]=2 4043 B13R1.418 O=C(O)\C(=C\Cl)Cc1ccccc1 Amb27187237 [0,2,0,0,0,0|0,0,2]=4 4044 B13R1.418 O=C(O)\C(Cc1ccccc1)=N/O Amb4035775 [0,2,0,0,0,0|1,0,1]=4 4045 B13R1.418 O=C=C(Cc1ccccc1)C(=O)Cl Amb27607123 [0,2,0,0,0,0|0,0,2]=4 4046 B13R1.418 O=[N+]([O-])\C(=C/c1ccccc1)CO Amb27191700 [0,2,0,0,0,0|1,0,0]=3 4047 B13R1.418 [C-]#[N+]\C(=C/c1ccccc1)C(=O)O Amb27608648 [0,2,0,0,0,0|0,0,1]=3 4048 B13R1.1073 CC(=O)C(C)(Cl)Cc1ccccc1 Amb4020126 [0,2,0,0,0,0|0,0,2]=4 4049 B13R1.1073 CC(=O)C(C)(N)Cc1ccccc1 Amb28239796 [0,2,0,0,0,0|0,0,2]=4 4050 B13R1.1073 CC(=O)C(C)(N)Cc1ccccc1 Amb35746580 [0,2,0,0,0,0|0,0,2]=4 4051 B13R1.1073 CC(=O)C(C)(O)Cc1ccccc1 Amb22641853 [0,2,0,0,0,0|0,0,2]=4 4052 B13R1.1073 CC(=O)C(C)(O)Nc1ccccc1 Amb27777272 [0,2,0,0,0,0|1,0,1]=4 4053 B13R1.1073 CC(Br)(Cc1ccccc1)C(=O)O Amb25957726 [0,2,0,0,0,0|0,0,2]=4 4054 B13R1.1073 CC(C)(Cc1ccccc1)C(=O)O Amb8439763 [0,2,0,0,0,0|0,0,2]=4 4055 B13R1.1073 CC(C)(Cc1ccccc1)C(N)=O Amb16939814 [0,2,0,0,0,0|0,0,2]=4 4056 B13R1.1073 CC(C)(Nc1ccccc1)C(=O)O Amb840740 [0,2,0,0,0,0|1,0,1]=4 4057 B13R1.1073 CC(C)(Nc1ccccc1)C(N)=O Amb1394882 [0,2,0,0,0,0|1,0,1]=4 4058 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)Cl Amb16230100 [0,2,0,0,0,0|1,0,1]=4 4059 B13R1.1073 CC(C)(Oc1ccccc1)C(=O)O Amb6551023 [0,2,0,0,0,0|1,0,1]=4 4060 B13R1.1073 CC(C)(Oc1ccccc1)C(N)=O Amb17142977 [0,2,0,0,0,0|1,0,1]=4 4061 B13R1.1073 CC(C)(Sc1ccccc1)C(=O)O Amb5769190 [0,2,0,0,0,0|1,0,1]=4 4062 B13R1.1073 CC(C)(Sc1ccccc1)C(N)=O Amb17143164 [0,2,0,0,0,0|1,0,1]=4 4063 B13R1.1073 CC(Cl)(Cc1ccccc1)C(=O)O Amb26944936 [0,2,0,0,0,0|0,0,2]=4 4064 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb28555907 [0,2,0,0,0,0|0,0,2]=4 4065 B13R1.1073 CC(N)(Cc1ccccc1)C(=O)O Amb3941655 [0,2,0,0,0,0|0,0,2]=4 4066 B13R1.1073 CC(N)(Cc1ccccc1)C(N)=O Amb19001791 [0,2,0,0,0,0|0,0,2]=4 4067 B13R1.1073 CC(O)(Cc1ccccc1)C(=O)O Amb10067052 [0,2,0,0,0,0|0,0,2]=4 4068 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb33482937 [0,2,0,0,0,0|0,0,2]=4 4069 B13R1.1073 C[C@@](N)(Cc1ccccc1)C(=O)O Amb8629107 [0,2,0,0,0,0|0,0,2]=4 4070 B13R1.1073 C[C@@](O)(Cc1ccccc1)C(=O)O Amb10067053 [0,2,0,0,0,0|0,0,2]=4 4071 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb2720582 [0,2,0,0,0,0|0,0,2]=4 4072 B13R1.1073 C[C@](N)(Cc1ccccc1)C(=O)O Amb33482933 [0,2,0,0,0,0|0,0,2]=4 4073 B13R1.1073 C[C@](O)(Cc1ccccc1)C(=O)O Amb4166326 [0,2,0,0,0,0|0,0,2]=4 4074 B13R1.1073 C[C@](S)(Cc1ccccc1)C(=O)O Amb28137940 [0,2,0,0,0,0|0,0,2]=4 4075 B13R1.5 CC(C=O)Cc1ccc(C#N)cc1 Amb18127075 [0,2,0,0,0,0|0,0,2]=4 4076 B13R1.5 CC(C=O)Oc1ccc(C#N)cc1 Amb30020619 [0,2,0,0,0,0|1,0,1]=4 4077 B13R1.5 CCc1ccc(\C=C(/C)C=O)cc1 Amb17334992 [0,2,0,0,0,0|0,0,0]=2 4078 B13R1.5 COc1ccc(CC(C)C=O)cc1 Amb8009294 [0,2,0,0,0,0|0,0,2]=4 4079 B13R1.5 COc1ccc(SC(C)C=O)cc1 Amb18130313 [0,2,0,0,0,0|1,0,1]=4 4080 B13R1.5 COc1ccc(\C=C(/C)C=O)cc1 Amb17335115 [0,2,0,0,0,0|0,0,0]=2 4081 B13R1.5 COc1ccc(\C=C(/F)C=O)cc1 Amb28208224 [0,2,0,0,0,0|1,0,0]=3 4082 B13R1.5 COc1ccc(\C=C(\C)C=O)cn1 Amb27226669 [0,2,0,0,0,0|1,0,0]=3 4083 B13R1.5 COc1ccc(\C=C(\Cl)C=O)cc1 Amb26871137 [0,2,0,0,0,0|1,0,0]=3 4084 B13R1.5 COc1ccc(\C=C(\O)C=O)cc1 Amb27467753 [0,2,0,0,0,0|1,0,0]=3 4085 B13R1.5 C\C(=C\c1ccc(C#N)cc1)CCl Amb27433817 [0,2,0,0,0,0|1,0,1]=4 4086 B13R1.5 C\C(=C\c1ccc(C#N)cc1)CN Amb27759002 [0,2,0,0,0,0|1,0,1]=4 4087 B13R1.5 C\C(C=O)=C\c1ccc(C#N)cc1 Amb27471726 [0,2,0,0,0,0|0,0,0]=2 4088 B13R1.145 CC\C(=C\c1ccc(C)cc1)CBr Amb27981146 [0,2,0,0,0,0|1,0,1]=4 4089 B13R1.145 CC\C(=C\c1ccc(I)cc1)CBr Amb27401224 [0,2,0,0,0,0|1,0,1]=4 4090 B13R1.145 CC\C(C=O)=C/c1ccc(Br)cc1 Amb17347962 [0,2,0,0,0,0|0,0,0]=2 4091 B13R1.145 CC\C(C=O)=C/c1ccc(C)cc1 Amb17334991 [0,2,0,0,0,0|0,0,0]=2 4092 B13R1.145 CC\C(C=O)=C/c1ccc(Cl)cc1 Amb17336899 [0,2,0,0,0,0|0,0,0]=2 4093 B13R1.145 CC\C(C=O)=C/c1ccc(F)cc1 Amb17335220 [0,2,0,0,0,0|0,0,0]=2 4094 B13R1.145 CC\C(C=O)=C/c1ccc(O)cc1 Amb17335120 [0,2,0,0,0,0|0,0,0]=2 4095 B13R1.145 CC\C(C=O)=C\c1ccc(Br)cc1 Amb27265357 [0,2,0,0,0,0|0,0,0]=2 4096 B13R1.145 CC\C(C=O)=C\c1ccc(Br)cn1 Amb27167122 [0,2,0,0,0,0|1,0,0]=3 4097 B13R1.145 CC\C(C=O)=C\c1ccc(C)cn1 Amb27601245 [0,2,0,0,0,0|1,0,0]=3 4098 B13R1.145 CC\C(C=O)=C\c1ccc(C)nc1 Amb27478878 [0,2,0,0,0,0|1,0,0]=3 4099 B13R1.145 CC\C(C=O)=C\c1ccc(F)cc1 Amb27602810 [0,2,0,0,0,0|0,0,0]=2 4100 B13R1.145 CC\C(C=O)=C\c1ccc(I)cc1 Amb27751449 [0,2,0,0,0,0|0,0,0]=2 4101 B13R1.145 Cc1ccc(C=C(C=O)C=O)cc1 Amb18127207 [0,2,0,0,0,0|0,0,1]=3 4102 B13R1.145 Cc1ccc(\C=C(\C#N)CN)cc1 Amb27984811 [0,2,0,0,0,0|1,0,1]=4 4103 B13R1.145 N#C\C(=C/c1ccc(F)cc1)CCl Amb25202054 [0,2,0,0,0,0|1,0,1]=4 4104 B13R1.145 N#C\C(=C\c1ccc(Cl)cc1)CCl Amb27949692 [0,2,0,0,0,0|1,0,1]=4 4105 B13R1.145 NCC(=Cc1ccc(O)cc1)CN Amb25817497 [0,2,0,0,0,0|1,0,1]=4 4106 B13R1.145 NC\C(=C/F)Cc1ccc(F)cc1 Amb27874176 [0,2,0,0,0,0|1,0,1]=4 4107 B13R1.145 NC\C(=C\F)Cc1ccc(F)cc1 Amb27626859 [0,2,0,0,0,0|1,0,1]=4 4108 B13R1.145 O=CC(C=O)=Cc1ccc(F)cc1 Amb27973010 [0,2,0,0,0,0|0,0,1]=3 4109 B13R1.249 CC(C)(C=O)Cc1ccc(Br)cc1 Amb25162192 [0,2,0,0,0,0|0,0,2]=4 4110 B13R1.249 CC(C)(C=O)Cc1ccc(Cl)cc1 Amb4035817 [0,2,0,0,0,0|0,0,2]=4 4111 B13R1.249 CC(C)(C=O)Cc1ccc(F)cc1 Amb18648369 [0,2,0,0,0,0|0,0,2]=4 4112 B13R1.249 CC(C)(C=O)Cc1ccc(I)cc1 Amb25162168 [0,2,0,0,0,0|0,0,2]=4 4113 B13R1.249 CC(C)(C=O)Cc1ccc(O)cc1 Amb27985182 [0,2,0,0,0,0|0,0,2]=4 4114 B13R1.249 CC(C)(C=O)Oc1ccc(Br)cc1 Amb27827599 [0,2,0,0,0,0|1,0,1]=4 4115 B13R1.249 CC(C)(C=O)Sc1ccc(Cl)cc1 Amb2412537 [0,2,0,0,0,0|1,0,1]=4 4116 B13R1.249 CC(O)(C=O)Cc1ccc(Br)cc1 Amb28286583 [0,2,0,0,0,0|0,0,2]=4 4117 B13R1.249 CC(O)(C=O)Cc1ccc(F)cc1 Amb28061732 [0,2,0,0,0,0|0,0,2]=4 4118 B13R1.249 Cc1ccc(CC(C)(C)C=O)cc1 Amb27148209 [0,2,0,0,0,0|0,0,2]=4 4119 B13R1.249 Cc1ccc(CC(C)(O)C=O)cc1 Amb27642989 [0,2,0,0,0,0|0,0,2]=4 4120 B13R1.249 Cc1ccc(SC(C)(C)C=O)cc1 Amb2412538 [0,2,0,0,0,0|1,0,1]=4 4121 B13R1.2679 CC(C=O)Cc1ccc(Br)cc1Br Amb28348429 [0,2,0,0,0,0|0,0,2]=4 4122 B13R1.2679 CC(C=O)Cc1ccc(Br)cc1F Amb28118663 [0,2,0,0,0,0|0,0,2]=4 4123 B13R1.2679 CC(C=O)Cc1ccc(Br)cc1I Amb24494896 [0,2,0,0,0,0|0,0,2]=4 4124 B13R1.2679 CC(C=O)Cc1ccc(Br)cc1N Amb28203782 [0,2,0,0,0,0|0,0,2]=4 4125 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1Br Amb28124860 [0,2,0,0,0,0|0,0,2]=4 4126 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1Cl Amb26559013 [0,2,0,0,0,0|0,0,2]=4 4127 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1F Amb24421802 [0,2,0,0,0,0|0,0,2]=4 4128 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1I Amb25125929 [0,2,0,0,0,0|0,0,2]=4 4129 B13R1.2679 CC(C=O)Cc1ccc(Cl)cc1O Amb25876120 [0,2,0,0,0,0|0,0,2]=4 4130 B13R1.2679 CC(C=O)Cc1ccc(F)cc1Br Amb25324754 [0,2,0,0,0,0|0,0,2]=4 4131 B13R1.2679 CC(C=O)Cc1ccc(F)cc1Cl Amb27217610 [0,2,0,0,0,0|0,0,2]=4 4132 B13R1.2679 CC(C=O)Cc1ccc(F)cc1F Amb27260830 [0,2,0,0,0,0|0,0,2]=4 4133 B13R1.2679 CC(C=O)Cc1ccc(F)cc1I Amb26477381 [0,2,0,0,0,0|0,0,2]=4 4134 B13R1.2679 CC(C=O)Cc1ccc(F)cc1N Amb24491966 [0,2,0,0,0,0|0,0,2]=4 4135 B13R1.2679 CC(C=O)Cc1ccc(F)cc1O Amb27248494 [0,2,0,0,0,0|0,0,2]=4 4136 B13R1.2679 CC(C=O)Cc1ccc(I)cc1F Amb24463579 [0,2,0,0,0,0|0,0,2]=4 4137 B13R1.2679 CC(C=O)Cc1ccc(I)cc1N Amb25281592 [0,2,0,0,0,0|0,0,2]=4 4138 B13R1.2679 CC(C=O)Cc1ccc(I)cc1O Amb25969069 [0,2,0,0,0,0|0,0,2]=4 4139 B13R1.2679 CC(C=O)Cc1ccc(N)cc1F Amb25876118 [0,2,0,0,0,0|0,0,2]=4 4140 B13R1.2679 CC(C=O)Cc1ccc(N)cc1O Amb24494875 [0,2,0,0,0,0|0,0,2]=4 4141 B13R1.2679 CC(C=O)Cc1ccc(O)cc1F Amb27868585 [0,2,0,0,0,0|0,0,2]=4 4142 B13R1.2679 CC(C=O)Cc1ccc(O)cc1O Amb24454551 [0,2,0,0,0,0|0,0,2]=4 4143 B13R1.2679 CC(C=O)Oc1ccc(Br)cc1Br Amb30020800 [0,2,0,0,0,0|1,0,1]=4 4144 B13R1.2679 CC(C=O)Oc1ccc(Br)cc1Cl Amb30020799 [0,2,0,0,0,0|1,0,1]=4 4145 B13R1.2679 CC(C=O)Oc1ccc(Br)cc1F Amb30020793 [0,2,0,0,0,0|1,0,1]=4 4146 B13R1.2679 CC(C=O)Oc1ccc(Cl)cc1Br Amb30020798 [0,2,0,0,0,0|1,0,1]=4 4147 B13R1.2679 CC(C=O)Oc1ccc(Cl)cc1F Amb30020780 [0,2,0,0,0,0|1,0,1]=4 4148 B13R1.2679 CC(C=O)Oc1ccc(F)cc1Br Amb30020791 [0,2,0,0,0,0|1,0,1]=4 4149 B13R1.2679 CC(C=O)Oc1ccc(F)cc1Cl Amb30020776 [0,2,0,0,0,0|1,0,1]=4 4150 B13R1.2679 CC(C=O)Oc1ccc(F)cc1F Amb30020768 [0,2,0,0,0,0|1,0,1]=4 4151 B13R1.2679 CC(C=O)Sc1ccc(Cl)cc1Cl Amb30020909 [0,2,0,0,0,0|1,0,1]=4 4152 B13R1.2679 CC(C=O)Sc1ccc(F)cc1F Amb30020888 [0,2,0,0,0,0|1,0,1]=4 4153 B13R1.2679 CN(C=O)Cc1ccc(F)cc1F Amb27808911 [0,2,0,0,0,0|1,0,1]=4 4154 B13R1.2679 C\C(=C/c1ccc(F)cc1F)CN Amb27663005 [0,2,0,0,0,0|1,0,1]=4 4155 B13R1.2679 C\C(=C\c1ccc(Br)cc1C)CBr Amb27967026 [0,2,0,0,0,0|1,0,1]=4 4156 B13R1.2679 C\C(=C\c1ccc(Br)cc1C)CO Amb27262826 [0,2,0,0,0,0|0,0,2]=4 4157 B13R1.2679 C\C(=C\c1ccc(Br)cc1Cl)CN Amb27790172 [0,2,0,0,0,0|1,0,1]=4 4158 B13R1.2679 C\C(=C\c1ccc(Br)cc1Cl)CO Amb28206776 [0,2,0,0,0,0|0,0,2]=4 4159 B13R1.2679 C\C(=C\c1ccc(Br)cc1F)CCl Amb27590620 [0,2,0,0,0,0|1,0,1]=4 4160 B13R1.2679 C\C(=C\c1ccc(Br)cc1F)CN Amb28046164 [0,2,0,0,0,0|1,0,1]=4 4161 B13R1.2679 C\C(=C\c1ccc(C)cc1C)CO Amb28077498 [0,2,0,0,0,0|0,0,2]=4 4162 B13R1.2679 C\C(=C\c1ccc(C)cc1Cl)CBr Amb30012827 [0,2,0,0,0,0|1,0,1]=4 4163 B13R1.2679 C\C(=C\c1ccc(C)cc1Cl)CCl Amb30012826 [0,2,0,0,0,0|1,0,1]=4 4164 B13R1.2679 C\C(=C\c1ccc(C)cc1Cl)CN Amb27257729 [0,2,0,0,0,0|1,0,1]=4 4165 B13R1.2679 C\C(=C\c1ccc(C)cc1Cl)CO Amb35711127 [0,2,0,0,0,0|0,0,2]=4 4166 B13R1.2679 C\C(=C\c1ccc(Cl)cc1C)CBr Amb27173033 [0,2,0,0,0,0|1,0,1]=4 4167 B13R1.2679 C\C(=C\c1ccc(Cl)cc1Cl)CN Amb27947745 [0,2,0,0,0,0|1,0,1]=4 4168 B13R1.2679 C\C(=C\c1ccc(F)cc1Br)CN Amb27258532 [0,2,0,0,0,0|1,0,1]=4 4169 B13R1.2679 C\C(=C\c1ccc(F)cc1C)CBr Amb27458131 [0,2,0,0,0,0|1,0,1]=4 4170 B13R1.2679 C\C(=C\c1ccc(F)cc1Cl)CN Amb28383223 [0,2,0,0,0,0|1,0,1]=4 4171 B13R1.2679 C\C(=C\c1ccc(F)cc1Cl)CO Amb28317296 [0,2,0,0,0,0|0,0,2]=4 4172 B13R1.2679 C\C(=C\c1ccc(F)cc1F)CN Amb27851218 [0,2,0,0,0,0|1,0,1]=4 4173 B13R1.2679 C\C(=C\c1ccc(F)cc1F)CO Amb27272853 [0,2,0,0,0,0|0,0,2]=4 4174 B13R1.2679 C\C(=C\c1ccc(O)cc1F)CO Amb35696349 [0,2,0,0,0,0|0,0,2]=4 4175 B13R1.2679 C\C(C=O)=C\c1ccc(C)cc1Cl Amb35711142 [0,2,0,0,0,0|0,0,0]=2 4176 B13R1.2679 C\C(C=O)=C\c1ccc(Cl)cc1Cl Amb27483823 [0,2,0,0,0,0|0,0,0]=2 4177 B13R1.2679 C\C(C=O)=C\c1ccc(O)cc1F Amb35688756 [0,2,0,0,0,0|0,0,0]=2 4178 B13R1.2679 C\C=C(\C)Cc1ccc(C)cc1O Amb27427789 [0,2,0,0,0,0|1,0,1]=4 4179 B13R1.2679 Cc1cc(Br)ccc1OC(C)C=O Amb30020786 [0,2,0,0,0,0|1,0,1]=4 4180 B13R1.2679 Cc1cc(Cl)ccc1CC(C)C=O Amb24413851 [0,2,0,0,0,0|0,0,2]=4 4181 B13R1.2679 Cc1cc(Cl)ccc1OC(C)C=O Amb30020772 [0,2,0,0,0,0|1,0,1]=4 4182 B13R1.2679 Cc1cc(F)ccc1CC(C)C=O Amb28248644 [0,2,0,0,0,0|0,0,2]=4 4183 B13R1.2679 Cc1cc(F)ccc1OC(C)C=O Amb30020626 [0,2,0,0,0,0|1,0,1]=4 4184 B13R1.2679 Cc1cc(I)ccc1CC(C)C=O Amb27450401 [0,2,0,0,0,0|0,0,2]=4 4185 B13R1.2679 Cc1cc(N)ccc1CC(C)C=O Amb25841541 [0,2,0,0,0,0|0,0,2]=4 4186 B13R1.2679 Cc1ccc(CC(C)C=O)c(C)c1 Amb26437265 [0,2,0,0,0,0|0,0,2]=4 4187 B13R1.2679 Cc1ccc(CN(C)C=O)c(C)c1 Amb28365881 [0,2,0,0,0,0|1,0,1]=4 4188 B13R1.2679 Cc1ccc(OC(C)C=O)c(Br)c1 Amb30020787 [0,2,0,0,0,0|1,0,1]=4 4189 B13R1.2679 Cc1ccc(OC(C)C=O)c(Cl)c1 Amb30020774 [0,2,0,0,0,0|1,0,1]=4 4190 B13R1.2679 Cc1ccc(SC(C)C=O)c(C)c1 Amb30020881 [0,2,0,0,0,0|1,0,1]=4 4191 B13R1.2679 O=CC(=O)Cc1ccc(F)cc1F Amb28054338 [0,2,0,0,0,0|1,0,1]=4 4192 B13R1.2879 CC(C=O)Cc1ccc(Br)c(Br)c1 Amb25353746 [0,2,0,0,0,0|0,0,2]=4 4193 B13R1.2879 CC(C=O)Cc1ccc(Br)c(Cl)c1 Amb25850015 [0,2,0,0,0,0|0,0,2]=4 4194 B13R1.2879 CC(C=O)Cc1ccc(Br)c(I)c1 Amb24367741 [0,2,0,0,0,0|0,0,2]=4 4195 B13R1.2879 CC(C=O)Cc1ccc(Br)c(N)c1 Amb25342335 [0,2,0,0,0,0|0,0,2]=4 4196 B13R1.2879 CC(C=O)Cc1ccc(Br)c(O)c1 Amb26513031 [0,2,0,0,0,0|0,0,2]=4 4197 B13R1.2879 CC(C=O)Cc1ccc(Cl)c(Br)c1 Amb27162229 [0,2,0,0,0,0|0,0,2]=4 4198 B13R1.2879 CC(C=O)Cc1ccc(Cl)c(Cl)c1 Amb26936819 [0,2,0,0,0,0|0,0,2]=4 4199 B13R1.2879 CC(C=O)Cc1ccc(Cl)c(F)c1 Amb27867477 [0,2,0,0,0,0|0,0,2]=4 4200 B13R1.2879 CC(C=O)Cc1ccc(Cl)c(I)c1 Amb26597458 [0,2,0,0,0,0|0,0,2]=4 4201 B13R1.2879 CC(C=O)Cc1ccc(Cl)c(O)c1 Amb27856647 [0,2,0,0,0,0|0,0,2]=4 4202 B13R1.2879 CC(C=O)Cc1ccc(F)c(Cl)c1 Amb28365044 [0,2,0,0,0,0|0,0,2]=4 4203 B13R1.2879 CC(C=O)Cc1ccc(F)c(F)c1 Amb28206606 [0,2,0,0,0,0|0,0,2]=4 4204 B13R1.2879 CC(C=O)Cc1ccc(F)c(I)c1 Amb24470858 [0,2,0,0,0,0|0,0,2]=4 4205 B13R1.2879 CC(C=O)Cc1ccc(F)c(O)c1 Amb25876061 [0,2,0,0,0,0|0,0,2]=4 4206 B13R1.2879 CC(C=O)Cc1ccc(I)c(Br)c1 Amb26840549 [0,2,0,0,0,0|0,0,2]=4 4207 B13R1.2879 CC(C=O)Cc1ccc(I)c(Cl)c1 Amb25876143 [0,2,0,0,0,0|0,0,2]=4 4208 B13R1.2879 CC(C=O)Cc1ccc(I)c(F)c1 Amb25352434 [0,2,0,0,0,0|0,0,2]=4 4209 B13R1.2879 CC(C=O)Cc1ccc(I)c(O)c1 Amb26318874 [0,2,0,0,0,0|0,0,2]=4 4210 B13R1.2879 CC(C=O)Cc1ccc(N)c(Br)c1 Amb27411379 [0,2,0,0,0,0|0,0,2]=4 4211 B13R1.2879 CC(C=O)Cc1ccc(N)c(Cl)c1 Amb25140855 [0,2,0,0,0,0|0,0,2]=4 4212 B13R1.2879 CC(C=O)Cc1ccc(N)c(F)c1 Amb24494759 [0,2,0,0,0,0|0,0,2]=4 4213 B13R1.2879 CC(C=O)Cc1ccc(N)c(N)c1 Amb26080959 [0,2,0,0,0,0|0,0,2]=4 4214 B13R1.2879 CC(C=O)Cc1ccc(N)c(O)c1 Amb25715389 [0,2,0,0,0,0|0,0,2]=4 4215 B13R1.2879 CC(C=O)Cc1ccc(O)c(Cl)c1 Amb26984272 [0,2,0,0,0,0|0,0,2]=4 4216 B13R1.2879 CC(C=O)Cc1ccc(O)c(F)c1 Amb26330521 [0,2,0,0,0,0|0,0,2]=4 4217 B13R1.2879 CC(C=O)Cc1ccc(O)c(I)c1 Amb27495400 [0,2,0,0,0,0|0,0,2]=4 4218 B13R1.2879 CC(C=O)Cc1ccc(O)c(N)c1 Amb24437480 [0,2,0,0,0,0|0,0,2]=4 4219 B13R1.2879 CC(C=O)Oc1ccc(Br)c(Cl)c1 Amb35640762 [0,2,0,0,0,0|1,0,1]=4 4220 B13R1.2879 CC(C=O)Oc1ccc(Br)c(F)c1 Amb30020792 [0,2,0,0,0,0|1,0,1]=4 4221 B13R1.2879 CC(C=O)Oc1ccc(Cl)c(Cl)c1 Amb30020783 [0,2,0,0,0,0|1,0,1]=4 4222 B13R1.2879 CC(C=O)Oc1ccc(Cl)c(F)c1 Amb30020779 [0,2,0,0,0,0|1,0,1]=4 4223 B13R1.2879 CC(C=O)Oc1ccc(F)c(Br)c1 Amb30020796 [0,2,0,0,0,0|1,0,1]=4 4224 B13R1.2879 CC(C=O)Oc1ccc(F)c(Cl)c1 Amb30020777 [0,2,0,0,0,0|1,0,1]=4 4225 B13R1.2879 CC(C=O)Oc1ccc(F)c(F)c1 Amb30020728 [0,2,0,0,0,0|1,0,1]=4 4226 B13R1.2879 CC(C=O)Sc1ccc(Cl)c(Cl)c1 Amb30020891 [0,2,0,0,0,0|1,0,1]=4 4227 B13R1.2879 CC(C=O)Sc1ccc(F)c(F)c1 Amb30020889 [0,2,0,0,0,0|1,0,1]=4 4228 B13R1.2879 C\C(=C/c1ccc(Cl)c(C)c1)CN Amb33252878 [0,2,0,0,0,0|1,0,1]=4 4229 B13R1.2879 C\C(=C\c1ccc(Br)c(Br)c1)CBr Amb27817620 [0,2,0,0,0,0|1,0,1]=4 4230 B13R1.2879 C\C(=C\c1ccc(Br)c(Br)c1)CN Amb28202534 [0,2,0,0,0,0|1,0,1]=4 4231 B13R1.2879 C\C(=C\c1ccc(Br)c(Br)c1)CO Amb27251735 [0,2,0,0,0,0|0,0,2]=4 4232 B13R1.2879 C\C(=C\c1ccc(Br)c(C)c1)CN Amb27460645 [0,2,0,0,0,0|1,0,1]=4 4233 B13R1.2879 C\C(=C\c1ccc(Br)c(Cl)c1)CBr Amb27752510 [0,2,0,0,0,0|1,0,1]=4 4234 B13R1.2879 C\C(=C\c1ccc(Br)c(Cl)c1)CCl Amb28070111 [0,2,0,0,0,0|1,0,1]=4 4235 B13R1.2879 C\C(=C\c1ccc(Br)c(Cl)c1)CO Amb28204430 [0,2,0,0,0,0|0,0,2]=4 4236 B13R1.2879 C\C(=C\c1ccc(Br)c(F)c1)CO Amb27609152 [0,2,0,0,0,0|0,0,2]=4 4237 B13R1.2879 C\C(=C\c1ccc(C)c(Cl)c1)CO Amb27232542 [0,2,0,0,0,0|0,0,2]=4 4238 B13R1.2879 C\C(=C\c1ccc(C)c(F)c1)CCl Amb28207863 [0,2,0,0,0,0|1,0,1]=4 4239 B13R1.2879 C\C(=C\c1ccc(Cl)c(Br)c1)CCl Amb27400504 [0,2,0,0,0,0|1,0,1]=4 4240 B13R1.2879 C\C(=C\c1ccc(F)c(C)c1)CCl Amb27254534 [0,2,0,0,0,0|1,0,1]=4 4241 B13R1.2879 C\C(=C\c1ccc(F)c(C)c1)CO Amb27604832 [0,2,0,0,0,0|0,0,2]=4 4242 B13R1.2879 C\C(=C\c1ccc(F)c(Cl)c1)CCl Amb27834022 [0,2,0,0,0,0|1,0,1]=4 4243 B13R1.2879 C\C(=C\c1ccc(F)c(F)c1)CCl Amb27982301 [0,2,0,0,0,0|1,0,1]=4 4244 B13R1.2879 C\C(=C\c1ccc(O)c(O)c1)CO Amb27657172 [0,2,0,0,0,0|0,0,2]=4 4245 B13R1.2879 C\C(C=O)=C\c1ccc(C)c(Br)c1 Amb27654815 [0,2,0,0,0,0|0,0,0]=2 4246 B13R1.2879 C\C(C=O)=C\c1ccc(C)c(C)c1 Amb27651071 [0,2,0,0,0,0|0,0,0]=2 4247 B13R1.2879 C\C(C=O)=C\c1ccc(C)c(F)c1 Amb27401528 [0,2,0,0,0,0|0,0,0]=2 4248 B13R1.2879 C\C(C=O)=C\c1ccc(Cl)c(Br)c1 Amb27412323 [0,2,0,0,0,0|0,0,0]=2 4249 B13R1.2879 C\C(C=O)=C\c1ccc(Cl)c(Cl)c1 Amb27590553 [0,2,0,0,0,0|0,0,0]=2 4250 B13R1.2879 C\C(C=O)=C\c1ccc(Cl)c(F)c1 Amb27658511 [0,2,0,0,0,0|0,0,0]=2 4251 B13R1.2879 C\C(C=O)=C\c1ccc(O)c(Cl)c1 Amb28244635 [0,2,0,0,0,0|0,0,0]=2 4252 B13R1.2879 C\C(C=O)=C\c1ccc(O)c(F)c1 Amb27783763 [0,2,0,0,0,0|0,0,0]=2 4253 B13R1.2879 Cc1cc(CC(C)C=O)ccc1I Amb28074263 [0,2,0,0,0,0|0,0,2]=4 4254 B13R1.2879 Cc1cc(CC(C)C=O)ccc1N Amb28118659 [0,2,0,0,0,0|0,0,2]=4 4255 B13R1.2879 Cc1cc(CC(C)C=O)ccc1O Amb25126946 [0,2,0,0,0,0|0,0,2]=4 4256 B13R1.2879 Cc1cc(OC(C)C=O)ccc1Br Amb30020788 [0,2,0,0,0,0|1,0,1]=4 4257 B13R1.2879 Cc1cc(OC(C)C=O)ccc1F Amb30020625 [0,2,0,0,0,0|1,0,1]=4 4258 B13R1.2879 Cc1ccc(CC(C)C=O)cc1Br Amb24554106 [0,2,0,0,0,0|0,0,2]=4 4259 B13R1.2879 Cc1ccc(CC(C)C=O)cc1C Amb26623492 [0,2,0,0,0,0|0,0,2]=4 4260 B13R1.2879 Cc1ccc(CC(C)C=O)cc1F Amb28280137 [0,2,0,0,0,0|0,0,2]=4 4261 B13R1.2879 Cc1ccc(CC(C)C=O)cc1I Amb26840597 [0,2,0,0,0,0|0,0,2]=4 4262 B13R1.2879 Cc1ccc(OC(C)C=O)cc1Br Amb35640761 [0,2,0,0,0,0|1,0,1]=4 4263 B13R1.2879 Cc1ccc(OC(C)C=O)cc1F Amb30020628 [0,2,0,0,0,0|1,0,1]=4 4264 B13R1.2879 Cc1ccc(SC(C)C=O)cc1C Amb30020882 [0,2,0,0,0,0|1,0,1]=4 4265 B13R1.40 CC(C=O)Cc1cccc(Br)c1Br Amb24494488 [0,2,0,0,0,0|0,0,2]=4 4266 B13R1.40 CC(C=O)Cc1cccc(Br)c1I Amb26328826 [0,2,0,0,0,0|0,0,2]=4 4267 B13R1.40 CC(C=O)Cc1cccc(Br)c1N Amb25125326 [0,2,0,0,0,0|0,0,2]=4 4268 B13R1.40 CC(C=O)Cc1cccc(Br)c1O Amb25244541 [0,2,0,0,0,0|0,0,2]=4 4269 B13R1.40 CC(C=O)Cc1cccc(Cl)c1Br Amb25256018 [0,2,0,0,0,0|0,0,2]=4 4270 B13R1.40 CC(C=O)Cc1cccc(Cl)c1Cl Amb25683165 [0,2,0,0,0,0|0,0,2]=4 4271 B13R1.40 CC(C=O)Cc1cccc(Cl)c1F Amb25308049 [0,2,0,0,0,0|0,0,2]=4 4272 B13R1.40 CC(C=O)Cc1cccc(Cl)c1I Amb26622255 [0,2,0,0,0,0|0,0,2]=4 4273 B13R1.40 CC(C=O)Cc1cccc(Cl)c1N Amb27166585 [0,2,0,0,0,0|0,0,2]=4 4274 B13R1.40 CC(C=O)Cc1cccc(Cl)c1O Amb27398149 [0,2,0,0,0,0|0,0,2]=4 4275 B13R1.40 CC(C=O)Cc1cccc(F)c1Br Amb25140323 [0,2,0,0,0,0|0,0,2]=4 4276 B13R1.40 CC(C=O)Cc1cccc(F)c1Cl Amb26632546 [0,2,0,0,0,0|0,0,2]=4 4277 B13R1.40 CC(C=O)Cc1cccc(F)c1I Amb28203868 [0,2,0,0,0,0|0,0,2]=4 4278 B13R1.40 CC(C=O)Cc1cccc(F)c1N Amb25116700 [0,2,0,0,0,0|0,0,2]=4 4279 B13R1.40 CC(C=O)Cc1cccc(F)c1O Amb26840807 [0,2,0,0,0,0|0,0,2]=4 4280 B13R1.40 CC(C=O)Cc1cccc(I)c1F Amb28241196 [0,2,0,0,0,0|0,0,2]=4 4281 B13R1.40 CC(C=O)Cc1cccc(I)c1N Amb25703696 [0,2,0,0,0,0|0,0,2]=4 4282 B13R1.40 CC(C=O)Cc1cccc(I)c1O Amb25998732 [0,2,0,0,0,0|0,0,2]=4 4283 B13R1.40 CC(C=O)Cc1cccc(N)c1N Amb25244511 [0,2,0,0,0,0|0,0,2]=4 4284 B13R1.40 CC(C=O)Cc1cccc(N)c1O Amb26327756 [0,2,0,0,0,0|0,0,2]=4 4285 B13R1.40 CC(C=O)Cc1cccc(O)c1F Amb26470213 [0,2,0,0,0,0|0,0,2]=4 4286 B13R1.40 CC(C=O)Cc1cccc(O)c1O Amb24491914 [0,2,0,0,0,0|0,0,2]=4 4287 B13R1.40 CC(C=O)Oc1cccc(Cl)c1Cl Amb30020785 [0,2,0,0,0,0|1,0,1]=4 4288 B13R1.40 CC(C=O)Oc1cccc(Cl)c1F Amb30020778 [0,2,0,0,0,0|1,0,1]=4 4289 B13R1.40 CC(C=O)Oc1cccc(F)c1F Amb30020771 [0,2,0,0,0,0|1,0,1]=4 4290 B13R1.40 C\C(=C\c1cccc(Br)c1F)CN Amb28320843 [0,2,0,0,0,0|1,0,1]=4 4291 B13R1.40 C\C(=C\c1cccc(C)c1F)CBr Amb27213341 [0,2,0,0,0,0|1,0,1]=4 4292 B13R1.40 C\C(=C\c1cccc(Cl)c1Cl)CBr Amb27402796 [0,2,0,0,0,0|1,0,1]=4 4293 B13R1.40 C\C(=C\c1cccc(Cl)c1Cl)CCl Amb27401585 [0,2,0,0,0,0|1,0,1]=4 4294 B13R1.40 C\C(=C\c1cccc(Cl)c1Cl)CO Amb27648648 [0,2,0,0,0,0|0,0,2]=4 4295 B13R1.40 C\C(=C\c1cccc(Cl)c1F)CBr Amb27273515 [0,2,0,0,0,0|1,0,1]=4 4296 B13R1.40 C\C(=C\c1cccc(Cl)c1F)CCl Amb28288846 [0,2,0,0,0,0|1,0,1]=4 4297 B13R1.40 C\C(=C\c1cccc(F)c1Br)CBr Amb28144681 [0,2,0,0,0,0|1,0,1]=4 4298 B13R1.40 C\C(=C\c1cccc(F)c1Br)CN Amb28242413 [0,2,0,0,0,0|1,0,1]=4 4299 B13R1.40 C\C(=C\c1cccc(F)c1Cl)CN Amb27621352 [0,2,0,0,0,0|1,0,1]=4 4300 B13R1.40 C\C(=C\c1cccc(O)c1Cl)CO Amb27436760 [0,2,0,0,0,0|0,0,2]=4 4301 B13R1.40 C\C(C=O)=C/c1cccc(C)c1O Amb23596358 [0,2,0,0,0,0|0,0,0]=2 4302 B13R1.40 C\C(C=O)=C\c1cccc(C)c1F Amb27861971 [0,2,0,0,0,0|0,0,0]=2 4303 B13R1.40 C\C(C=O)=C\c1cccc(F)c1F Amb27805588 [0,2,0,0,0,0|0,0,0]=2 4304 B13R1.40 C\C(C=O)=C\c1cccc(O)c1Cl Amb27953520 [0,2,0,0,0,0|0,0,0]=2 4305 B13R1.40 Cc1c(Br)cccc1CC(C)C=O Amb26921222 [0,2,0,0,0,0|0,0,2]=4 4306 B13R1.40 Cc1c(Cl)cccc1CC(C)C=O Amb25286842 [0,2,0,0,0,0|0,0,2]=4 4307 B13R1.40 Cc1c(I)cccc1CC(C)C=O Amb25876063 [0,2,0,0,0,0|0,0,2]=4 4308 B13R1.40 Cc1c(N)cccc1CC(C)C=O Amb25233794 [0,2,0,0,0,0|0,0,2]=4 4309 B13R1.40 Cc1c(O)cccc1CC(C)C=O Amb24731851 [0,2,0,0,0,0|0,0,2]=4 4310 B13R1.40 Cc1cccc(CC(C)C=O)c1C Amb27801863 [0,2,0,0,0,0|0,0,2]=4 4311 B13R1.40 Cc1cccc(CC(C)C=O)c1F Amb24491965 [0,2,0,0,0,0|0,0,2]=4 4312 B13R1.40 Cc1cccc(OC(C)C=O)c1C Amb30020623 [0,2,0,0,0,0|1,0,1]=4 4313 B13R1.40 Cc1cccc(OC(C)C=O)c1F Amb30020629 [0,2,0,0,0,0|1,0,1]=4 4314 B13R1.81 C#Cc1ccnc(\C=C(/C)C=O)c1 Amb27409588 [0,2,0,0,0,0|1,0,0]=3 4315 B13R1.81 C#Cc1ccnc(\C=C(\C)C=O)c1 Amb27216495 [0,2,0,0,0,0|1,0,0]=3 4316 B13R1.81 CC(C=O)Cc1cccc(C#N)c1 Amb24494469 [0,2,0,0,0,0|0,0,2]=4 4317 B13R1.81 CC(C=O)Oc1cccc(C#N)c1 Amb30020621 [0,2,0,0,0,0|1,0,1]=4 4318 B13R1.81 COc1cccc(SC(C)C=O)c1 Amb32682549 [0,2,0,0,0,0|1,0,1]=4 4319 B13R1.81 COc1cccc(\C=C(/C)C=O)c1 Amb17335113 [0,2,0,0,0,0|0,0,0]=2 4320 B13R1.81 COc1cccc(\C=C(/F)C=O)c1 Amb27230611 [0,2,0,0,0,0|1,0,0]=3 4321 B13R1.81 COc1cccc(\C=C(\Br)C=O)c1 Amb28184948 [0,2,0,0,0,0|1,0,0]=3 4322 B13R1.81 COc1cccc(\C=C(\F)C=O)c1 Amb27214030 [0,2,0,0,0,0|1,0,0]=3 4323 B13R1.81 COc1cncc(\C=C(\C)C=O)c1 Amb35667193 [0,2,0,0,0,0|1,0,0]=3 4324 B13R1.81 C\C(=C\c1cccc(C#N)c1)CBr Amb27877328 [0,2,0,0,0,0|1,0,1]=4 4325 B13R1.81 C\C(C=O)=C/c1cccc(C#N)c1 Amb28364606 [0,2,0,0,0,0|0,0,0]=2 4326 B13R1.81 C\C(C=O)=C\c1cccc(C#N)c1 Amb28184375 [0,2,0,0,0,0|0,0,0]=2 4327 B13R1.146 CC\C(=C\c1cccc(C)c1)CCl Amb27809766 [0,2,0,0,0,0|1,0,1]=4 4328 B13R1.146 CC\C(=C\c1cccc(C)c1)CO Amb27601291 [0,2,0,0,0,0|0,0,2]=4 4329 B13R1.146 CC\C(=C\c1cccc(Cl)c1)CBr Amb27877329 [0,2,0,0,0,0|1,0,1]=4 4330 B13R1.146 CC\C(=C\c1cccc(Cl)c1)CO Amb28187606 [0,2,0,0,0,0|0,0,2]=4 4331 B13R1.146 CC\C(=C\c1cccc(I)c1)CN Amb27768923 [0,2,0,0,0,0|1,0,1]=4 4332 B13R1.146 CC\C(=C\c1cccc(O)c1)CO Amb28197549 [0,2,0,0,0,0|0,0,2]=4 4333 B13R1.146 CC\C(C=O)=C/c1cccc(Br)c1 Amb17347961 [0,2,0,0,0,0|0,0,0]=2 4334 B13R1.146 CC\C(C=O)=C/c1cccc(C)c1 Amb17334990 [0,2,0,0,0,0|0,0,0]=2 4335 B13R1.146 CC\C(C=O)=C/c1cccc(Cl)c1 Amb17336898 [0,2,0,0,0,0|0,0,0]=2 4336 B13R1.146 CC\C(C=O)=C/c1cccc(O)c1 Amb17335121 [0,2,0,0,0,0|0,0,0]=2 4337 B13R1.146 CC\C(C=O)=C\c1cccc(I)c1 Amb27394552 [0,2,0,0,0,0|0,0,0]=2 4338 B13R1.146 CC\C(C=O)=C\c1cccc(O)c1 Amb27869033 [0,2,0,0,0,0|0,0,0]=2 4339 B13R1.146 CC\C(C=O)=C\c1ccnc(C)n1 Amb28388490 [0,2,0,0,0,0|2,0,0]=4 4340 B13R1.146 Cc1cccc(C=C(CO)CO)c1 Amb28401033 [0,2,0,0,0,0|0,0,2]=4 4341 B13R1.146 NC\C(=C/F)Cc1cccc(F)c1 Amb28131394 [0,2,0,0,0,0|1,0,1]=4 4342 B13R1.250 CC(C)(C=O)Cc1cccc(Br)c1 Amb25308014 [0,2,0,0,0,0|0,0,2]=4 4343 B13R1.250 CC(C)(C=O)Cc1cccc(Cl)c1 Amb25318834 [0,2,0,0,0,0|0,0,2]=4 4344 B13R1.250 CC(C)(C=O)Cc1cccc(F)c1 Amb24490384 [0,2,0,0,0,0|0,0,2]=4 4345 B13R1.250 CC(C)(C=O)Cc1cccc(O)c1 Amb25162179 [0,2,0,0,0,0|0,0,2]=4 4346 B13R1.250 Cc1cccc(CC(C)(C)C=O)c1 Amb25192247 [0,2,0,0,0,0|0,0,2]=4 4347 B13R1.250 Cc1cccc(OC(C)(C)C=O)c1 Amb27200874 [0,2,0,0,0,0|1,0,1]=4 4348 B13R1.2872 CC(C=O)Oc1cc(Br)ccc1Cl Amb30020797 [0,2,0,0,0,0|1,0,1]=4 4349 B13R1.2872 CC(C=O)Oc1cc(Br)ccc1F Amb30020790 [0,2,0,0,0,0|1,0,1]=4 4350 B13R1.2872 CC(C=O)Oc1cc(Cl)ccc1Cl Amb30020784 [0,2,0,0,0,0|1,0,1]=4 4351 B13R1.2872 CC(C=O)Oc1cc(F)ccc1Br Amb30020795 [0,2,0,0,0,0|1,0,1]=4 4352 B13R1.2872 CC(C=O)Oc1cc(F)ccc1Cl Amb30020781 [0,2,0,0,0,0|1,0,1]=4 4353 B13R1.2872 CC(C=O)Oc1cc(F)ccc1F Amb30020769 [0,2,0,0,0,0|1,0,1]=4 4354 B13R1.2872 CC(C=O)Sc1cc(Cl)ccc1Cl Amb30020892 [0,2,0,0,0,0|1,0,1]=4 4355 B13R1.2872 CC(C=O)Sc1cc(F)ccc1F Amb30020887 [0,2,0,0,0,0|1,0,1]=4 4356 B13R1.2872 C\C(=C/c1cc(Cl)ccc1O)CO Amb23527205 [0,2,0,0,0,0|0,0,2]=4 4357 B13R1.2872 C\C(=C\c1cc(Br)ccc1Cl)CCl Amb27661611 [0,2,0,0,0,0|1,0,1]=4 4358 B13R1.2872 C\C(=C\c1cc(Br)ccc1F)CBr Amb28454460 [0,2,0,0,0,0|1,0,1]=4 4359 B13R1.2872 C\C(=C\c1cc(C)ccc1C)CO Amb27875751 [0,2,0,0,0,0|0,0,2]=4 4360 B13R1.2872 C\C(=C\c1cc(Cl)ccc1Cl)CO Amb27871122 [0,2,0,0,0,0|0,0,2]=4 4361 B13R1.2872 C\C(=C\c1cc(Cl)ccc1F)CCl Amb27478370 [0,2,0,0,0,0|1,0,1]=4 4362 B13R1.2872 C\C(=C\c1cc(Cl)ccc1I)CN Amb29853252 [0,2,0,0,0,0|1,0,1]=4 4363 B13R1.2872 C\C(=C\c1cc(F)ccc1Br)CBr Amb28135971 [0,2,0,0,0,0|1,0,1]=4 4364 B13R1.2872 C\C(=C\c1cc(F)ccc1Br)CCl Amb27215938 [0,2,0,0,0,0|1,0,1]=4 4365 B13R1.2872 C\C(=C\c1cc(F)ccc1C)CBr Amb27629947 [0,2,0,0,0,0|1,0,1]=4 4366 B13R1.2872 C\C(=C\c1cc(F)ccc1Cl)CN Amb27395312 [0,2,0,0,0,0|1,0,1]=4 4367 B13R1.2872 C\C(C#N)=C/c1cc(Cl)ccc1Cl Amb27177386 [0,2,0,0,0,0|1,0,1]=4 4368 B13R1.2872 C\C(C#N)=C\c1cc(Cl)ccc1Cl Amb9871407 [0,2,0,0,0,0|1,0,1]=4 4369 B13R1.2872 C\C(C=O)=C/c1cc(Br)ccc1O Amb3590889 [0,2,0,0,0,0|0,0,0]=2 4370 B13R1.2872 C\C(C=O)=C/c1cc(Cl)ccc1O Amb3465504 [0,2,0,0,0,0|0,0,0]=2 4371 B13R1.2872 C\C(C=O)=C/c1cc(F)ccc1F Amb28122344 [0,2,0,0,0,0|0,0,0]=2 4372 B13R1.2872 C\C(C=O)=C\c1cc(Cl)ccc1Br Amb28249932 [0,2,0,0,0,0|0,0,0]=2 4373 B13R1.2872 C\C(C=O)=C\c1cc(Cl)ccc1O Amb23483418 [0,2,0,0,0,0|0,0,0]=2 4374 B13R1.2872 C\C=C(\C)Cc1cc(F)ccc1O Amb27205187 [0,2,0,0,0,0|1,0,1]=4 4375 B13R1.2872 Cc1ccc(Br)c(OC(C)C=O)c1 Amb35663102 [0,2,0,0,0,0|1,0,1]=4 4376 B13R1.2872 Cc1ccc(Br)cc1OC(C)C=O Amb30020789 [0,2,0,0,0,0|1,0,1]=4 4377 B13R1.2872 Cc1ccc(C)c(SC(C)C=O)c1 Amb24666692 [0,2,0,0,0,0|1,0,1]=4 4378 B13R1.2872 Cc1ccc(Cl)c(OC(C)C=O)c1 Amb30020773 [0,2,0,0,0,0|1,0,1]=4 4379 B13R1.2872 Cc1ccc(Cl)cc1OC(C)C=O Amb30020775 [0,2,0,0,0,0|1,0,1]=4 4380 B13R1.2872 Cc1ccc(F)c(CC(C)C=O)c1 Amb28043690 [0,2,0,0,0,0|0,0,2]=4 4381 B13R1.2872 Cc1ccc(F)c(OC(C)C=O)c1 Amb30020627 [0,2,0,0,0,0|1,0,1]=4 4382 B13R1.2872 Cc1ccc(F)cc1OC(C)C=O Amb30020630 [0,2,0,0,0,0|1,0,1]=4 4383 B13R1.2872 N\C(C=O)=C\c1cc(Cl)ccc1O Amb18034042 [0,2,0,0,0,0|1,0,0]=3 4384 B13R1.2872 O=C\C(Cl)=C/c1cc(Cl)ccc1O Amb27263035 [0,2,0,0,0,0|1,0,0]=3 4385 B13R1.2872 O=C\C(Cl)=C\c1cc(Cl)ccc1O Amb17143680 [0,2,0,0,0,0|1,0,0]=3 4386 B13R1.2874 CC(C=O)Oc1cc(Cl)cc(Br)c1 Amb35640767 [0,2,0,0,0,0|1,0,1]=4 4387 B13R1.2874 CC(C=O)Oc1cc(Cl)cc(Cl)c1 Amb30020782 [0,2,0,0,0,0|1,0,1]=4 4388 B13R1.2874 CC(C=O)Oc1cc(F)cc(Br)c1 Amb30020794 [0,2,0,0,0,0|1,0,1]=4 4389 B13R1.2874 CC(C=O)Oc1cc(F)cc(F)c1 Amb30020770 [0,2,0,0,0,0|1,0,1]=4 4390 B13R1.2874 CC(C=O)Sc1cc(Cl)cc(Cl)c1 Amb30020890 [0,2,0,0,0,0|1,0,1]=4 4391 B13R1.2874 CC1=CC(=O)OC(\C=C(/C)C=O)=C1 Amb18648107 [0,2,0,0,0,0|1,0,0]=3 4392 B13R1.2874 C\C(=C\c1cc(Br)cc(Br)c1)CO Amb27847864 [0,2,0,0,0,0|0,0,2]=4 4393 B13R1.2874 C\C(=C\c1cc(C)cc(Cl)c1)CBr Amb27232193 [0,2,0,0,0,0|1,0,1]=4 4394 B13R1.2874 C\C(=C\c1cc(C)cc(Cl)c1)CCl Amb27491414 [0,2,0,0,0,0|1,0,1]=4 4395 B13R1.2874 C\C(=C\c1cc(Cl)cc(Cl)c1)CBr Amb27260616 [0,2,0,0,0,0|1,0,1]=4 4396 B13R1.2874 C\C(=C\c1cc(Cl)cc(Cl)c1)CCl Amb27954951 [0,2,0,0,0,0|1,0,1]=4 4397 B13R1.2874 C\C(=C\c1cc(F)cc(Br)c1)CBr Amb28343283 [0,2,0,0,0,0|1,0,1]=4 4398 B13R1.2874 C\C(=C\c1cc(F)cc(Br)c1)CCl Amb28313344 [0,2,0,0,0,0|1,0,1]=4 4399 B13R1.2874 C\C(=C\c1cc(F)cc(F)c1)CN Amb27663742 [0,2,0,0,0,0|1,0,1]=4 4400 B13R1.2874 C\C(C=O)=C/c1cc(F)cc(F)c1 Amb27862356 [0,2,0,0,0,0|0,0,0]=2 4401 B13R1.2874 C\C(C=O)=C\c1cc(Br)cc(Br)c1 Amb27221144 [0,2,0,0,0,0|0,0,0]=2 4402 B13R1.2874 Cc1cc(C)cc(OC(C)C=O)c1 Amb30020622 [0,2,0,0,0,0|1,0,1]=4 4403 B13R1.335 CC\C(=C\c1ccccc1Br)CBr Amb27777727 [0,2,0,0,0,0|1,0,1]=4 4404 B13R1.335 CC\C(=C\c1ccccc1Br)CO Amb27240484 [0,2,0,0,0,0|0,0,2]=4 4405 B13R1.335 CC\C(=C\c1ccccc1C)CCl Amb27589224 [0,2,0,0,0,0|1,0,1]=4 4406 B13R1.335 CC\C(=C\c1ccccc1C)CN Amb28046163 [0,2,0,0,0,0|1,0,1]=4 4407 B13R1.335 CC\C(=C\c1ccccc1Cl)CO Amb27162012 [0,2,0,0,0,0|0,0,2]=4 4408 B13R1.335 CC\C(=C\c1ccccc1F)CN Amb28285499 [0,2,0,0,0,0|1,0,1]=4 4409 B13R1.335 CC\C(C=O)=C/c1ccccc1C Amb17334989 [0,2,0,0,0,0|0,0,0]=2 4410 B13R1.335 CC\C(C=O)=C/c1ccccc1Cl Amb17336897 [0,2,0,0,0,0|0,0,0]=2 4411 B13R1.335 CC\C(C=O)=C/c1ccccc1F Amb17335219 [0,2,0,0,0,0|0,0,0]=2 4412 B13R1.335 CC\C(C=O)=C/c1nccnc1C Amb35600876 [0,2,0,0,0,0|2,0,0]=4 4413 B13R1.335 CC\C(C=O)=C\c1ccccc1Br Amb27951163 [0,2,0,0,0,0|0,0,0]=2 4414 B13R1.335 CC\C(C=O)=C\c1ccccc1O Amb27841287 [0,2,0,0,0,0|0,0,0]=2 4415 B13R1.335 CC\C(C=O)=C\c1cnccc1C Amb27461851 [0,2,0,0,0,0|1,0,0]=3 4416 B13R1.335 C\C=C(/C=O)Cc1ccccc1C Amb27640726 [0,2,0,0,0,0|0,0,1]=3 4417 B13R1.335 Cc1ccccc1C=C(C=O)C=O Amb27390174 [0,2,0,0,0,0|0,0,1]=3 4418 B13R1.335 Cc1ccccc1\C=C(/C#N)C=O Amb27776899 [0,2,0,0,0,0|0,0,1]=3 4419 B13R1.335 Cc1ccccc1\C=C(/C#N)CO Amb28188257 [0,2,0,0,0,0|1,0,1]=4 4420 B13R1.335 N#C\C(=C\c1ccccc1Cl)CN Amb28119878 [0,2,0,0,0,0|1,0,1]=4 4421 B13R1.335 O=CC(C=O)=Cc1ccccc1O Amb18127566 [0,2,0,0,0,0|0,0,1]=3 4422 B13R1.3080 CCC(C)(C=O)Cc1ccccc1 Amb33504024 [0,2,0,0,0,0|0,0,2]=4 4423 B13R1.275 CC(C)(C=O)Cc1ccccc1Br Amb26327952 [0,2,0,0,0,0|0,0,2]=4 4424 B13R1.275 CC(C)(C=O)Cc1ccccc1Cl Amb25896227 [0,2,0,0,0,0|0,0,2]=4 4425 B13R1.275 CC(C)(C=O)Cc1ccccc1F Amb25952525 [0,2,0,0,0,0|0,0,2]=4 4426 B13R1.275 CC(C)(C=O)Oc1ccccc1I Amb27213383 [0,2,0,0,0,0|1,0,1]=4 4427 B13R1.275 CC(O)(C=O)Cc1ccccc1Br Amb27229881 [0,2,0,0,0,0|0,0,2]=4 4428 B13R1.275 CC(O)(C=O)Cc1ccccc1F Amb27754614 [0,2,0,0,0,0|0,0,2]=4 4429 B13R1.275 Cc1ccccc1CC(C)(C)C=O Amb27492818 [0,2,0,0,0,0|0,0,2]=4 4430 B13R1.275 Cc1ccccc1OC(C)(C)C=O Amb27772112 [0,2,0,0,0,0|1,0,1]=4 4431 B13R1.91 C#Cc1ccccc1CC(C)C=O Amb28366731 [0,2,0,0,0,0|0,0,2]=4 4432 B13R1.91 CC(C=O)Cc1ccccc1C#N Amb25324791 [0,2,0,0,0,0|0,0,2]=4 4433 B13R1.91 CC(C=O)Oc1ccccc1C#N Amb30020618 [0,2,0,0,0,0|1,0,1]=4 4434 B13R1.91 CCc1ccccc1\C=C(\C)CCl Amb28385348 [0,2,0,0,0,0|1,0,1]=4 4435 B13R1.91 COc1ccccc1SC(C)C=O Amb32682550 [0,2,0,0,0,0|1,0,1]=4 4436 B13R1.91 COc1ccccc1\C=C(/C)C=O Amb17335111 [0,2,0,0,0,0|0,0,0]=2 4437 B13R1.91 COc1ccccc1\C=C(\F)C=O Amb28248169 [0,2,0,0,0,0|1,0,0]=3 4438 B13R1.91 C\C(=C\c1ccccc1C#N)CCl Amb27258777 [0,2,0,0,0,0|1,0,1]=4 4439 B13R1.4928 CC(C=O)Cc1c(F)cccc1Cl Amb28073854 [0,2,0,0,0,0|0,0,2]=4 4440 B13R1.4928 C\C(=C\c1c(C)cccc1C)CN Amb27829185 [0,2,0,0,0,0|1,0,1]=4 4441 B13R1.4928 C\C(=C\c1c(Cl)cccc1Cl)CCl Amb27836285 [0,2,0,0,0,0|1,0,1]=4 4442 B13R1.4928 C\C(=C\c1c(F)cccc1Br)CN Amb28458659 [0,2,0,0,0,0|1,0,1]=4 4443 B13R1.4928 C\C(C=O)=C/c1c(F)cccc1Cl Amb17337353 [0,2,0,0,0,0|0,0,0]=2 4444 B13R1.4928 C\C(C=O)=C\c1c(Cl)cccc1Cl Amb28342778 [0,2,0,0,0,0|0,0,0]=2 4445 B13R1.4928 C\C=C(\C)Nc1c(C)cccc1C Amb27652866 [0,2,0,0,0,0|2,0,0]=4 4446 B13R1.4928 Cc1cccc(C)c1OC(C)C=O Amb27587268 [0,2,0,0,0,0|1,0,1]=4 4447 B11R1.8 C=Cc1cc(C)cc(C)c1O Amb17593696 [0,0,1,1,0,0|0,0,2]=4 4448 B11R1.8 CC1=CC(=O)C=C(C=O)C1=O Amb27774868 [0,0,1,1,0,0|2,0,0]=4 4449 B11R1.9 C=Cc1cc(F)cc(C=O)c1 Amb32682058 [0,0,1,1,0,0|1,0,1]=4 4450 B11R1.494 CC1=CC=C(C)C(=O)C(C)=C1 Amb28182529 [0,0,1,1,0,0|0,0,2]=4 4451 B11R1.14 C=C1C=C(C=O)C=C(C)C1=O Amb25806184 [0,0,1,1,0,0|1,0,0]=3 4452 B11R1.14 C=Cc1cc(C)c(Br)c(C)c1 Amb33333384 [0,0,1,1,0,0|1,0,1]=4 4453 B11R1.14 C=Cc1cc(C)c(O)c(C)c1 Amb18124930 [0,0,1,1,0,0|0,0,2]=4 4454 B11R1.37 C=Cc1cc(C)ccc1C=O Amb26925052 [0,0,1,1,0,0|2,0,0]=4 4455 B11R1.189 C=CCc1cccc(C=O)c1 Amb25066956 [0,0,1,1,0,0|0,0,2]=4 4456 B11R1.192 C=CCc1ccc(C)c(C)c1 Amb6299317 [0,0,1,1,0,0|1,0,1]=4 4457 B11R1.192 C=CCc1ccc(Cl)c(C)c1 Amb2686233 [0,0,1,1,0,0|1,0,1]=4 4458 B11R1.192 C=CCc1ccc(F)c(C)c1 Amb2688228 [0,0,1,1,0,0|1,0,1]=4 4459 B11R1.192 C\C=C\c1ccc(C)c(C)c1 Amb26577177 [0,0,1,1,0,0|1,0,1]=4 4460 B11R1.192 Cc1cc(\C=C\Br)ccc1F Amb33135022 [0,0,1,1,0,0|2,0,0]=4 4461 B11R1.192 Cc1ccc(\C=C\Br)cc1C Amb33134903 [0,0,1,1,0,0|2,0,0]=4 4462 B11R1.192 Cc1ccc(\C=C\Cl)cc1C Amb27433922 [0,0,1,1,0,0|2,0,0]=4 4463 B11R1.383 C=CC1=CC=CC=C(C=O)C1 Amb24509238 [0,0,1,1,0,0|0,0,2]=4 4464 B11R1.941 C=Cc1cc(C=O)oc1C=O Amb27655619 [0,0,1,1,0,0|2,0,0]=4 4465 B11R1.13 C=CCN1C=CC=C(C)C1=O Amb18405637 [0,0,1,1,0,0|1,0,1]=4 4466 B11R1.13 C=CCc1cccc(C)c1C Amb6299293 [0,0,1,1,0,0|1,0,1]=4 4467 B11R1.13 C=COc1cccc(C)c1F Amb27866891 [0,0,1,1,0,0|2,0,0]=4 4468 B11R1.13 Cc1cccc(\C=C\Br)c1C Amb33134901 [0,0,1,1,0,0|2,0,0]=4 4469 B11R1.13 Cc1cccc(\C=C\Br)c1F Amb33135094 [0,0,1,1,0,0|2,0,0]=4 4470 B11R1.13 Cc1cccc(\C=C\Br)c1O Amb33135050 [0,0,1,1,0,0|1,0,1]=4 4471 B11R1.25 C[C@@H](C=O)\C=C\c1ccco1 Amb27854650 [0,0,1,1,0,0|1,0,1]=4 4472 B11R1.25 O=CC(=O)\C=C\c1ccco1 Amb26331989 [0,0,1,1,0,0|2,0,0]=4 4473 B11R1.229 C=C\C=C/C=C/[C@@H]1C[C@@H]1C=O Amb24766800 [0,0,1,1,0,0|0,0,2]=4 4474 B11R2.1 BrC1=CCc2ccccc21 Amb26318514 [1,0,0,1,0,0|1,0,1]=4 4475 B11R2.1 Brc1ccc2ccccn12 Amb18061677 [1,0,0,1,0,0|2,0,0]=4 4476 B11R2.1 Brc1coc2ccccc12 Amb6344810 [1,0,0,1,0,0|2,0,0]=4 4477 B11R2.1 Brc1csc2ccccc12 Amb2720075 [1,0,0,1,0,0|2,0,0]=4 4478 B11R2.1 CC1=CCc2ccccc21 Amb17778909 [1,0,0,1,0,0|1,0,1]=4 4479 B11R2.1 CC1C=Cc2ccccc21 Amb17844052 [1,0,0,1,0,0|1,0,1]=4 4480 B11R2.1 Cc1ccc2ccccn12 Amb28126713 [1,0,0,1,0,0|2,0,0]=4 4481 B11R2.1 Cc1coc2ccccc12 Amb2684177 [1,0,0,1,0,0|2,0,0]=4 4482 B11R2.1 Cc1csc2ccccc12 Amb2689330 [1,0,0,1,0,0|2,0,0]=4 4483 B11R2.1 Clc1ccc2ccccn12 Amb27618437 [1,0,0,1,0,0|2,0,0]=4 4484 B11R2.1 Clc1coc2ccccc12 Amb21963868 [1,0,0,1,0,0|2,0,0]=4 4485 B11R2.1 Clc1csc2ccccc12 Amb5494165 [1,0,0,1,0,0|2,0,0]=4 4486 B11R2.1 Cln1ccc2ccccc21 Amb28050191 [1,0,0,1,0,0|2,0,0]=4 4487 B11R2.1 Cn1ccc2ccccc21 Amb6297777 [1,0,0,1,0,0|2,0,0]=4 4488 B11R2.1 Fc1csc2ccccc12 Amb27667159 [1,0,0,1,0,0|2,0,0]=4 4489 B11R2.1 Ic1coc2ccccc12 Amb24622374 [1,0,0,1,0,0|2,0,0]=4 4490 B11R2.1 Ic1csc2ccccc12 Amb22002561 [1,0,0,1,0,0|2,0,0]=4 4491 B11R2.1 NC1C=Cc2ccccc21 Amb17470367 [1,0,0,1,0,0|1,0,1]=4 4492 B11R2.1 Nc1ccc2ccccn12 Amb18061678 [1,0,0,1,0,0|2,0,0]=4 4493 B11R2.1 Nc1ccn2ccccc12 Amb28119363 [1,0,0,1,0,0|2,0,0]=4 4494 B11R2.1 Nc1coc2ccccc12 Amb24371464 [1,0,0,1,0,0|2,0,0]=4 4495 B11R2.1 Nc1csc2ccccc12 Amb13890519 [1,0,0,1,0,0|2,0,0]=4 4496 B11R2.1 Nc1csc2ccccc12 Amb19957699 [1,0,0,1,0,0|2,0,0]=4 4497 B11R2.1 Nn1ccc2ccccc21 Amb16233739 [1,0,0,1,0,0|2,0,0]=4 4498 B11R2.1 O=C1C=Cc2ccccc21 Amb10603436 [1,0,0,1,0,0|0,0,0]=2 4499 B11R2.1 O=C1CCc2ccccc21 Amb6458950 [1,0,0,1,0,0|0,0,2]=4 4500 B11R2.1 O=C1CNc2ccccc21 Amb17593399 [1,0,0,1,0,0|1,0,1]=4 4501 B11R2.1 O=C1COc2ccccc21 Amb33534383 [1,0,0,1,0,0|1,0,1]=4 4502 B11R2.1 O=C1CSc2ccccc21 Amb4062421 [1,0,0,1,0,0|1,0,1]=4 4503 B11R2.1 O=C1N=Cc2ccccc21 Amb25265062 [1,0,0,1,0,0|1,0,0]=3 4504 B11R2.1 O=C1N=Cc2ccncc21 Amb28252569 [1,0,0,1,0,0|2,0,0]=4 4505 B11R2.1 O=C1NC=C2C=CC=CN12 Amb26008108 [1,0,0,1,0,0|2,0,0]=4 4506 B11R2.1 O=C1NCc2ccccc21 Amb773532 [1,0,0,1,0,0|1,0,1]=4 4507 B11R2.1 O=C1NNc2ccccc21 Amb19514505 [1,0,0,1,0,0|2,0,0]=4 4508 B11R2.1 O=C1NSc2ccccc21 Amb17933279 [1,0,0,1,0,0|2,0,0]=4 4509 B11R2.1 O=C1OCc2ccccc21 Amb2610613 [1,0,0,1,0,0|1,0,1]=4 4510 B11R2.1 O=C1ONc2ccccc21 Amb26994489 [1,0,0,1,0,0|2,0,0]=4 4511 B11R2.1 O=C1SCc2ccccc21 Amb2421358 [1,0,0,1,0,0|1,0,1]=4 4512 B11R2.1 O=C1SNc2ccccc21 Amb19416440 [1,0,0,1,0,0|2,0,0]=4 4513 B11R2.1 O=s1ccc2ccccc21 Amb24078341 [1,0,0,1,0,0|1,0,0]=3 4514 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [1,0,0,1,0,0|0,0,2]=4 4515 B11R2.1 Oc1coc2ccccc12 Amb24097480 [1,0,0,1,0,0|1,0,1]=4 4516 B11R2.1 Oc1csc2ccccc12 Amb4009443 [1,0,0,1,0,0|1,0,1]=4 4517 B11R2.1 On1ccc2ccccc21 Amb27243885 [1,0,0,1,0,0|1,0,1]=4 4518 B11R2.1 Sc1coc2ccccc12 Amb24061893 [1,0,0,1,0,0|1,1,0]=4 4519 B11R2.1 Sc1csc2ccccc12 Amb24396652 [1,0,0,1,0,0|1,1,0]=4 4520 B11R2.4 CC1=C(c2ccccc2)N1 Amb28194853 [1,0,0,1,0,0|2,0,0]=4 4521 B11R2.20 C1=CCc2ccccc2C1 Amb8392372 [1,0,0,1,0,0|1,0,1]=4 4522 B11R2.20 C1=COc2ccccc2N1 Amb27828258 [1,0,0,1,0,0|1,0,1]=4 4523 B11R2.20 C1=Cc2ccccc2CC1 Amb1162229 [1,0,0,1,0,0|1,0,1]=4 4524 B11R2.20 C1=Cc2ccccc2CN1 Amb25999205 [1,0,0,1,0,0|2,0,0]=4 4525 B11R2.20 C1=Cc2ccccc2CO1 Amb27473263 [1,0,0,1,0,0|2,0,0]=4 4526 B11R2.20 C1=Cc2ccccc2NC1 Amb17593383 [1,0,0,1,0,0|1,0,1]=4 4527 B11R2.20 C1=Cc2ccccc2OC1 Amb17844055 [1,0,0,1,0,0|0,0,2]=4 4528 B11R2.20 C1=Cc2ccccc2SC1 Amb27494059 [1,0,0,1,0,0|0,1,1]=4 4529 B11R2.20 c1cc[n+]2cccnc2c1 Amb2603162 [1,0,0,1,0,0|2,0,0]=4 4530 B11R2.20 c1ccc2[nH+]cccc2c1 Amb10839799 [1,0,0,1,0,0|1,0,0]=3 4531 B11R2.20 c1ccc2ccccc2c1 Amb6608803 [1,0,0,1,0,0|1,0,0]=3 4532 B11R2.20 c1ccc2cnccc2c1 Amb2609970 [1,0,0,1,0,0|2,0,0]=4 4533 B11R2.20 c1ccc2ncccc2c1 Amb22002632 [1,0,0,1,0,0|1,0,0]=3 4534 B11R2.20 c1ccc2ncccc2c1 Amb2610545 [1,0,0,1,0,0|1,0,0]=3 4535 B11R2.20 c1ccc2nccnc2c1 Amb2099438 [1,0,0,1,0,0|2,0,0]=4 4536 B11R2.20 c1ccc2ncncc2c1 Amb2609962 [1,0,0,1,0,0|2,0,0]=4 4537 B11R2.20 c1ccc2nnccc2c1 Amb21858429 [1,0,0,1,0,0|2,0,0]=4 4538 B11R2.20 c1ccc2nnccc2c1 Amb22001549 [1,0,0,1,0,0|2,0,0]=4 4539 B11R2.20 c1cnc2cccnc2c1 Amb1106274 [1,0,0,1,0,0|2,0,0]=4 4540 B11R2.20 c1cnc2ccncc2c1 Amb6565155 [1,0,0,1,0,0|2,0,0]=4 4541 B11R2.20 c1cnc2cnccc2c1 Amb4560929 [1,0,0,1,0,0|2,0,0]=4 4542 B11R2.20 c1cnc2ncccc2c1 Amb15692873 [1,0,0,1,0,0|2,0,0]=4 4543 B11R2.238 C(=C1CC1)c2ccccc2 Amb19515480 [1,0,0,1,0,0|1,0,1]=4 4544 B11R2.238 C1=C(Cc2ccccc2)C1 Amb27421346 [1,0,0,1,0,0|1,0,1]=4 4545 B11R2.988 CCC1=Cc2ccccc21 Amb27641412 [1,0,0,1,0,0|1,0,1]=4 4546 B11R2.988 COC1=Cc2ccccc21 Amb27267205 [1,0,0,1,0,0|2,0,0]=4 4547 B11R2.988 N#CC1=Cc2ccccc21 Amb22227852 [1,0,0,1,0,0|1,0,1]=4 4548 B11R2.988 O=CC1Cc2ccccc21 Amb16230472 [1,0,0,1,0,0|0,0,2]=4 4549 B11R2.10 BrC1=Cc2ccccc2C1 Amb8517387 [1,0,0,1,0,0|1,0,0]=3 4550 B11R2.10 BrC1=Nc2ccccc2C1 Amb27877570 [1,0,0,1,0,0|2,0,0]=4 4551 B11R2.10 Brc1cc2ccccc2o1 Amb2723106 [1,0,0,1,0,0|1,0,1]=4 4552 B11R2.10 Brc1cc2ccccc2s1 Amb2723178 [1,0,0,1,0,0|1,1,0]=4 4553 B11R2.10 Brc1cc2ccccn2c1 Amb27591844 [1,0,0,1,0,0|2,0,0]=4 4554 B11R2.10 CC1=Cc2ccccc2C1 Amb15692403 [1,0,0,1,0,0|0,0,1]=3 4555 B11R2.10 Cc1[nH+]c2ccccc2s1 Amb2243865 [1,0,0,1,0,0|1,1,0]=4 4556 B11R2.10 Cc1cc2ccccc2o1 Amb20621560 [1,0,0,1,0,0|0,0,1]=3 4557 B11R2.10 Cc1cc2ccccc2s1 Amb2237023 [1,0,0,1,0,0|0,1,0]=3 4558 B11R2.10 Cc1cc2ccccn2c1 Amb22264777 [1,0,0,1,0,0|1,0,0]=3 4559 B11R2.10 Cc1cc2cccnc2o1 Amb25299352 [1,0,0,1,0,0|1,0,1]=4 4560 B11R2.10 Cc1cc2cnccc2o1 Amb23590993 [1,0,0,1,0,0|1,0,1]=4 4561 B11R2.10 Cc1cn2ccccc2n1 Amb3348237 [1,0,0,1,0,0|2,0,0]=4 4562 B11R2.10 Cc1nc2ccccc2o1 Amb2599323 [1,0,0,1,0,0|1,0,1]=4 4563 B11R2.10 Cc1nc2ccccc2s1 Amb24084608 [1,0,0,1,0,0|1,1,0]=4 4564 B11R2.10 Cc1nc2ccccc2s1 Amb8056358 [1,0,0,1,0,0|1,1,0]=4 4565 B11R2.10 ClC1=Cc2ccccc2C1 Amb22752069 [1,0,0,1,0,0|1,0,0]=3 4566 B11R2.10 Clc1cc2ccccc2o1 Amb24104234 [1,0,0,1,0,0|1,0,1]=4 4567 B11R2.10 Clc1cc2ccccn2c1 Amb27209850 [1,0,0,1,0,0|2,0,0]=4 4568 B11R2.10 Cn1cc2ccccc2c1 Amb28313764 [1,0,0,1,0,0|1,0,0]=3 4569 B11R2.10 Cn1cc2ccccc2n1 Amb2609633 [1,0,0,1,0,0|2,0,0]=4 4570 B11R2.10 Ic1cc2ccccc2o1 Amb24482100 [1,0,0,1,0,0|1,0,1]=4 4571 B11R2.10 Ic1cc2ccccc2s1 Amb22896395 [1,0,0,1,0,0|1,1,0]=4 4572 B11R2.10 N=C1Cc2ccccc2N1 Amb26636218 [1,0,0,1,0,0|2,0,0]=4 4573 B11R2.10 N=C1Cc2ccccc2N1 Amb32661573 [1,0,0,1,0,0|2,0,0]=4 4574 B11R2.10 N=C1Cc2ccccc2S1 Amb28135700 [1,0,0,1,0,0|2,0,0]=4 4575 B11R2.10 Nc1cc2ccccc2s1 Amb17593717 [1,0,0,1,0,0|1,1,0]=4 4576 B11R2.10 O=C1C=C2C=CC=CC2=N1 Amb24620213 [1,0,0,1,0,0|1,0,0]=3 4577 B11R2.10 O=C1C=C2C=CC=CN2C1 Amb28126717 [1,0,0,1,0,0|1,0,0]=3 4578 B11R2.10 O=C1C=C2C=CC=CN2N1 Amb21858515 [1,0,0,1,0,0|2,0,0]=4 4579 B11R2.10 O=C1C=C2C=COC=C2O1 Amb19132425 [1,0,0,1,0,0|2,0,0]=4 4580 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17679305 [1,0,0,1,0,0|2,0,0]=4 4581 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17680921 [1,0,0,1,0,0|2,0,0]=4 4582 B11R2.10 O=C1CN2C=CC=CC2=N1 Amb17731514 [1,0,0,1,0,0|2,0,0]=4 4583 B11R2.10 O=C1CN2C=CC=CC2=[NH+]1 Amb17846513 [1,0,0,1,0,0|2,0,0]=4 4584 B11R2.10 O=C1Cc2ccccc2C1 Amb1227714 [1,0,0,1,0,0|0,0,1]=3 4585 B11R2.10 O=C1Cc2ccccc2N1 Amb1351379 [1,0,0,1,0,0|1,0,0]=3 4586 B11R2.10 O=C1Cc2ccccc2O1 Amb2781615 [1,0,0,1,0,0|1,0,0]=3 4587 B11R2.10 O=C1Cc2cccnc2N1 Amb22405864 [1,0,0,1,0,0|2,0,0]=4 4588 B11R2.10 O=C1Cc2cccnc2N1 Amb6307171 [1,0,0,1,0,0|2,0,0]=4 4589 B11R2.10 O=C1Cc2ccncc2N1 Amb19929479 [1,0,0,1,0,0|2,0,0]=4 4590 B11R2.10 O=C1Cc2ccncc2N1 Amb21964304 [1,0,0,1,0,0|2,0,0]=4 4591 B11R2.10 O=C1Cc2cnccc2N1 Amb8630016 [1,0,0,1,0,0|2,0,0]=4 4592 B11R2.10 O=C1Cc2ncccc2N1 Amb6307736 [1,0,0,1,0,0|2,0,0]=4 4593 B11R2.10 O=C1Nc2ccccc2N1 Amb18375774 [1,0,0,1,0,0|2,0,0]=4 4594 B11R2.10 O=C1Nc2ccccc2O1 Amb18043097 [1,0,0,1,0,0|2,0,0]=4 4595 B11R2.10 O=C1Nc2ccccc2S1 Amb17933260 [1,0,0,1,0,0|2,0,0]=4 4596 B11R2.10 O=C1Oc2ccccc2O1 Amb19514273 [1,0,0,1,0,0|2,0,0]=4 4597 B11R2.10 Oc1cc2ccccc2s1 Amb24518934 [1,0,0,1,0,0|1,0,1]=4 4598 B11R2.10 Oc1cc2ccccn2c1 Amb27841533 [1,0,0,1,0,0|2,0,0]=4 4599 B11R2.10 S=C1Cc2ccccc2N1 Amb1153150 [1,0,0,1,0,0|1,1,0]=4 4600 B11R2.10 Sc1cc2ccccc2s1 Amb24105482 [1,0,0,1,0,0|1,1,0]=4 4601 B11R2.54 CC1C(=O)c2ccccc21 Amb27602983 [0,0,0,1,1,0|0,0,1]=3 4602 B11R2.54 O=C1C(=O)c2ccccc21 Amb18048412 [0,0,0,1,1,0|1,0,0]=3 4603 B11R2.54 O=C1c2ccccc2C1Cl Amb21948336 [0,0,0,1,1,0|1,0,1]=4 4604 B11R2.54 O=C1c2ccccc2C1O Amb27164695 [0,0,0,1,1,0|1,0,1]=4 4605 B11R2.8 CC1=Nc2sccc2C1=O Amb5721189 [0,0,0,1,1,0|2,0,0]=4 4606 B11R2.15 O=Cc1cc2ccnc2n1 Amb27488076 [0,0,0,1,1,0|2,0,0]=4 4607 B11R2.15 O=Cc1cc2ccsc2o1 Amb27839409 [0,0,0,1,1,0|2,0,0]=4 4608 B11R2.15 O=Cc1cc2ccsc2s1 Amb4140122 [0,0,0,1,1,0|2,0,0]=4 4609 B11R2.15 O=Cc1cc2cscc2s1 Amb24722245 [0,0,0,1,1,0|2,0,0]=4 4610 B11R2.15 O=Cc1cc2sccc2s1 Amb2611536 [0,0,0,1,1,0|2,0,0]=4 4611 B11R2.36 Cc1ccc2c(c1)C=CC2 Amb24062964 [0,0,0,1,1,0|1,0,1]=4 4612 B11R2.36 Cc1ccc2c(c1)CC=C2 Amb28204212 [0,0,0,1,1,0|1,0,1]=4 4613 B11R2.36 Cc1ccc2cccn2c1 Amb22490217 [0,0,0,1,1,0|2,0,0]=4 4614 B11R2.36 Cc1ccc2ccoc2c1 Amb22039412 [0,0,0,1,1,0|2,0,0]=4 4615 B11R2.36 Cc1ccc2ccsc2c1 Amb10603775 [0,0,0,1,1,0|2,0,0]=4 4616 B11R2.36 Cc1ccc2occc2c1 Amb22751743 [0,0,0,1,1,0|2,0,0]=4 4617 B11R2.36 Cc1ccc2sccc2c1 Amb2689331 [0,0,0,1,1,0|2,0,0]=4 4618 B11R2.36 Cc1ccn2cccc2c1 Amb24670240 [0,0,0,1,1,0|2,0,0]=4 4619 B11R2.36 Cc1cnc2ccoc2c1 Amb27478517 [0,0,0,1,1,0|2,0,0]=4 4620 B11R2.36 Cc1cnc2ccsc2c1 Amb28342766 [0,0,0,1,1,0|2,0,0]=4 4621 B11R2.36 Cc1cnc2occc2c1 Amb23403003 [0,0,0,1,1,0|2,0,0]=4 4622 B13R2.10 Brc1ccc(-c2ccccc2)o1 Amb10600634 [0,0,0,1,0,1|2,0,0]=4 4623 B13R2.10 Brc1ccc(-c2ccccc2)s1 Amb2723158 [0,0,0,1,0,1|2,0,0]=4 4624 B13R2.10 Brc1cnc(-c2ccccc2)o1 Amb21864613 [0,0,0,1,0,1|2,0,0]=4 4625 B13R2.10 Brc1cnc(-c2ccccc2)s1 Amb10600205 [0,0,0,1,0,1|2,0,0]=4 4626 B13R2.10 Brc1cnn(-c2ccccc2)c1 Amb1775775 [0,0,0,1,0,1|2,0,0]=4 4627 B13R2.10 Brc1coc(-c2ccccc2)n1 Amb22235329 [0,0,0,1,0,1|1,0,1]=4 4628 B13R2.10 Brc1csc(-c2ccccc2)n1 Amb10599940 [0,0,0,1,0,1|1,1,0]=4 4629 B13R2.10 CC1=CCP(c2ccccc2)C1 Amb22734694 [0,0,0,1,0,1|1,0,1]=4 4630 B13R2.10 CC1=NN(c2ccccc2)P=C1 Amb4297480 [0,0,0,1,0,1|2,0,0]=4 4631 B13R2.10 Cc1cc(-c2ccccc2)no1 Amb10553849 [0,0,0,1,0,1|2,0,0]=4 4632 B13R2.10 Cc1cc(-c2ccccc2)on1 Amb1893875 [0,0,0,1,0,1|1,0,1]=4 4633 B13R2.10 Cc1cc(-c2ccccc2)sn1 Amb24410959 [0,0,0,1,0,1|1,1,0]=4 4634 B13R2.10 Cc1ccc(-c2ccccn2)s1 Amb25149792 [0,0,0,1,0,1|2,0,0]=4 4635 B13R2.10 Cc1ccc(-c2cccnc2)o1 Amb28044106 [0,0,0,1,0,1|2,0,0]=4 4636 B13R2.10 Cc1ccn(-c2ccccc2)n1 Amb1834349 [0,0,0,1,0,1|2,0,0]=4 4637 B13R2.10 Cc1cnc(-c2ccccc2)s1 Amb24674111 [0,0,0,1,0,1|1,0,0]=3 4638 B13R2.10 Cc1cnc(-c2cccnc2)o1 Amb28292404 [0,0,0,1,0,1|2,0,0]=4 4639 B13R2.10 Cc1cnc(-c2ccncc2)s1 Amb28315385 [0,0,0,1,0,1|2,0,0]=4 4640 B13R2.10 Cc1cnn(-c2ccccc2)c1 Amb10553844 [0,0,0,1,0,1|1,0,0]=3 4641 B13R2.10 Cc1cnn(-c2ccncc2)c1 Amb20628163 [0,0,0,1,0,1|2,0,0]=4 4642 B13R2.10 Cc1coc(-c2ccccc2)n1 Amb7990046 [0,0,0,1,0,1|0,0,1]=3 4643 B13R2.10 Cc1coc(-c2ccccn2)n1 Amb24436519 [0,0,0,1,0,1|1,0,1]=4 4644 B13R2.10 Cc1csc(-c2ccccc2)c1 Amb2778539 [0,0,0,1,0,1|0,1,0]=3 4645 B13R2.10 Cc1csc(-c2ccccc2)n1 Amb6357520 [0,0,0,1,0,1|0,1,0]=3 4646 B13R2.10 Cc1csc(-c2ccccn2)n1 Amb10083548 [0,0,0,1,0,1|1,1,0]=4 4647 B13R2.10 Cc1csc(-c2cccnc2)n1 Amb9808865 [0,0,0,1,0,1|1,1,0]=4 4648 B13R2.10 Cc1csc(-c2ccncc2)n1 Amb18494699 [0,0,0,1,0,1|1,1,0]=4 4649 B13R2.10 Cc1nc(-c2ccccc2)co1 Amb17400054 [0,0,0,1,0,1|2,0,0]=4 4650 B13R2.10 Cc1nc(-c2ccccc2)cs1 Amb6367662 [0,0,0,1,0,1|2,0,0]=4 4651 B13R2.10 Cc1nc(-c2ccccc2)no1 Amb2766523 [0,0,0,1,0,1|2,0,0]=4 4652 B13R2.10 Cc1ncc(-c2ccccc2)o1 Amb4139870 [0,0,0,1,0,1|2,0,0]=4 4653 B13R2.10 Cc1nnc(-c2ccccc2)s1 Amb3550068 [0,0,0,1,0,1|2,0,0]=4 4654 B13R2.10 Cc1noc(-c2ccccc2)n1 Amb2610736 [0,0,0,1,0,1|1,0,1]=4 4655 B13R2.10 Clc1ccc(-c2ccccc2)s1 Amb27643261 [0,0,0,1,0,1|2,0,0]=4 4656 B13R2.10 Clc1cnc(-c2ccccc2)s1 Amb4165851 [0,0,0,1,0,1|2,0,0]=4 4657 B13R2.10 Clc1coc(-c2ccccc2)c1 Amb28401506 [0,0,0,1,0,1|1,0,1]=4 4658 B13R2.10 Cn1ccc(-c2ccccc2)c1 Amb27441036 [0,0,0,1,0,1|2,0,0]=4 4659 B13R2.10 Cn1ccc(-c2ccccc2)n1 Amb1777540 [0,0,0,1,0,1|2,0,0]=4 4660 B13R2.10 Cn1cnc(-c2ccccc2)c1 Amb2384409 [0,0,0,1,0,1|2,0,0]=4 4661 B13R2.10 Fc1ccc(-c2ccccc2)s1 Amb2611434 [0,0,0,1,0,1|2,0,0]=4 4662 B13R2.10 Fc1ccn(-c2ccccc2)c1 Amb25152299 [0,0,0,1,0,1|2,0,0]=4 4663 B13R2.10 Fc1cnc(-c2ccccc2)o1 Amb25083271 [0,0,0,1,0,1|2,0,0]=4 4664 B13R2.10 Fc1cnn(-c2ccccc2)c1 Amb23400563 [0,0,0,1,0,1|2,0,0]=4 4665 B13R2.10 Ic1ccc(-c2ccccc2)s1 Amb22482828 [0,0,0,1,0,1|2,0,0]=4 4666 B13R2.10 Ic1cnc(-c2ccccc2)s1 Amb22448167 [0,0,0,1,0,1|2,0,0]=4 4667 B13R2.10 Ic1cnn(-c2ccccc2)c1 Amb20241761 [0,0,0,1,0,1|2,0,0]=4 4668 B13R2.10 Nc1ccc(-c2ccccc2)o1 Amb10600635 [0,0,0,1,0,1|2,0,0]=4 4669 B13R2.10 Nc1ccc(-c2ccccc2)s1 Amb10600633 [0,0,0,1,0,1|2,0,0]=4 4670 B13R2.10 Nc1ccn(-c2ccccc2)c1 Amb26464063 [0,0,0,1,0,1|2,0,0]=4 4671 B13R2.10 Nc1cnc(-c2ccccc2)o1 Amb18563482 [0,0,0,1,0,1|2,0,0]=4 4672 B13R2.10 Nc1cnc(-c2ccccc2)s1 Amb10600206 [0,0,0,1,0,1|2,0,0]=4 4673 B13R2.10 Nc1cnn(-c2ccccc2)c1 Amb22280421 [0,0,0,1,0,1|2,0,0]=4 4674 B13R2.10 Nc1cnn(-c2ccccc2)c1 Amb33528643 [0,0,0,1,0,1|2,0,0]=4 4675 B13R2.10 Nc1coc(-c2ccccc2)n1 Amb28126972 [0,0,0,1,0,1|1,0,1]=4 4676 B13R2.10 Nc1csc(-c2ccccc2)n1 Amb10599942 [0,0,0,1,0,1|1,1,0]=4 4677 B13R2.10 Nc1csc(-c2ccccc2)n1 Amb32664885 [0,0,0,1,0,1|1,1,0]=4 4678 B13R2.10 Oc1ccc(-c2ccccc2)s1 Amb20617905 [0,0,0,1,0,1|2,0,0]=4 4679 B13R2.10 Oc1cnc(-c2ccccc2)s1 Amb10600207 [0,0,0,1,0,1|2,0,0]=4 4680 B13R2.10 Oc1cnn(-c2ccccc2)c1 Amb8503688 [0,0,0,1,0,1|2,0,0]=4 4681 B13R2.10 Oc1csc(-c2ccccc2)n1 Amb2608744 [0,0,0,1,0,1|1,1,0]=4 4682 B13R2.10 Sc1ccc(-c2ccccc2)s1 Amb33175558 [0,0,0,1,0,1|2,0,0]=4 4683 B13R2.10 Sc1cnn(-c2ccccc2)c1 Amb8834018 [0,0,0,1,0,1|2,0,0]=4 4684 B13R2.32 Brc1c(I)cnc2ccccc12 Amb26908959 [0,0,0,1,0,1|2,0,0]=4 4685 B13R2.32 Brc1ccc2ccccc2c1I Amb24594397 [0,0,0,1,0,1|2,0,0]=4 4686 B13R2.32 Brc1ncc2ccccc2c1Br Amb2609660 [0,0,0,1,0,1|2,0,0]=4 4687 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [0,0,0,1,0,1|2,0,0]=4 4688 B13R2.32 C=C1CCc2ccccc2C1=O Amb18561613 [0,0,0,1,0,1|0,0,2]=4 4689 B13R2.32 C=C1COc2ccccc2C1=O Amb18063792 [0,0,0,1,0,1|0,0,2]=4 4690 B13R2.32 CC1=C(C)c2ccccc2CC1 Amb31292547 [0,0,0,1,0,1|1,0,1]=4 4691 B13R2.32 CC1=C(C)c2ccccc2CN1 Amb27392086 [0,0,0,1,0,1|1,0,1]=4 4692 B13R2.32 CC1=C2C=CC=CC2=CNC1=O Amb27857230 [0,0,0,1,0,1|2,0,0]=4 4693 B13R2.32 CC1=CN=C2C=CC=CN2C1=O Amb20661993 [0,0,0,1,0,1|1,0,0]=3 4694 B13R2.32 CC1=CNc2ccccc2C1=O Amb21811680 [0,0,0,1,0,1|0,0,0]=2 4695 B13R2.32 CC1=COc2ccccc2C1=O Amb18048475 [0,0,0,1,0,1|0,0,0]=2 4696 B13R2.32 CC1=CSc2ccccc2C1=O Amb27154899 [0,0,0,1,0,1|0,0,0]=2 4697 B13R2.32 CC1=NN=C2C=CC=CN2C1=O Amb19268370 [0,0,0,1,0,1|2,0,0]=4 4698 B13R2.32 CC1=NNc2ccccc2C1=O Amb22522609 [0,0,0,1,0,1|1,0,0]=3 4699 B13R2.32 CC1C=Nc2ccccc2C1=O Amb35781865 [0,0,0,1,0,1|0,0,1]=3 4700 B13R2.32 CC1CCc2ccccc2C1=O Amb6357464 [0,0,0,1,0,1|0,0,2]=4 4701 B13R2.32 CC1CNc2ccccc2C1=O Amb18062583 [0,0,0,1,0,1|0,0,2]=4 4702 B13R2.32 CC1COc2ccccc2C1=O Amb9783173 [0,0,0,1,0,1|0,0,2]=4 4703 B13R2.32 CC1CSc2ccccc2C1=O Amb9400184 [0,0,0,1,0,1|0,0,2]=4 4704 B13R2.32 CC1N=Cc2ccccc2C1=O Amb27433155 [0,0,0,1,0,1|0,0,1]=3 4705 B13R2.32 CN1C=Cc2ccccc2C1=O Amb19127190 [0,0,0,1,0,1|1,0,0]=3 4706 B13R2.32 CN1C=Cc2cccnc2C1=O Amb33715092 [0,0,0,1,0,1|2,0,0]=4 4707 B13R2.32 CN1C=Cc2cnccc2C1=O Amb27453522 [0,0,0,1,0,1|2,0,0]=4 4708 B13R2.32 CN1C=Cc2ncccc2C1=O Amb26874474 [0,0,0,1,0,1|2,0,0]=4 4709 B13R2.32 CN1C=Nc2ccccc2C1=O Amb24746656 [0,0,0,1,0,1|1,0,0]=3 4710 B13R2.32 CN1C=Nc2ccccc2C1=S Amb27481367 [0,0,0,1,0,1|1,1,0]=4 4711 B13R2.32 CN1C=Nc2cnccc2C1=O Amb27765650 [0,0,0,1,0,1|2,0,0]=4 4712 B13R2.32 CN1CCc2ccccc2C1=O Amb27958468 [0,0,0,1,0,1|1,0,1]=4 4713 B13R2.32 CN1N=Cc2ccccc2C1=O Amb19665644 [0,0,0,1,0,1|1,0,0]=3 4714 B13R2.32 CN1N=Cc2ncccc2C1=O Amb28241795 [0,0,0,1,0,1|2,0,0]=4 4715 B13R2.32 CN1N=Nc2ccccc2C1=O Amb21927177 [0,0,0,1,0,1|2,0,0]=4 4716 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,0,0,1,0,1|1,0,1]=4 4717 B13R2.32 CN1NCc2ccccc2C1=O Amb32652549 [0,0,0,1,0,1|1,0,1]=4 4718 B13R2.32 Cc1c(Br)ccc2ccccc12 Amb21929204 [0,0,0,1,0,1|2,0,0]=4 4719 B13R2.32 Cc1c(Br)cnc2ccccc12 Amb22263020 [0,0,0,1,0,1|2,0,0]=4 4720 B13R2.32 Cc1c(Cl)ccc2ccccc12 Amb26843093 [0,0,0,1,0,1|2,0,0]=4 4721 B13R2.32 Cc1c(F)ccc2ccccc12 Amb26880002 [0,0,0,1,0,1|2,0,0]=4 4722 B13R2.32 Cc1c(F)cnc2ccccc12 Amb25872717 [0,0,0,1,0,1|2,0,0]=4 4723 B13R2.32 Cc1c(I)ccc2ccccc12 Amb26367182 [0,0,0,1,0,1|2,0,0]=4 4724 B13R2.32 Cc1c(N)ccc2ccccc12 Amb17593938 [0,0,0,1,0,1|2,0,0]=4 4725 B13R2.32 Cc1c(N)cnc2ccccc12 Amb4016185 [0,0,0,1,0,1|2,0,0]=4 4726 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [0,0,0,1,0,1|2,0,0]=4 4727 B13R2.32 Cc1c(O)cnc2ccccc12 Amb18645166 [0,0,0,1,0,1|2,0,0]=4 4728 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [0,0,0,1,0,1|2,0,0]=4 4729 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb2540178 [0,0,0,1,0,1|2,0,0]=4 4730 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb4322944 [0,0,0,1,0,1|2,0,0]=4 4731 B13R2.32 Cc1ccc2ccccc2c1Br Amb3939041 [0,0,0,1,0,1|1,0,0]=3 4732 B13R2.32 Cc1ccc2ccccc2c1C Amb6297194 [0,0,0,1,0,1|1,0,0]=3 4733 B13R2.32 Cc1ccc2ccccc2c1I Amb27851450 [0,0,0,1,0,1|1,0,0]=3 4734 B13R2.32 Cc1ccc2ccccc2c1N Amb2429201 [0,0,0,1,0,1|1,0,0]=3 4735 B13R2.32 Cc1ccc2ccccc2c1N Amb6383344 [0,0,0,1,0,1|1,0,0]=3 4736 B13R2.32 Cc1ccc2ccccc2c1O Amb3939072 [0,0,0,1,0,1|0,0,1]=3 4737 B13R2.32 Cc1ccc2ccccc2c1S Amb25340394 [0,0,0,1,0,1|0,1,0]=3 4738 B13R2.32 Cc1ccc2cccnc2c1Br Amb22584155 [0,0,0,1,0,1|2,0,0]=4 4739 B13R2.32 Cc1ccc2cccnc2c1C Amb19101295 [0,0,0,1,0,1|2,0,0]=4 4740 B13R2.32 Cc1ccc2cccnc2c1C Amb34202228 [0,0,0,1,0,1|2,0,0]=4 4741 B13R2.32 Cc1ccc2cccnc2c1Cl Amb1678477 [0,0,0,1,0,1|2,0,0]=4 4742 B13R2.32 Cc1ccc2cccnc2c1F Amb23448791 [0,0,0,1,0,1|2,0,0]=4 4743 B13R2.32 Cc1ccc2cccnc2c1N Amb2226936 [0,0,0,1,0,1|2,0,0]=4 4744 B13R2.32 Cc1ccc2cccnc2c1O Amb9790954 [0,0,0,1,0,1|1,0,1]=4 4745 B13R2.32 Cc1ccc2ccncc2c1Br Amb24497835 [0,0,0,1,0,1|2,0,0]=4 4746 B13R2.32 Cc1ccc2ccncc2c1F Amb32795007 [0,0,0,1,0,1|2,0,0]=4 4747 B13R2.32 Cc1ccc2cnccc2c1Br Amb21963323 [0,0,0,1,0,1|2,0,0]=4 4748 B13R2.32 Cc1ccc2cnccc2c1C Amb25940951 [0,0,0,1,0,1|2,0,0]=4 4749 B13R2.32 Cc1ccc2cnccc2c1Cl Amb23453146 [0,0,0,1,0,1|2,0,0]=4 4750 B13R2.32 Cc1ccc2cnccc2c1F Amb32670337 [0,0,0,1,0,1|2,0,0]=4 4751 B13R2.32 Cc1ccc2cnccc2c1N Amb23504053 [0,0,0,1,0,1|2,0,0]=4 4752 B13R2.32 Cc1ccc2ncccc2c1Br Amb22261628 [0,0,0,1,0,1|2,0,0]=4 4753 B13R2.32 Cc1ccc2ncccc2c1C Amb2612996 [0,0,0,1,0,1|2,0,0]=4 4754 B13R2.32 Cc1ccc2ncccc2c1N Amb2429223 [0,0,0,1,0,1|2,0,0]=4 4755 B13R2.32 Cc1ccc2ncccc2c1O Amb22750813 [0,0,0,1,0,1|1,0,1]=4 4756 B13R2.32 Cc1cnc2ccccc2[n+]1[O-] Amb26517513 [0,0,0,1,0,1|1,0,1]=4 4757 B13R2.32 Cc1cnc2ccccc2c1Br Amb27963907 [0,0,0,1,0,1|1,0,0]=3 4758 B13R2.32 Cc1cnc2ccccc2c1C Amb2612997 [0,0,0,1,0,1|1,0,0]=3 4759 B13R2.32 Cc1cnc2ccccc2c1Cl Amb17739750 [0,0,0,1,0,1|1,0,0]=3 4760 B13R2.32 Cc1cnc2ccccc2c1N Amb8389560 [0,0,0,1,0,1|1,0,0]=3 4761 B13R2.32 Cc1cnc2ccccc2c1O Amb18560317 [0,0,0,1,0,1|0,0,1]=3 4762 B13R2.32 Cc1ncc2ccccc2c1Br Amb10573335 [0,0,0,1,0,1|1,0,0]=3 4763 B13R2.32 Cc1ncc2ccccc2c1C Amb23560126 [0,0,0,1,0,1|1,0,0]=3 4764 B13R2.32 Cc1ncc2ccccc2c1O Amb18126185 [0,0,0,1,0,1|0,0,1]=3 4765 B13R2.32 Cc1ncc2ncccc2c1Br Amb7101481 [0,0,0,1,0,1|2,0,0]=4 4766 B13R2.32 Cc1ncc2ncccc2c1N Amb27971478 [0,0,0,1,0,1|2,0,0]=4 4767 B13R2.32 Cc1nnc2ccccc2c1Cl Amb22522610 [0,0,0,1,0,1|2,0,0]=4 4768 B13R2.32 Clc1c(Br)ccc2ccccc12 Amb24444356 [0,0,0,1,0,1|2,0,0]=4 4769 B13R2.32 Clc1c(Br)cnc2ccccc12 Amb8439996 [0,0,0,1,0,1|2,0,0]=4 4770 B13R2.32 Clc1c(I)ccc2ccccc12 Amb25866644 [0,0,0,1,0,1|2,0,0]=4 4771 B13R2.32 Clc1c(I)cnc2ccccc12 Amb22002439 [0,0,0,1,0,1|2,0,0]=4 4772 B13R2.32 Clc1ccc2ccccc2c1Br Amb25082370 [0,0,0,1,0,1|2,0,0]=4 4773 B13R2.32 Clc1ccc2ccccc2c1Cl Amb25189491 [0,0,0,1,0,1|2,0,0]=4 4774 B13R2.32 Clc1ccc2ccccc2c1I Amb25309391 [0,0,0,1,0,1|2,0,0]=4 4775 B13R2.32 Clc1cnc2ccccc2c1Br Amb10808171 [0,0,0,1,0,1|2,0,0]=4 4776 B13R2.32 Clc1cnc2ccccc2c1Cl Amb10241203 [0,0,0,1,0,1|2,0,0]=4 4777 B13R2.32 Clc1ncc2ccccc2c1Br Amb24381966 [0,0,0,1,0,1|2,0,0]=4 4778 B13R2.32 Clc1ncc2ccccc2c1Cl Amb27434433 [0,0,0,1,0,1|2,0,0]=4 4779 B13R2.32 Cn1ccc2ccccc2c1=S Amb2613183 [0,0,0,1,0,1|1,1,0]=4 4780 B13R2.32 Fc1c(Br)ccc2ccccc12 Amb16186009 [0,0,0,1,0,1|2,0,0]=4 4781 B13R2.32 Fc1c(Br)cnc2ccccc12 Amb25751891 [0,0,0,1,0,1|2,0,0]=4 4782 B13R2.32 Fc1c(I)ccc2ccccc12 Amb22547558 [0,0,0,1,0,1|2,0,0]=4 4783 B13R2.32 Fc1ccc2ccccc2c1Br Amb25068848 [0,0,0,1,0,1|2,0,0]=4 4784 B13R2.32 Fc1ccc2ccccc2c1Cl Amb25232022 [0,0,0,1,0,1|2,0,0]=4 4785 B13R2.32 Fc1ccc2ccccc2c1I Amb28250690 [0,0,0,1,0,1|2,0,0]=4 4786 B13R2.32 Fc1cnc2ccccc2c1Br Amb22547375 [0,0,0,1,0,1|2,0,0]=4 4787 B13R2.32 Fc1cnc2ccccc2c1I Amb24099978 [0,0,0,1,0,1|2,0,0]=4 4788 B13R2.32 Ic1ccc2ccccc2c1I Amb8392015 [0,0,0,1,0,1|2,0,0]=4 4789 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [0,0,0,1,0,1|2,0,0]=4 4790 B13R2.32 N=C1C=Cc2ccccc2C1=O Amb27948681 [0,0,0,1,0,1|1,0,0]=3 4791 B13R2.32 N=C1COc2ccccc2C1=O Amb27186345 [0,0,0,1,0,1|1,0,1]=4 4792 B13R2.32 NC1=CN=C2C=CC=CN2C1=O Amb18645471 [0,0,0,1,0,1|2,0,0]=4 4793 B13R2.32 NC1=CNc2ccncc2C1=O Amb23455392 [0,0,0,1,0,1|2,0,0]=4 4794 B13R2.32 NC1=COc2ccccc2C1=O Amb23399677 [0,0,0,1,0,1|1,0,0]=3 4795 B13R2.32 NC1=CSc2ccccc2C1=O Amb18648055 [0,0,0,1,0,1|1,0,0]=3 4796 B13R2.32 NC1=NC=C2C=CC=CN2C1=O Amb18830007 [0,0,0,1,0,1|2,0,0]=4 4797 B13R2.32 NN1C=Nc2ccccc2C1=O Amb18800500 [0,0,0,1,0,1|2,0,0]=4 4798 B13R2.32 Nc1c(Br)ccc2ccccc12 Amb17596049 [0,0,0,1,0,1|2,0,0]=4 4799 B13R2.32 Nc1c(Br)cnc2ccccc12 Amb2609668 [0,0,0,1,0,1|2,0,0]=4 4800 B13R2.32 Nc1c(Br)ncc2ccccc12 Amb18658784 [0,0,0,1,0,1|2,0,0]=4 4801 B13R2.32 Nc1c(Cl)ccc2ccccc12 Amb17594523 [0,0,0,1,0,1|2,0,0]=4 4802 B13R2.32 Nc1c(Cl)cnc2ccccc12 Amb10808268 [0,0,0,1,0,1|2,0,0]=4 4803 B13R2.32 Nc1c(Cl)ncc2ccccc12 Amb10603681 [0,0,0,1,0,1|2,0,0]=4 4804 B13R2.32 Nc1c(F)ccc2ccccc12 Amb17594017 [0,0,0,1,0,1|2,0,0]=4 4805 B13R2.32 Nc1c(I)ccc2ccccc12 Amb22491989 [0,0,0,1,0,1|2,0,0]=4 4806 B13R2.32 Nc1c(I)cnc2ccccc12 Amb24463620 [0,0,0,1,0,1|2,0,0]=4 4807 B13R2.32 Nc1c(I)ncc2ccccc12 Amb27847148 [0,0,0,1,0,1|2,0,0]=4 4808 B13R2.32 Nc1c(O)ccc2ccccc12 Amb1088955 [0,0,0,1,0,1|2,0,0]=4 4809 B13R2.32 Nc1c(O)ccc2ccccc12 Amb2592795 [0,0,0,1,0,1|2,0,0]=4 4810 B13R2.32 Nc1c(O)ncc2ccccc12 Amb25249568 [0,0,0,1,0,1|2,0,0]=4 4811 B13R2.32 Nc1c(P)ccc2ccccc12 Amb28186928 [0,0,0,1,0,1|2,0,0]=4 4812 B13R2.32 Nc1c(S)ccc2ccccc12 Amb17594453 [0,0,0,1,0,1|2,0,0]=4 4813 B13R2.32 Nc1ccc2ccccc2c1Br Amb19374680 [0,0,0,1,0,1|2,0,0]=4 4814 B13R2.32 Nc1ccc2ccccc2c1Br Amb4012961 [0,0,0,1,0,1|2,0,0]=4 4815 B13R2.32 Nc1ccc2ccccc2c1Cl Amb4006312 [0,0,0,1,0,1|2,0,0]=4 4816 B13R2.32 Nc1ccc2ccccc2c1F Amb22497545 [0,0,0,1,0,1|2,0,0]=4 4817 B13R2.32 Nc1ccc2ccccc2c1I Amb27407346 [0,0,0,1,0,1|2,0,0]=4 4818 B13R2.32 Nc1ccc2ccccc2c1N Amb16191900 [0,0,0,1,0,1|2,0,0]=4 4819 B13R2.32 Nc1ccc2ccccc2c1O Amb17593980 [0,0,0,1,0,1|1,0,1]=4 4820 B13R2.32 Nc1ccc2ccccc2c1O Amb19930160 [0,0,0,1,0,1|1,0,1]=4 4821 B13R2.32 Nc1ccc2ccccc2c1S Amb18647914 [0,0,0,1,0,1|1,1,0]=4 4822 B13R2.32 Nc1cnc2ccccc2c1Br Amb33548927 [0,0,0,1,0,1|2,0,0]=4 4823 B13R2.32 Nc1cnc2ccccc2c1Cl Amb18128300 [0,0,0,1,0,1|2,0,0]=4 4824 B13R2.32 Nc1cnc2ccccc2c1F Amb33035705 [0,0,0,1,0,1|2,0,0]=4 4825 B13R2.32 Nc1cnc2ccccc2c1N Amb2695557 [0,0,0,1,0,1|2,0,0]=4 4826 B13R2.32 Nc1cnc2ccccc2c1O Amb23402467 [0,0,0,1,0,1|1,0,1]=4 4827 B13R2.32 Nc1cnc2ccccc2c1S Amb8439780 [0,0,0,1,0,1|1,1,0]=4 4828 B13R2.32 Nc1ncc2ccccc2c1Cl Amb22498015 [0,0,0,1,0,1|2,0,0]=4 4829 B13R2.32 Nc1ncc2ccccc2c1I Amb22498014 [0,0,0,1,0,1|2,0,0]=4 4830 B13R2.32 Nn1cnc2ccccc2c1=O Amb1148138 [0,0,0,1,0,1|2,0,0]=4 4831 B13R2.32 O=C1C(Br)=COc2ccccc21 Amb19664799 [0,0,0,1,0,1|1,0,0]=3 4832 B13R2.32 O=C1C(Br)=CSc2ccccc21 Amb21859134 [0,0,0,1,0,1|1,0,0]=3 4833 B13R2.32 O=C1C(Br)=NNc2ccccc21 Amb22057604 [0,0,0,1,0,1|2,0,0]=4 4834 B13R2.32 O=C1C(Cl)=COc2ccccc21 Amb27492891 [0,0,0,1,0,1|1,0,0]=3 4835 B13R2.32 O=C1C(Cl)=NNc2ccccc21 Amb24062609 [0,0,0,1,0,1|2,0,0]=4 4836 B13R2.32 O=C1C(I)=CNc2ccncc21 Amb26994185 [0,0,0,1,0,1|2,0,0]=4 4837 B13R2.32 O=C1C(I)=COc2ccccc21 Amb19887490 [0,0,0,1,0,1|1,0,0]=3 4838 B13R2.32 O=C1C(O)=CSc2ccccc21 Amb20252018 [0,0,0,1,0,1|1,0,0]=3 4839 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [0,0,0,1,0,1|1,0,0]=3 4840 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [0,0,0,1,0,1|1,1,0]=4 4841 B13R2.32 O=C1CCc2ccccc2C1=O Amb28200177 [0,0,0,1,0,1|1,0,1]=4 4842 B13R2.32 O=C1NC=C2C=CC=CC2=C1F Amb25269874 [0,0,0,1,0,1|2,0,0]=4 4843 B13R2.32 O=C1OCc2ccccc2C1=O Amb24633619 [0,0,0,1,0,1|1,0,1]=4 4844 B13R2.32 O=c1c(Br)ccc2ccccn12 Amb2610131 [0,0,0,1,0,1|2,0,0]=4 4845 B13R2.32 O=c1c2ccccc2ncn1O Amb2795808 [0,0,0,1,0,1|2,0,0]=4 4846 B13R2.32 Oc1c(Br)ccc2ccccc12 Amb8394123 [0,0,0,1,0,1|1,0,1]=4 4847 B13R2.32 Oc1c(Br)cnc2ccccc12 Amb2610838 [0,0,0,1,0,1|1,0,1]=4 4848 B13R2.32 Oc1c(Cl)ccc2ccccc12 Amb17594568 [0,0,0,1,0,1|1,0,1]=4 4849 B13R2.32 Oc1c(Cl)cnc2ccccc12 Amb10241101 [0,0,0,1,0,1|1,0,1]=4 4850 B13R2.32 Oc1c(Cl)ncc2ccccc12 Amb22284687 [0,0,0,1,0,1|1,0,1]=4 4851 B13R2.32 Oc1c(F)ccc2ccccc12 Amb18645623 [0,0,0,1,0,1|1,0,1]=4 4852 B13R2.32 Oc1c(F)cnc2ccccc12 Amb24650731 [0,0,0,1,0,1|1,0,1]=4 4853 B13R2.32 Oc1c(I)ccc2ccccc12 Amb26478044 [0,0,0,1,0,1|1,0,1]=4 4854 B13R2.32 Oc1c(I)cnc2ccccc12 Amb22491992 [0,0,0,1,0,1|1,0,1]=4 4855 B13R2.32 Oc1ccc2ccccc2c1Br Amb6399651 [0,0,0,1,0,1|2,0,0]=4 4856 B13R2.32 Oc1ccc2ccccc2c1Cl Amb17594574 [0,0,0,1,0,1|2,0,0]=4 4857 B13R2.32 Oc1ccc2ccccc2c1F Amb18645624 [0,0,0,1,0,1|2,0,0]=4 4858 B13R2.32 Oc1ccc2ccccc2c1I Amb2782872 [0,0,0,1,0,1|2,0,0]=4 4859 B13R2.32 Oc1ccc2ccccc2c1O Amb18054059 [0,0,0,1,0,1|1,0,1]=4 4860 B13R2.32 Oc1ccc2ccccc2c1S Amb20093303 [0,0,0,1,0,1|1,1,0]=4 4861 B13R2.32 Oc1cnc2ccccc2c1Br Amb8438944 [0,0,0,1,0,1|2,0,0]=4 4862 B13R2.32 Oc1cnc2ccccc2c1Cl Amb18648301 [0,0,0,1,0,1|2,0,0]=4 4863 B13R2.32 Oc1cnc2ccccc2c1Cl Amb32653571 [0,0,0,1,0,1|2,0,0]=4 4864 B13R2.32 Oc1cnc2ccccc2c1F Amb27592408 [0,0,0,1,0,1|2,0,0]=4 4865 B13R2.32 Oc1cnc2ccccc2c1I Amb22752326 [0,0,0,1,0,1|2,0,0]=4 4866 B13R2.32 Oc1cnc2ccccc2c1O Amb5718045 [0,0,0,1,0,1|1,0,1]=4 4867 B13R2.32 Oc1cnc2ccccc2c1S Amb18127892 [0,0,0,1,0,1|1,1,0]=4 4868 B13R2.32 S=C1C(S)=CNc2ccccc21 Amb27209576 [0,0,0,1,0,1|1,1,0]=4 4869 B13R2.32 [NH3+]c1c(O)ccc2ccccc12 Amb22489532 [0,0,0,1,0,1|2,0,0]=4 4870 B13R2.32 [NH3+]c1c([O-])ccc2ccccc12 Amb4268650 [0,0,0,1,0,1|2,0,0]=4 4871 B13R2.33 CC1=NNc2ccccc2C=C1 Amb27421335 [0,0,0,1,0,1|2,0,0]=4 4872 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [0,0,0,1,0,1|2,0,0]=4 4873 B13R2.33 O=C1C=Nc2ccccc2C=N1 Amb22489908 [0,0,0,1,0,1|2,0,0]=4 4874 B13R2.50 O=CC1CC1Cc2ccccc2 Amb24537604 [0,0,0,1,0,1|0,0,2]=4 4875 B13R2.50 O=C[C@@H]1C[C@H]1Oc2ccccc2 Amb27257945 [0,0,0,1,0,1|0,0,2]=4 4876 B13R2.50 O=C[C@@H]1C[C@H]1Sc2ccccc2 Amb28400027 [0,0,0,1,0,1|0,0,2]=4 4877 B13R2.52 O=CC1CC(c2ccccc2)C1 Amb25725908 [0,0,0,1,0,1|0,0,2]=4 4878 B13R2.57 C=Cc1ccc2ccccc2c1 Amb8394029 [0,0,0,1,0,1|1,0,1]=4 4879 B13R2.57 C=Cc1ccc2ccccc2n1 Amb10071967 [0,0,0,1,0,1|2,0,0]=4 4880 B13R2.57 C=Cc1cnc2ccccc2c1 Amb8394032 [0,0,0,1,0,1|1,0,1]=4 4881 B13R2.57 C=Cc1cnc2ccccc2n1 Amb24085078 [0,0,0,1,0,1|2,0,0]=4 4882 B13R2.57 Cl\C=C1\CCc2ccccc2C1 Amb27843521 [0,0,0,1,0,1|1,0,1]=4 4883 B13R2.57 N=Cc1ccc2ccccc2n1 Amb27642853 [0,0,0,1,0,1|2,0,0]=4 4884 B13R2.57 O=CC1=CNc2ccccc2C1 Amb25152519 [0,0,0,1,0,1|0,0,0]=2 4885 B13R2.57 O=CC1=COc2ccccc2O1 Amb25348637 [0,0,0,1,0,1|1,0,0]=3 4886 B13R2.57 O=CC1=CSc2ccccc2S1 Amb28239532 [0,0,0,1,0,1|1,0,0]=3 4887 B13R2.57 O=CC1=Cc2ccccc2OC1 Amb1158025 [0,0,0,1,0,1|0,0,2]=4 4888 B13R2.57 O=CC1=Cc2ccccc2SS1 Amb27409512 [0,0,0,1,0,1|1,0,1]=4 4889 B13R2.57 O=CC1CCc2ccccc2C1 Amb18645362 [0,0,0,1,0,1|0,0,2]=4 4890 B13R2.57 O=CC1COc2ccccc2C1 Amb17606111 [0,0,0,1,0,1|0,0,2]=4 4891 B13R2.57 O=Cc1cc2ccccc2cn1 Amb8010573 [0,0,0,1,0,1|0,0,1]=3 4892 B13R2.57 O=Cc1cc2cccnc2cn1 Amb31379099 [0,0,0,1,0,1|1,0,1]=4 4893 B13R2.57 O=Cc1ccc2ccccc2c1 Amb3939951 [0,0,0,1,0,1|0,0,1]=3 4894 B13R2.57 O=Cc1ccc2ccccc2n1 Amb533663 [0,0,0,1,0,1|1,0,0]=3 4895 B13R2.57 O=Cc1ccc2cccnc2c1 Amb2548373 [0,0,0,1,0,1|1,0,1]=4 4896 B13R2.57 O=Cc1ccc2cccnc2n1 Amb1323330 [0,0,0,1,0,1|2,0,0]=4 4897 B13R2.57 O=Cc1ccc2ccncc2c1 Amb8010572 [0,0,0,1,0,1|1,0,1]=4 4898 B13R2.57 O=Cc1ccc2ccncc2n1 Amb22498133 [0,0,0,1,0,1|2,0,0]=4 4899 B13R2.57 O=Cc1ccc2cnccc2c1 Amb8010571 [0,0,0,1,0,1|1,0,1]=4 4900 B13R2.57 O=Cc1ccc2cnccc2n1 Amb3931332 [0,0,0,1,0,1|2,0,0]=4 4901 B13R2.57 O=Cc1ccc2ncccc2c1 Amb1266161 [0,0,0,1,0,1|1,0,1]=4 4902 B13R2.57 O=Cc1ccc2ncccc2n1 Amb25292132 [0,0,0,1,0,1|2,0,0]=4 4903 B13R2.57 O=Cc1cnc2ccccc2c1 Amb1995106 [0,0,0,1,0,1|0,0,1]=3 4904 B13R2.57 O=Cc1cnc2ccccc2n1 Amb6315572 [0,0,0,1,0,1|1,0,0]=3 4905 B13R2.57 O=Cc1cnc2cccnc2c1 Amb13890074 [0,0,0,1,0,1|1,0,1]=4 4906 B13R2.57 O=Cc1cnc2cccnc2n1 Amb27616908 [0,0,0,1,0,1|2,0,0]=4 4907 B13R2.57 O=Cc1cnc2ccncc2c1 Amb27846960 [0,0,0,1,0,1|1,0,1]=4 4908 B13R2.57 O=Cc1cnc2ncccc2c1 Amb8010589 [0,0,0,1,0,1|1,0,1]=4 4909 B13R2.57 O=Nc1ccc2ccccc2c1 Amb27170669 [0,0,0,1,0,1|1,0,1]=4 4910 B13R2.98 CC1(C=O)CC1c2ccccc2 Amb25674437 [0,0,0,1,0,1|0,0,2]=4 4911 B13R2.98 CC1(C=O)N=C1c2ccccc2 Amb27178234 [0,0,0,1,0,1|0,0,1]=3 4912 B13R2.98 C[C@@]1(C=O)C[C@H]1c2ccccc2 Amb24545890 [0,0,0,1,0,1|0,0,2]=4 4913 B13R2.98 C[C@@]1(C=O)O[C@H]1c2ccccc2 Amb27841129 [0,0,0,1,0,1|0,0,2]=4 4914 B13R2.98 C[C@]1(C=O)C[C@@H]1c2ccccc2 Amb24460888 [0,0,0,1,0,1|0,0,2]=4 4915 B13R2.98 C[C@]1(C=O)C[C@H]1c2ccccc2 Amb24678176 [0,0,0,1,0,1|0,0,2]=4 4916 B13R2.373 C=C1CN(c2ccccc2)C1=O Amb27808537 [0,0,0,1,0,1|0,0,2]=4 4917 B13R2.373 O=C1C=C(c2ccccc2)C1=O Amb22172059 [0,0,0,1,0,1|1,0,0]=3 4918 B13R2.373 O=C1CC(c2ccccc2)C1=O Amb27245972 [0,0,0,1,0,1|1,0,1]=4 4919 B13R2.2531 CC1(C=O)CCc2ccccc21 Amb25835066 [0,0,0,1,0,1|0,0,2]=4 4920 B13R2.2531 CC1(C=O)COc2ccccc21 Amb26403201 [0,0,0,1,0,1|0,0,2]=4 4921 B13R2.4745 CC1CC2=C(C=CC=CC2)C1=O Amb27219313 [0,0,0,1,0,1|0,0,2]=4 4922 B13R2.4745 Cc1cc2cccccc2c1F Amb24551867 [0,0,0,1,0,1|1,0,0]=3 4923 B13R2.4745 O=C1C=C2C=CC=CC=C2C1=O Amb27754142 [0,0,0,1,0,1|1,0,0]=3 4924 B13R2.15 Brc1cnoc1-c2ccccc2 Amb25301051 [0,1,0,1,0,0|1,0,1]=4 4925 B13R2.15 Brc1cnsc1-c2ccccc2 Amb18731588 [0,1,0,1,0,0|1,1,0]=4 4926 B13R2.15 Brc1cscc1-c2ccccc2 Amb2642791 [0,1,0,1,0,0|1,1,0]=4 4927 B13R2.15 Brc1ncoc1-c2ccccc2 Amb22436805 [0,1,0,1,0,0|1,0,1]=4 4928 B13R2.15 Brc1ncsc1-c2ccccc2 Amb18157035 [0,1,0,1,0,0|1,1,0]=4 4929 B13R2.15 Brc1occc1-c2ccccc2 Amb13884539 [0,1,0,1,0,0|2,0,0]=4 4930 B13R2.15 Brc1ocnc1-c2ccccc2 Amb24632531 [0,1,0,1,0,0|2,0,0]=4 4931 B13R2.15 Brc1sccc1-c2ccccc2 Amb13884517 [0,1,0,1,0,0|2,0,0]=4 4932 B13R2.15 Brc1scnc1-c2ccccc2 Amb17410191 [0,1,0,1,0,0|2,0,0]=4 4933 B13R2.15 Cc1ccnn1-c2ccccc2 Amb2700475 [0,1,0,1,0,0|2,0,0]=4 4934 B13R2.15 Cc1ccoc1-c2ccccc2 Amb27467621 [0,1,0,1,0,0|0,0,1]=3 4935 B13R2.15 Cc1ccsc1-c2ccccn2 Amb25149791 [0,1,0,1,0,0|1,1,0]=4 4936 B13R2.15 Cc1cocc1-c2ccccc2 Amb27947523 [0,1,0,1,0,0|0,0,1]=3 4937 B13R2.15 Cc1conc1-c2ccccc2 Amb25112012 [0,1,0,1,0,0|0,0,1]=3 4938 B13R2.15 Cc1nccn1-c2ccccc2 Amb28127089 [0,1,0,1,0,0|2,0,0]=4 4939 B13R2.15 Cc1ncoc1-c2ccccc2 Amb17400053 [0,1,0,1,0,0|0,0,1]=3 4940 B13R2.15 Cc1ncoc1-c2ccccn2 Amb17400065 [0,1,0,1,0,0|1,0,1]=4 4941 B13R2.15 Cc1ncoc1-c2cccnc2 Amb17400066 [0,1,0,1,0,0|1,0,1]=4 4942 B13R2.15 Cc1ncoc1-c2ccncc2 Amb17400067 [0,1,0,1,0,0|1,0,1]=4 4943 B13R2.15 Cc1ncsc1-c2ccccc2 Amb17400513 [0,1,0,1,0,0|0,1,0]=3 4944 B13R2.15 Cc1ncsc1-c2ccccn2 Amb17400569 [0,1,0,1,0,0|1,1,0]=4 4945 B13R2.15 Cc1ncsc1-c2cccnc2 Amb17400570 [0,1,0,1,0,0|1,1,0]=4 4946 B13R2.15 Cc1ncsc1-c2ccncc2 Amb17400571 [0,1,0,1,0,0|1,1,0]=4 4947 B13R2.15 Cc1nocc1-c2ccccc2 Amb24707807 [0,1,0,1,0,0|1,0,1]=4 4948 B13R2.15 Cc1nonc1-c2ccccc2 Amb22397210 [0,1,0,1,0,0|1,0,1]=4 4949 B13R2.15 Cc1oncc1-c2ccccc2 Amb27243828 [0,1,0,1,0,0|2,0,0]=4 4950 B13R2.15 Cc1scnc1-c2ccccc2 Amb2852363 [0,1,0,1,0,0|1,0,0]=3 4951 B13R2.15 Cc1scnc1-c2ccccn2 Amb27480855 [0,1,0,1,0,0|2,0,0]=4 4952 B13R2.15 Cc1scnc1-c2cccnc2 Amb28315195 [0,1,0,1,0,0|2,0,0]=4 4953 B13R2.15 Cc1snnc1-c2ccccc2 Amb2725075 [0,1,0,1,0,0|2,0,0]=4 4954 B13R2.15 Clc1cnoc1-c2ccccc2 Amb28073965 [0,1,0,1,0,0|1,0,1]=4 4955 B13R2.15 Clc1ncoc1-c2ccccc2 Amb22500850 [0,1,0,1,0,0|1,0,1]=4 4956 B13R2.15 Clc1scnc1-c2ccccc2 Amb22753527 [0,1,0,1,0,0|2,0,0]=4 4957 B13R2.15 Cn1cccc1-c2ccccc2 Amb26311299 [0,1,0,1,0,0|2,0,0]=4 4958 B13R2.15 Cn1ccnc1-c2ccccc2 Amb17232250 [0,1,0,1,0,0|2,0,0]=4 4959 B13R2.15 Cn1cncc1-c2ccccc2 Amb10564255 [0,1,0,1,0,0|2,0,0]=4 4960 B13R2.15 Cn1cnnc1-c2ccccc2 Amb20668220 [0,1,0,1,0,0|2,0,0]=4 4961 B13R2.15 Cn1nccc1-c2ccccc2 Amb18787762 [0,1,0,1,0,0|2,0,0]=4 4962 B13R2.15 Fc1ccoc1-c2ccccc2 Amb26476292 [0,1,0,1,0,0|1,0,1]=4 4963 B13R2.15 Ic1ncoc1-c2ccccc2 Amb22500851 [0,1,0,1,0,0|1,0,1]=4 4964 B13R2.15 Nc1ccsc1-c2ccccc2 Amb18825118 [0,1,0,1,0,0|1,1,0]=4 4965 B13R2.15 Nc1cnoc1-c2ccccc2 Amb18830260 [0,1,0,1,0,0|1,0,1]=4 4966 B13R2.15 Nc1cnsc1-c2ccccc2 Amb18196384 [0,1,0,1,0,0|1,1,0]=4 4967 B13R2.15 Nc1conc1-c2ccccc2 Amb23571001 [0,1,0,1,0,0|1,0,1]=4 4968 B13R2.15 Nc1conc1-c2ccccc2 Amb33483683 [0,1,0,1,0,0|1,0,1]=4 4969 B13R2.15 Nc1cscc1-c2ccccc2 Amb17335068 [0,1,0,1,0,0|1,1,0]=4 4970 B13R2.15 Nc1cscc1-c2ccccc2 Amb32653600 [0,1,0,1,0,0|1,1,0]=4 4971 B13R2.15 Nc1csnc1-c2ccccc2 Amb18647981 [0,1,0,1,0,0|1,1,0]=4 4972 B13R2.15 Nc1ncoc1-c2ccccc2 Amb26548318 [0,1,0,1,0,0|1,0,1]=4 4973 B13R2.15 Nc1ncsc1-c2ccccc2 Amb18862916 [0,1,0,1,0,0|1,1,0]=4 4974 B13R2.15 Nc1ocnc1-c2ccccc2 Amb25108523 [0,1,0,1,0,0|2,0,0]=4 4975 B13R2.15 Nc1scnc1-c2ccccc2 Amb13951990 [0,1,0,1,0,0|2,0,0]=4 4976 B13R2.25 O=CCC1CC1c2ccccc2 Amb28243837 [0,1,0,1,0,0|0,0,2]=4 4977 B13R2.25 O=CC[C@@H]1C[C@@H]1c2ccccc2 Amb34915327 [0,1,0,1,0,0|0,0,2]=4 4978 B13R2.25 O=CC[C@@H]1C[C@H]1c2ccccc2 Amb32667655 [0,1,0,1,0,0|0,0,2]=4 4979 B13R2.26 C=CCc1cc2ccccc2s1 Amb28129898 [0,1,0,1,0,0|2,0,0]=4 4980 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,1,0,1,0,0|1,0,1]=4 4981 B13R2.26 C\C=C\c1cc2ccccc2o1 Amb27209407 [0,1,0,1,0,0|2,0,0]=4 4982 B13R2.26 ClC[SiH2]C1=Cc2ccccc2C1 Amb28396661 [0,1,0,1,0,0|1,0,1]=4 4983 B13R2.26 N#CCC1=Cc2ccccc2C1 Amb25809437 [0,1,0,1,0,0|1,0,1]=4 4984 B13R2.26 NCC=C1Cc2ccccc2C1 Amb28144579 [0,1,0,1,0,0|1,0,1]=4 4985 B13R2.26 NCCC1=Cc2ccccc2C1 Amb27441993 [0,1,0,1,0,0|1,0,1]=4 4986 B13R2.26 N\N=C\c1cc2ccccc2o1 Amb27451513 [0,1,0,1,0,0|2,0,0]=4 4987 B13R2.26 O=C=Nc1cc2ccccc2o1 Amb25060167 [0,1,0,1,0,0|1,0,1]=4 4988 B13R2.26 O=C=Nc1cc2ccccc2s1 Amb18945392 [0,1,0,1,0,0|1,0,1]=4 4989 B13R2.26 O=CCC1=Cc2ccccc2C1 Amb28351452 [0,1,0,1,0,0|0,0,0]=2 4990 B13R2.26 O=CCC1Cc2ccccc2C1 Amb27804233 [0,1,0,1,0,0|0,0,2]=4 4991 B13R2.26 O=CCC1Cc2ccccc2N1 Amb27186234 [0,1,0,1,0,0|1,0,1]=4 4992 B13R2.26 O=CCN1Cc2ccccc2C1 Amb18800520 [0,1,0,1,0,0|1,0,1]=4 4993 B13R2.26 O=CCc1cc2ccccc2s1 Amb27614816 [0,1,0,1,0,0|1,0,0]=3 4994 B13R2.26 O=CCc1cc2cccnc2s1 Amb27612961 [0,1,0,1,0,0|2,0,0]=4 4995 B13R2.26 O=CCc1cn2ccccc2n1 Amb24330441 [0,1,0,1,0,0|2,0,0]=4 4996 B13R2.26 O=CCc1nc2ccccc2s1 Amb18648050 [0,1,0,1,0,0|2,0,0]=4 4997 B13R2.26 O=CNC1Cc2ccccc2C1 Amb27955819 [0,1,0,1,0,0|0,0,2]=4 4998 B13R2.26 O=CNc1nc2ccccc2s1 Amb4322939 [0,1,0,1,0,0|2,0,0]=4 4999 B13R2.26 OCCC1=Cc2ccccc2C1 Amb17594005 [0,1,0,1,0,0|0,0,2]=4 5000 B13R2.26 O\N=C\c1cc2ccccc2s1 Amb27664129 [0,1,0,1,0,0|1,0,1]=4 5001 B13R2.30 CC1NC(=O)C1c2ccccc2 Amb26968702 [0,1,0,1,0,0|0,0,2]=4 5002 B13R2.30 NC1=C(c2ccccc2)C(=O)C1 Amb27597507 [0,1,0,1,0,0|1,0,0]=3 5003 B13R2.30 O=C1C=C(O)N1c2ccccc2 Amb3445036 [0,1,0,1,0,0|2,0,0]=4 5004 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,1,0,1,0,0|0,0,2]=4 5005 B13R2.31 O=C1CC(Cc2ccccc2)N1 Amb27468739 [0,1,0,1,0,0|0,0,2]=4 5006 B13R2.31 O=C1CC(Oc2ccccc2)C1 Amb23439309 [0,1,0,1,0,0|1,0,1]=4 5007 B13R2.31 O=C1CC(Sc2ccccc2)C1 Amb32670640 [0,1,0,1,0,0|1,0,1]=4 5008 B13R2.31 O=C1CC(Sc2ccccc2)N1 Amb27264782 [0,1,0,1,0,0|1,0,1]=4 5009 B13R2.31 O=C1CC([Se]c2ccccc2)N1 Amb2612117 [0,1,0,1,0,0|1,0,1]=4 5010 B13R2.31 O=C1CN(Cc2ccccc2)C1 Amb10602421 [0,1,0,1,0,0|1,0,1]=4 5011 B13R2.31 O=C1C[C@@H](Cc2ccccc2)N1 Amb28243189 [0,1,0,1,0,0|0,0,2]=4 5012 B13R2.31 O=C1C[C@@H](Sc2ccccc2)N1 Amb27647757 [0,1,0,1,0,0|1,0,1]=4 5013 B13R2.31 OC1CC(=Cc2ccccc2)C1 Amb27763850 [0,1,0,1,0,0|0,0,2]=4 5014 B13R2.64 C(=C1/CCCN1)/c2ccccc2 Amb27814288 [0,1,0,1,0,0|1,0,1]=4 5015 B13R2.64 C(=C1/CCNC1)/c2ccccc2 Amb26544410 [0,1,0,1,0,0|1,0,1]=4 5016 B13R2.64 C(=C1CCCC1)c2ccccc2 Amb10606582 [0,1,0,1,0,0|1,0,1]=4 5017 B13R2.64 C1=C(Cc2ccccc2)NCC1 Amb17938862 [0,1,0,1,0,0|1,0,1]=4 5018 B13R2.135 C=Cn1c(C)cc2ccccc21 Amb28052745 [0,1,0,1,0,0|1,0,0]=3 5019 B13R2.135 CC1=C(C#N)c2ccccc2C1 Amb17778902 [0,1,0,1,0,0|1,0,1]=4 5020 B13R2.135 CCc1c(C)cn2ccccc12 Amb27667224 [0,1,0,1,0,0|2,0,0]=4 5021 B13R2.135 CCc1c(C)sc2ccccc12 Amb27962459 [0,1,0,1,0,0|2,0,0]=4 5022 B13R2.135 CCn1c(C)cc2ccccc21 Amb6773014 [0,1,0,1,0,0|1,0,1]=4 5023 B13R2.135 COc1c(C)cn2ccccc12 Amb26480686 [0,1,0,1,0,0|1,0,1]=4 5024 B13R2.135 COc1c2ccccc2cn1C Amb28399341 [0,1,0,1,0,0|1,0,1]=4 5025 B13R2.135 Cc1cc2ccccc2n1C=O Amb25793459 [0,1,0,1,0,0|0,0,0]=2 5026 B13R2.135 Cc1cc2ccccn2c1C#N Amb347230 [0,1,0,1,0,0|2,0,0]=4 5027 B13R2.135 Cc1cc2ccccn2c1C=O Amb18061680 [0,1,0,1,0,0|1,0,0]=3 5028 B13R2.135 Cc1cc2ccccn2c1CN Amb10879958 [0,1,0,1,0,0|2,0,0]=4 5029 B13R2.135 Cc1cc2occcc2c1CO Amb25762895 [0,1,0,1,0,0|1,0,1]=4 5030 B13R2.135 Cc1cn2ccccc2c1C#N Amb18644807 [0,1,0,1,0,0|2,0,0]=4 5031 B13R2.135 Cc1nc2ccccc2n1N=O Amb348284 [0,1,0,1,0,0|2,0,0]=4 5032 B13R2.135 Cc1nc2ccccn2c1C=O Amb1106632 [0,1,0,1,0,0|2,0,0]=4 5033 B13R2.135 Cc1nc2ccccn2c1N=O Amb18107455 [0,1,0,1,0,0|2,0,0]=4 5034 B13R2.135 Cc1nn2ccccc2c1C=O Amb18830238 [0,1,0,1,0,0|2,0,0]=4 5035 B13R2.135 Cc1oc2ccccc2c1C#N Amb341638 [0,1,0,1,0,0|2,0,0]=4 5036 B13R2.135 Cc1oc2ccccc2c1C=O Amb1003032 [0,1,0,1,0,0|1,0,0]=3 5037 B13R2.135 Cc1oc2ccccc2c1CN Amb24061887 [0,1,0,1,0,0|2,0,0]=4 5038 B13R2.135 Cc1oc2ccccc2c1CO Amb22011694 [0,1,0,1,0,0|1,0,1]=4 5039 B13R2.135 Cc1oc2ccccc2c1CS Amb32788223 [0,1,0,1,0,0|1,1,0]=4 5040 B13R2.135 Cc1sc2ccccc2c1C#N Amb24656788 [0,1,0,1,0,0|2,0,0]=4 5041 B13R2.135 Cc1sc2ccccc2c1C=O Amb10569109 [0,1,0,1,0,0|1,0,0]=3 5042 B13R2.135 Cc1sc2ccccc2c1CCl Amb8385138 [0,1,0,1,0,0|2,0,0]=4 5043 B13R2.135 Cc1sc2ccccc2c1CN Amb33613289 [0,1,0,1,0,0|2,0,0]=4 5044 B13R2.135 Cc1sc2ccccc2c1CO Amb26363790 [0,1,0,1,0,0|1,0,1]=4 5045 B13R2.135 Cn1cc2ccccc2c1C=O Amb27265953 [0,1,0,1,0,0|1,0,0]=3 5046 B13R2.135 Cn1nc2ccccc2c1C=O Amb2723782 [0,1,0,1,0,0|2,0,0]=4 5047 B13R2.135 Nc1oc2ccccc2c1C=O Amb18830101 [0,1,0,1,0,0|2,0,0]=4 5048 B13R2.135 Nc1sc2ccccc2c1C=O Amb18825001 [0,1,0,1,0,0|2,0,0]=4 5049 B13R2.135 O=CC1C(=O)Nc2ccccc21 Amb1039695 [0,1,0,1,0,0|2,0,0]=4 5050 B13R2.135 O=CC1C(=O)Oc2ccccc21 Amb27592987 [0,1,0,1,0,0|2,0,0]=4 5051 B13R2.135 O=CN1C(=S)Nc2ccccc21 Amb27409206 [0,1,0,1,0,0|2,0,0]=4 5052 B13R2.135 O=Cc1c(Br)sc2ccccc12 Amb18661020 [0,1,0,1,0,0|2,0,0]=4 5053 B13R2.135 O=Cc1c(Cl)oc2ccccc12 Amb33527349 [0,1,0,1,0,0|2,0,0]=4 5054 B13R2.135 O=Cc1c(Cl)sc2ccccc12 Amb18675050 [0,1,0,1,0,0|2,0,0]=4 5055 B13R2.135 O=Cc1c(I)sc2ccccc12 Amb27230314 [0,1,0,1,0,0|2,0,0]=4 5056 B13R2.135 O=Cc1c(S)sc2ccccc12 Amb27636510 [0,1,0,1,0,0|2,0,0]=4 5057 B13R2.138 CC1C(C=O)C1c2ccccc2 Amb28388674 [0,1,0,1,0,0|0,0,2]=4 5058 B13R2.138 CCC1=C(c2ccccc2)C1=O Amb27176039 [0,1,0,1,0,0|0,0,0]=2 5059 B13R2.138 COC1=C(c2ccccc2)C1=O Amb27748603 [0,1,0,1,0,0|0,0,0]=2 5060 B13R2.138 C[C@H]1[C@@H](C=O)[C@@H]1c2ccccc2 Amb25302243 [0,1,0,1,0,0|0,0,2]=4 5061 B13R2.163 CC1=CN=Cc2ccccc2N1 Amb27248260 [0,1,0,1,0,0|2,0,0]=4 5062 B13R2.328 Brc1cc(I)c2ccccc2c1 Amb26331453 [0,1,0,1,0,0|2,0,0]=4 5063 B13R2.328 Brc1cc(I)cc2ccccc12 Amb27804458 [0,1,0,1,0,0|2,0,0]=4 5064 B13R2.328 Brc1cc2ccccc2c(Br)n1 Amb2609658 [0,1,0,1,0,0|2,0,0]=4 5065 B13R2.328 CC1=C2C=CC=CC2=CC(=O)N1 Amb22371049 [0,1,0,1,0,0|2,0,0]=4 5066 B13R2.328 CC1=CC(=O)N2C=CC=CC2=N1 Amb18034915 [0,1,0,1,0,0|2,0,0]=4 5067 B13R2.328 CC1=CC(=O)c2ccccc2N1 Amb18368798 [0,1,0,1,0,0|1,0,0]=3 5068 B13R2.328 CC1=CC(=O)c2ccccc2O1 Amb19666848 [0,1,0,1,0,0|1,0,0]=3 5069 B13R2.328 CC1=CC(=O)c2ccccc2S1 Amb20414518 [0,1,0,1,0,0|1,0,0]=3 5070 B13R2.328 CC1=CC(=O)c2ccncc2N1 Amb25759073 [0,1,0,1,0,0|2,0,0]=4 5071 B13R2.328 CC1=CC(=O)c2cnccc2O1 Amb28202041 [0,1,0,1,0,0|2,0,0]=4 5072 B13R2.328 CC1=CC(=O)c2ncccc2N1 Amb24497195 [0,1,0,1,0,0|2,0,0]=4 5073 B13R2.328 CC1=CN(C)c2ccccc2N1 Amb27620722 [0,1,0,1,0,0|2,0,0]=4 5074 B13R2.328 CC1=Cc2ccccc2C(=O)O1 Amb20247502 [0,1,0,1,0,0|0,0,0]=2 5075 B13R2.328 CC1=Cc2cnccc2C(=O)N1 Amb25891932 [0,1,0,1,0,0|1,0,0]=3 5076 B13R2.328 CC1=Cc2ncccc2C(=O)O1 Amb25359892 [0,1,0,1,0,0|1,0,0]=3 5077 B13R2.328 CC1=NC(=O)N2C=CC=CC2=N1 Amb27816676 [0,1,0,1,0,0|2,0,0]=4 5078 B13R2.328 CC1=NC(=O)c2ccccc2N1 Amb19844242 [0,1,0,1,0,0|1,0,0]=3 5079 B13R2.328 CC1=NC(=O)c2ccncc2N1 Amb22493797 [0,1,0,1,0,0|2,0,0]=4 5080 B13R2.328 CC1=Nc2ccccc2C(=O)N1 Amb17997717 [0,1,0,1,0,0|1,0,0]=3 5081 B13R2.328 CC1=Nc2ccccc2C(=O)O1 Amb18800494 [0,1,0,1,0,0|1,0,0]=3 5082 B13R2.328 CC1=Nc2ccccc2C(=S)S1 Amb22464984 [0,1,0,1,0,0|1,1,0]=4 5083 B13R2.328 CC1=Nc2ccncc2C(=O)O1 Amb22499186 [0,1,0,1,0,0|2,0,0]=4 5084 B13R2.328 CC1=Nc2cnccc2C(=O)N1 Amb20668477 [0,1,0,1,0,0|2,0,0]=4 5085 B13R2.328 CC1=Nc2cnccc2C(=O)O1 Amb26590766 [0,1,0,1,0,0|2,0,0]=4 5086 B13R2.328 CC1=Nc2ncccc2C(=O)N1 Amb18034920 [0,1,0,1,0,0|2,0,0]=4 5087 B13R2.328 CC1=Nc2ncccc2C(=O)O1 Amb22524594 [0,1,0,1,0,0|2,0,0]=4 5088 B13R2.328 CC1CC(=O)c2ccccc2C1 Amb17594003 [0,1,0,1,0,0|0,0,2]=4 5089 B13R2.328 CC1CC(=O)c2ccccc2N1 Amb18560059 [0,1,0,1,0,0|1,0,1]=4 5090 B13R2.328 CC1CC(=O)c2ccccc2O1 Amb9398195 [0,1,0,1,0,0|1,0,1]=4 5091 B13R2.328 CC1CC(=O)c2ccccc2S1 Amb9398275 [0,1,0,1,0,0|1,0,1]=4 5092 B13R2.328 CC1Cc2ccccc2C(=O)N1 Amb33545648 [0,1,0,1,0,0|0,0,2]=4 5093 B13R2.328 CC1NC(=O)c2ccccc2N1 Amb26607899 [0,1,0,1,0,0|1,0,1]=4 5094 B13R2.328 CC1NC(=O)c2ccccc2O1 Amb2184910 [0,1,0,1,0,0|1,0,1]=4 5095 B13R2.328 CN1CC(=O)c2ccccc2C1 Amb30584907 [0,1,0,1,0,0|1,0,1]=4 5096 B13R2.328 CN1CC(=O)c2ccccc2C1 Amb9783329 [0,1,0,1,0,0|1,0,1]=4 5097 B13R2.328 CN1Cc2ccccc2C(=O)N1 Amb32675087 [0,1,0,1,0,0|1,0,1]=4 5098 B13R2.328 C[C@@H]1CC(=O)c2ccccc2N1 Amb26940694 [0,1,0,1,0,0|1,0,1]=4 5099 B13R2.328 C[C@@H]1CC(=O)c2ccccc2O1 Amb25713529 [0,1,0,1,0,0|1,0,1]=4 5100 B13R2.328 C[n+]1cc(Br)c2ccccc2c1 Amb2613513 [0,1,0,1,0,0|2,0,0]=4 5101 B13R2.328 C[n+]1cc(Br)cc2ccccc21 Amb2610039 [0,1,0,1,0,0|2,0,0]=4 5102 B13R2.328 C[n+]1cc2ccccc2c([O-])n1 Amb10565015 [0,1,0,1,0,0|1,0,1]=4 5103 B13R2.328 Cc1cc(Br)c2ccccc2c1 Amb20669369 [0,1,0,1,0,0|1,0,0]=3 5104 B13R2.328 Cc1cc(Br)c2ccccc2n1 Amb9386790 [0,1,0,1,0,0|2,0,0]=4 5105 B13R2.328 Cc1cc(Br)c2cccnc2c1 Amb22755388 [0,1,0,1,0,0|2,0,0]=4 5106 B13R2.328 Cc1cc(Br)c2ccncc2c1 Amb19100697 [0,1,0,1,0,0|2,0,0]=4 5107 B13R2.328 Cc1cc(Br)c2cnccc2c1 Amb26329512 [0,1,0,1,0,0|2,0,0]=4 5108 B13R2.328 Cc1cc(Br)c2ncccc2c1 Amb16192038 [0,1,0,1,0,0|2,0,0]=4 5109 B13R2.328 Cc1cc(Br)c2ncccc2c1 Amb20171135 [0,1,0,1,0,0|2,0,0]=4 5110 B13R2.328 Cc1cc(Br)cc2ccccc12 Amb27603982 [0,1,0,1,0,0|2,0,0]=4 5111 B13R2.328 Cc1cc(C)c2ccccc2c1 Amb6296604 [0,1,0,1,0,0|1,0,0]=3 5112 B13R2.328 Cc1cc(C)c2ccccc2n1 Amb4037272 [0,1,0,1,0,0|2,0,0]=4 5113 B13R2.328 Cc1cc(C)c2cccnc2c1 Amb18353755 [0,1,0,1,0,0|2,0,0]=4 5114 B13R2.328 Cc1cc(C)c2ccncc2c1 Amb24086382 [0,1,0,1,0,0|2,0,0]=4 5115 B13R2.328 Cc1cc(C)c2cnccc2c1 Amb27626041 [0,1,0,1,0,0|2,0,0]=4 5116 B13R2.328 Cc1cc(C)c2ncccc2c1 Amb18355306 [0,1,0,1,0,0|2,0,0]=4 5117 B13R2.328 Cc1cc(C)c2ncccc2c1 Amb20171154 [0,1,0,1,0,0|2,0,0]=4 5118 B13R2.328 Cc1cc(Cl)c2ccccc2n1 Amb22496125 [0,1,0,1,0,0|2,0,0]=4 5119 B13R2.328 Cc1cc(Cl)c2ccccc2n1 Amb6335281 [0,1,0,1,0,0|2,0,0]=4 5120 B13R2.328 Cc1cc(Cl)c2cccnc2c1 Amb23580774 [0,1,0,1,0,0|2,0,0]=4 5121 B13R2.328 Cc1cc(Cl)c2ccncc2c1 Amb32670344 [0,1,0,1,0,0|2,0,0]=4 5122 B13R2.328 Cc1cc(Cl)c2cnccc2c1 Amb31156557 [0,1,0,1,0,0|2,0,0]=4 5123 B13R2.328 Cc1cc(Cl)c2ncccc2c1 Amb21858699 [0,1,0,1,0,0|2,0,0]=4 5124 B13R2.328 Cc1cc(Cl)cc2ccccc12 Amb27231656 [0,1,0,1,0,0|2,0,0]=4 5125 B13R2.328 Cc1cc(F)c2cnccc2c1 Amb32795008 [0,1,0,1,0,0|2,0,0]=4 5126 B13R2.328 Cc1cc(F)c2ncccc2c1 Amb6892905 [0,1,0,1,0,0|2,0,0]=4 5127 B13R2.328 Cc1cc(F)cc2ccccc12 Amb26895615 [0,1,0,1,0,0|2,0,0]=4 5128 B13R2.328 Cc1cc(I)c2ccccc2c1 Amb26442248 [0,1,0,1,0,0|1,0,0]=3 5129 B13R2.328 Cc1cc(I)c2ccccc2n1 Amb22756186 [0,1,0,1,0,0|2,0,0]=4 5130 B13R2.328 Cc1cc(I)cc2ccccc12 Amb24427637 [0,1,0,1,0,0|2,0,0]=4 5131 B13R2.328 Cc1cc(N)c2ccccc2c1 Amb18644932 [0,1,0,1,0,0|1,0,0]=3 5132 B13R2.328 Cc1cc(N)c2ccccc2n1 Amb1204080 [0,1,0,1,0,0|2,0,0]=4 5133 B13R2.328 Cc1cc(N)c2cnccc2c1 Amb32650248 [0,1,0,1,0,0|2,0,0]=4 5134 B13R2.328 Cc1cc(N)c2ncccc2c1 Amb2721852 [0,1,0,1,0,0|2,0,0]=4 5135 B13R2.328 Cc1cc(N)c2ncccc2c1 Amb33299405 [0,1,0,1,0,0|2,0,0]=4 5136 B13R2.328 Cc1cc(N)cc2ccccc12 Amb18126074 [0,1,0,1,0,0|2,0,0]=4 5137 B13R2.328 Cc1cc(O)c2ccccc2n1 Amb1796824 [0,1,0,1,0,0|1,0,1]=4 5138 B13R2.328 Cc1cc(O)c2cccnc2c1 Amb23589101 [0,1,0,1,0,0|1,0,1]=4 5139 B13R2.328 Cc1cc(O)c2ncccc2c1 Amb18645162 [0,1,0,1,0,0|1,0,1]=4 5140 B13R2.328 Cc1cc(O)cc2ccccc12 Amb18645052 [0,1,0,1,0,0|2,0,0]=4 5141 B13R2.328 Cc1cc(S)c2ccccc2n1 Amb534230 [0,1,0,1,0,0|1,1,0]=4 5142 B13R2.328 Cc1cc2ccccc2[n+]([O-])c1 Amb33141042 [0,1,0,1,0,0|0,0,1]=3 5143 B13R2.328 Cc1cc2ccccc2[n+]([O-])c1 Amb9826886 [0,1,0,1,0,0|0,0,1]=3 5144 B13R2.328 Cc1cc2ccccc2c(Br)n1 Amb18346662 [0,1,0,1,0,0|1,0,0]=3 5145 B13R2.328 Cc1cc2ccccc2c(C)n1 Amb24382962 [0,1,0,1,0,0|1,0,0]=3 5146 B13R2.328 Cc1cc2ccccc2c(C)p1 Amb28461003 [0,1,0,1,0,0|1,0,0]=3 5147 B13R2.328 Cc1cc2ccccc2c(Cl)n1 Amb18790902 [0,1,0,1,0,0|1,0,0]=3 5148 B13R2.328 Cc1cc2ccccc2c(N)n1 Amb23589139 [0,1,0,1,0,0|1,0,0]=3 5149 B13R2.328 Cc1cc2ccccc2c(O)n1 Amb18645154 [0,1,0,1,0,0|0,0,1]=3 5150 B13R2.328 Cc1cc2ccccc2n(=O)c1 Amb20247263 [0,1,0,1,0,0|0,0,0]=2 5151 B13R2.328 Cc1cc2cccnc2c(Br)n1 Amb23440806 [0,1,0,1,0,0|2,0,0]=4 5152 B13R2.328 Cc1cc2cccnc2c(Cl)n1 Amb23590786 [0,1,0,1,0,0|2,0,0]=4 5153 B13R2.328 Cc1cc2cccnc2c(N)n1 Amb10879388 [0,1,0,1,0,0|2,0,0]=4 5154 B13R2.328 Cc1cc2cnccc2c(Cl)n1 Amb28244711 [0,1,0,1,0,0|2,0,0]=4 5155 B13R2.328 Cc1cc2ncccc2c(N)n1 Amb27186109 [0,1,0,1,0,0|2,0,0]=4 5156 B13R2.328 Cc1nc(=O)c2ccccc2o1 Amb344572 [0,1,0,1,0,0|1,0,0]=3 5157 B13R2.328 Cc1nc(Br)c2ccccc2n1 Amb20618768 [0,1,0,1,0,0|2,0,0]=4 5158 B13R2.328 Cc1nc(Br)cc2ccccc12 Amb22494860 [0,1,0,1,0,0|2,0,0]=4 5159 B13R2.328 Cc1nc(C)c2ccccc2n1 Amb19957953 [0,1,0,1,0,0|2,0,0]=4 5160 B13R2.328 Cc1nc(Cl)c2ccccc2n1 Amb4449857 [0,1,0,1,0,0|2,0,0]=4 5161 B13R2.328 Cc1nc(Cl)cc2ccccc12 Amb25692259 [0,1,0,1,0,0|2,0,0]=4 5162 B13R2.328 Cc1nc(F)c2ccccc2n1 Amb35643322 [0,1,0,1,0,0|2,0,0]=4 5163 B13R2.328 Cc1nc(N)c2ccccc2n1 Amb5385927 [0,1,0,1,0,0|2,0,0]=4 5164 B13R2.328 Cc1nc(N)cc2ccccc12 Amb22491342 [0,1,0,1,0,0|2,0,0]=4 5165 B13R2.328 Cc1nc(O)c2ccccc2n1 Amb6540413 [0,1,0,1,0,0|1,0,1]=4 5166 B13R2.328 Cc1nc(S)c2ccccc2n1 Amb1105825 [0,1,0,1,0,0|1,1,0]=4 5167 B13R2.328 Cc1nc2ccccc2c(=O)o1 Amb1216866 [0,1,0,1,0,0|1,0,0]=3 5168 B13R2.328 Cc1nc2cccnc2c(=O)o1 Amb5720887 [0,1,0,1,0,0|2,0,0]=4 5169 B13R2.328 Clc1cc(Br)c2ccccc2c1 Amb28411408 [0,1,0,1,0,0|2,0,0]=4 5170 B13R2.328 Clc1cc(Cl)c2ccccc2c1 Amb27233231 [0,1,0,1,0,0|2,0,0]=4 5171 B13R2.328 Clc1cc(I)cc2ccccc12 Amb25217612 [0,1,0,1,0,0|2,0,0]=4 5172 B13R2.328 Clc1cc2ccccc2c(Cl)n1 Amb1156942 [0,1,0,1,0,0|2,0,0]=4 5173 B13R2.328 Clc1nc(Br)cc2ccccc12 Amb20242096 [0,1,0,1,0,0|2,0,0]=4 5174 B13R2.328 Fc1cc(Br)c2ccccc2c1 Amb26969445 [0,1,0,1,0,0|2,0,0]=4 5175 B13R2.328 Fc1cc(Br)cc2ccccc12 Amb8629527 [0,1,0,1,0,0|2,0,0]=4 5176 B13R2.328 Fc1cc(Cl)c2ccccc2c1 Amb25121500 [0,1,0,1,0,0|2,0,0]=4 5177 B13R2.328 Fc1cc(Cl)cc2ccccc12 Amb26511445 [0,1,0,1,0,0|2,0,0]=4 5178 B13R2.328 Fc1cc(F)c2ccccc2c1 Amb26319288 [0,1,0,1,0,0|2,0,0]=4 5179 B13R2.328 Fc1cc(I)c2ccccc2c1 Amb26024837 [0,1,0,1,0,0|2,0,0]=4 5180 B13R2.328 Fc1cc(I)cc2ccccc12 Amb22547559 [0,1,0,1,0,0|2,0,0]=4 5181 B13R2.328 Fc1cc2ccccc2c(Br)n1 Amb26055863 [0,1,0,1,0,0|2,0,0]=4 5182 B13R2.328 Fc1cc2ccccc2c(F)n1 Amb27638755 [0,1,0,1,0,0|2,0,0]=4 5183 B13R2.328 Fc1nc(Cl)cc2ccccc12 Amb25312649 [0,1,0,1,0,0|2,0,0]=4 5184 B13R2.328 Ic1cc(I)c2ccccc2c1 Amb25848812 [0,1,0,1,0,0|2,0,0]=4 5185 B13R2.328 NC1=C2C=CC=CC2=CC(=O)N1 Amb24511574 [0,1,0,1,0,0|2,0,0]=4 5186 B13R2.328 NC1=CC(=O)c2ccccc2N1 Amb21856421 [0,1,0,1,0,0|2,0,0]=4 5187 B13R2.328 NC1=CC(=O)c2ccccc2O1 Amb19870090 [0,1,0,1,0,0|2,0,0]=4 5188 B13R2.328 NC1=CC(=O)c2ccccc2S1 Amb25097114 [0,1,0,1,0,0|2,0,0]=4 5189 B13R2.328 NC1=Cc2ccccc2C(=O)N1 Amb18943964 [0,1,0,1,0,0|1,0,0]=3 5190 B13R2.328 NC1=NC(=O)c2ccccc2N1 Amb19665071 [0,1,0,1,0,0|2,0,0]=4 5191 B13R2.328 NC1=Nc2ccccc2C(=O)N1 Amb17933195 [0,1,0,1,0,0|2,0,0]=4 5192 B13R2.328 NC1=Nc2ccccc2C(=O)S1 Amb19756356 [0,1,0,1,0,0|2,0,0]=4 5193 B13R2.328 Nc1cc(Br)c2ccccc2c1 Amb17596046 [0,1,0,1,0,0|2,0,0]=4 5194 B13R2.328 Nc1cc(Br)c2ccccc2c1 Amb32675699 [0,1,0,1,0,0|2,0,0]=4 5195 B13R2.328 Nc1cc(Br)cc2ccccc12 Amb17596048 [0,1,0,1,0,0|2,0,0]=4 5196 B13R2.328 Nc1cc(Br)cc2ccccc12 Amb32992791 [0,1,0,1,0,0|2,0,0]=4 5197 B13R2.328 Nc1cc(Cl)c2ccccc2c1 Amb17594518 [0,1,0,1,0,0|2,0,0]=4 5198 B13R2.328 Nc1cc(Cl)cc2ccccc12 Amb17594522 [0,1,0,1,0,0|2,0,0]=4 5199 B13R2.328 Nc1cc(F)cc2ccccc12 Amb26464234 [0,1,0,1,0,0|2,0,0]=4 5200 B13R2.328 Nc1cc(I)cc2ccccc12 Amb26016187 [0,1,0,1,0,0|2,0,0]=4 5201 B13R2.328 Nc1cc(N)c2ccccc2c1 Amb17593963 [0,1,0,1,0,0|2,0,0]=4 5202 B13R2.328 Nc1cc(O)c2ccccc2c1 Amb17593981 [0,1,0,1,0,0|1,0,1]=4 5203 B13R2.328 Nc1cc(O)c2ccccc2c1 Amb28555827 [0,1,0,1,0,0|1,0,1]=4 5204 B13R2.328 Nc1cc(O)cc2ccccc12 Amb18048469 [0,1,0,1,0,0|2,0,0]=4 5205 B13R2.328 Nc1cc2ccccc2[n+]([O-])c1 Amb26480726 [0,1,0,1,0,0|1,0,1]=4 5206 B13R2.328 Nc1cc2ccccc2c(Br)n1 Amb2609969 [0,1,0,1,0,0|2,0,0]=4 5207 B13R2.328 Nc1cc2ccccc2c(Cl)n1 Amb18648196 [0,1,0,1,0,0|2,0,0]=4 5208 B13R2.328 Nc1nc(Br)cc2ccccc12 Amb25699182 [0,1,0,1,0,0|2,0,0]=4 5209 B13R2.328 Nc1nc(Cl)cc2ccccc12 Amb22749871 [0,1,0,1,0,0|2,0,0]=4 5210 B13R2.328 Nc1nc(S)cc2ccccc12 Amb27484730 [0,1,0,1,0,0|2,0,0]=4 5211 B13R2.328 Nc1nc2ccccc2c(=O)o1 Amb24081051 [0,1,0,1,0,0|2,0,0]=4 5212 B13R2.328 O=C1C=C(Cl)Nc2ccccc21 Amb22500808 [0,1,0,1,0,0|2,0,0]=4 5213 B13R2.328 O=C1C=C(Cl)Oc2ccccc21 Amb28140666 [0,1,0,1,0,0|2,0,0]=4 5214 B13R2.328 O=C1C=C(O)Sc2ccccc21 Amb26517364 [0,1,0,1,0,0|2,0,0]=4 5215 B13R2.328 O=C1C=C(S)Oc2ccccc21 Amb27407667 [0,1,0,1,0,0|2,0,0]=4 5216 B13R2.328 O=C1C=C2C=CC=CC2=C(Br)N1 Amb26067798 [0,1,0,1,0,0|2,0,0]=4 5217 B13R2.328 O=C1C=C2C=CC=CC2=C(I)N1 Amb27624963 [0,1,0,1,0,0|2,0,0]=4 5218 B13R2.328 O=C1CC(=O)c2ccccc2N1 Amb22263121 [0,1,0,1,0,0|2,0,0]=4 5219 B13R2.328 O=C1CC(=O)c2ccccc2O1 Amb19748567 [0,1,0,1,0,0|2,0,0]=4 5220 B13R2.328 O=C1CC(=S)Oc2ccccc21 Amb27193516 [0,1,0,1,0,0|2,0,0]=4 5221 B13R2.328 O=C1Cc2ccccc2C(=O)N1 Amb1221580 [0,1,0,1,0,0|1,0,1]=4 5222 B13R2.328 O=C1Cc2ccccc2C(=O)O1 Amb1157145 [0,1,0,1,0,0|1,0,1]=4 5223 B13R2.328 O=C1N=C(Cl)Sc2ccccc21 Amb19513972 [0,1,0,1,0,0|2,0,0]=4 5224 B13R2.328 O=C1N=C(S)Nc2ccccc21 Amb19748659 [0,1,0,1,0,0|2,0,0]=4 5225 B13R2.328 O=C1N=C(S)Sc2ccccc21 Amb19906700 [0,1,0,1,0,0|2,0,0]=4 5226 B13R2.328 O=C1NC(=O)c2ccccc2N1 Amb18005794 [0,1,0,1,0,0|2,0,0]=4 5227 B13R2.328 O=C1NC(=O)c2ccccc2O1 Amb20243206 [0,1,0,1,0,0|2,0,0]=4 5228 B13R2.328 O=C1NC(=O)c2ccccc2S1 Amb22036855 [0,1,0,1,0,0|2,0,0]=4 5229 B13R2.328 O=C1NC(=S)Nc2ccccc21 Amb18010655 [0,1,0,1,0,0|2,0,0]=4 5230 B13R2.328 O=C1NC(=S)Oc2ccccc21 Amb27170743 [0,1,0,1,0,0|2,0,0]=4 5231 B13R2.328 O=C1NC(=S)Sc2ccccc21 Amb19651119 [0,1,0,1,0,0|2,0,0]=4 5232 B13R2.328 O=C1NC(Br)=Cc2ccccc21 Amb25971614 [0,1,0,1,0,0|1,0,0]=3 5233 B13R2.328 O=C1NC(Cl)=Cc2ccccc21 Amb19269127 [0,1,0,1,0,0|1,0,0]=3 5234 B13R2.328 O=C1NC(Cl)=Nc2ccccc21 Amb20171410 [0,1,0,1,0,0|2,0,0]=4 5235 B13R2.328 O=C1NC(S)=Nc2ccccc21 Amb19517606 [0,1,0,1,0,0|2,0,0]=4 5236 B13R2.328 O=C1Nc2ccccc2C(=O)O1 Amb18183505 [0,1,0,1,0,0|2,0,0]=4 5237 B13R2.328 O=C1OC(Cl)=Cc2ccccc21 Amb27786314 [0,1,0,1,0,0|1,0,0]=3 5238 B13R2.328 O=C1OC(O)=Nc2ccccc21 Amb22569820 [0,1,0,1,0,0|2,0,0]=4 5239 B13R2.328 O=C1SC(S)=Nc2ccccc21 Amb22359116 [0,1,0,1,0,0|2,0,0]=4 5240 B13R2.328 Oc1cc(Br)c2ccccc2c1 Amb17596081 [0,1,0,1,0,0|2,0,0]=4 5241 B13R2.328 Oc1cc(Br)cc2ccccc12 Amb17596075 [0,1,0,1,0,0|1,0,1]=4 5242 B13R2.328 Oc1cc(Cl)cc2ccccc12 Amb17594569 [0,1,0,1,0,0|1,0,1]=4 5243 B13R2.328 Oc1cc(F)c2ccccc2c1 Amb26843113 [0,1,0,1,0,0|2,0,0]=4 5244 B13R2.328 Oc1cc(F)cc2ccccc12 Amb26966920 [0,1,0,1,0,0|1,0,1]=4 5245 B13R2.328 Oc1cc(I)c2ccccc2c1 Amb26850789 [0,1,0,1,0,0|2,0,0]=4 5246 B13R2.328 Oc1cc(I)cc2ccccc12 Amb27260646 [0,1,0,1,0,0|1,0,1]=4 5247 B13R2.328 Oc1cc(O)c2ccccc2c1 Amb6357421 [0,1,0,1,0,0|1,0,1]=4 5248 B13R2.328 Sc1nc(Cl)cc2ccccc12 Amb25273217 [0,1,0,1,0,0|1,1,0]=4 5249 B13R2.328 [NH-][n+]1cc(Br)cc2ccccc21 Amb24110830 [0,1,0,1,0,0|2,0,0]=4 5250 B13R2.328 [O-][n+]1cc(Br)cc2ccccc21 Amb2610670 [0,1,0,1,0,0|1,0,1]=4 5251 B13R2.328 [O-][n+]1cc(F)cc2ccccc21 Amb27668932 [0,1,0,1,0,0|1,0,1]=4 5252 B13R2.328 [O-][n+]1cc(O)cc2ccccc21 Amb25873892 [0,1,0,1,0,0|1,0,1]=4 5253 B13R2.444 C\C(=C/c1ccccc1)C2CO2 Amb32953224 [0,1,0,1,0,0|0,0,2]=4 5254 B13R2.444 C\C(=C/c1ccccc1)[C@@H]2CO2 Amb33381484 [0,1,0,1,0,0|0,0,2]=4 5255 B13R2.444 C\C(=C/c1ccccc1)[C@H]2CO2 Amb33381508 [0,1,0,1,0,0|0,0,2]=4 5256 B13R2.45 BrCC1=Cc2ccccc2C1Br Amb22359598 [0,1,0,1,0,0|1,0,1]=4 5257 B13R2.45 BrCc1oc2ccccc2c1Br Amb32665146 [0,1,0,1,0,0|2,0,0]=4 5258 B13R2.45 C#Cc1cc2ccccc2n1C Amb26893375 [0,1,0,1,0,0|1,0,1]=4 5259 B13R2.45 C=Cc1cc2ccccc2n1C Amb24656723 [0,1,0,1,0,0|1,0,0]=3 5260 B13R2.45 C=Cc1oc2ccccc2c1C Amb24102391 [0,1,0,1,0,0|2,0,0]=4 5261 B13R2.45 CC1=C(C#N)Cc2ccccc21 Amb17778901 [0,1,0,1,0,0|1,0,1]=4 5262 B13R2.45 CC1=C(C=O)Cc2ccccc21 Amb25276375 [0,1,0,1,0,0|0,0,0]=2 5263 B13R2.45 CC1c2ccccc2NC1C=O Amb18829943 [0,1,0,1,0,0|1,0,1]=4 5264 B13R2.45 CCC1=Cc2ccccc2C1=O Amb27177754 [0,1,0,1,0,0|0,0,0]=2 5265 B13R2.45 CCC1Cc2ccccc2C1=O Amb4605959 [0,1,0,1,0,0|0,0,2]=4 5266 B13R2.45 CCC1Nc2ccccc2C1=O Amb17594018 [0,1,0,1,0,0|1,0,1]=4 5267 B13R2.45 CCC1Oc2ccccc2C1=O Amb24061517 [0,1,0,1,0,0|1,0,1]=4 5268 B13R2.45 CCC1Sc2ccccc2C1=O Amb27612959 [0,1,0,1,0,0|1,0,1]=4 5269 B13R2.45 CCN1Cc2ccccc2C1=O Amb27400274 [0,1,0,1,0,0|1,0,1]=4 5270 B13R2.45 CCN1Nc2ccccc2C1=O Amb26871870 [0,1,0,1,0,0|2,0,0]=4 5271 B13R2.45 CCN1Sc2ccccc2C1=O Amb27977546 [0,1,0,1,0,0|2,0,0]=4 5272 B13R2.45 CC[C@@H]1Cc2ccccc2C1=O Amb27262889 [0,1,0,1,0,0|0,0,2]=4 5273 B13R2.45 CCc1cc2ccccn2c1Br Amb18559302 [0,1,0,1,0,0|2,0,0]=4 5274 B13R2.45 CCc1cc2ccccn2c1N Amb18559303 [0,1,0,1,0,0|2,0,0]=4 5275 B13R2.45 CCc1cc2ccocc2c1N Amb25697612 [0,1,0,1,0,0|2,0,0]=4 5276 B13R2.45 CCc1oc2ccccc2c1Br Amb10569511 [0,1,0,1,0,0|2,0,0]=4 5277 B13R2.45 CCc1sc2ccccc2c1C Amb27186788 [0,1,0,1,0,0|2,0,0]=4 5278 B13R2.45 CNc1cc2ccccc2n1C Amb22753877 [0,1,0,1,0,0|2,0,0]=4 5279 B13R2.45 COC1=Nc2ccccc2C1=O Amb28122389 [0,1,0,1,0,0|1,0,0]=3 5280 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,1,0,1,0,0|0,0,2]=4 5281 B13R2.45 COc1cn2ccccc2c1C Amb28252492 [0,1,0,1,0,0|2,0,0]=4 5282 B13R2.45 COc1sc2ccccc2c1C Amb27634358 [0,1,0,1,0,0|2,0,0]=4 5283 B13R2.45 CSC1Cc2ccccc2C1=O Amb28054308 [0,1,0,1,0,0|0,0,2]=4 5284 B13R2.45 C\C=C1/Cc2ccccc2C1=O Amb28076573 [0,1,0,1,0,0|0,0,1]=3 5285 B13R2.45 Cc1c(C=O)cc2ccccn12 Amb24407253 [0,1,0,1,0,0|1,0,0]=3 5286 B13R2.45 Cc1c(C=O)nc2ccccn12 Amb22886668 [0,1,0,1,0,0|2,0,0]=4 5287 B13R2.45 Cc1c(C=O)oc2ccccc12 Amb2702463 [0,1,0,1,0,0|1,0,0]=3 5288 B13R2.45 Cc1c(C=O)sc2ccccc12 Amb2725058 [0,1,0,1,0,0|1,0,0]=3 5289 B13R2.45 Cc1c(C=O)sc2cccnc12 Amb18139838 [0,1,0,1,0,0|2,0,0]=4 5290 B13R2.45 Cc1c(C=O)sc2ccncc12 Amb18141158 [0,1,0,1,0,0|2,0,0]=4 5291 B13R2.45 Cc1c(C=O)sc2cnccc12 Amb18675143 [0,1,0,1,0,0|2,0,0]=4 5292 B13R2.45 Cc1c(C=O)sc2ncccc12 Amb18141153 [0,1,0,1,0,0|2,0,0]=4 5293 B13R2.45 Cc1c(CBr)oc2ccccc12 Amb26953529 [0,1,0,1,0,0|2,0,0]=4 5294 B13R2.45 Cc1c(CCl)oc2ccccc12 Amb19649864 [0,1,0,1,0,0|2,0,0]=4 5295 B13R2.45 Cc1c(CCl)sc2ccccc12 Amb26452002 [0,1,0,1,0,0|2,0,0]=4 5296 B13R2.45 Cc1c(CN)oc2ccccc12 Amb15701585 [0,1,0,1,0,0|2,0,0]=4 5297 B13R2.45 Cc1c(CN)oc2ccccc12 Amb35788738 [0,1,0,1,0,0|2,0,0]=4 5298 B13R2.45 Cc1c(CO)oc2ccccc12 Amb18554026 [0,1,0,1,0,0|2,0,0]=4 5299 B13R2.45 Cc1c(CO)sc2ccccc12 Amb3430711 [0,1,0,1,0,0|2,0,0]=4 5300 B13R2.45 Cc1c(CS)oc2ccccc12 Amb33372615 [0,1,0,1,0,0|2,0,0]=4 5301 B13R2.45 ClCc1sc2ccccc2c1Cl Amb1157174 [0,1,0,1,0,0|2,0,0]=4 5302 B13R2.45 Clc1c(CBr)sc2ccccc12 Amb2608910 [0,1,0,1,0,0|2,0,0]=4 5303 B13R2.45 Cn1c(C#N)cc2ccccc21 Amb18644812 [0,1,0,1,0,0|1,0,1]=4 5304 B13R2.45 Cn1c(C=O)cc2ccccc21 Amb534693 [0,1,0,1,0,0|0,0,0]=2 5305 B13R2.45 Cn1c(C=O)cc2cccnc21 Amb18830239 [0,1,0,1,0,0|1,0,0]=3 5306 B13R2.45 Cn1c(C=O)cc2ccncc21 Amb18830233 [0,1,0,1,0,0|1,0,0]=3 5307 B13R2.45 Cn1c(C=O)cc2cnccc21 Amb18830237 [0,1,0,1,0,0|1,0,0]=3 5308 B13R2.45 Cn1c(C=O)cc2cncnc21 Amb18830015 [0,1,0,1,0,0|2,0,0]=4 5309 B13R2.45 Cn1c(C=O)cc2ncccc21 Amb18830240 [0,1,0,1,0,0|1,0,0]=3 5310 B13R2.45 Cn1c(C=O)nc2ccccc21 Amb6336137 [0,1,0,1,0,0|1,0,0]=3 5311 B13R2.45 Cn1c(C=O)nc2cccnc21 Amb18830058 [0,1,0,1,0,0|2,0,0]=4 5312 B13R2.45 Cn1c(C=O)nc2ccncc21 Amb18830060 [0,1,0,1,0,0|2,0,0]=4 5313 B13R2.45 Cn1c(C=O)nc2ncccc21 Amb18830059 [0,1,0,1,0,0|2,0,0]=4 5314 B13R2.45 Cn1c(C=O)nc2ncccc21 Amb21864645 [0,1,0,1,0,0|2,0,0]=4 5315 B13R2.45 Cn1c(CBr)cc2ccccc21 Amb23401676 [0,1,0,1,0,0|1,0,1]=4 5316 B13R2.45 Cn1c(CCl)cc2ccccc21 Amb23400182 [0,1,0,1,0,0|1,0,1]=4 5317 B13R2.45 Cn1c(CN)cc2ccccc21 Amb10071078 [0,1,0,1,0,0|1,0,1]=4 5318 B13R2.45 Cn1c(CO)cc2ccccc21 Amb22224825 [0,1,0,1,0,0|0,0,2]=4 5319 B13R2.45 Cn1c(CS)cc2ccccc21 Amb33142751 [0,1,0,1,0,0|0,1,1]=4 5320 B13R2.45 N#CC1=C(N)c2ccccc2C1 Amb9786087 [0,1,0,1,0,0|1,0,1]=4 5321 B13R2.45 N=Cc1oc2ccccc2c1O Amb26023954 [0,1,0,1,0,0|2,0,0]=4 5322 B13R2.45 N=Cc1sc2ccccc2c1O Amb27441867 [0,1,0,1,0,0|2,0,0]=4 5323 B13R2.45 N=Cc1sc2ccccc2c1S Amb28368586 [0,1,0,1,0,0|2,0,0]=4 5324 B13R2.45 NCC1=Cc2ccccc2C1=O Amb27466253 [0,1,0,1,0,0|0,0,0]=2 5325 B13R2.45 NCC1Cc2ccccc2C1=O Amb27857480 [0,1,0,1,0,0|0,0,2]=4 5326 B13R2.45 NCc1oc2ccccc2c1Br Amb27796056 [0,1,0,1,0,0|2,0,0]=4 5327 B13R2.45 NCc1oc2ccccc2c1O Amb27641904 [0,1,0,1,0,0|1,0,1]=4 5328 B13R2.45 NCc1sc2ccccc2c1Br Amb2614560 [0,1,0,1,0,0|2,0,0]=4 5329 B13R2.45 NCc1sc2ccccc2c1Cl Amb22586794 [0,1,0,1,0,0|2,0,0]=4 5330 B13R2.45 NCc1sc2ccccc2c1N Amb23402513 [0,1,0,1,0,0|2,0,0]=4 5331 B13R2.45 NCc1sc2ccccc2c1O Amb27624946 [0,1,0,1,0,0|1,0,1]=4 5332 B13R2.45 N\C=C1/Cc2ccccc2C1=O Amb26398787 [0,1,0,1,0,0|1,0,0]=3 5333 B13R2.45 N\C=C1\Cc2ccccc2C1=O Amb24553059 [0,1,0,1,0,0|1,0,0]=3 5334 B13R2.45 N\C=C1\Nc2ccccc2C1=O Amb2637551 [0,1,0,1,0,0|1,0,1]=4 5335 B13R2.45 N\C=C1\Sc2ccccc2C1=O Amb27959187 [0,1,0,1,0,0|1,0,1]=4 5336 B13R2.45 N\N=C1\Oc2ccccc2C1=O Amb28351488 [0,1,0,1,0,0|2,0,0]=4 5337 B13R2.45 Nc1c(C=O)nc2ccccn12 Amb18830012 [0,1,0,1,0,0|2,0,0]=4 5338 B13R2.45 Nc1c(C=O)oc2ccccc12 Amb18830111 [0,1,0,1,0,0|1,0,0]=3 5339 B13R2.45 Nc1c(C=O)sc2ccccc12 Amb18825002 [0,1,0,1,0,0|1,0,0]=3 5340 B13R2.45 Nc1c(CBr)sc2ccccc12 Amb27986113 [0,1,0,1,0,0|2,0,0]=4 5341 B13R2.45 Nc1c(CO)cn2ccccc12 Amb24488650 [0,1,0,1,0,0|2,0,0]=4 5342 B13R2.45 Nc1c(CO)sc2ccccc12 Amb23403643 [0,1,0,1,0,0|2,0,0]=4 5343 B13R2.45 O=C1C(CO)=Cc2ccccc21 Amb27805332 [0,1,0,1,0,0|0,0,0]=2 5344 B13R2.45 O=C1\C(=C/[O-])Cc2ccccc21 Amb28241911 [0,1,0,1,0,0|0,0,1]=3 5345 B13R2.45 O=C1\C(=C\Cl)Cc2ccccc21 Amb27865662 [0,1,0,1,0,0|1,0,0]=3 5346 B13R2.45 O=C1\C(=C\O)Nc2ccccc21 Amb27175913 [0,1,0,1,0,0|1,0,1]=4 5347 B13R2.45 O=C1\C(=C\[O-])Cc2ccccc21 Amb20669424 [0,1,0,1,0,0|0,0,1]=3 5348 B13R2.45 O=C1\C(=N/O)Cc2ccccc21 Amb2610323 [0,1,0,1,0,0|1,0,1]=4 5349 B13R2.45 O=C1\C(=N\O)Cc2ccccc21 Amb22348033 [0,1,0,1,0,0|1,0,1]=4 5350 B13R2.45 O=C1c2ccccc2CN1CO Amb28188217 [0,1,0,1,0,0|1,0,1]=4 5351 B13R2.45 O=CC1Cc2cccnc2C1=O Amb33356129 [0,1,0,1,0,0|1,0,1]=4 5352 B13R2.45 O=CC1Sc2ccccc2C1=O Amb26578767 [0,1,0,1,0,0|1,0,1]=4 5353 B13R2.45 O=Cc1nc2ccccn2c1Br Amb19515096 [0,1,0,1,0,0|2,0,0]=4 5354 B13R2.45 O=Cc1nc2ccccn2c1Br Amb2384529 [0,1,0,1,0,0|2,0,0]=4 5355 B13R2.45 O=Cc1nc2ccccn2c1Cl Amb2612935 [0,1,0,1,0,0|2,0,0]=4 5356 B13R2.45 O=Cc1oc2ccccc2c1Br Amb18134589 [0,1,0,1,0,0|1,0,0]=3 5357 B13R2.45 O=Cc1oc2ccccc2c1Cl Amb33528139 [0,1,0,1,0,0|1,0,0]=3 5358 B13R2.45 O=Cc1oc2ccccc2c1O Amb27636087 [0,1,0,1,0,0|1,0,0]=3 5359 B13R2.45 O=Cc1oc2cccnc2c1Br Amb18160777 [0,1,0,1,0,0|2,0,0]=4 5360 B13R2.45 O=Cc1oc2ccncc2c1Cl Amb18823882 [0,1,0,1,0,0|2,0,0]=4 5361 B13R2.45 O=Cc1oc2ncccc2c1Br Amb18160779 [0,1,0,1,0,0|2,0,0]=4 5362 B13R2.45 O=Cc1oc2ncccc2c1Cl Amb18648559 [0,1,0,1,0,0|2,0,0]=4 5363 B13R2.45 O=Cc1sc2cccc[n+]2c1[O-] Amb28042885 [0,1,0,1,0,0|2,0,0]=4 5364 B13R2.45 O=Cc1sc2ccccc2c1Br Amb18156446 [0,1,0,1,0,0|1,0,0]=3 5365 B13R2.45 O=Cc1sc2ccccc2c1Cl Amb6368941 [0,1,0,1,0,0|1,0,0]=3 5366 B13R2.45 O=Cc1sc2ccccc2c1I Amb22751335 [0,1,0,1,0,0|1,0,0]=3 5367 B13R2.45 O=Cc1sc2ccccc2c1O Amb4303853 [0,1,0,1,0,0|1,0,0]=3 5368 B13R2.45 O=Cc1sc2cccnc2c1Br Amb18727447 [0,1,0,1,0,0|2,0,0]=4 5369 B13R2.45 O=Cc1sc2cccnc2c1Cl Amb18812040 [0,1,0,1,0,0|2,0,0]=4 5370 B13R2.45 O=Cc1sc2ccncc2c1Br Amb18156162 [0,1,0,1,0,0|2,0,0]=4 5371 B13R2.45 O=Cc1sc2ccncc2c1Cl Amb18812039 [0,1,0,1,0,0|2,0,0]=4 5372 B13R2.45 O=Cc1sc2ncccc2c1Br Amb18728474 [0,1,0,1,0,0|2,0,0]=4 5373 B13R2.45 O=Cc1sc2ncccc2c1Cl Amb18812041 [0,1,0,1,0,0|2,0,0]=4 5374 B13R2.45 OCc1oc2ccccc2c1Br Amb24743941 [0,1,0,1,0,0|2,0,0]=4 5375 B13R2.45 OCc1sc2ccccc2c1Br Amb27631078 [0,1,0,1,0,0|2,0,0]=4 5376 B13R2.45 OCc1sc2ccccc2c1Cl Amb1157146 [0,1,0,1,0,0|2,0,0]=4 5377 B13R2.45 SCc1sc2ccccc2c1Cl Amb32650847 [0,1,0,1,0,0|2,0,0]=4 5378 B13R2.45 [N-]=[N+]=C1Cc2ccccc2C1=O Amb17593950 [0,1,0,1,0,0|1,0,1]=4 5379 B13R2.56 O=CC1CCC1c2ccccc2 Amb28290504 [0,1,0,1,0,0|0,0,2]=4 5380 B13R2.56 O=C[C@@H]1CC[C@@H]1c2ccccc2 Amb26951878 [0,1,0,1,0,0|0,0,2]=4 5381 B13R2.56 O=C[C@@H]1CC[C@H]1c2ccccc2 Amb26935631 [0,1,0,1,0,0|0,0,2]=4 5382 B13R2.56 O=C[C@H]1CC[C@H]1c2ccccc2 Amb26388586 [0,1,0,1,0,0|0,0,2]=4 5383 B13R2.382 C=C1CC1C(=O)c2ccccc2 Amb27177712 [0,1,0,1,0,0|1,0,1]=4 5384 B13R2.382 CC1=C([C@@H](O)c2ccccc2)C1 Amb28207381 [0,1,0,1,0,0|1,0,1]=4 5385 B13R2.382 CC1=C([C@H](O)c2ccccc2)C1 Amb27615227 [0,1,0,1,0,0|1,0,1]=4 5386 B13R2.633 CC1(c2ccccc2)CC1C=O Amb28351425 [0,1,0,1,0,0|0,0,2]=4 5387 B13R2.3085 CC1=C(C)c2ccccc2C1=O Amb27177578 [0,1,0,1,0,0|0,0,0]=2 5388 B13R2.3085 CC1=C(N)c2ccccc2C1=O Amb28127184 [0,1,0,1,0,0|0,0,0]=2 5389 B13R2.3085 CC1C(=N)c2ccccc2C1=O Amb27177779 [0,1,0,1,0,0|0,0,1]=3 5390 B13R2.3085 CC1C(=O)c2ccccc2C1=O Amb4009534 [0,1,0,1,0,0|0,0,1]=3 5391 B13R2.3085 CC1C(=O)c2ccccc2C1Cl Amb27865661 [0,1,0,1,0,0|0,0,2]=4 5392 B13R2.3085 CN1C(=O)C(=O)c2ccccc21 Amb6335574 [0,1,0,1,0,0|2,0,0]=4 5393 B13R2.3085 CN1C(=O)c2ccccc2C1=O Amb5794489 [0,1,0,1,0,0|1,0,0]=3 5394 B13R2.3085 CN1C(=O)c2ccccc2C1O Amb1155091 [0,1,0,1,0,0|1,0,1]=4 5395 B13R2.3085 CN1C(=O)c2ccncc2C1=O Amb27658728 [0,1,0,1,0,0|2,0,0]=4 5396 B13R2.3085 C[C@@H]1C(=O)c2ccccc2[C@H]1C Amb27195793 [0,1,0,1,0,0|0,0,2]=4 5397 B13R2.3085 Cc1c(Br)c2ccccc2n1C Amb17133648 [0,1,0,1,0,0|2,0,0]=4 5398 B13R2.3085 Cc1c(C)c2ccocc2c1N Amb27812228 [0,1,0,1,0,0|2,0,0]=4 5399 B13R2.3085 Cc1c(C)n(C)c2ccccc12 Amb26899733 [0,1,0,1,0,0|2,0,0]=4 5400 B13R2.3085 Cc1c(I)c2ccccc2n1C Amb17134454 [0,1,0,1,0,0|2,0,0]=4 5401 B13R2.3085 Cc1c(N)c2ccccc2n1C Amb18563503 [0,1,0,1,0,0|2,0,0]=4 5402 B13R2.3085 Cc1c(N)c2cccoc2c1C Amb24497756 [0,1,0,1,0,0|2,0,0]=4 5403 B13R2.3085 Cc1c(O)c2ccccc2n1C Amb32732864 [0,1,0,1,0,0|1,0,1]=4 5404 B13R2.3085 Cc1c(S)c2ccccc2n1C Amb24361774 [0,1,0,1,0,0|1,1,0]=4 5405 B13R2.3085 N=C1C(=O)c2ccccc2C1=O Amb27176138 [0,1,0,1,0,0|1,0,0]=3 5406 B13R2.3085 N=C1c2ccccc2C(=O)C1N Amb27860216 [0,1,0,1,0,0|1,0,1]=4 5407 B13R2.3085 NC1C(=O)c2ccccc2C1=O Amb18645446 [0,1,0,1,0,0|1,0,1]=4 5408 B13R2.3085 NN1C(=O)c2ccccc2C1=O Amb1151859 [0,1,0,1,0,0|2,0,0]=4 5409 B13R2.3085 O=C1C(=O)N(Cl)c2ccccc21 Amb2720848 [0,1,0,1,0,0|2,0,0]=4 5410 B13R2.3085 O=C1C(=O)N(O)c2ccccc21 Amb27177861 [0,1,0,1,0,0|2,0,0]=4 5411 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb18048474 [0,1,0,1,0,0|1,0,0]=3 5412 B13R2.3085 O=C1C(=O)c2ccccc2C1=O Amb22001415 [0,1,0,1,0,0|1,0,0]=3 5413 B13R2.3085 O=C1c2ccccc2C(=O)C1Br Amb10071900 [0,1,0,1,0,0|1,0,1]=4 5414 B13R2.3085 O=C1c2ccccc2C(=O)C1Cl Amb19988287 [0,1,0,1,0,0|1,0,1]=4 5415 B13R2.3085 O=C1c2ccccc2C(=O)N1Br Amb6296045 [0,1,0,1,0,0|2,0,0]=4 5416 B13R2.3085 O=C1c2ccccc2C(=O)N1O Amb1351864 [0,1,0,1,0,0|2,0,0]=4 5417 B13R2.3085 O=C1c2ccccc2C(=O)N1[K] Amb21520437 [0,1,0,1,0,0|2,0,0]=4 5418 B13R2.3085 O=S1C(Br)=C(Br)c2ccccc21 Amb27163304 [0,1,0,1,0,0|2,0,0]=4 5419 B13R2.8137 O=C(c1ccccc1)N2C=CC2 Amb26848824 [0,1,0,1,0,0|2,0,0]=4 5420 B13R2.359 CC1=Cc2ccccc2S1(=O)=O Amb5717428 [0,1,0,1,0,0|1,0,0]=3 5421 B13R2.359 CC1=Nc2ccccc2S1(=O)=O Amb27767987 [0,1,0,1,0,0|2,0,0]=4 5422 B13R2.359 O=S1(=O)C(Br)=Cc2ccccc21 Amb5720553 [0,1,0,1,0,0|2,0,0]=4 5423 B13R2.369 Brc1cc2ccccc2cc1Br Amb4027856 [0,1,0,1,0,0|2,0,0]=4 5424 B13R2.369 Brc1cc2ccccc2cc1I Amb13883628 [0,1,0,1,0,0|2,0,0]=4 5425 B13R2.369 Brc1cc2ccccc2nc1Br Amb2609656 [0,1,0,1,0,0|2,0,0]=4 5426 B13R2.369 Brc1cc2ccccc2nc1I Amb24483630 [0,1,0,1,0,0|2,0,0]=4 5427 B13R2.369 Brc1nc2ccccc2cc1I Amb27665904 [0,1,0,1,0,0|2,0,0]=4 5428 B13R2.369 C=C1C=C2C=CC=CC2=CC1=O Amb27175861 [0,1,0,1,0,0|0,0,1]=3 5429 B13R2.369 C=C1Nc2ccccc2OC1=O Amb25996357 [0,1,0,1,0,0|1,0,1]=4 5430 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,1,0,1,0,0|0,0,0]=2 5431 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,1,0,1,0,0|0,0,0]=2 5432 B13R2.369 CC1=Cc2cccnc2NC1=O Amb22497900 [0,1,0,1,0,0|1,0,0]=3 5433 B13R2.369 CC1=Cc2cnccc2NC1=O Amb27876494 [0,1,0,1,0,0|1,0,0]=3 5434 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,1,0,1,0,0|1,0,0]=3 5435 B13R2.369 CC1=Nc2ccccc2NC1=S Amb18043495 [0,1,0,1,0,0|1,1,0]=4 5436 B13R2.369 CC1=Nc2ccccc2OC1=O Amb27482974 [0,1,0,1,0,0|1,0,0]=3 5437 B13R2.369 CC1=Nc2cccnc2NC1=O Amb19373141 [0,1,0,1,0,0|2,0,0]=4 5438 B13R2.369 CC1=Nc2ccncc2NC1=O Amb23597005 [0,1,0,1,0,0|2,0,0]=4 5439 B13R2.369 CC1=Nc2ncccc2NC1=O Amb26342261 [0,1,0,1,0,0|2,0,0]=4 5440 B13R2.369 CC1C=C2C=CC=CC2=NC1=O Amb22015245 [0,1,0,1,0,0|0,0,1]=3 5441 B13R2.369 CC1Cc2ccccc2CC1=O Amb28321881 [0,1,0,1,0,0|0,0,2]=4 5442 B13R2.369 CC1Cc2ccccc2NC1=O Amb10604462 [0,1,0,1,0,0|0,0,2]=4 5443 B13R2.369 CC1Nc2ccccc2NC1=O Amb2418151 [0,1,0,1,0,0|1,0,1]=4 5444 B13R2.369 CC1Nc2ccccc2OC1=O Amb17217247 [0,1,0,1,0,0|1,0,1]=4 5445 B13R2.369 CC1Oc2ccccc2NC1=O Amb2568450 [0,1,0,1,0,0|1,0,1]=4 5446 B13R2.369 CC1Sc2ccccc2CC1=O Amb27836849 [0,1,0,1,0,0|1,0,1]=4 5447 B13R2.369 CC1Sc2ccccc2NC1=O Amb2714505 [0,1,0,1,0,0|1,0,1]=4 5448 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,1,0,1,0,0|1,0,1]=4 5449 B13R2.369 CN1Cc2ccccc2NC1=O Amb6198737 [0,1,0,1,0,0|1,0,1]=4 5450 B13R2.369 CN1Cc2ccccc2OC1=O Amb28244326 [0,1,0,1,0,0|1,0,1]=4 5451 B13R2.369 C[C@H]1Nc2ccccc2NC1=O Amb24653859 [0,1,0,1,0,0|1,0,1]=4 5452 B13R2.369 Cc1cc2cccc[n+]2cc1C Amb2613497 [0,1,0,1,0,0|2,0,0]=4 5453 B13R2.369 Cc1cc2ccccc2c[n+]1[O-] Amb2612197 [0,1,0,1,0,0|1,0,1]=4 5454 B13R2.369 Cc1cc2ccccc2cc1Br Amb22228668 [0,1,0,1,0,0|1,0,0]=3 5455 B13R2.369 Cc1cc2ccccc2cc1C Amb4012683 [0,1,0,1,0,0|1,0,0]=3 5456 B13R2.369 Cc1cc2ccccc2cc1Cl Amb24408885 [0,1,0,1,0,0|1,0,0]=3 5457 B13R2.369 Cc1cc2ccccc2cc1F Amb24484265 [0,1,0,1,0,0|1,0,0]=3 5458 B13R2.369 Cc1cc2ccccc2cc1I Amb26457588 [0,1,0,1,0,0|1,0,0]=3 5459 B13R2.369 Cc1cc2ccccc2cc1N Amb22751118 [0,1,0,1,0,0|1,0,0]=3 5460 B13R2.369 Cc1cc2ccccc2cc1O Amb22262990 [0,1,0,1,0,0|0,0,1]=3 5461 B13R2.369 Cc1cc2ccccc2nc1Br Amb4057225 [0,1,0,1,0,0|1,0,0]=3 5462 B13R2.369 Cc1cc2ccccc2nc1C Amb2411347 [0,1,0,1,0,0|1,0,0]=3 5463 B13R2.369 Cc1cc2ccccc2nc1Cl Amb2447526 [0,1,0,1,0,0|1,0,0]=3 5464 B13R2.369 Cc1cc2ccccc2nc1F Amb34164902 [0,1,0,1,0,0|1,0,0]=3 5465 B13R2.369 Cc1cc2ccccc2nc1I Amb27840817 [0,1,0,1,0,0|1,0,0]=3 5466 B13R2.369 Cc1cc2ccccc2nc1N Amb9134109 [0,1,0,1,0,0|1,0,0]=3 5467 B13R2.369 Cc1cc2ccccc2nc1S Amb2786384 [0,1,0,1,0,0|0,1,0]=3 5468 B13R2.369 Cc1cc2cccnc2cc1Br Amb26041897 [0,1,0,1,0,0|2,0,0]=4 5469 B13R2.369 Cc1cc2cccnc2cc1C Amb24309324 [0,1,0,1,0,0|2,0,0]=4 5470 B13R2.369 Cc1cc2cccnc2cc1O Amb18645153 [0,1,0,1,0,0|1,0,1]=4 5471 B13R2.369 Cc1cc2cccnc2nc1Cl Amb22497901 [0,1,0,1,0,0|2,0,0]=4 5472 B13R2.369 Cc1cc2ccncc2cc1Br Amb27200092 [0,1,0,1,0,0|2,0,0]=4 5473 B13R2.369 Cc1cc2ccncc2cc1O Amb27262920 [0,1,0,1,0,0|1,0,1]=4 5474 B13R2.369 Cc1cc2ccncc2nc1Cl Amb9174243 [0,1,0,1,0,0|2,0,0]=4 5475 B13R2.369 Cc1cc2cnccc2cc1F Amb24485443 [0,1,0,1,0,0|2,0,0]=4 5476 B13R2.369 Cc1cc2cnccc2cc1O Amb21963927 [0,1,0,1,0,0|1,0,1]=4 5477 B13R2.369 Cc1cc2ncccc2cc1Br Amb21858684 [0,1,0,1,0,0|2,0,0]=4 5478 B13R2.369 Cc1cc2ncccc2cc1F Amb23504855 [0,1,0,1,0,0|2,0,0]=4 5479 B13R2.369 Cc1cc2ncccc2cc1N Amb594754 [0,1,0,1,0,0|2,0,0]=4 5480 B13R2.369 Cc1cc2ncccc2cc1O Amb18645152 [0,1,0,1,0,0|1,0,1]=4 5481 B13R2.369 Cc1cc2ncccc2cc1O Amb35747831 [0,1,0,1,0,0|1,0,1]=4 5482 B13R2.369 Cc1cc2ncccc2nc1Br Amb10879381 [0,1,0,1,0,0|2,0,0]=4 5483 B13R2.369 Cc1cc2ncccc2nc1Cl Amb7101485 [0,1,0,1,0,0|2,0,0]=4 5484 B13R2.369 Cc1cc2ncccc2nc1N Amb7101466 [0,1,0,1,0,0|2,0,0]=4 5485 B13R2.369 Cc1cc2ncccc2nc1O Amb7101465 [0,1,0,1,0,0|1,0,1]=4 5486 B13R2.369 Cc1nc2ccccc2cc1Br Amb2720703 [0,1,0,1,0,0|2,0,0]=4 5487 B13R2.369 Cc1nc2ccccc2cc1I Amb27628637 [0,1,0,1,0,0|2,0,0]=4 5488 B13R2.369 Cc1nc2ccccc2cc1N Amb18062093 [0,1,0,1,0,0|2,0,0]=4 5489 B13R2.369 Cc1nc2ccccc2cc1N Amb20239532 [0,1,0,1,0,0|2,0,0]=4 5490 B13R2.369 Cc1nc2ccccc2cc1O Amb660984 [0,1,0,1,0,0|1,0,1]=4 5491 B13R2.369 Cc1nc2ccccc2nc1Br Amb19374379 [0,1,0,1,0,0|2,0,0]=4 5492 B13R2.369 Cc1nc2ccccc2nc1C Amb4026039 [0,1,0,1,0,0|2,0,0]=4 5493 B13R2.369 Cc1nc2ccccc2nc1C Amb6339409 [0,1,0,1,0,0|2,0,0]=4 5494 B13R2.369 Cc1nc2ccccc2nc1Cl Amb6336175 [0,1,0,1,0,0|2,0,0]=4 5495 B13R2.369 Cc1nc2ccccc2nc1N Amb2609680 [0,1,0,1,0,0|2,0,0]=4 5496 B13R2.369 Cc1nc2ccccc2nc1O Amb631810 [0,1,0,1,0,0|1,0,1]=4 5497 B13R2.369 Cc1nc2ccccc2nc1S Amb6371739 [0,1,0,1,0,0|1,1,0]=4 5498 B13R2.369 Clc1cc2ccccc2cc1Br Amb26539587 [0,1,0,1,0,0|2,0,0]=4 5499 B13R2.369 Clc1cc2ccccc2cc1Cl Amb22730503 [0,1,0,1,0,0|2,0,0]=4 5500 B13R2.369 Clc1cc2ccccc2nc1Cl Amb19958556 [0,1,0,1,0,0|2,0,0]=4 5501 B13R2.369 Clc1cc2ccccc2nc1I Amb27603446 [0,1,0,1,0,0|2,0,0]=4 5502 B13R2.369 Clc1nc2ccccc2cc1Br Amb10606855 [0,1,0,1,0,0|2,0,0]=4 5503 B13R2.369 Fc1cc2ccccc2cc1Br Amb25351655 [0,1,0,1,0,0|2,0,0]=4 5504 B13R2.369 Fc1cc2ccccc2cc1Cl Amb24606517 [0,1,0,1,0,0|2,0,0]=4 5505 B13R2.369 Fc1cc2ccccc2cc1F Amb25100177 [0,1,0,1,0,0|2,0,0]=4 5506 B13R2.369 Fc1cc2ccccc2cc1I Amb28436689 [0,1,0,1,0,0|2,0,0]=4 5507 B13R2.369 Fc1cc2ccccc2nc1Br Amb22547372 [0,1,0,1,0,0|2,0,0]=4 5508 B13R2.369 Fc1cc2ccccc2nc1Cl Amb26328980 [0,1,0,1,0,0|2,0,0]=4 5509 B13R2.369 Fc1cc2ccccc2nc1I Amb25797787 [0,1,0,1,0,0|2,0,0]=4 5510 B13R2.369 Fc1nc2ccccc2cc1Br Amb25897111 [0,1,0,1,0,0|2,0,0]=4 5511 B13R2.369 Ic1cc2ccccc2cc1I Amb21954221 [0,1,0,1,0,0|2,0,0]=4 5512 B13R2.369 N=C1Nc2ccccc2NC1=O Amb19804517 [0,1,0,1,0,0|2,0,0]=4 5513 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,1,0,1,0,0|2,0,0]=4 5514 B13R2.369 NC1=Cc2ccccc2NC1=S Amb24373878 [0,1,0,1,0,0|1,1,0]=4 5515 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,1,0,1,0,0|1,0,0]=3 5516 B13R2.369 NC1=Cc2cnccc2NC1=O Amb32418303 [0,1,0,1,0,0|2,0,0]=4 5517 B13R2.369 Nc1cc2ccccc2cc1Br Amb2610350 [0,1,0,1,0,0|2,0,0]=4 5518 B13R2.369 Nc1cc2ccccc2cc1Cl Amb18648080 [0,1,0,1,0,0|2,0,0]=4 5519 B13R2.369 Nc1cc2ccccc2cc1F Amb26978863 [0,1,0,1,0,0|2,0,0]=4 5520 B13R2.369 Nc1cc2ccccc2cc1I Amb21955955 [0,1,0,1,0,0|2,0,0]=4 5521 B13R2.369 Nc1cc2ccccc2cc1N Amb2710387 [0,1,0,1,0,0|2,0,0]=4 5522 B13R2.369 Nc1cc2ccccc2cc1O Amb2781576 [0,1,0,1,0,0|1,0,1]=4 5523 B13R2.369 Nc1cc2ccccc2nc1Br Amb22499505 [0,1,0,1,0,0|2,0,0]=4 5524 B13R2.369 Nc1cc2ccccc2nc1Cl Amb22263229 [0,1,0,1,0,0|2,0,0]=4 5525 B13R2.369 Nc1cc2ccccc2nc1O Amb18645300 [0,1,0,1,0,0|1,0,1]=4 5526 B13R2.369 Nc1nc2ccccc2cc1Br Amb21962044 [0,1,0,1,0,0|2,0,0]=4 5527 B13R2.369 Nc1nc2ccccc2cc1F Amb25800913 [0,1,0,1,0,0|2,0,0]=4 5528 B13R2.369 Nc1nc2ccccc2cc1O Amb27471786 [0,1,0,1,0,0|2,0,0]=4 5529 B13R2.369 O=C1Cc2ccccc2OC1=O Amb22755081 [0,1,0,1,0,0|1,0,1]=4 5530 B13R2.369 O=C1N=C2C=CC=CC2=CC1Cl Amb22015161 [0,1,0,1,0,0|1,0,1]=4 5531 B13R2.369 O=C1Nc2ccccc2C=C1Br Amb20247010 [0,1,0,1,0,0|1,0,0]=3 5532 B13R2.369 O=C1Nc2ccccc2C=C1Cl Amb21857147 [0,1,0,1,0,0|1,0,0]=3 5533 B13R2.369 O=C1Nc2ccccc2C=C1F Amb22547229 [0,1,0,1,0,0|1,0,0]=3 5534 B13R2.369 O=C1Nc2ccccc2C=C1O Amb20619410 [0,1,0,1,0,0|1,0,0]=3 5535 B13R2.369 O=C1Nc2ccccc2NC1=O Amb18545062 [0,1,0,1,0,0|2,0,0]=4 5536 B13R2.369 O=C1Nc2ccccc2NC1=S Amb19654259 [0,1,0,1,0,0|2,0,0]=4 5537 B13R2.369 O=C1Nc2ccccc2OC1=O Amb19650977 [0,1,0,1,0,0|2,0,0]=4 5538 B13R2.369 O=C1Nc2ccccc2SC1=O Amb27949655 [0,1,0,1,0,0|2,0,0]=4 5539 B13R2.369 O=C1Nc2cccnc2C=C1Br Amb20671324 [0,1,0,1,0,0|2,0,0]=4 5540 B13R2.369 O=C1Nc2ccncc2C=C1Br Amb26647449 [0,1,0,1,0,0|2,0,0]=4 5541 B13R2.369 O=C1Nc2ccncc2C=C1Cl Amb27587506 [0,1,0,1,0,0|2,0,0]=4 5542 B13R2.369 O=C1Nc2ccncc2C=C1O Amb25034645 [0,1,0,1,0,0|2,0,0]=4 5543 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,1,0,1,0,0|1,0,0]=3 5544 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,1,0,1,0,0|1,0,0]=3 5545 B13R2.369 O=C1Oc2ccccc2C=C1O Amb18511465 [0,1,0,1,0,0|1,0,0]=3 5546 B13R2.369 O=C1Oc2ccccc2C=C1S Amb27173626 [0,1,0,1,0,0|1,0,0]=3 5547 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,1,0,1,0,0|2,0,0]=4 5548 B13R2.369 O=C1Oc2ccccc2N=C1O Amb22494623 [0,1,0,1,0,0|2,0,0]=4 5549 B13R2.369 O=C1Oc2ccccc2NC1=S Amb27947432 [0,1,0,1,0,0|2,0,0]=4 5550 B13R2.369 O=C1Sc2ccccc2C=C1Br Amb19886583 [0,1,0,1,0,0|1,0,0]=3 5551 B13R2.369 O=C1Sc2ccccc2C=C1Cl Amb22347336 [0,1,0,1,0,0|1,0,0]=3 5552 B13R2.369 O=C1Sc2ccccc2C=C1F Amb22641706 [0,1,0,1,0,0|1,0,0]=3 5553 B13R2.369 Oc1cc2ccccc2cc1Br Amb17596080 [0,1,0,1,0,0|1,0,1]=4 5554 B13R2.369 Oc1cc2ccccc2cc1Cl Amb4010282 [0,1,0,1,0,0|1,0,1]=4 5555 B13R2.369 Oc1cc2ccccc2cc1F Amb26494442 [0,1,0,1,0,0|1,0,1]=4 5556 B13R2.369 Oc1cc2ccccc2cc1I Amb25148790 [0,1,0,1,0,0|1,0,1]=4 5557 B13R2.369 Oc1cc2ccccc2cc1O Amb6296607 [0,1,0,1,0,0|1,0,1]=4 5558 B13R2.369 Oc1cc2ccccc2nc1Br Amb18134374 [0,1,0,1,0,0|2,0,0]=4 5559 B13R2.369 Oc1cc2ccccc2nc1Cl Amb21963885 [0,1,0,1,0,0|2,0,0]=4 5560 B13R2.369 Oc1cc2ccccc2nc1F Amb27244594 [0,1,0,1,0,0|2,0,0]=4 5561 B13R2.369 Oc1cc2ccccc2nc1I Amb28187128 [0,1,0,1,0,0|2,0,0]=4 5562 B13R2.369 Oc1nc2ccccc2cc1Br Amb10608236 [0,1,0,1,0,0|1,0,1]=4 5563 B13R2.369 S=C1Nc2ccccc2C=C1Br Amb27631744 [0,1,0,1,0,0|1,1,0]=4 5564 B13R2.369 Sc1cc2ccccc2nc1Cl Amb26056479 [0,1,0,1,0,0|2,0,0]=4 5565 B13R2.423 CC(=O)C1CC1c2ccccc2 Amb534893 [0,1,0,1,0,0|0,0,2]=4 5566 B13R2.423 CC(=O)C1N=C1c2ccccc2 Amb25863961 [0,1,0,1,0,0|1,0,1]=4 5567 B13R2.423 CC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb27780823 [0,1,0,1,0,0|0,0,2]=4 5568 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,1,0,1,0,0|0,0,2]=4 5569 B13R2.423 CC(=O)[C@H]1CC1c2ccccc2 Amb27770300 [0,1,0,1,0,0|0,0,2]=4 5570 B13R2.423 CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb28054879 [0,1,0,1,0,0|0,0,2]=4 5571 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,1,0,1,0,0|0,0,2]=4 5572 B13R2.423 NC(=O)C1=NC1c2ccccc2 Amb27954727 [0,1,0,1,0,0|1,0,1]=4 5573 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25965684 [0,1,0,1,0,0|0,0,2]=4 5574 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb26624595 [0,1,0,1,0,0|0,0,2]=4 5575 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,1,0,1,0,0|0,0,2]=4 5576 B13R2.423 O=C(Cl)[C@@H]1C[C@H]1c2ccccc2 Amb3939047 [0,1,0,1,0,0|0,0,2]=4 5577 B13R2.423 O=C(O)C1=C(c2ccccc2)C1 Amb28121109 [0,1,0,1,0,0|0,0,0]=2 5578 B13R2.423 O=C(O)C1CC1c2ccccc2 Amb534800 [0,1,0,1,0,0|0,0,2]=4 5579 B13R2.423 O=C(O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,1,0,1,0,0|0,0,2]=4 5580 B13R2.423 O=C(O)[C@@H]1C[C@H]1c2ccccc2 Amb33524226 [0,1,0,1,0,0|0,0,2]=4 5581 B13R2.423 O=C(O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,1,0,1,0,0|0,0,2]=4 5582 B13R2.423 O=C(O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,1,0,1,0,0|0,0,2]=4 5583 B13R2.435 C=C(C)c1cc2ccccc2s1 Amb27218285 [0,1,0,1,0,0|2,0,0]=4 5584 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,1,0,1,0,0|0,0,0]=2 5585 B13R2.435 CC(=O)C1Cc2ccccc2C1 Amb10071756 [0,1,0,1,0,0|0,0,2]=4 5586 B13R2.435 CC(=O)C1Cc2ccccc2N1 Amb28423109 [0,1,0,1,0,0|1,0,1]=4 5587 B13R2.435 CC(=O)C1Cc2ccccc2O1 Amb23586288 [0,1,0,1,0,0|1,0,1]=4 5588 B13R2.435 CC(=O)N1Cc2ccccc2C1 Amb26627508 [0,1,0,1,0,0|1,0,1]=4 5589 B13R2.435 CC(=O)c1cc2ccccc2o1 Amb1212626 [0,1,0,1,0,0|1,0,0]=3 5590 B13R2.435 CC(=O)c1cc2ccccc2s1 Amb5719845 [0,1,0,1,0,0|1,0,0]=3 5591 B13R2.435 CC(=O)c1cc2ccccn2c1 Amb10607345 [0,1,0,1,0,0|1,0,1]=4 5592 B13R2.435 CC(=O)c1cc2cccnc2s1 Amb18195959 [0,1,0,1,0,0|2,0,0]=4 5593 B13R2.435 CC(=O)c1cc2ccncc2o1 Amb18830115 [0,1,0,1,0,0|2,0,0]=4 5594 B13R2.435 CC(=O)c1cc2ccncc2s1 Amb18825003 [0,1,0,1,0,0|2,0,0]=4 5595 B13R2.435 CC(=O)c1cc2cnccc2o1 Amb18830138 [0,1,0,1,0,0|2,0,0]=4 5596 B13R2.435 CC(=O)c1cc2cnccc2s1 Amb18195960 [0,1,0,1,0,0|2,0,0]=4 5597 B13R2.435 CC(=O)c1cn2ccccc2n1 Amb21963117 [0,1,0,1,0,0|2,0,0]=4 5598 B13R2.435 CC(=O)c1nc2ccccc2o1 Amb19957805 [0,1,0,1,0,0|2,0,0]=4 5599 B13R2.435 CC(=O)c1nc2ccccc2s1 Amb1655468 [0,1,0,1,0,0|2,0,0]=4 5600 B13R2.435 CC(=O)n1cc2ccccc2c1 Amb25831153 [0,1,0,1,0,0|1,0,1]=4 5601 B13R2.435 CC(=O)n1cc2ccccc2n1 Amb25876913 [0,1,0,1,0,0|2,0,0]=4 5602 B13R2.435 CC(C)C1=Cc2ccccc2C1 Amb27480774 [0,1,0,1,0,0|1,0,1]=4 5603 B13R2.435 N=C(N)c1cc2ccccc2o1 Amb19374967 [0,1,0,1,0,0|2,0,0]=4 5604 B13R2.435 N=C(N)c1cc2ccccc2s1 Amb23116599 [0,1,0,1,0,0|2,0,0]=4 5605 B13R2.435 NC(=O)C1=Cc2ccccc2C1 Amb22227964 [0,1,0,1,0,0|0,0,0]=2 5606 B13R2.435 NC(=O)C1Cc2ccccc2C1 Amb28291341 [0,1,0,1,0,0|0,0,2]=4 5607 B13R2.435 NC(=O)C1Cc2ccccc2N1 Amb7173128 [0,1,0,1,0,0|1,0,1]=4 5608 B13R2.435 NC(=O)C1Cc2ccccc2S1 Amb8998792 [0,1,0,1,0,0|1,0,1]=4 5609 B13R2.435 NC(=O)[C@@H]1Cc2ccccc2N1 Amb9753465 [0,1,0,1,0,0|1,0,1]=4 5610 B13R2.435 NC(=O)c1cc2ccccc2o1 Amb6337587 [0,1,0,1,0,0|1,0,0]=3 5611 B13R2.435 NC(=O)c1cc2ccccc2s1 Amb6341890 [0,1,0,1,0,0|1,0,0]=3 5612 B13R2.435 NC(=O)c1cc2ccccn2c1 Amb26349575 [0,1,0,1,0,0|1,0,1]=4 5613 B13R2.435 NC(=O)c1cc2ccccn2n1 Amb22002382 [0,1,0,1,0,0|2,0,0]=4 5614 B13R2.435 NC(=O)c1cn2ccccc2n1 Amb33551894 [0,1,0,1,0,0|2,0,0]=4 5615 B13R2.435 NC(=O)c1nc2ccccc2o1 Amb22500295 [0,1,0,1,0,0|2,0,0]=4 5616 B13R2.435 NC(=O)c1nc2ccccc2s1 Amb2565672 [0,1,0,1,0,0|2,0,0]=4 5617 B13R2.435 NC(=O)n1cc2ccccc2n1 Amb27983685 [0,1,0,1,0,0|2,0,0]=4 5618 B13R2.435 NC(=S)c1cc2ccccc2o1 Amb8834038 [0,1,0,1,0,0|1,1,0]=4 5619 B13R2.435 NC(=S)c1cc2ccccc2s1 Amb28043019 [0,1,0,1,0,0|1,1,0]=4 5620 B13R2.435 O=C(Cl)C1Cc2ccccc2O1 Amb2723362 [0,1,0,1,0,0|1,0,1]=4 5621 B13R2.435 O=C(Cl)N1Cc2ccccc2C1 Amb24061265 [0,1,0,1,0,0|1,0,1]=4 5622 B13R2.435 O=C(Cl)c1cc2ccccc2o1 Amb2684582 [0,1,0,1,0,0|1,0,0]=3 5623 B13R2.435 O=C(Cl)c1cc2ccccc2s1 Amb2723175 [0,1,0,1,0,0|1,0,0]=3 5624 B13R2.435 O=C(Cl)c1cc2ccccn2c1 Amb27259695 [0,1,0,1,0,0|1,0,1]=4 5625 B13R2.435 O=C(Cl)c1cc2cccnc2s1 Amb22736489 [0,1,0,1,0,0|2,0,0]=4 5626 B13R2.435 O=C(Cl)c1cc2cccnc2s1 Amb27185816 [0,1,0,1,0,0|2,0,0]=4 5627 B13R2.435 O=C(Cl)c1nc2ccccc2s1 Amb2723093 [0,1,0,1,0,0|2,0,0]=4 5628 B13R2.435 O=C(O)C1=Cc2ccccc2C1 Amb10553818 [0,1,0,1,0,0|0,0,0]=2 5629 B13R2.435 O=C(O)C1=Nc2ccccc2C1 Amb24078944 [0,1,0,1,0,0|1,0,0]=3 5630 B13R2.435 O=C(O)C1Cc2ccccc2C1 Amb33537232 [0,1,0,1,0,0|0,0,2]=4 5631 B13R2.435 O=C(O)C1Cc2ccccc2N1 Amb1914079 [0,1,0,1,0,0|1,0,1]=4 5632 B13R2.435 O=C(O)C1Cc2ccccc2O1 Amb1154832 [0,1,0,1,0,0|1,0,1]=4 5633 B13R2.435 O=C(O)C1Cc2ccccc2S1 Amb9702994 [0,1,0,1,0,0|1,0,1]=4 5634 B13R2.435 O=C(O)[C@@H]1Cc2ccccc2N1 Amb2698470 [0,1,0,1,0,0|1,0,1]=4 5635 B13R2.435 O=C(O)[C@@H]1Cc2ccccc2O1 Amb28396501 [0,1,0,1,0,0|1,0,1]=4 5636 B13R2.435 O=C(O)[C@H]1Cc2ccccc2N1 Amb2699613 [0,1,0,1,0,0|1,0,1]=4 5637 B13R2.435 O=C(O)c1cc2ccccc2[se]1 Amb2611625 [0,1,0,1,0,0|1,0,0]=3 5638 B13R2.435 O=C(O)c1cc2ccccc2o1 Amb1203290 [0,1,0,1,0,0|1,0,0]=3 5639 B13R2.435 O=C(O)c1cc2ccccc2s1 Amb6335225 [0,1,0,1,0,0|1,0,0]=3 5640 B13R2.435 O=C(O)c1cc2ccccn2c1 Amb2610302 [0,1,0,1,0,0|1,0,1]=4 5641 B13R2.435 O=C(O)c1cc2ccccn2n1 Amb2235996 [0,1,0,1,0,0|2,0,0]=4 5642 B13R2.435 O=C(O)c1cc2cccnc2o1 Amb8383389 [0,1,0,1,0,0|2,0,0]=4 5643 B13R2.435 O=C(O)c1cc2cccnc2s1 Amb2723080 [0,1,0,1,0,0|2,0,0]=4 5644 B13R2.435 O=C(O)c1cc2ccncc2o1 Amb18645760 [0,1,0,1,0,0|2,0,0]=4 5645 B13R2.435 O=C(O)c1cc2ccncc2s1 Amb18824745 [0,1,0,1,0,0|2,0,0]=4 5646 B13R2.435 O=C(O)c1cc2cnccc2o1 Amb18645761 [0,1,0,1,0,0|2,0,0]=4 5647 B13R2.435 O=C(O)c1cc2cnccc2s1 Amb18648240 [0,1,0,1,0,0|2,0,0]=4 5648 B13R2.435 O=C(O)c1cc2ncccc2o1 Amb17774703 [0,1,0,1,0,0|2,0,0]=4 5649 B13R2.435 O=C(O)c1cc2ncccc2o1 Amb7173138 [0,1,0,1,0,0|2,0,0]=4 5650 B13R2.435 O=C(O)c1cc2ncccc2s1 Amb9677586 [0,1,0,1,0,0|2,0,0]=4 5651 B13R2.435 O=C(O)c1cn2ccccc2n1 Amb1106602 [0,1,0,1,0,0|2,0,0]=4 5652 B13R2.435 O=C(O)c1cn2ccccc2n1 Amb19514889 [0,1,0,1,0,0|2,0,0]=4 5653 B13R2.435 O=C(O)c1cn2ccccc2n1 Amb2688822 [0,1,0,1,0,0|2,0,0]=4 5654 B13R2.435 O=C(O)c1nc2ccccc2o1 Amb10066905 [0,1,0,1,0,0|2,0,0]=4 5655 B13R2.435 O=C(O)c1nc2ccccc2s1 Amb17622301 [0,1,0,1,0,0|2,0,0]=4 5656 B13R2.435 O=C(O)c1nc2ccccc2s1 Amb3428729 [0,1,0,1,0,0|2,0,0]=4 5657 B13R2.435 O=C([O-])C1Cc2ccccc2C1 Amb32660995 [0,1,0,1,0,0|0,0,2]=4 5658 B13R2.435 O=C([O-])C1Cc2ccccc2N1 Amb33513028 [0,1,0,1,0,0|1,0,1]=4 5659 B13R2.435 O=C([O-])c1cn2ccccc2n1 Amb19665498 [0,1,0,1,0,0|2,0,0]=4 5660 B13R2.435 O=C([O-])c1nc2ccccc2o1 Amb19651173 [0,1,0,1,0,0|2,0,0]=4 5661 B13R2.435 O=C([O-])c1nc2ccccc2o1 Amb19944614 [0,1,0,1,0,0|2,0,0]=4 5662 B13R2.435 O=C([O-])c1nc2ccccc2o1 Amb21961465 [0,1,0,1,0,0|2,0,0]=4 5663 B13R2.435 O=C([O-])c1nc2ccccc2s1 Amb1103264 [0,1,0,1,0,0|2,0,0]=4 5664 B13R2.435 O=C([O-])c1nc2ccccc2s1 Amb2354722 [0,1,0,1,0,0|2,0,0]=4 5665 B13R2.435 O=S([O-])c1cc2ccccc2o1 Amb32754314 [0,1,0,1,0,0|2,0,0]=4 5666 B13R2.435 O=[N+]([O-])c1cc2ccccc2o1 Amb19958202 [0,1,0,1,0,0|2,0,0]=4 5667 B13R2.435 OB(O)C1=Cc2ccccc2C1 Amb22753921 [0,1,0,1,0,0|1,0,1]=4 5668 B13R2.5517 CC(=O)C1(C)Oc2ccccc21 Amb26484343 [0,1,0,1,0,0|1,0,1]=4 5669 B13R2.5517 CC1(C(=O)O)Cc2ccccc21 Amb17778872 [0,1,0,1,0,0|0,0,2]=4 5670 B13R2.42 Cc1ccc(C2=NC2C=O)cc1 Amb27760326 [0,1,0,1,0,0|1,0,1]=4 5671 B13R2.42 Cc1ccc(C2CC2C=O)cc1 Amb18118196 [0,1,0,1,0,0|0,0,2]=4 5672 B13R2.42 Cc1ccc([C@@H]2C[C@H]2C=O)cc1 Amb27421987 [0,1,0,1,0,0|0,0,2]=4 5673 B13R2.42 O=CC1CC1c2ccc(F)cc2 Amb18636299 [0,1,0,1,0,0|0,0,2]=4 5674 B13R2.42 O=C[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb34915466 [0,1,0,1,0,0|0,0,2]=4 5675 B13R2.42 O=C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25694932 [0,1,0,1,0,0|0,0,2]=4 5676 B13R2.43 Cc1cc2oc(C=O)cc2cn1 Amb18830128 [0,1,0,1,0,0|2,0,0]=4 5677 B13R2.43 Cc1ccc2c(c1)CC(C=O)O2 Amb18829761 [0,1,0,1,0,0|1,0,1]=4 5678 B13R2.43 Cc1ccc2c(c1)CC(C=O)S2 Amb28282575 [0,1,0,1,0,0|1,0,1]=4 5679 B13R2.43 Cc1ccc2c(c1)CC(CN)=C2 Amb27797533 [0,1,0,1,0,0|1,0,1]=4 5680 B13R2.43 Cc1ccc2cc(C=O)nn2c1 Amb27390587 [0,1,0,1,0,0|2,0,0]=4 5681 B13R2.43 Cc1ccc2cc(C=O)oc2c1 Amb7094335 [0,1,0,1,0,0|1,0,0]=3 5682 B13R2.43 Cc1ccc2cc(C=O)sc2c1 Amb18675010 [0,1,0,1,0,0|1,0,0]=3 5683 B13R2.43 Cc1ccc2nc(C=O)cn2c1 Amb2613561 [0,1,0,1,0,0|2,0,0]=4 5684 B13R2.43 Cc1ccc2nc(C=O)sc2c1 Amb8010286 [0,1,0,1,0,0|2,0,0]=4 5685 B13R2.43 Cc1ccc2oc(C=O)cc2c1 Amb7094339 [0,1,0,1,0,0|1,0,0]=3 5686 B13R2.43 Cc1ccc2oc(C=O)nc2c1 Amb18830123 [0,1,0,1,0,0|2,0,0]=4 5687 B13R2.43 Cc1ccc2sc(C=O)cc2c1 Amb2693744 [0,1,0,1,0,0|1,0,0]=3 5688 B13R2.43 Cc1ccc2sc(C=O)nc2c1 Amb18825005 [0,1,0,1,0,0|2,0,0]=4 5689 B13R2.43 Cc1ccn2cc(C=O)nc2c1 Amb17097118 [0,1,0,1,0,0|2,0,0]=4 5690 B13R2.43 NCC1=Cc2cc(F)ccc2C1 Amb27796488 [0,1,0,1,0,0|1,0,1]=4 5691 B13R2.43 Nc1cc2oc(C=O)cc2cn1 Amb18829865 [0,1,0,1,0,0|2,0,0]=4 5692 B13R2.43 Nc1ccc2c(c1)CN(C=O)C2 Amb19373946 [0,1,0,1,0,0|1,0,1]=4 5693 B13R2.43 Nc1ccc2nc(C=O)oc2c1 Amb28458255 [0,1,0,1,0,0|2,0,0]=4 5694 B13R2.43 Nc1ccc2oc(C=O)cc2c1 Amb18830113 [0,1,0,1,0,0|1,0,0]=3 5695 B13R2.43 Nc1ccc2sc(C=O)nc2c1 Amb18824881 [0,1,0,1,0,0|2,0,0]=4 5696 B13R2.43 O=CC1Cc2cc(F)ccc2O1 Amb27811772 [0,1,0,1,0,0|1,0,1]=4 5697 B13R2.43 O=CC1Cc2ccc(F)cc2C1 Amb27789573 [0,1,0,1,0,0|0,0,2]=4 5698 B13R2.43 O=Cc1cc2cc(Br)ccc2o1 Amb2570005 [0,1,0,1,0,0|1,0,0]=3 5699 B13R2.43 O=Cc1cc2cc(Br)ccc2s1 Amb17621475 [0,1,0,1,0,0|1,0,0]=3 5700 B13R2.43 O=Cc1cc2cc(Br)ccn2n1 Amb27615413 [0,1,0,1,0,0|2,0,0]=4 5701 B13R2.43 O=Cc1cc2cc(Br)cnc2o1 Amb18750980 [0,1,0,1,0,0|2,0,0]=4 5702 B13R2.43 O=Cc1cc2cc(Br)cnc2s1 Amb18155655 [0,1,0,1,0,0|2,0,0]=4 5703 B13R2.43 O=Cc1cc2cc(Cl)ccc2s1 Amb15695226 [0,1,0,1,0,0|1,0,0]=3 5704 B13R2.43 O=Cc1cc2cc(Cl)cnc2o1 Amb21959409 [0,1,0,1,0,0|2,0,0]=4 5705 B13R2.43 O=Cc1cc2cc(Cl)ncc2o1 Amb18823878 [0,1,0,1,0,0|2,0,0]=4 5706 B13R2.43 O=Cc1cc2cc(Cl)ncc2s1 Amb18188035 [0,1,0,1,0,0|2,0,0]=4 5707 B13R2.43 O=Cc1cc2cc(F)ccc2o1 Amb18829078 [0,1,0,1,0,0|1,0,0]=3 5708 B13R2.43 O=Cc1cc2cc(F)ccc2s1 Amb13882835 [0,1,0,1,0,0|1,0,0]=3 5709 B13R2.43 O=Cc1cc2cc(F)cnc2s1 Amb32655512 [0,1,0,1,0,0|2,0,0]=4 5710 B13R2.43 O=Cc1cc2cc(I)ccc2s1 Amb27616797 [0,1,0,1,0,0|1,0,0]=3 5711 B13R2.43 O=Cc1cc2cc(O)ccc2o1 Amb18829872 [0,1,0,1,0,0|1,0,0]=3 5712 B13R2.43 O=Cc1cc2cc(O)ccc2s1 Amb18824899 [0,1,0,1,0,0|1,0,0]=3 5713 B13R2.43 O=Cc1cc2ccc(Br)cc2o1 Amb18754952 [0,1,0,1,0,0|1,0,0]=3 5714 B13R2.43 O=Cc1cc2ccc(Br)cc2s1 Amb17621476 [0,1,0,1,0,0|1,0,0]=3 5715 B13R2.43 O=Cc1cc2ccc(Br)cn2n1 Amb25726476 [0,1,0,1,0,0|2,0,0]=4 5716 B13R2.43 O=Cc1cc2ccc(Br)nc2s1 Amb18728475 [0,1,0,1,0,0|2,0,0]=4 5717 B13R2.43 O=Cc1cc2ccc(Cl)cc2s1 Amb18675006 [0,1,0,1,0,0|1,0,0]=3 5718 B13R2.43 O=Cc1cc2ccc(Cl)nc2s1 Amb18130454 [0,1,0,1,0,0|2,0,0]=4 5719 B13R2.43 O=Cc1cc2ccc(F)cc2o1 Amb18829081 [0,1,0,1,0,0|1,0,0]=3 5720 B13R2.43 O=Cc1cc2ccc(F)cc2s1 Amb18141134 [0,1,0,1,0,0|1,0,0]=3 5721 B13R2.43 O=Cc1cc2ccc(O)cc2o1 Amb25159565 [0,1,0,1,0,0|1,0,0]=3 5722 B13R2.43 O=Cc1cc2cnc(Br)cc2o1 Amb18750968 [0,1,0,1,0,0|2,0,0]=4 5723 B13R2.43 O=Cc1cc2nc(Br)ccc2o1 Amb18160790 [0,1,0,1,0,0|2,0,0]=4 5724 B13R2.43 O=Cc1cc2nc(Br)ccc2s1 Amb18155652 [0,1,0,1,0,0|2,0,0]=4 5725 B13R2.43 O=Cc1cc2nc(Cl)ccc2s1 Amb26903112 [0,1,0,1,0,0|2,0,0]=4 5726 B13R2.43 O=Cc1cc2ncc(Br)cc2o1 Amb13890167 [0,1,0,1,0,0|2,0,0]=4 5727 B13R2.43 O=Cc1cn2cc(Br)ccc2n1 Amb33549144 [0,1,0,1,0,0|2,0,0]=4 5728 B13R2.43 O=Cc1cn2cc(Cl)ccc2n1 Amb10610306 [0,1,0,1,0,0|2,0,0]=4 5729 B13R2.43 O=Cc1cn2cc(F)ccc2n1 Amb21962430 [0,1,0,1,0,0|2,0,0]=4 5730 B13R2.43 O=Cc1cn2ccc(Br)cc2n1 Amb21964693 [0,1,0,1,0,0|2,0,0]=4 5731 B13R2.43 O=Cc1cn2ccc(Cl)cc2n1 Amb18101392 [0,1,0,1,0,0|2,0,0]=4 5732 B13R2.43 O=Cc1nc2cc(Br)ccc2o1 Amb18160780 [0,1,0,1,0,0|2,0,0]=4 5733 B13R2.43 O=Cc1nc2cc(Br)ccc2s1 Amb18155963 [0,1,0,1,0,0|2,0,0]=4 5734 B13R2.43 O=Cc1nc2cc(F)ccc2o1 Amb18199719 [0,1,0,1,0,0|2,0,0]=4 5735 B13R2.43 O=Cc1nc2cc(F)ccc2s1 Amb18193371 [0,1,0,1,0,0|2,0,0]=4 5736 B13R2.43 O=Cc1nc2cc(I)ccc2o1 Amb27615809 [0,1,0,1,0,0|2,0,0]=4 5737 B13R2.43 O=Cc1nc2cc(O)ccc2o1 Amb18829550 [0,1,0,1,0,0|2,0,0]=4 5738 B13R2.43 O=Cc1nc2cc(O)ccc2s1 Amb18824746 [0,1,0,1,0,0|2,0,0]=4 5739 B13R2.43 O=Cc1nc2cc(S)ccc2o1 Amb27848637 [0,1,0,1,0,0|2,0,0]=4 5740 B13R2.43 O=Cc1nc2ccc(Br)cc2o1 Amb22499255 [0,1,0,1,0,0|2,0,0]=4 5741 B13R2.43 O=Cc1nc2ccc(Br)cc2s1 Amb18155969 [0,1,0,1,0,0|2,0,0]=4 5742 B13R2.43 O=Cc1nc2ccc(Cl)cc2o1 Amb18823884 [0,1,0,1,0,0|2,0,0]=4 5743 B13R2.43 O=Cc1nc2ccc(Cl)cc2s1 Amb18812045 [0,1,0,1,0,0|2,0,0]=4 5744 B13R2.43 O=Cc1nc2ccc(F)cc2o1 Amb18828625 [0,1,0,1,0,0|2,0,0]=4 5745 B13R2.43 O=Cc1nc2ccc(F)cc2s1 Amb18193373 [0,1,0,1,0,0|2,0,0]=4 5746 B13R2.43 O=Cc1nc2ccc(I)cc2o1 Amb27615811 [0,1,0,1,0,0|2,0,0]=4 5747 B13R2.43 O=Cc1nc2ccc(O)cc2o1 Amb18829549 [0,1,0,1,0,0|2,0,0]=4 5748 B13R2.43 O=Cc1nc2ccc(O)cc2s1 Amb18824747 [0,1,0,1,0,0|2,0,0]=4 5749 B13R2.43 O=Cc1nc2ccc(S)cc2o1 Amb28428666 [0,1,0,1,0,0|2,0,0]=4 5750 B13R2.1062 N=C1C=CC(=C2C(N)=C2N)C=C1 Amb27607918 [0,1,0,1,0,0|2,0,0]=4 5751 B13R2.1069 Fc1ccc(C=C2CCC2)cc1 Amb33097070 [0,1,0,1,0,0|1,0,1]=4 5752 B13R2.1069 Nc1ccc(CC2=CCC2)cc1 Amb27389368 [0,1,0,1,0,0|1,0,1]=4 5753 B13R2.3028 C=C1Cc2ccc(Br)cc2C1=O Amb18063783 [0,1,0,1,0,0|0,0,2]=4 5754 B13R2.3028 C=C1Cc2ccc(C)cc2C1=O Amb18561519 [0,1,0,1,0,0|0,0,2]=4 5755 B13R2.3028 C=C1Cc2ccc(Cl)cc2C1=O Amb18063782 [0,1,0,1,0,0|0,0,2]=4 5756 B13R2.3028 C=C1Cc2ccc(F)cc2C1=O Amb18063781 [0,1,0,1,0,0|0,0,2]=4 5757 B13R2.3028 CC1=Cc2ccc(Cl)cc2C1=O Amb22753539 [0,1,0,1,0,0|0,0,0]=2 5758 B13R2.3028 CC1Cc2ccc(Br)cc2C1=O Amb18063798 [0,1,0,1,0,0|0,0,2]=4 5759 B13R2.3028 CC1Cc2ccc(Cl)cc2C1=O Amb17233769 [0,1,0,1,0,0|0,0,2]=4 5760 B13R2.3028 CC1Cc2ccc(F)cc2C1=O Amb13883761 [0,1,0,1,0,0|0,0,2]=4 5761 B13R2.3028 CC1Cc2ccc(N)cc2C1=O Amb24442350 [0,1,0,1,0,0|0,0,2]=4 5762 B13R2.3028 CC1Oc2ccc(Br)cc2C1=O Amb25683716 [0,1,0,1,0,0|1,0,1]=4 5763 B13R2.3028 CC1Oc2ccc(Cl)cc2C1=O Amb19068160 [0,1,0,1,0,0|1,0,1]=4 5764 B13R2.3028 CC1Oc2ccc(F)cc2C1=O Amb18798518 [0,1,0,1,0,0|1,0,1]=4 5765 B13R2.3028 CC1Oc2ccc(N)cc2C1=O Amb33310032 [0,1,0,1,0,0|1,0,1]=4 5766 B13R2.3028 CN1Cc2ccc(Br)cc2C1=O Amb22500789 [0,1,0,1,0,0|1,0,1]=4 5767 B13R2.3028 CN1Cc2ccc(Cl)cc2C1=O Amb22500792 [0,1,0,1,0,0|1,0,1]=4 5768 B13R2.3028 CN1Cc2ccc(F)cc2C1=O Amb22500798 [0,1,0,1,0,0|1,0,1]=4 5769 B13R2.3028 CN1Cc2ccc(I)cc2C1=O Amb22500801 [0,1,0,1,0,0|1,0,1]=4 5770 B13R2.3028 CN1Cc2ccc(N)cc2C1=O Amb17483271 [0,1,0,1,0,0|1,0,1]=4 5771 B13R2.3028 CN1Cc2ccc(O)cc2C1=O Amb23443235 [0,1,0,1,0,0|1,0,1]=4 5772 B13R2.3028 CN1Nc2ccc(Cl)cc2C1=O Amb28315105 [0,1,0,1,0,0|2,0,0]=4 5773 B13R2.3028 CN1Oc2ccc(Br)cc2C1=O Amb24757038 [0,1,0,1,0,0|2,0,0]=4 5774 B13R2.3028 Cc1c2cc(N)ccc2cn1C Amb27616910 [0,1,0,1,0,0|2,0,0]=4 5775 B13R2.3028 Cc1cc2ccc(Cl)cc2n1C Amb18065225 [0,1,0,1,0,0|2,0,0]=4 5776 B13R2.3028 Cc1cc2ccc(F)cc2n1C Amb18065232 [0,1,0,1,0,0|2,0,0]=4 5777 B13R2.3028 Cc1cc2ccc(F)cc2n1N Amb28254655 [0,1,0,1,0,0|2,0,0]=4 5778 B13R2.3028 Cc1cc2ccc(N)cc2n1C Amb17570037 [0,1,0,1,0,0|2,0,0]=4 5779 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)N2 Amb6355801 [0,1,0,1,0,0|2,0,0]=4 5780 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)O2 Amb27177687 [0,1,0,1,0,0|2,0,0]=4 5781 B13R2.3028 Cc1ccc2c(c1)C(=O)C(C)C2 Amb33547614 [0,1,0,1,0,0|0,0,2]=4 5782 B13R2.3028 Cc1ccc2c(c1)C(=O)C(Cl)=N2 Amb17594603 [0,1,0,1,0,0|2,0,0]=4 5783 B13R2.3028 Cc1ccc2cc(C)n(C)c2c1 Amb9768409 [0,1,0,1,0,0|2,0,0]=4 5784 B13R2.3028 Cc1ccc2oc(C)c(C)c2c1 Amb26359812 [0,1,0,1,0,0|2,0,0]=4 5785 B13R2.3028 Cc1ccc2sc(C)c(N)c2c1 Amb27439213 [0,1,0,1,0,0|2,0,0]=4 5786 B13R2.3028 Cc1oc2ccc(Br)cc2c1C Amb22904302 [0,1,0,1,0,0|2,0,0]=4 5787 B13R2.3028 Cc1oc2ccc(N)cc2c1C Amb18645489 [0,1,0,1,0,0|2,0,0]=4 5788 B13R2.3028 Cc1oc2ccc(O)cc2c1N Amb18829458 [0,1,0,1,0,0|2,0,0]=4 5789 B13R2.3028 Cc1sc2ccc(Br)cc2c1C Amb2646305 [0,1,0,1,0,0|2,0,0]=4 5790 B13R2.3028 Cc1sc2ccc(Br)cc2c1N Amb27846092 [0,1,0,1,0,0|2,0,0]=4 5791 B13R2.3028 Cc1sc2ccc(Cl)cc2c1Br Amb27782169 [0,1,0,1,0,0|2,0,0]=4 5792 B13R2.3028 Cc1sc2ccc(Cl)cc2c1C Amb28388914 [0,1,0,1,0,0|2,0,0]=4 5793 B13R2.3028 Cc1sc2ccc(Cl)cc2c1I Amb27230753 [0,1,0,1,0,0|2,0,0]=4 5794 B13R2.3028 Cc1sc2ccc(Cl)cc2c1N Amb20667872 [0,1,0,1,0,0|2,0,0]=4 5795 B13R2.3028 Cc1sc2ccc(F)cc2c1Br Amb27670242 [0,1,0,1,0,0|2,0,0]=4 5796 B13R2.3028 Cc1sc2ccc(F)cc2c1C Amb25800551 [0,1,0,1,0,0|2,0,0]=4 5797 B13R2.3028 Cc1sc2ccc(F)cc2c1Cl Amb27845566 [0,1,0,1,0,0|2,0,0]=4 5798 B13R2.3028 Cc1sc2ccc(F)cc2c1F Amb27778739 [0,1,0,1,0,0|2,0,0]=4 5799 B13R2.3028 Cc1sc2ccc(F)cc2c1O Amb27618682 [0,1,0,1,0,0|1,0,1]=4 5800 B13R2.3028 Cc1sc2ccc(I)cc2c1C Amb28246913 [0,1,0,1,0,0|2,0,0]=4 5801 B13R2.3028 Cc1sc2ccc(I)cc2c1F Amb27774886 [0,1,0,1,0,0|2,0,0]=4 5802 B13R2.3028 Cc1sc2ccc(I)cc2c1N Amb27787922 [0,1,0,1,0,0|2,0,0]=4 5803 B13R2.3028 Cc1sc2ccc(N)cc2c1N Amb28290878 [0,1,0,1,0,0|2,0,0]=4 5804 B13R2.3028 Cc1sc2ccc(N)cc2c1S Amb27216212 [0,1,0,1,0,0|1,1,0]=4 5805 B13R2.3028 Cc1sc2ccc(O)cc2c1Br Amb27435151 [0,1,0,1,0,0|2,0,0]=4 5806 B13R2.3028 Cc1sc2ccc(O)cc2c1O Amb27194704 [0,1,0,1,0,0|1,0,1]=4 5807 B13R2.3028 Cc1sc2ccc(S)cc2c1N Amb28134748 [0,1,0,1,0,0|2,0,0]=4 5808 B13R2.3028 Nc1ccc2c(c1)C(=O)C(=O)N2 Amb6298390 [0,1,0,1,0,0|2,0,0]=4 5809 B13R2.3028 O=C1C(Br)=Cc2ccc(Br)cc21 Amb28138101 [0,1,0,1,0,0|1,0,0]=3 5810 B13R2.3028 O=C1C(Cl)=Nc2ccc(Br)cc21 Amb4430940 [0,1,0,1,0,0|2,0,0]=4 5811 B13R2.3028 O=C1C(O)=Nc2ccc(Br)cc21 Amb1351906 [0,1,0,1,0,0|2,0,0]=4 5812 B13R2.3028 O=C1C(O)=Nc2ccc(F)cc21 Amb19860944 [0,1,0,1,0,0|2,0,0]=4 5813 B13R2.3028 O=C1Nc2ccc(Br)cc2C1=O Amb6364736 [0,1,0,1,0,0|2,0,0]=4 5814 B13R2.3028 O=C1Nc2ccc(Cl)cc2C1=O Amb6335221 [0,1,0,1,0,0|2,0,0]=4 5815 B13R2.3028 O=C1Nc2ccc(F)cc2C1=O Amb6315494 [0,1,0,1,0,0|2,0,0]=4 5816 B13R2.3028 O=C1Nc2ccc(I)cc2C1=O Amb1038277 [0,1,0,1,0,0|2,0,0]=4 5817 B13R2.3028 O=C1Nc2ccc(O)cc2C1=O Amb33544078 [0,1,0,1,0,0|2,0,0]=4 5818 B13R2.3028 O=C1Sc2ccc(Cl)cc2C1=O Amb27606006 [0,1,0,1,0,0|2,0,0]=4 5819 B13R2.3683 Brc1ccc2cc(Br)ccc2c1 Amb4317505 [0,1,0,1,0,0|2,0,0]=4 5820 B13R2.3683 Brc1ccc2cc(I)ccc2c1 Amb21858593 [0,1,0,1,0,0|2,0,0]=4 5821 B13R2.3683 Brc1ccc2cc(I)cnc2c1 Amb28124716 [0,1,0,1,0,0|2,0,0]=4 5822 B13R2.3683 Brc1cnc2cc(Br)ccc2c1 Amb22495197 [0,1,0,1,0,0|2,0,0]=4 5823 B13R2.3683 Brc1cnc2cc(I)ccc2c1 Amb26893802 [0,1,0,1,0,0|2,0,0]=4 5824 B13R2.3683 CC1=CC2=CNC(=O)C=C2C=C1 Amb26015179 [0,1,0,1,0,0|2,0,0]=4 5825 B13R2.3683 CC1=Cc2ccc(C)cc2NC1 Amb18559657 [0,1,0,1,0,0|1,0,1]=4 5826 B13R2.3683 CC1=Cc2ccc(Cl)cc2NC1 Amb18559658 [0,1,0,1,0,0|1,0,1]=4 5827 B13R2.3683 C[n+]1ccc2cc(Br)ccc2c1 Amb27872613 [0,1,0,1,0,0|2,0,0]=4 5828 B13R2.3683 Cc1cc2ccc(Br)cc2cn1 Amb23401097 [0,1,0,1,0,0|2,0,0]=4 5829 B13R2.3683 Cc1cc2ccc(Cl)cc2cn1 Amb27959160 [0,1,0,1,0,0|2,0,0]=4 5830 B13R2.3683 Cc1cc2ccc(F)cc2cn1 Amb32684120 [0,1,0,1,0,0|2,0,0]=4 5831 B13R2.3683 Cc1cc2ccc(N)cc2cn1 Amb25687409 [0,1,0,1,0,0|2,0,0]=4 5832 B13R2.3683 Cc1cc2ccc(O)cc2cn1 Amb18645159 [0,1,0,1,0,0|2,0,0]=4 5833 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)N2 Amb18546035 [0,1,0,1,0,0|2,0,0]=4 5834 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 Amb18511482 [0,1,0,1,0,0|2,0,0]=4 5835 B13R2.3683 Cc1ccc2cc(Br)ccc2n1 Amb2685485 [0,1,0,1,0,0|2,0,0]=4 5836 B13R2.3683 Cc1ccc2cc(Br)cnc2c1 Amb28288254 [0,1,0,1,0,0|2,0,0]=4 5837 B13R2.3683 Cc1ccc2cc(C)ccc2c1 Amb6297769 [0,1,0,1,0,0|1,0,0]=3 5838 B13R2.3683 Cc1ccc2cc(Cl)ccc2c1 Amb27490799 [0,1,0,1,0,0|1,0,0]=3 5839 B13R2.3683 Cc1ccc2cc(Cl)ccc2n1 Amb2686458 [0,1,0,1,0,0|2,0,0]=4 5840 B13R2.3683 Cc1ccc2cc(Cl)ncc2c1 Amb20171137 [0,1,0,1,0,0|2,0,0]=4 5841 B13R2.3683 Cc1ccc2cc(F)ccc2c1 Amb2725263 [0,1,0,1,0,0|1,0,0]=3 5842 B13R2.3683 Cc1ccc2cc(F)ccc2n1 Amb2688236 [0,1,0,1,0,0|2,0,0]=4 5843 B13R2.3683 Cc1ccc2cc(I)ccc2c1 Amb26517135 [0,1,0,1,0,0|1,0,0]=3 5844 B13R2.3683 Cc1ccc2cc(I)ccc2n1 Amb17586361 [0,1,0,1,0,0|2,0,0]=4 5845 B13R2.3683 Cc1ccc2cc(N)ccc2c1 Amb22490950 [0,1,0,1,0,0|1,0,0]=3 5846 B13R2.3683 Cc1ccc2cc(N)ccc2n1 Amb1034891 [0,1,0,1,0,0|2,0,0]=4 5847 B13R2.3683 Cc1ccc2cc(N)cnc2c1 Amb20239508 [0,1,0,1,0,0|2,0,0]=4 5848 B13R2.3683 Cc1ccc2cc(N)cnc2c1 Amb25233126 [0,1,0,1,0,0|2,0,0]=4 5849 B13R2.3683 Cc1ccc2cc(O)ccc2c1 Amb21964548 [0,1,0,1,0,0|1,0,0]=3 5850 B13R2.3683 Cc1ccc2cc(O)ccc2n1 Amb3319419 [0,1,0,1,0,0|2,0,0]=4 5851 B13R2.3683 Cc1ccc2cc(O)cnc2c1 Amb24407164 [0,1,0,1,0,0|2,0,0]=4 5852 B13R2.3683 Cc1ccc2cc(S)ccc2n1 Amb28256298 [0,1,0,1,0,0|2,0,0]=4 5853 B13R2.3683 Cc1ccc2nc(Br)ccc2c1 Amb2610689 [0,1,0,1,0,0|2,0,0]=4 5854 B13R2.3683 Cc1ccc2nc(C)ccc2c1 Amb1152516 [0,1,0,1,0,0|2,0,0]=4 5855 B13R2.3683 Cc1ccc2nc(C)cnc2c1 Amb27596107 [0,1,0,1,0,0|2,0,0]=4 5856 B13R2.3683 Cc1ccc2nc(Cl)ccc2c1 Amb5718537 [0,1,0,1,0,0|2,0,0]=4 5857 B13R2.3683 Cc1ccc2nc(N)ccc2c1 Amb8386595 [0,1,0,1,0,0|2,0,0]=4 5858 B13R2.3683 Cc1ccc2nc(S)ccc2c1 Amb23536152 [0,1,0,1,0,0|2,0,0]=4 5859 B13R2.3683 Cc1cnc2cc(Br)ccc2c1 Amb24368689 [0,1,0,1,0,0|1,0,0]=3 5860 B13R2.3683 Cc1cnc2cc(C)ccc2c1 Amb17334417 [0,1,0,1,0,0|1,0,0]=3 5861 B13R2.3683 Cc1cnc2cc(F)ccc2c1 Amb24358980 [0,1,0,1,0,0|1,0,0]=3 5862 B13R2.3683 Cc1cnc2cc(I)ccc2n1 Amb26575477 [0,1,0,1,0,0|2,0,0]=4 5863 B13R2.3683 Cc1cnc2cc(N)ccc2c1 Amb30594180 [0,1,0,1,0,0|1,0,0]=3 5864 B13R2.3683 Cc1cnc2cc(O)ccc2c1 Amb25046100 [0,1,0,1,0,0|1,0,0]=3 5865 B13R2.3683 Cc1cnc2nc(C)ccc2c1 Amb13890057 [0,1,0,1,0,0|2,0,0]=4 5866 B13R2.3683 Clc1ccc2cc(Br)ccc2c1 Amb22054542 [0,1,0,1,0,0|2,0,0]=4 5867 B13R2.3683 Clc1ccc2cc(Br)cnc2c1 Amb21856471 [0,1,0,1,0,0|2,0,0]=4 5868 B13R2.3683 Clc1ccc2cc(Cl)ccc2c1 Amb4021784 [0,1,0,1,0,0|2,0,0]=4 5869 B13R2.3683 Clc1ccc2cc(I)ccc2c1 Amb24594378 [0,1,0,1,0,0|2,0,0]=4 5870 B13R2.3683 Clc1cnc2cc(Br)ccc2c1 Amb21858959 [0,1,0,1,0,0|2,0,0]=4 5871 B13R2.3683 Clc1cnc2cc(Cl)ccc2c1 Amb22055067 [0,1,0,1,0,0|2,0,0]=4 5872 B13R2.3683 Fc1ccc2cc(Br)ccc2c1 Amb16231048 [0,1,0,1,0,0|2,0,0]=4 5873 B13R2.3683 Fc1ccc2cc(Br)cnc2c1 Amb22899304 [0,1,0,1,0,0|2,0,0]=4 5874 B13R2.3683 Fc1ccc2cc(Cl)ccc2c1 Amb24707840 [0,1,0,1,0,0|2,0,0]=4 5875 B13R2.3683 Fc1ccc2cc(F)ccc2c1 Amb26967084 [0,1,0,1,0,0|2,0,0]=4 5876 B13R2.3683 Fc1ccc2cc(I)ccc2c1 Amb24743550 [0,1,0,1,0,0|2,0,0]=4 5877 B13R2.3683 Fc1ccc2cc(I)cnc2c1 Amb24183792 [0,1,0,1,0,0|2,0,0]=4 5878 B13R2.3683 Fc1cnc2cc(Br)ccc2c1 Amb22899360 [0,1,0,1,0,0|2,0,0]=4 5879 B13R2.3683 Ic1ccc2cc(I)ccc2c1 Amb25148656 [0,1,0,1,0,0|2,0,0]=4 5880 B13R2.3683 Nc1ccc2cc(Br)ccc2c1 Amb1348322 [0,1,0,1,0,0|2,0,0]=4 5881 B13R2.3683 Nc1ccc2cc(Br)ccc2c1 Amb22234013 [0,1,0,1,0,0|2,0,0]=4 5882 B13R2.3683 Nc1ccc2cc(Br)cnc2c1 Amb22899267 [0,1,0,1,0,0|2,0,0]=4 5883 B13R2.3683 Nc1ccc2cc(Cl)ccc2c1 Amb17594516 [0,1,0,1,0,0|2,0,0]=4 5884 B13R2.3683 Nc1ccc2cc(Cl)cnc2c1 Amb22899380 [0,1,0,1,0,0|2,0,0]=4 5885 B13R2.3683 Nc1ccc2cc(F)ccc2c1 Amb22234014 [0,1,0,1,0,0|2,0,0]=4 5886 B13R2.3683 Nc1ccc2cc(F)cnc2c1 Amb22899379 [0,1,0,1,0,0|2,0,0]=4 5887 B13R2.3683 Nc1ccc2cc(I)ccc2c1 Amb25309310 [0,1,0,1,0,0|2,0,0]=4 5888 B13R2.3683 Nc1ccc2cc(N)ccc2c1 Amb17843067 [0,1,0,1,0,0|2,0,0]=4 5889 B13R2.3683 Nc1ccc2cc(O)ccc2c1 Amb17843066 [0,1,0,1,0,0|2,0,0]=4 5890 B13R2.3683 Nc1ccc2cc(O)cnc2c1 Amb22899407 [0,1,0,1,0,0|2,0,0]=4 5891 B13R2.3683 Nc1ccc2cc(S)ccc2c1 Amb18647917 [0,1,0,1,0,0|2,0,0]=4 5892 B13R2.3683 Nc1cnc2cc(Br)ccc2c1 Amb17621718 [0,1,0,1,0,0|2,0,0]=4 5893 B13R2.3683 Nc1cnc2cc(Br)ccc2c1 Amb22235016 [0,1,0,1,0,0|2,0,0]=4 5894 B13R2.3683 Nc1cnc2cc(Cl)ccc2c1 Amb19889367 [0,1,0,1,0,0|2,0,0]=4 5895 B13R2.3683 Nc1cnc2cc(F)ccc2c1 Amb17621722 [0,1,0,1,0,0|2,0,0]=4 5896 B13R2.3683 Nc1cnc2cc(F)ccc2c1 Amb22899303 [0,1,0,1,0,0|2,0,0]=4 5897 B13R2.3683 Nc1cnc2cc(O)ccc2c1 Amb27590358 [0,1,0,1,0,0|2,0,0]=4 5898 B13R2.3683 O=C1C=CC2=CC(=O)C=CC2=C1 Amb17778320 [0,1,0,1,0,0|2,0,0]=4 5899 B13R2.3683 Oc1ccc2cc(Br)ccc2c1 Amb1333685 [0,1,0,1,0,0|2,0,0]=4 5900 B13R2.3683 Oc1ccc2cc(Br)cnc2c1 Amb22491312 [0,1,0,1,0,0|2,0,0]=4 5901 B13R2.3683 Oc1ccc2cc(Cl)ccc2c1 Amb17777189 [0,1,0,1,0,0|2,0,0]=4 5902 B13R2.3683 Oc1ccc2cc(Cl)cnc2c1 Amb22494665 [0,1,0,1,0,0|2,0,0]=4 5903 B13R2.3683 Oc1ccc2cc(F)ccc2c1 Amb22751763 [0,1,0,1,0,0|2,0,0]=4 5904 B13R2.3683 Oc1ccc2cc(F)cnc2c1 Amb24102179 [0,1,0,1,0,0|2,0,0]=4 5905 B13R2.3683 Oc1ccc2cc(I)ccc2c1 Amb25669689 [0,1,0,1,0,0|2,0,0]=4 5906 B13R2.3683 Oc1ccc2cc(I)cnc2c1 Amb22494874 [0,1,0,1,0,0|2,0,0]=4 5907 B13R2.3683 Oc1ccc2cc(O)ccc2c1 Amb2708568 [0,1,0,1,0,0|2,0,0]=4 5908 B13R2.3683 Oc1ccc2cc(S)ccc2c1 Amb17594487 [0,1,0,1,0,0|2,0,0]=4 5909 B13R2.3683 Oc1cnc2cc(Br)ccc2c1 Amb22494957 [0,1,0,1,0,0|2,0,0]=4 5910 B13R2.3683 Oc1cnc2cc(Cl)ccc2c1 Amb24183780 [0,1,0,1,0,0|2,0,0]=4 5911 B13R2.3683 Oc1cnc2cc(F)ccc2c1 Amb24183788 [0,1,0,1,0,0|2,0,0]=4 5912 B13R2.3683 Oc1cnc2cc(I)ccc2c1 Amb25883423 [0,1,0,1,0,0|2,0,0]=4 5913 B13R2.3683 Oc1cnc2cc(O)ccc2c1 Amb27214209 [0,1,0,1,0,0|2,0,0]=4 5914 B13R2.3683 Sc1ccc2cc(S)ccc2c1 Amb21954243 [0,1,0,1,0,0|2,0,0]=4 5915 B13R2.54 CCC1=Cc2cccc(Cl)c2C1 Amb20242793 [0,1,0,1,0,0|1,0,1]=4 5916 B13R2.54 Cc1cccc2c1CC(C=O)=C2 Amb18645055 [0,1,0,1,0,0|0,0,0]=2 5917 B13R2.54 Cc1cccc2cc(C=O)nn12 Amb28244131 [0,1,0,1,0,0|2,0,0]=4 5918 B13R2.54 Cc1cccc2cc(C=O)sc12 Amb18675012 [0,1,0,1,0,0|1,0,0]=3 5919 B13R2.54 Cc1cccc2nc(C=O)cn12 Amb2613591 [0,1,0,1,0,0|2,0,0]=4 5920 B13R2.54 Cc1cccc2oc(C=O)cc12 Amb18830290 [0,1,0,1,0,0|1,0,0]=3 5921 B13R2.54 Cc1cccc2sc(C=O)cc12 Amb18675011 [0,1,0,1,0,0|1,0,0]=3 5922 B13R2.54 Cc1cccc2sc(C=O)nc12 Amb18825006 [0,1,0,1,0,0|2,0,0]=4 5923 B13R2.54 Cc1nccc2oc(C=O)cc12 Amb18830129 [0,1,0,1,0,0|2,0,0]=4 5924 B13R2.54 NCC1=Cc2c(F)cccc2C1 Amb28196144 [0,1,0,1,0,0|1,0,1]=4 5925 B13R2.54 NCC1=Cc2cccc(F)c2C1 Amb28436266 [0,1,0,1,0,0|1,0,1]=4 5926 B13R2.54 NCC1=Cc2cccc(O)c2C1 Amb27967642 [0,1,0,1,0,0|1,0,1]=4 5927 B13R2.54 Nc1cccc2cc(C=O)oc12 Amb18830109 [0,1,0,1,0,0|1,0,0]=3 5928 B13R2.54 Nc1cccc2nc(C=O)cn12 Amb18830016 [0,1,0,1,0,0|2,0,0]=4 5929 B13R2.54 Nc1cccc2oc(C=O)cc12 Amb18830105 [0,1,0,1,0,0|1,0,0]=3 5930 B13R2.54 Nc1nccc2oc(C=O)cc12 Amb32659214 [0,1,0,1,0,0|2,0,0]=4 5931 B13R2.54 O=Cc1cc2c(Br)cccc2o1 Amb18754939 [0,1,0,1,0,0|1,0,0]=3 5932 B13R2.54 O=Cc1cc2c(Br)cccc2s1 Amb18156449 [0,1,0,1,0,0|1,0,0]=3 5933 B13R2.54 O=Cc1cc2c(Br)cccn2n1 Amb33728228 [0,1,0,1,0,0|2,0,0]=4 5934 B13R2.54 O=Cc1cc2c(Br)cncc2s1 Amb33740155 [0,1,0,1,0,0|2,0,0]=4 5935 B13R2.54 O=Cc1cc2c(Br)nccc2o1 Amb18160775 [0,1,0,1,0,0|2,0,0]=4 5936 B13R2.54 O=Cc1cc2c(Br)nccc2s1 Amb18156202 [0,1,0,1,0,0|2,0,0]=4 5937 B13R2.54 O=Cc1cc2c(Cl)cccc2s1 Amb10975246 [0,1,0,1,0,0|1,0,0]=3 5938 B13R2.54 O=Cc1cc2c(Cl)cncc2s1 Amb13890510 [0,1,0,1,0,0|2,0,0]=4 5939 B13R2.54 O=Cc1cc2c(Cl)nccc2o1 Amb18648558 [0,1,0,1,0,0|2,0,0]=4 5940 B13R2.54 O=Cc1cc2c(Cl)nccc2s1 Amb24571188 [0,1,0,1,0,0|2,0,0]=4 5941 B13R2.54 O=Cc1cc2c(F)cccc2s1 Amb18141133 [0,1,0,1,0,0|1,0,0]=3 5942 B13R2.54 O=Cc1cc2c(I)cccc2s1 Amb27207327 [0,1,0,1,0,0|1,0,0]=3 5943 B13R2.54 O=Cc1cc2c(O)cccc2o1 Amb27209821 [0,1,0,1,0,0|1,0,0]=3 5944 B13R2.54 O=Cc1cc2c(O)cccc2s1 Amb32667665 [0,1,0,1,0,0|1,0,0]=3 5945 B13R2.54 O=Cc1cc2c(O)nccc2o1 Amb18829556 [0,1,0,1,0,0|2,0,0]=4 5946 B13R2.54 O=Cc1cc2c(s1)C=CNC2=O Amb33715571 [0,1,0,1,0,0|2,0,0]=4 5947 B13R2.54 O=Cc1cc2cccc(Br)c2o1 Amb16233534 [0,1,0,1,0,0|1,0,0]=3 5948 B13R2.54 O=Cc1cc2cccc(Br)c2s1 Amb22371020 [0,1,0,1,0,0|1,0,0]=3 5949 B13R2.54 O=Cc1cc2cccc(Cl)c2o1 Amb18824315 [0,1,0,1,0,0|1,0,0]=3 5950 B13R2.54 O=Cc1cc2cccc(Cl)c2s1 Amb18675014 [0,1,0,1,0,0|1,0,0]=3 5951 B13R2.54 O=Cc1cc2cccc(F)c2o1 Amb18829079 [0,1,0,1,0,0|1,0,0]=3 5952 B13R2.54 O=Cc1cc2cccc(F)c2s1 Amb18139675 [0,1,0,1,0,0|1,0,0]=3 5953 B13R2.54 O=Cc1cc2ccnc(Cl)c2o1 Amb18823879 [0,1,0,1,0,0|2,0,0]=4 5954 B13R2.54 O=Cc1cc2ccnc(Cl)c2s1 Amb18811784 [0,1,0,1,0,0|2,0,0]=4 5955 B13R2.54 O=Cc1cc2cncc(Br)c2o1 Amb18750971 [0,1,0,1,0,0|2,0,0]=4 5956 B13R2.54 O=Cc1cc2cncc(I)c2o1 Amb28350365 [0,1,0,1,0,0|2,0,0]=4 5957 B13R2.54 O=Cc1cc2cncc(O)c2o1 Amb28255523 [0,1,0,1,0,0|2,0,0]=4 5958 B13R2.54 O=Cc1cc2nccc(Cl)c2s1 Amb18812037 [0,1,0,1,0,0|2,0,0]=4 5959 B13R2.54 O=Cc1cn2c(Br)cccc2n1 Amb22057543 [0,1,0,1,0,0|2,0,0]=4 5960 B13R2.54 O=Cc1cn2c(Cl)cccc2n1 Amb18624696 [0,1,0,1,0,0|2,0,0]=4 5961 B13R2.54 O=Cc1cn2c(F)cccc2n1 Amb15695344 [0,1,0,1,0,0|2,0,0]=4 5962 B13R2.54 O=Cc1cn2cccc(Br)c2n1 Amb22057560 [0,1,0,1,0,0|2,0,0]=4 5963 B13R2.54 O=Cc1cn2cccc(F)c2n1 Amb24054280 [0,1,0,1,0,0|2,0,0]=4 5964 B13R2.54 O=Cc1nc2c(Br)cccc2o1 Amb22756790 [0,1,0,1,0,0|2,0,0]=4 5965 B13R2.54 O=Cc1nc2c(Br)cccc2s1 Amb33067969 [0,1,0,1,0,0|2,0,0]=4 5966 B13R2.54 O=Cc1nc2c(Cl)cccc2o1 Amb25057912 [0,1,0,1,0,0|2,0,0]=4 5967 B13R2.54 O=Cc1nc2c(F)cccc2o1 Amb18828624 [0,1,0,1,0,0|2,0,0]=4 5968 B13R2.54 O=Cc1nc2c(O)cccc2o1 Amb27851721 [0,1,0,1,0,0|2,0,0]=4 5969 B13R2.54 O=Cc1nc2c(O)cccc2s1 Amb18824743 [0,1,0,1,0,0|2,0,0]=4 5970 B13R2.54 O=Cc1nc2c(S)cccc2o1 Amb27268657 [0,1,0,1,0,0|2,0,0]=4 5971 B13R2.54 O=Cc1nc2c(S)cccc2s1 Amb28074684 [0,1,0,1,0,0|2,0,0]=4 5972 B13R2.54 O=Cc1nc2cccc(Br)c2o1 Amb22756059 [0,1,0,1,0,0|2,0,0]=4 5973 B13R2.54 O=Cc1nc2cccc(Br)c2s1 Amb32797298 [0,1,0,1,0,0|2,0,0]=4 5974 B13R2.54 O=Cc1nc2cccc(Cl)c2s1 Amb18812043 [0,1,0,1,0,0|2,0,0]=4 5975 B13R2.54 O=Cc1nc2cccc(F)c2s1 Amb18193372 [0,1,0,1,0,0|2,0,0]=4 5976 B13R2.54 O=Cc1nc2cccc(I)c2o1 Amb26619942 [0,1,0,1,0,0|2,0,0]=4 5977 B13R2.54 O=Cc1nc2cccc(O)c2o1 Amb27463591 [0,1,0,1,0,0|2,0,0]=4 5978 B13R2.54 O=Cc1nc2cccc(O)c2s1 Amb25724431 [0,1,0,1,0,0|2,0,0]=4 5979 B13R2.54 O=Cc1nc2cccc(S)c2o1 Amb27615812 [0,1,0,1,0,0|2,0,0]=4 5980 B13R2.155 Brc1ccc2ccc(Br)cc2c1 Amb2609443 [0,1,0,1,0,0|2,0,0]=4 5981 B13R2.155 Brc1ccc2ccc(I)cc2c1 Amb24758917 [0,1,0,1,0,0|2,0,0]=4 5982 B13R2.155 Brc1ccc2ncc(Br)cc2c1 Amb21964475 [0,1,0,1,0,0|2,0,0]=4 5983 B13R2.155 Brc1ccc2ncc(I)cc2c1 Amb24179183 [0,1,0,1,0,0|2,0,0]=4 5984 B13R2.155 Brc1cnc2ccc(I)cc2c1 Amb15693012 [0,1,0,1,0,0|2,0,0]=4 5985 B13R2.155 CC1=CC2=CC(=O)NC=C2C=C1 Amb22371048 [0,1,0,1,0,0|2,0,0]=4 5986 B13R2.155 CC1=Cc2cc(C)ccc2NC1 Amb18559660 [0,1,0,1,0,0|1,0,1]=4 5987 B13R2.155 CC1=Cc2cc(Cl)ccc2NC1 Amb18559662 [0,1,0,1,0,0|1,0,1]=4 5988 B13R2.155 CC1=Cc2cc(F)ccc2NC1 Amb18559661 [0,1,0,1,0,0|1,0,1]=4 5989 B13R2.155 Cc1cc2cc(Br)ccc2cn1 Amb23401576 [0,1,0,1,0,0|2,0,0]=4 5990 B13R2.155 Cc1cc2cc(Cl)ccc2cn1 Amb21964541 [0,1,0,1,0,0|2,0,0]=4 5991 B13R2.155 Cc1cc2cc(F)ccc2cn1 Amb22586589 [0,1,0,1,0,0|2,0,0]=4 5992 B13R2.155 Cc1cc2cc(N)ccc2cn1 Amb28324250 [0,1,0,1,0,0|2,0,0]=4 5993 B13R2.155 Cc1ccc2c(c1)NC(=O)C=C2 Amb21857833 [0,1,0,1,0,0|2,0,0]=4 5994 B13R2.155 Cc1ccc2c(c1)OC(=O)C=C2 Amb18511476 [0,1,0,1,0,0|2,0,0]=4 5995 B13R2.155 Cc1ccc2ccc(Br)cc2c1 Amb21864772 [0,1,0,1,0,0|1,0,0]=3 5996 B13R2.155 Cc1ccc2ccc(Br)cc2n1 Amb1994793 [0,1,0,1,0,0|2,0,0]=4 5997 B13R2.155 Cc1ccc2ccc(C)cc2c1 Amb2687557 [0,1,0,1,0,0|1,0,0]=3 5998 B13R2.155 Cc1ccc2ccc(C)nc2c1 Amb22002033 [0,1,0,1,0,0|2,0,0]=4 5999 B13R2.155 Cc1ccc2ccc(Cl)cc2c1 Amb24626109 [0,1,0,1,0,0|1,0,0]=3 6000 B13R2.155 Cc1ccc2ccc(Cl)cc2n1 Amb2371819 [0,1,0,1,0,0|2,0,0]=4 6001 B13R2.155 Cc1ccc2ccc(Cl)nc2c1 Amb22007944 [0,1,0,1,0,0|2,0,0]=4 6002 B13R2.155 Cc1ccc2ccc(F)cc2c1 Amb24429006 [0,1,0,1,0,0|1,0,0]=3 6003 B13R2.155 Cc1ccc2ccc(F)cc2n1 Amb2688237 [0,1,0,1,0,0|2,0,0]=4 6004 B13R2.155 Cc1ccc2ccc(I)cc2n1 Amb26576362 [0,1,0,1,0,0|2,0,0]=4 6005 B13R2.155 Cc1ccc2ccc(N)cc2c1 Amb24707712 [0,1,0,1,0,0|1,0,0]=3 6006 B13R2.155 Cc1ccc2ccc(N)nc2c1 Amb25982717 [0,1,0,1,0,0|2,0,0]=4 6007 B13R2.155 Cc1ccc2ccc(O)cc2c1 Amb18645051 [0,1,0,1,0,0|1,0,0]=3 6008 B13R2.155 Cc1ccc2ccc(O)cc2n1 Amb18353419 [0,1,0,1,0,0|2,0,0]=4 6009 B13R2.155 Cc1ccc2ccc(S)nc2c1 Amb23536151 [0,1,0,1,0,0|2,0,0]=4 6010 B13R2.155 Cc1ccc2cnc(C)cc2c1 Amb24085597 [0,1,0,1,0,0|2,0,0]=4 6011 B13R2.155 Cc1ccc2cnc(Cl)cc2c1 Amb24744437 [0,1,0,1,0,0|2,0,0]=4 6012 B13R2.155 Cc1ccc2cnc(N)cc2c1 Amb22234743 [0,1,0,1,0,0|2,0,0]=4 6013 B13R2.155 Cc1ccc2ncc(Br)cc2c1 Amb24054480 [0,1,0,1,0,0|2,0,0]=4 6014 B13R2.155 Cc1ccc2ncc(C)cc2c1 Amb17334418 [0,1,0,1,0,0|1,0,0]=3 6015 B13R2.155 Cc1ccc2ncc(C)nc2c1 Amb27962656 [0,1,0,1,0,0|2,0,0]=4 6016 B13R2.155 Cc1ccc2ncc(F)cc2c1 Amb28244382 [0,1,0,1,0,0|2,0,0]=4 6017 B13R2.155 Cc1ccc2ncc(N)cc2c1 Amb17157131 [0,1,0,1,0,0|2,0,0]=4 6018 B13R2.155 Cc1ccc2ncc(O)cc2c1 Amb8506040 [0,1,0,1,0,0|2,0,0]=4 6019 B13R2.155 Cc1cnc2c(c1)NC(=O)C=C2 Amb24556512 [0,1,0,1,0,0|2,0,0]=4 6020 B13R2.155 Cc1cnc2ccc(Br)cc2c1 Amb1994327 [0,1,0,1,0,0|1,0,0]=3 6021 B13R2.155 Cc1cnc2ccc(N)cc2c1 Amb26609461 [0,1,0,1,0,0|1,0,0]=3 6022 B13R2.155 Cc1cnc2ccc(O)cc2c1 Amb25204459 [0,1,0,1,0,0|1,0,0]=3 6023 B13R2.155 Cc1cnc2ncc(Br)cc2c1 Amb34932623 [0,1,0,1,0,0|2,0,0]=4 6024 B13R2.155 Clc1ccc2ccc(Br)cc2c1 Amb28241023 [0,1,0,1,0,0|2,0,0]=4 6025 B13R2.155 Clc1ccc2ccc(Cl)cc2c1 Amb6298113 [0,1,0,1,0,0|2,0,0]=4 6026 B13R2.155 Clc1ccc2ccc(I)cc2c1 Amb25790503 [0,1,0,1,0,0|2,0,0]=4 6027 B13R2.155 Clc1ccc2ncc(Br)cc2c1 Amb22899265 [0,1,0,1,0,0|2,0,0]=4 6028 B13R2.155 Clc1ccc2ncc(I)cc2c1 Amb28135713 [0,1,0,1,0,0|2,0,0]=4 6029 B13R2.155 Clc1cnc2ccc(Br)cc2c1 Amb22751168 [0,1,0,1,0,0|2,0,0]=4 6030 B13R2.155 Fc1ccc2ccc(Br)cc2c1 Amb25365032 [0,1,0,1,0,0|2,0,0]=4 6031 B13R2.155 Fc1ccc2ccc(Cl)cc2c1 Amb27862466 [0,1,0,1,0,0|2,0,0]=4 6032 B13R2.155 Fc1ccc2ccc(F)cc2c1 Amb25347384 [0,1,0,1,0,0|2,0,0]=4 6033 B13R2.155 Fc1ccc2ccc(I)cc2c1 Amb24483667 [0,1,0,1,0,0|2,0,0]=4 6034 B13R2.155 Fc1ccc2ncc(Br)cc2c1 Amb22899327 [0,1,0,1,0,0|2,0,0]=4 6035 B13R2.155 Fc1ccc2ncc(Cl)cc2c1 Amb27218236 [0,1,0,1,0,0|2,0,0]=4 6036 B13R2.155 Fc1ccc2ncc(F)cc2c1 Amb25793547 [0,1,0,1,0,0|2,0,0]=4 6037 B13R2.155 Fc1ccc2ncc(I)cc2c1 Amb25739549 [0,1,0,1,0,0|2,0,0]=4 6038 B13R2.155 Fc1cnc2ccc(Br)cc2c1 Amb22899328 [0,1,0,1,0,0|2,0,0]=4 6039 B13R2.155 Fc1cnc2ccc(Cl)cc2c1 Amb24553217 [0,1,0,1,0,0|2,0,0]=4 6040 B13R2.155 Fc1cnc2ccc(I)cc2c1 Amb26374202 [0,1,0,1,0,0|2,0,0]=4 6041 B13R2.155 Ic1ccc2ccc(I)cc2c1 Amb27152994 [0,1,0,1,0,0|2,0,0]=4 6042 B13R2.155 Nc1ccc2ccc(Br)cc2c1 Amb17596044 [0,1,0,1,0,0|2,0,0]=4 6043 B13R2.155 Nc1ccc2ccc(Br)cc2c1 Amb35751800 [0,1,0,1,0,0|2,0,0]=4 6044 B13R2.155 Nc1ccc2ccc(Cl)cc2c1 Amb17594515 [0,1,0,1,0,0|2,0,0]=4 6045 B13R2.155 Nc1ccc2ccc(F)cc2c1 Amb26879895 [0,1,0,1,0,0|2,0,0]=4 6046 B13R2.155 Nc1ccc2ccc(N)cc2c1 Amb2613342 [0,1,0,1,0,0|2,0,0]=4 6047 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb21955697 [0,1,0,1,0,0|2,0,0]=4 6048 B13R2.155 Nc1ccc2ccc(O)cc2c1 Amb9173657 [0,1,0,1,0,0|2,0,0]=4 6049 B13R2.155 Nc1ccc2ncc(Br)cc2c1 Amb1101979 [0,1,0,1,0,0|2,0,0]=4 6050 B13R2.155 Nc1ccc2ncc(Cl)cc2c1 Amb22586586 [0,1,0,1,0,0|2,0,0]=4 6051 B13R2.155 Nc1ccc2ncc(F)cc2c1 Amb22899391 [0,1,0,1,0,0|2,0,0]=4 6052 B13R2.155 Nc1ccc2ncc(I)cc2c1 Amb24359099 [0,1,0,1,0,0|2,0,0]=4 6053 B13R2.155 Nc1ccc2ncc(O)cc2c1 Amb24183776 [0,1,0,1,0,0|2,0,0]=4 6054 B13R2.155 Nc1cnc2ccc(Br)cc2c1 Amb1994332 [0,1,0,1,0,0|2,0,0]=4 6055 B13R2.155 Nc1cnc2ccc(Br)cc2c1 Amb9134115 [0,1,0,1,0,0|2,0,0]=4 6056 B13R2.155 Nc1cnc2ccc(Cl)cc2c1 Amb17157138 [0,1,0,1,0,0|2,0,0]=4 6057 B13R2.155 Nc1cnc2ccc(F)cc2c1 Amb17157137 [0,1,0,1,0,0|2,0,0]=4 6058 B13R2.155 Nc1cnc2ccc(F)cc2c1 Amb17621721 [0,1,0,1,0,0|2,0,0]=4 6059 B13R2.155 Nc1cnc2ccc(I)cc2c1 Amb32673379 [0,1,0,1,0,0|2,0,0]=4 6060 B13R2.155 Nc1cnc2ccc(O)cc2c1 Amb23580321 [0,1,0,1,0,0|2,0,0]=4 6061 B13R2.155 Oc1ccc2ccc(Br)cc2c1 Amb17596083 [0,1,0,1,0,0|2,0,0]=4 6062 B13R2.155 Oc1ccc2ccc(Cl)cc2c1 Amb17594576 [0,1,0,1,0,0|2,0,0]=4 6063 B13R2.155 Oc1ccc2ccc(F)cc2c1 Amb24589653 [0,1,0,1,0,0|2,0,0]=4 6064 B13R2.155 Oc1ccc2ccc(I)cc2c1 Amb24429632 [0,1,0,1,0,0|2,0,0]=4 6065 B13R2.155 Oc1ccc2ccc(O)cc2c1 Amb6357388 [0,1,0,1,0,0|2,0,0]=4 6066 B13R2.155 Oc1ccc2ncc(Br)cc2c1 Amb21964255 [0,1,0,1,0,0|2,0,0]=4 6067 B13R2.155 Oc1ccc2ncc(Cl)cc2c1 Amb22497692 [0,1,0,1,0,0|2,0,0]=4 6068 B13R2.155 Oc1ccc2ncc(F)cc2c1 Amb22899330 [0,1,0,1,0,0|2,0,0]=4 6069 B13R2.155 Oc1ccc2ncc(I)cc2c1 Amb22494723 [0,1,0,1,0,0|2,0,0]=4 6070 B13R2.155 Oc1ccc2ncc(O)cc2c1 Amb24485547 [0,1,0,1,0,0|2,0,0]=4 6071 B13R2.155 Oc1cnc2ccc(Br)cc2c1 Amb33548540 [0,1,0,1,0,0|2,0,0]=4 6072 B13R2.155 Oc1cnc2ccc(Cl)cc2c1 Amb33547567 [0,1,0,1,0,0|2,0,0]=4 6073 B13R2.155 Oc1cnc2ccc(F)cc2c1 Amb22494761 [0,1,0,1,0,0|2,0,0]=4 6074 B13R2.155 Oc1cnc2ccc(I)cc2c1 Amb22494758 [0,1,0,1,0,0|2,0,0]=4 6075 B13R2.155 Sc1ccc2ccc(S)cc2c1 Amb21954230 [0,1,0,1,0,0|2,0,0]=4 6076 B13R2.155 Sc1cnc2ccc(Cl)cc2c1 Amb28123722 [0,1,0,1,0,0|2,0,0]=4 6077 B13R2.3021 Brc1cccc(C=C2CNC2)c1 Amb27830470 [0,1,0,1,0,0|1,0,1]=4 6078 B13R2.4856 CC1Cc2cccc(Br)c2C1=O Amb20620513 [0,1,0,1,0,0|0,0,2]=4 6079 B13R2.4856 CC1Cc2cccc(Cl)c2C1=O Amb20620748 [0,1,0,1,0,0|0,0,2]=4 6080 B13R2.4856 CC1Cc2cccc(F)c2C1=O Amb20621294 [0,1,0,1,0,0|0,0,2]=4 6081 B13R2.4856 CC1Cc2cccc(I)c2C1=O Amb27241092 [0,1,0,1,0,0|0,0,2]=4 6082 B13R2.4856 CN1Cc2cccc(Br)c2C1=O Amb22500799 [0,1,0,1,0,0|1,0,1]=4 6083 B13R2.4856 CN1Cc2cccc(Cl)c2C1=O Amb22500796 [0,1,0,1,0,0|1,0,1]=4 6084 B13R2.4856 CN1Cc2cccc(F)c2C1=O Amb22500793 [0,1,0,1,0,0|1,0,1]=4 6085 B13R2.4856 CN1Cc2cccc(I)c2C1=O Amb22500802 [0,1,0,1,0,0|1,0,1]=4 6086 B13R2.4856 CN1Cc2cccc(N)c2C1=O Amb22737063 [0,1,0,1,0,0|1,0,1]=4 6087 B13R2.4856 CN1Nc2cccc(Br)c2C1=O Amb26932474 [0,1,0,1,0,0|2,0,0]=4 6088 B13R2.4856 Cc1cc2cccc(Cl)c2n1C Amb18065230 [0,1,0,1,0,0|2,0,0]=4 6089 B13R2.4856 Cc1cc2cccc(F)c2n1C Amb18065229 [0,1,0,1,0,0|2,0,0]=4 6090 B13R2.4856 Cc1cc2ccoc(C)c2c1N Amb27219417 [0,1,0,1,0,0|2,0,0]=4 6091 B13R2.4856 Cc1cc2occc(C)c2c1N Amb25762907 [0,1,0,1,0,0|2,0,0]=4 6092 B13R2.4856 Cc1cccc2c1C(=O)C(=O)N2 Amb4140113 [0,1,0,1,0,0|2,0,0]=4 6093 B13R2.4856 Cc1cccc2c1C(=O)C(C)C2 Amb27176168 [0,1,0,1,0,0|0,0,2]=4 6094 B13R2.4856 Cc1cccc2c1C(=O)C(Cl)=N2 Amb17594602 [0,1,0,1,0,0|2,0,0]=4 6095 B13R2.4856 Cc1cccc2cc(C)n(C)c12 Amb18065228 [0,1,0,1,0,0|2,0,0]=4 6096 B13R2.4856 Cc1oc2cccc(Br)c2c1C Amb18754579 [0,1,0,1,0,0|2,0,0]=4 6097 B13R2.4856 Cc1oc2cccc(C)c2c1C Amb26872725 [0,1,0,1,0,0|2,0,0]=4 6098 B13R2.4856 Cc1sc2cccc(Br)c2c1Br Amb27797700 [0,1,0,1,0,0|2,0,0]=4 6099 B13R2.4856 Cc1sc2cccc(Br)c2c1F Amb27962057 [0,1,0,1,0,0|2,0,0]=4 6100 B13R2.4856 Cc1sc2cccc(Br)c2c1I Amb27779353 [0,1,0,1,0,0|2,0,0]=4 6101 B13R2.4856 Cc1sc2cccc(Br)c2c1N Amb27799044 [0,1,0,1,0,0|2,0,0]=4 6102 B13R2.4856 Cc1sc2cccc(Br)c2c1O Amb27880306 [0,1,0,1,0,0|1,0,1]=4 6103 B13R2.4856 Cc1sc2cccc(Br)c2c1S Amb27619563 [0,1,0,1,0,0|1,1,0]=4 6104 B13R2.4856 Cc1sc2cccc(C)c2c1Cl Amb27783222 [0,1,0,1,0,0|2,0,0]=4 6105 B13R2.4856 Cc1sc2cccc(C)c2c1N Amb28287435 [0,1,0,1,0,0|2,0,0]=4 6106 B13R2.4856 Cc1sc2cccc(C)c2c1O Amb28287001 [0,1,0,1,0,0|1,0,1]=4 6107 B13R2.4856 Cc1sc2cccc(C)c2c1S Amb27463651 [0,1,0,1,0,0|1,1,0]=4 6108 B13R2.4856 Cc1sc2cccc(Cl)c2c1Br Amb27622385 [0,1,0,1,0,0|2,0,0]=4 6109 B13R2.4856 Cc1sc2cccc(Cl)c2c1S Amb28130668 [0,1,0,1,0,0|1,1,0]=4 6110 B13R2.4856 Cc1sc2cccc(I)c2c1O Amb27788654 [0,1,0,1,0,0|1,0,1]=4 6111 B13R2.4856 Cc1sc2cccc(I)c2c1S Amb27786404 [0,1,0,1,0,0|1,1,0]=4 6112 B13R2.4856 Cc1sc2cccc(N)c2c1F Amb27849281 [0,1,0,1,0,0|2,0,0]=4 6113 B13R2.4856 Cc1sc2cccc(N)c2c1O Amb27474910 [0,1,0,1,0,0|1,0,1]=4 6114 B13R2.4856 Cc1sc2cccc(O)c2c1Cl Amb27787892 [0,1,0,1,0,0|2,0,0]=4 6115 B13R2.4856 Cc1sc2cccc(O)c2c1N Amb27870065 [0,1,0,1,0,0|2,0,0]=4 6116 B13R2.4856 Cc1sc2cccc(S)c2c1C Amb28252521 [0,1,0,1,0,0|2,0,0]=4 6117 B13R2.4856 Cc1sc2cccc(S)c2c1Cl Amb28247361 [0,1,0,1,0,0|2,0,0]=4 6118 B13R2.4856 Nc1cccc2c1C(=O)C(=O)N2 Amb27974583 [0,1,0,1,0,0|2,0,0]=4 6119 B13R2.4856 O=C1C(Cl)=Nc2cccc(Cl)c21 Amb17595294 [0,1,0,1,0,0|2,0,0]=4 6120 B13R2.4856 O=C1Nc2cccc(Br)c2C1=O Amb6374120 [0,1,0,1,0,0|2,0,0]=4 6121 B13R2.4856 O=C1Nc2cccc(Cl)c2C1=O Amb4017458 [0,1,0,1,0,0|2,0,0]=4 6122 B13R2.4856 O=C1Nc2cccc(F)c2C1=O Amb8397161 [0,1,0,1,0,0|2,0,0]=4 6123 B13R2.4856 O=C1Nc2cccc(I)c2C1=O Amb8629770 [0,1,0,1,0,0|2,0,0]=4 6124 B13R2.5179 Brc1ccc2c(Br)cccc2c1 Amb22899601 [0,1,0,1,0,0|2,0,0]=4 6125 B13R2.5179 Brc1cccc2cc(I)ccc12 Amb28072559 [0,1,0,1,0,0|2,0,0]=4 6126 B13R2.5179 Brc1cccc2cc(I)cnc12 Amb22170457 [0,1,0,1,0,0|2,0,0]=4 6127 B13R2.5179 Brc1cnc2c(Br)cccc2c1 Amb27755703 [0,1,0,1,0,0|2,0,0]=4 6128 B13R2.5179 Brc1cnc2c(I)cccc2c1 Amb22584153 [0,1,0,1,0,0|2,0,0]=4 6129 B13R2.5179 CC1=COc2c(N)cccc2O1 Amb17570074 [0,1,0,1,0,0|1,0,1]=4 6130 B13R2.5179 CC1=Cc2cccc(C)c2NC1 Amb18559653 [0,1,0,1,0,0|1,0,1]=4 6131 B13R2.5179 CC1=Cc2cccc(Cl)c2NC1 Amb18559655 [0,1,0,1,0,0|1,0,1]=4 6132 B13R2.5179 CC1=Cc2cccc(F)c2NC1 Amb18559654 [0,1,0,1,0,0|1,0,1]=4 6133 B13R2.5179 C[n+]1ccc2c(O)cccc2c1 Amb27762491 [0,1,0,1,0,0|2,0,0]=4 6134 B13R2.5179 Cc1cc2cccc(Br)c2cn1 Amb26028339 [0,1,0,1,0,0|2,0,0]=4 6135 B13R2.5179 Cc1cc2cccc(Cl)c2cn1 Amb32684129 [0,1,0,1,0,0|2,0,0]=4 6136 B13R2.5179 Cc1cc2cccc(F)c2cn1 Amb32684124 [0,1,0,1,0,0|2,0,0]=4 6137 B13R2.5179 Cc1cc2cccc(N)c2cn1 Amb24610579 [0,1,0,1,0,0|2,0,0]=4 6138 B13R2.5179 Cc1cc2cccc(O)c2cn1 Amb26450488 [0,1,0,1,0,0|2,0,0]=4 6139 B13R2.5179 Cc1ccc2c(Br)cccc2c1 Amb26921428 [0,1,0,1,0,0|1,0,0]=3 6140 B13R2.5179 Cc1ccc2c(Br)cccc2n1 Amb21857879 [0,1,0,1,0,0|2,0,0]=4 6141 B13R2.5179 Cc1ccc2c(Br)ccnc2c1 Amb9134333 [0,1,0,1,0,0|2,0,0]=4 6142 B13R2.5179 Cc1ccc2c(Br)nccc2c1 Amb18559765 [0,1,0,1,0,0|2,0,0]=4 6143 B13R2.5179 Cc1ccc2c(C)cccc2c1 Amb6296605 [0,1,0,1,0,0|1,0,0]=3 6144 B13R2.5179 Cc1ccc2c(C)cccc2n1 Amb21858709 [0,1,0,1,0,0|2,0,0]=4 6145 B13R2.5179 Cc1ccc2c(C)ccnc2c1 Amb24094524 [0,1,0,1,0,0|2,0,0]=4 6146 B13R2.5179 Cc1ccc2c(C)cncc2c1 Amb27631489 [0,1,0,1,0,0|2,0,0]=4 6147 B13R2.5179 Cc1ccc2c(C)nccc2c1 Amb27962482 [0,1,0,1,0,0|2,0,0]=4 6148 B13R2.5179 Cc1ccc2c(Cl)cccc2c1 Amb27632327 [0,1,0,1,0,0|1,0,0]=3 6149 B13R2.5179 Cc1ccc2c(Cl)cccc2n1 Amb8390716 [0,1,0,1,0,0|2,0,0]=4 6150 B13R2.5179 Cc1ccc2c(Cl)ccnc2c1 Amb1994640 [0,1,0,1,0,0|2,0,0]=4 6151 B13R2.5179 Cc1ccc2c(Cl)nccc2c1 Amb17216938 [0,1,0,1,0,0|2,0,0]=4 6152 B13R2.5179 Cc1ccc2c(F)cccc2c1 Amb25760151 [0,1,0,1,0,0|1,0,0]=3 6153 B13R2.5179 Cc1ccc2c(I)cccc2c1 Amb26849069 [0,1,0,1,0,0|1,0,0]=3 6154 B13R2.5179 Cc1ccc2c(N)cccc2c1 Amb17593939 [0,1,0,1,0,0|1,0,0]=3 6155 B13R2.5179 Cc1ccc2c(N)cccc2n1 Amb6355822 [0,1,0,1,0,0|2,0,0]=4 6156 B13R2.5179 Cc1ccc2c(N)ccnc2c1 Amb1994612 [0,1,0,1,0,0|2,0,0]=4 6157 B13R2.5179 Cc1ccc2c(N)nccc2c1 Amb17216958 [0,1,0,1,0,0|2,0,0]=4 6158 B13R2.5179 Cc1ccc2c(O)cccc2c1 Amb18559380 [0,1,0,1,0,0|1,0,0]=3 6159 B13R2.5179 Cc1ccc2c(O)cccc2n1 Amb18353422 [0,1,0,1,0,0|2,0,0]=4 6160 B13R2.5179 Cc1ccc2c(O)ccnc2c1 Amb1994825 [0,1,0,1,0,0|2,0,0]=4 6161 B13R2.5179 Cc1ccc2c(O)cncc2c1 Amb19110675 [0,1,0,1,0,0|2,0,0]=4 6162 B13R2.5179 Cc1ccc2c(O)nccc2c1 Amb18062793 [0,1,0,1,0,0|2,0,0]=4 6163 B13R2.5179 Cc1ccc2c(c1)SC=CC2=O Amb27164624 [0,1,0,1,0,0|2,0,0]=4 6164 B13R2.5179 Cc1ccc2c(ccc[n+]2C)c1 Amb2609753 [0,1,0,1,0,0|2,0,0]=4 6165 B13R2.5179 Cc1cccc2cc(Br)ccc12 Amb26057223 [0,1,0,1,0,0|2,0,0]=4 6166 B13R2.5179 Cc1cccc2cc(Br)cnc12 Amb25152656 [0,1,0,1,0,0|2,0,0]=4 6167 B13R2.5179 Cc1cccc2cc(F)ccc12 Amb26879845 [0,1,0,1,0,0|2,0,0]=4 6168 B13R2.5179 Cc1cccc2cc(I)ccc12 Amb27623183 [0,1,0,1,0,0|2,0,0]=4 6169 B13R2.5179 Cc1cccc2cc(I)cnc12 Amb26605053 [0,1,0,1,0,0|2,0,0]=4 6170 B13R2.5179 Cc1cccc2cc(N)ccc12 Amb22751120 [0,1,0,1,0,0|2,0,0]=4 6171 B13R2.5179 Cc1cccc2cc(N)cnc12 Amb17157128 [0,1,0,1,0,0|2,0,0]=4 6172 B13R2.5179 Cc1cccc2cc(O)cnc12 Amb27878570 [0,1,0,1,0,0|2,0,0]=4 6173 B13R2.5179 Cc1cnc2c(Br)cccc2c1 Amb28244065 [0,1,0,1,0,0|1,0,0]=3 6174 B13R2.5179 Cc1cnc2c(C)cccc2c1 Amb17334416 [0,1,0,1,0,0|1,0,0]=3 6175 B13R2.5179 Cc1cnc2c(I)cccc2n1 Amb28129352 [0,1,0,1,0,0|2,0,0]=4 6176 B13R2.5179 Cc1cnc2c(N)cccc2c1 Amb22899667 [0,1,0,1,0,0|1,0,0]=3 6177 B13R2.5179 Cc1cnc2c(O)cccc2c1 Amb22750809 [0,1,0,1,0,0|1,0,0]=3 6178 B13R2.5179 Cc1cnc2c(O)ccnc2c1 Amb26549162 [0,1,0,1,0,0|2,0,0]=4 6179 B13R2.5179 Cc1cnc2c(S)cccc2c1 Amb27441552 [0,1,0,1,0,0|1,0,0]=3 6180 B13R2.5179 Clc1ccc2c(Br)cccc2c1 Amb25865332 [0,1,0,1,0,0|2,0,0]=4 6181 B13R2.5179 Clc1ccc2c(Cl)cccc2c1 Amb26360398 [0,1,0,1,0,0|2,0,0]=4 6182 B13R2.5179 Clc1ccc2c(I)cccc2c1 Amb25743943 [0,1,0,1,0,0|2,0,0]=4 6183 B13R2.5179 Clc1cccc2cc(Br)ccc12 Amb26372387 [0,1,0,1,0,0|2,0,0]=4 6184 B13R2.5179 Clc1cccc2cc(Br)cnc12 Amb24183732 [0,1,0,1,0,0|2,0,0]=4 6185 B13R2.5179 Clc1cccc2cc(I)ccc12 Amb25148787 [0,1,0,1,0,0|2,0,0]=4 6186 B13R2.5179 Clc1cccc2cc(I)cnc12 Amb19515722 [0,1,0,1,0,0|2,0,0]=4 6187 B13R2.5179 Fc1ccc2c(Br)cccc2c1 Amb27816933 [0,1,0,1,0,0|2,0,0]=4 6188 B13R2.5179 Fc1ccc2c(Cl)cccc2c1 Amb25360850 [0,1,0,1,0,0|2,0,0]=4 6189 B13R2.5179 Fc1ccc2c(I)cccc2c1 Amb25063229 [0,1,0,1,0,0|2,0,0]=4 6190 B13R2.5179 Fc1cccc2cc(Br)cnc12 Amb22899268 [0,1,0,1,0,0|2,0,0]=4 6191 B13R2.5179 Fc1cccc2cc(Cl)ccc12 Amb26590969 [0,1,0,1,0,0|2,0,0]=4 6192 B13R2.5179 Fc1cccc2cc(I)ccc12 Amb26517149 [0,1,0,1,0,0|2,0,0]=4 6193 B13R2.5179 Fc1cccc2cc(I)cnc12 Amb17933793 [0,1,0,1,0,0|2,0,0]=4 6194 B13R2.5179 Fc1cnc2c(Br)cccc2c1 Amb22547350 [0,1,0,1,0,0|2,0,0]=4 6195 B13R2.5179 Fc1cnc2c(F)cccc2c1 Amb28369998 [0,1,0,1,0,0|2,0,0]=4 6196 B13R2.5179 Ic1ccc2c(I)cccc2c1 Amb24448388 [0,1,0,1,0,0|2,0,0]=4 6197 B13R2.5179 Nc1ccc2c(Br)cccc2c1 Amb17596045 [0,1,0,1,0,0|2,0,0]=4 6198 B13R2.5179 Nc1ccc2c(Cl)cccc2c1 Amb17594517 [0,1,0,1,0,0|2,0,0]=4 6199 B13R2.5179 Nc1ccc2c(F)cccc2c1 Amb26980785 [0,1,0,1,0,0|2,0,0]=4 6200 B13R2.5179 Nc1ccc2c(I)cccc2c1 Amb27462216 [0,1,0,1,0,0|2,0,0]=4 6201 B13R2.5179 Nc1ccc2c(N)cccc2c1 Amb17593962 [0,1,0,1,0,0|2,0,0]=4 6202 B13R2.5179 Nc1ccc2c(N)cccc2c1 Amb33611679 [0,1,0,1,0,0|2,0,0]=4 6203 B13R2.5179 Nc1ccc2c(O)cccc2c1 Amb2684495 [0,1,0,1,0,0|2,0,0]=4 6204 B13R2.5179 Nc1cccc2cc(Br)ccc12 Amb25073486 [0,1,0,1,0,0|2,0,0]=4 6205 B13R2.5179 Nc1cccc2cc(Br)cnc12 Amb21962760 [0,1,0,1,0,0|2,0,0]=4 6206 B13R2.5179 Nc1cccc2cc(Cl)ccc12 Amb17594521 [0,1,0,1,0,0|2,0,0]=4 6207 B13R2.5179 Nc1cccc2cc(Cl)cnc12 Amb22584113 [0,1,0,1,0,0|2,0,0]=4 6208 B13R2.5179 Nc1cccc2cc(F)ccc12 Amb22497264 [0,1,0,1,0,0|2,0,0]=4 6209 B13R2.5179 Nc1cccc2cc(F)ccc12 Amb31156387 [0,1,0,1,0,0|2,0,0]=4 6210 B13R2.5179 Nc1cccc2cc(F)cnc12 Amb22899387 [0,1,0,1,0,0|2,0,0]=4 6211 B13R2.5179 Nc1cccc2cc(I)ccc12 Amb24410696 [0,1,0,1,0,0|2,0,0]=4 6212 B13R2.5179 Nc1cccc2cc(I)cnc12 Amb21927513 [0,1,0,1,0,0|2,0,0]=4 6213 B13R2.5179 Nc1cccc2cc(O)ccc12 Amb2776482 [0,1,0,1,0,0|2,0,0]=4 6214 B13R2.5179 Nc1cccc2cc(O)cnc12 Amb24183774 [0,1,0,1,0,0|2,0,0]=4 6215 B13R2.5179 Nc1cnc2c(Br)cccc2c1 Amb17621719 [0,1,0,1,0,0|2,0,0]=4 6216 B13R2.5179 Nc1cnc2c(Br)cccc2c1 Amb22494702 [0,1,0,1,0,0|2,0,0]=4 6217 B13R2.5179 Nc1cnc2c(Cl)cccc2c1 Amb22753383 [0,1,0,1,0,0|2,0,0]=4 6218 B13R2.5179 Nc1cnc2c(F)cccc2c1 Amb17621723 [0,1,0,1,0,0|2,0,0]=4 6219 B13R2.5179 Nc1cnc2c(F)cccc2c1 Amb22899402 [0,1,0,1,0,0|2,0,0]=4 6220 B13R2.5179 Nc1cnc2c(F)cccc2c1 Amb32666798 [0,1,0,1,0,0|2,0,0]=4 6221 B13R2.5179 Nc1cnc2c(I)cccc2c1 Amb28143911 [0,1,0,1,0,0|2,0,0]=4 6222 B13R2.5179 Nc1cnc2c(O)cccc2c1 Amb24557383 [0,1,0,1,0,0|2,0,0]=4 6223 B13R2.5179 Oc1ccc2c(Br)cccc2c1 Amb17596082 [0,1,0,1,0,0|2,0,0]=4 6224 B13R2.5179 Oc1ccc2c(Cl)cccc2c1 Amb17594575 [0,1,0,1,0,0|2,0,0]=4 6225 B13R2.5179 Oc1ccc2c(F)cccc2c1 Amb28342977 [0,1,0,1,0,0|2,0,0]=4 6226 B13R2.5179 Oc1ccc2c(I)cccc2c1 Amb25883430 [0,1,0,1,0,0|2,0,0]=4 6227 B13R2.5179 Oc1ccc2c(O)cccc2c1 Amb6357829 [0,1,0,1,0,0|2,0,0]=4 6228 B13R2.5179 Oc1cccc2cc(Br)ccc12 Amb17596077 [0,1,0,1,0,0|2,0,0]=4 6229 B13R2.5179 Oc1cccc2cc(Br)cnc12 Amb22491313 [0,1,0,1,0,0|2,0,0]=4 6230 B13R2.5179 Oc1cccc2cc(Cl)ccc12 Amb17594571 [0,1,0,1,0,0|2,0,0]=4 6231 B13R2.5179 Oc1cccc2cc(Cl)cnc12 Amb22499642 [0,1,0,1,0,0|2,0,0]=4 6232 B13R2.5179 Oc1cccc2cc(F)ccc12 Amb28458147 [0,1,0,1,0,0|2,0,0]=4 6233 B13R2.5179 Oc1cccc2cc(F)cnc12 Amb22899348 [0,1,0,1,0,0|2,0,0]=4 6234 B13R2.5179 Oc1cccc2cc(I)ccc12 Amb26016186 [0,1,0,1,0,0|2,0,0]=4 6235 B13R2.5179 Oc1cccc2cc(I)cnc12 Amb27631430 [0,1,0,1,0,0|2,0,0]=4 6236 B13R2.5179 Oc1cnc2c(Br)cccc2c1 Amb22494958 [0,1,0,1,0,0|2,0,0]=4 6237 B13R2.5179 Oc1cnc2c(Cl)cccc2c1 Amb24183739 [0,1,0,1,0,0|2,0,0]=4 6238 B13R2.5179 Oc1cnc2c(F)cccc2c1 Amb22899408 [0,1,0,1,0,0|2,0,0]=4 6239 B13R2.5179 Oc1cnc2c(O)cccc2c1 Amb27175611 [0,1,0,1,0,0|2,0,0]=4 6240 B13R2.5190 CC1=C(C)c2ccc(N)cc2C1 Amb27233481 [0,1,0,1,0,0|1,0,1]=4 6241 B13R2.5190 CC1=Cc2cc(O)ccc2C1=O Amb27177971 [0,1,0,1,0,0|0,0,0]=2 6242 B13R2.5190 CC1Cc2cc(Br)ccc2C1=O Amb20620512 [0,1,0,1,0,0|0,0,2]=4 6243 B13R2.5190 CC1Cc2cc(Cl)ccc2C1=O Amb20620749 [0,1,0,1,0,0|0,0,2]=4 6244 B13R2.5190 CC1Cc2cc(F)ccc2C1=O Amb8390791 [0,1,0,1,0,0|0,0,2]=4 6245 B13R2.5190 CC1Cc2cc(N)ccc2C1=O Amb25062276 [0,1,0,1,0,0|0,0,2]=4 6246 B13R2.5190 CC1Cc2cc(O)ccc2C1=O Amb2708656 [0,1,0,1,0,0|0,0,2]=4 6247 B13R2.5190 CC1Oc2cc(Cl)ccc2C1=O Amb27239410 [0,1,0,1,0,0|1,0,1]=4 6248 B13R2.5190 CC1Oc2cc(F)ccc2C1=O Amb33550779 [0,1,0,1,0,0|1,0,1]=4 6249 B13R2.5190 CC1Sc2cc(F)ccc2C1=O Amb27419853 [0,1,0,1,0,0|1,0,1]=4 6250 B13R2.5190 CN1Cc2cc(Br)ccc2C1=O Amb15693065 [0,1,0,1,0,0|1,0,1]=4 6251 B13R2.5190 CN1Cc2cc(Cl)ccc2C1=O Amb22500795 [0,1,0,1,0,0|1,0,1]=4 6252 B13R2.5190 CN1Cc2cc(F)ccc2C1=O Amb22500804 [0,1,0,1,0,0|1,0,1]=4 6253 B13R2.5190 CN1Cc2cc(I)ccc2C1=O Amb22500800 [0,1,0,1,0,0|1,0,1]=4 6254 B13R2.5190 CN1Cc2cc(N)ccc2C1=O Amb21960556 [0,1,0,1,0,0|1,0,1]=4 6255 B13R2.5190 CN1Cc2cc(O)ccc2C1=O Amb18645797 [0,1,0,1,0,0|1,0,1]=4 6256 B13R2.5190 CN1Nc2cc(Br)ccc2C1=O Amb27603585 [0,1,0,1,0,0|2,0,0]=4 6257 B13R2.5190 CN1Nc2cc(Cl)ccc2C1=O Amb27241381 [0,1,0,1,0,0|2,0,0]=4 6258 B13R2.5190 Cc1cc2cc(Br)ccc2n1C Amb17571991 [0,1,0,1,0,0|2,0,0]=4 6259 B13R2.5190 Cc1cc2cc(Cl)ccc2n1C Amb18065222 [0,1,0,1,0,0|2,0,0]=4 6260 B13R2.5190 Cc1cc2cc(F)ccc2n1C Amb18065221 [0,1,0,1,0,0|2,0,0]=4 6261 B13R2.5190 Cc1cc2cc(F)ccc2n1N Amb28250021 [0,1,0,1,0,0|2,0,0]=4 6262 B13R2.5190 Cc1cc2cc(N)ccc2n1C Amb10783198 [0,1,0,1,0,0|2,0,0]=4 6263 B13R2.5190 Cc1cc2cc(N)ccc2n1C Amb845137 [0,1,0,1,0,0|2,0,0]=4 6264 B13R2.5190 Cc1cc2cc(O)ccc2n1C Amb4418583 [0,1,0,1,0,0|2,0,0]=4 6265 B13R2.5190 Cc1cc2oc(F)ccc2c1N Amb24733832 [0,1,0,1,0,0|2,0,0]=4 6266 B13R2.5190 Cc1ccc2c(C)c(C)oc2c1 Amb27616941 [0,1,0,1,0,0|2,0,0]=4 6267 B13R2.5190 Cc1ccc2c(Cl)c(C)sc2c1 Amb27800198 [0,1,0,1,0,0|2,0,0]=4 6268 B13R2.5190 Cc1ccc2c(N)c(C)sc2c1 Amb28133701 [0,1,0,1,0,0|2,0,0]=4 6269 B13R2.5190 Cc1ccc2c(S)c(C)sc2c1 Amb28290546 [0,1,0,1,0,0|1,1,0]=4 6270 B13R2.5190 Cc1ccc2c(c1)N=C(Cl)C2=O Amb17594604 [0,1,0,1,0,0|2,0,0]=4 6271 B13R2.5190 Cc1ccc2c(c1)NC(=O)C2=O Amb1887200 [0,1,0,1,0,0|2,0,0]=4 6272 B13R2.5190 Cc1ccc2c(c1)OC(C)C2=O Amb26868636 [0,1,0,1,0,0|1,0,1]=4 6273 B13R2.5190 Cc1ccc2c(c1)SC(=O)C2=O Amb28144149 [0,1,0,1,0,0|2,0,0]=4 6274 B13R2.5190 Cc1ccc2c(c1)cc(C)n2C Amb18065027 [0,1,0,1,0,0|2,0,0]=4 6275 B13R2.5190 Cc1ccn2c(C)c(C)cc2c1 Amb28246126 [0,1,0,1,0,0|2,0,0]=4 6276 B13R2.5190 Cc1sc2cc(Br)ccc2c1F Amb27625402 [0,1,0,1,0,0|2,0,0]=4 6277 B13R2.5190 Cc1sc2cc(Br)ccc2c1I Amb27230697 [0,1,0,1,0,0|2,0,0]=4 6278 B13R2.5190 Cc1sc2cc(Br)ccc2c1N Amb27963343 [0,1,0,1,0,0|2,0,0]=4 6279 B13R2.5190 Cc1sc2cc(Br)ccc2c1O Amb28247451 [0,1,0,1,0,0|1,0,1]=4 6280 B13R2.5190 Cc1sc2cc(Br)ccc2c1S Amb27460294 [0,1,0,1,0,0|1,1,0]=4 6281 B13R2.5190 Cc1sc2cc(Cl)ccc2c1Cl Amb28133490 [0,1,0,1,0,0|2,0,0]=4 6282 B13R2.5190 Cc1sc2cc(Cl)ccc2c1I Amb28288318 [0,1,0,1,0,0|2,0,0]=4 6283 B13R2.5190 Cc1sc2cc(Cl)ccc2c1N Amb27627412 [0,1,0,1,0,0|2,0,0]=4 6284 B13R2.5190 Cc1sc2cc(F)ccc2c1Br Amb27463662 [0,1,0,1,0,0|2,0,0]=4 6285 B13R2.5190 Cc1sc2cc(F)ccc2c1Cl Amb27194705 [0,1,0,1,0,0|2,0,0]=4 6286 B13R2.5190 Cc1sc2cc(F)ccc2c1I Amb27971290 [0,1,0,1,0,0|2,0,0]=4 6287 B13R2.5190 Cc1sc2cc(F)ccc2c1N Amb28287839 [0,1,0,1,0,0|2,0,0]=4 6288 B13R2.5190 Cc1sc2cc(I)ccc2c1Cl Amb27782846 [0,1,0,1,0,0|2,0,0]=4 6289 B13R2.5190 Cc1sc2cc(I)ccc2c1I Amb28135196 [0,1,0,1,0,0|2,0,0]=4 6290 B13R2.5190 Cc1sc2cc(I)ccc2c1N Amb27627634 [0,1,0,1,0,0|2,0,0]=4 6291 B13R2.5190 Cc1sc2cc(I)ccc2c1O Amb28287012 [0,1,0,1,0,0|1,0,1]=4 6292 B13R2.5190 Cc1sc2cc(N)ccc2c1C Amb27439212 [0,1,0,1,0,0|2,0,0]=4 6293 B13R2.5190 Cc1sc2cc(N)ccc2c1Cl Amb27429266 [0,1,0,1,0,0|2,0,0]=4 6294 B13R2.5190 Cc1sc2cc(N)ccc2c1I Amb27870224 [0,1,0,1,0,0|2,0,0]=4 6295 B13R2.5190 Cc1sc2cc(N)ccc2c1O Amb27263093 [0,1,0,1,0,0|1,0,1]=4 6296 B13R2.5190 Cc1sc2cc(O)ccc2c1Br Amb28410956 [0,1,0,1,0,0|2,0,0]=4 6297 B13R2.5190 Cc1sc2cc(O)ccc2c1O Amb27844838 [0,1,0,1,0,0|1,0,1]=4 6298 B13R2.5190 O=C1C(Cl)=Nc2cc(Cl)ccc21 Amb17595295 [0,1,0,1,0,0|2,0,0]=4 6299 B13R2.5190 O=C1Cc2cc(F)ccc2C1=O Amb27416492 [0,1,0,1,0,0|1,0,1]=4 6300 B13R2.5190 O=C1Nc2cc(Br)ccc2C1=O Amb6374119 [0,1,0,1,0,0|2,0,0]=4 6301 B13R2.5190 O=C1Nc2cc(Cl)ccc2C1=O Amb2786130 [0,1,0,1,0,0|2,0,0]=4 6302 B13R2.5190 O=C1Nc2cc(F)ccc2C1=O Amb1155086 [0,1,0,1,0,0|2,0,0]=4 6303 B13R2.5190 O=C1Nc2cc(I)ccc2C1=O Amb8629769 [0,1,0,1,0,0|2,0,0]=4 6304 B13R2.5190 O=C1Nc2cc(O)ccc2C1=O Amb6306510 [0,1,0,1,0,0|2,0,0]=4 6305 B13R2.5190 O=C1Sc2cc(Br)ccc2C1=O Amb26472295 [0,1,0,1,0,0|2,0,0]=4 6306 B13R2.101 O=CC1(Cc2ccccc2)CC1 Amb25739009 [0,1,0,1,0,0|0,0,2]=4 6307 B13R2.103 CC1(C=O)Cc2ccccc2C1 Amb25667431 [0,1,0,1,0,0|0,0,2]=4 6308 B13R2.243 CC1(C)Cc2ccccc2C1=O Amb16191937 [0,1,0,1,0,0|0,0,2]=4 6309 B13R2.243 CC1(C)Nc2ccccc2C1=O Amb18829945 [0,1,0,1,0,0|1,0,1]=4 6310 B13R2.243 CC1(C)Oc2ccccc2C1=O Amb26849546 [0,1,0,1,0,0|1,0,1]=4 6311 B13R2.243 CC1(O)Cc2ccccc2C1=O Amb17778835 [0,1,0,1,0,0|0,0,2]=4 6312 B13R2.243 C[C@@]1(F)Cc2ccccc2C1=O Amb28253981 [0,1,0,1,0,0|0,0,2]=4 6313 B13R2.243 C[C@@]1(O)Cc2ccccc2C1=O Amb2612712 [0,1,0,1,0,0|0,0,2]=4 6314 B13R2.243 C[C@]1(F)Cc2ccccc2C1=O Amb28253952 [0,1,0,1,0,0|0,0,2]=4 6315 B13R2.243 C[C@]1(O)Cc2ccccc2C1=O Amb27175939 [0,1,0,1,0,0|0,0,2]=4 6316 B13R2.162 Brc1ccc2cccc(Br)c2c1 Amb24367292 [0,1,0,1,0,0|2,0,0]=4 6317 B13R2.162 Brc1ccc2cccc(I)c2c1 Amb24663180 [0,1,0,1,0,0|2,0,0]=4 6318 B13R2.162 Brc1cccc2ccc(I)cc12 Amb4016207 [0,1,0,1,0,0|2,0,0]=4 6319 B13R2.162 Brc1cccc2ncc(I)cc12 Amb27770974 [0,1,0,1,0,0|2,0,0]=4 6320 B13R2.162 Brc1cnc2cccc(Br)c2c1 Amb15693009 [0,1,0,1,0,0|2,0,0]=4 6321 B13R2.162 CC1=CNC2=CC=CC(=N)C2=C1 Amb28245115 [0,1,0,1,0,0|1,0,0]=3 6322 B13R2.162 Cc1cc2c(Br)cccc2cn1 Amb18349267 [0,1,0,1,0,0|2,0,0]=4 6323 B13R2.162 Cc1cc2c(C)cccc2cn1 Amb27847100 [0,1,0,1,0,0|2,0,0]=4 6324 B13R2.162 Cc1cc2c(Cl)cccc2cn1 Amb24727684 [0,1,0,1,0,0|2,0,0]=4 6325 B13R2.162 Cc1cc2c(F)cccc2cn1 Amb32684127 [0,1,0,1,0,0|2,0,0]=4 6326 B13R2.162 Cc1cc2c(I)cccc2cn1 Amb25218079 [0,1,0,1,0,0|2,0,0]=4 6327 B13R2.162 Cc1cc2c(N)cccc2cn1 Amb8009308 [0,1,0,1,0,0|2,0,0]=4 6328 B13R2.162 Cc1cc2c(N)cccc2nn1 Amb2227080 [0,1,0,1,0,0|2,0,0]=4 6329 B13R2.162 Cc1ccc2c(c1)C(=O)C=CN2 Amb18177635 [0,1,0,1,0,0|2,0,0]=4 6330 B13R2.162 Cc1ccc2c(c1)C(=O)C=CO2 Amb19665381 [0,1,0,1,0,0|2,0,0]=4 6331 B13R2.162 Cc1ccc2c(c1)C(=O)C=CO2 Amb22351292 [0,1,0,1,0,0|2,0,0]=4 6332 B13R2.162 Cc1ccc2c(c1)C(=O)C=CS2 Amb27630214 [0,1,0,1,0,0|2,0,0]=4 6333 B13R2.162 Cc1ccc2c(c1)C(=O)NC=C2 Amb18349272 [0,1,0,1,0,0|2,0,0]=4 6334 B13R2.162 Cc1ccc2c(c1)C(=S)C=CN2 Amb22010839 [0,1,0,1,0,0|2,0,0]=4 6335 B13R2.162 Cc1ccc2c(c1)C(=S)NC=C2 Amb27613070 [0,1,0,1,0,0|2,0,0]=4 6336 B13R2.162 Cc1ccc2cccc(Br)c2c1 Amb27619152 [0,1,0,1,0,0|1,0,0]=3 6337 B13R2.162 Cc1ccc2cccc(Br)c2n1 Amb2234931 [0,1,0,1,0,0|2,0,0]=4 6338 B13R2.162 Cc1ccc2cccc(C)c2c1 Amb6297868 [0,1,0,1,0,0|1,0,0]=3 6339 B13R2.162 Cc1ccc2cccc(C)c2n1 Amb13883939 [0,1,0,1,0,0|2,0,0]=4 6340 B13R2.162 Cc1ccc2cccc(C)c2n1 Amb1994369 [0,1,0,1,0,0|2,0,0]=4 6341 B13R2.162 Cc1ccc2cccc(Cl)c2c1 Amb24707706 [0,1,0,1,0,0|1,0,0]=3 6342 B13R2.162 Cc1ccc2cccc(Cl)c2n1 Amb2686459 [0,1,0,1,0,0|2,0,0]=4 6343 B13R2.162 Cc1ccc2cccc(F)c2c1 Amb24425397 [0,1,0,1,0,0|1,0,0]=3 6344 B13R2.162 Cc1ccc2cccc(F)c2n1 Amb17578178 [0,1,0,1,0,0|2,0,0]=4 6345 B13R2.162 Cc1ccc2cccc(I)c2c1 Amb27817685 [0,1,0,1,0,0|1,0,0]=3 6346 B13R2.162 Cc1ccc2cccc(I)c2n1 Amb2732184 [0,1,0,1,0,0|2,0,0]=4 6347 B13R2.162 Cc1ccc2cccc(N)c2c1 Amb22751119 [0,1,0,1,0,0|1,0,0]=3 6348 B13R2.162 Cc1ccc2cccc(N)c2n1 Amb6336162 [0,1,0,1,0,0|2,0,0]=4 6349 B13R2.162 Cc1ccc2cccc(O)c2c1 Amb17689149 [0,1,0,1,0,0|1,0,0]=3 6350 B13R2.162 Cc1ccc2cccc(O)c2n1 Amb1210122 [0,1,0,1,0,0|2,0,0]=4 6351 B13R2.162 Cc1ccc2cccc(O)c2n1 Amb24081196 [0,1,0,1,0,0|2,0,0]=4 6352 B13R2.162 Cc1ccc2cccc(S)c2n1 Amb26494302 [0,1,0,1,0,0|2,0,0]=4 6353 B13R2.162 Cc1ccc2ccnc(Br)c2c1 Amb18560391 [0,1,0,1,0,0|2,0,0]=4 6354 B13R2.162 Cc1ccc2ccnc(Cl)c2c1 Amb17935702 [0,1,0,1,0,0|2,0,0]=4 6355 B13R2.162 Cc1ccc2ccnc(N)c2c1 Amb33545529 [0,1,0,1,0,0|2,0,0]=4 6356 B13R2.162 Cc1ccc2cncc(Br)c2c1 Amb16185648 [0,1,0,1,0,0|2,0,0]=4 6357 B13R2.162 Cc1ccc2cncc(C)c2c1 Amb27959032 [0,1,0,1,0,0|2,0,0]=4 6358 B13R2.162 Cc1ccc2cncc(O)c2c1 Amb18357327 [0,1,0,1,0,0|2,0,0]=4 6359 B13R2.162 Cc1ccc2nccc(Br)c2c1 Amb9134332 [0,1,0,1,0,0|2,0,0]=4 6360 B13R2.162 Cc1ccc2nccc(Cl)c2c1 Amb1994850 [0,1,0,1,0,0|2,0,0]=4 6361 B13R2.162 Cc1ccc2nccc(N)c2c1 Amb1994598 [0,1,0,1,0,0|2,0,0]=4 6362 B13R2.162 Cc1ccc2nccc(O)c2c1 Amb1994185 [0,1,0,1,0,0|2,0,0]=4 6363 B13R2.162 Cc1cccc2ccc(Br)cc12 Amb25771803 [0,1,0,1,0,0|2,0,0]=4 6364 B13R2.162 Cc1cccc2ccc(Cl)cc12 Amb25849279 [0,1,0,1,0,0|2,0,0]=4 6365 B13R2.162 Cc1cccc2ccc(F)cc12 Amb24390185 [0,1,0,1,0,0|2,0,0]=4 6366 B13R2.162 Cc1cccc2ccc(I)cc12 Amb26517175 [0,1,0,1,0,0|2,0,0]=4 6367 B13R2.162 Cc1cccc2ccc(N)cc12 Amb22751121 [0,1,0,1,0,0|2,0,0]=4 6368 B13R2.162 Cc1cccc2ccc(O)cc12 Amb28347350 [0,1,0,1,0,0|2,0,0]=4 6369 B13R2.162 Cc1cccc2ncc(Br)cc12 Amb27959053 [0,1,0,1,0,0|2,0,0]=4 6370 B13R2.162 Cc1cccc2ncc(O)cc12 Amb25696317 [0,1,0,1,0,0|2,0,0]=4 6371 B13R2.162 Cc1cnc2cccc(Br)c2c1 Amb22001832 [0,1,0,1,0,0|1,0,0]=3 6372 B13R2.162 Cc1cnc2cccc(Cl)c2n1 Amb27209004 [0,1,0,1,0,0|2,0,0]=4 6373 B13R2.162 Cc1cnc2cccc(I)c2n1 Amb27777406 [0,1,0,1,0,0|2,0,0]=4 6374 B13R2.162 Cc1cnc2cccc(N)c2n1 Amb24557872 [0,1,0,1,0,0|2,0,0]=4 6375 B13R2.162 Cc1cnc2cccc(O)c2c1 Amb24102421 [0,1,0,1,0,0|1,0,0]=3 6376 B13R2.162 Cc1cnc2ccnc(Cl)c2c1 Amb27470825 [0,1,0,1,0,0|2,0,0]=4 6377 B13R2.162 Cc1cnc2nccc(C)c2c1 Amb28292925 [0,1,0,1,0,0|2,0,0]=4 6378 B13R2.162 Cc1cnc2nccc(Cl)c2c1 Amb27947978 [0,1,0,1,0,0|2,0,0]=4 6379 B13R2.162 Cc1cnc2nccc(O)c2c1 Amb26478649 [0,1,0,1,0,0|2,0,0]=4 6380 B13R2.162 Clc1ccc2cccc(Br)c2c1 Amb24451031 [0,1,0,1,0,0|2,0,0]=4 6381 B13R2.162 Clc1ccc2cccc(Cl)c2c1 Amb25731654 [0,1,0,1,0,0|2,0,0]=4 6382 B13R2.162 Clc1ccc2cccc(I)c2c1 Amb27814338 [0,1,0,1,0,0|2,0,0]=4 6383 B13R2.162 Clc1cccc2ccc(Br)cc12 Amb24079753 [0,1,0,1,0,0|2,0,0]=4 6384 B13R2.162 Clc1cccc2ncc(Br)cc12 Amb22757130 [0,1,0,1,0,0|2,0,0]=4 6385 B13R2.162 Clc1cccc2ncc(I)cc12 Amb27642615 [0,1,0,1,0,0|2,0,0]=4 6386 B13R2.162 Clc1cnc2cccc(Br)c2c1 Amb22899337 [0,1,0,1,0,0|2,0,0]=4 6387 B13R2.162 Fc1ccc2cccc(Br)c2c1 Amb25150060 [0,1,0,1,0,0|2,0,0]=4 6388 B13R2.162 Fc1ccc2cccc(Cl)c2c1 Amb28282810 [0,1,0,1,0,0|2,0,0]=4 6389 B13R2.162 Fc1ccc2cccc(F)c2c1 Amb26601031 [0,1,0,1,0,0|2,0,0]=4 6390 B13R2.162 Fc1ccc2cccc(I)c2c1 Amb24616468 [0,1,0,1,0,0|2,0,0]=4 6391 B13R2.162 Fc1cccc2ccc(Br)cc12 Amb26061306 [0,1,0,1,0,0|2,0,0]=4 6392 B13R2.162 Fc1cccc2ccc(Cl)cc12 Amb25104805 [0,1,0,1,0,0|2,0,0]=4 6393 B13R2.162 Fc1cccc2ccc(I)cc12 Amb25148957 [0,1,0,1,0,0|2,0,0]=4 6394 B13R2.162 Fc1cccc2ncc(Br)cc12 Amb22899332 [0,1,0,1,0,0|2,0,0]=4 6395 B13R2.162 Fc1cnc2cccc(Br)c2c1 Amb22292331 [0,1,0,1,0,0|2,0,0]=4 6396 B13R2.162 Ic1ccc2cccc(I)c2c1 Amb26335509 [0,1,0,1,0,0|2,0,0]=4 6397 B13R2.162 Nc1ccc2cccc(Br)c2c1 Amb27796262 [0,1,0,1,0,0|2,0,0]=4 6398 B13R2.162 Nc1ccc2cccc(Cl)c2c1 Amb17594514 [0,1,0,1,0,0|2,0,0]=4 6399 B13R2.162 Nc1ccc2cccc(F)c2c1 Amb24400529 [0,1,0,1,0,0|2,0,0]=4 6400 B13R2.162 Nc1ccc2cccc(I)c2c1 Amb25778164 [0,1,0,1,0,0|2,0,0]=4 6401 B13R2.162 Nc1ccc2cccc(N)c2c1 Amb17593961 [0,1,0,1,0,0|2,0,0]=4 6402 B13R2.162 Nc1ccc2cccc(O)c2c1 Amb17593982 [0,1,0,1,0,0|2,0,0]=4 6403 B13R2.162 Nc1cccc2ccc(Br)cc12 Amb17596047 [0,1,0,1,0,0|2,0,0]=4 6404 B13R2.162 Nc1cccc2ccc(Cl)cc12 Amb17594520 [0,1,0,1,0,0|2,0,0]=4 6405 B13R2.162 Nc1cccc2ccc(F)cc12 Amb24465110 [0,1,0,1,0,0|2,0,0]=4 6406 B13R2.162 Nc1cccc2ccc(I)cc12 Amb25784705 [0,1,0,1,0,0|2,0,0]=4 6407 B13R2.162 Nc1cccc2ccc(O)cc12 Amb17750263 [0,1,0,1,0,0|2,0,0]=4 6408 B13R2.162 Nc1cccc2ccc(S)cc12 Amb27657661 [0,1,0,1,0,0|2,0,0]=4 6409 B13R2.162 Nc1cccc2ncc(Br)cc12 Amb22899398 [0,1,0,1,0,0|2,0,0]=4 6410 B13R2.162 Nc1cccc2ncc(Cl)cc12 Amb22755312 [0,1,0,1,0,0|2,0,0]=4 6411 B13R2.162 Nc1cccc2ncc(F)cc12 Amb22899389 [0,1,0,1,0,0|2,0,0]=4 6412 B13R2.162 Nc1cccc2ncc(O)cc12 Amb22899411 [0,1,0,1,0,0|2,0,0]=4 6413 B13R2.162 Nc1cnc2cccc(Br)c2c1 Amb22494701 [0,1,0,1,0,0|2,0,0]=4 6414 B13R2.162 Nc1cnc2cccc(Cl)c2c1 Amb24183747 [0,1,0,1,0,0|2,0,0]=4 6415 B13R2.162 Nc1cnc2cccc(F)c2c1 Amb22899331 [0,1,0,1,0,0|2,0,0]=4 6416 B13R2.162 Nc1cnc2cccc(O)c2c1 Amb22899338 [0,1,0,1,0,0|2,0,0]=4 6417 B13R2.162 O=C1C=CC2=CC=CC(=O)C2=C1 Amb27256369 [0,1,0,1,0,0|2,0,0]=4 6418 B13R2.162 Oc1ccc2cccc(Br)c2c1 Amb16231039 [0,1,0,1,0,0|2,0,0]=4 6419 B13R2.162 Oc1ccc2cccc(Cl)c2c1 Amb17594577 [0,1,0,1,0,0|2,0,0]=4 6420 B13R2.162 Oc1ccc2cccc(F)c2c1 Amb18645622 [0,1,0,1,0,0|2,0,0]=4 6421 B13R2.162 Oc1ccc2cccc(I)c2c1 Amb25148831 [0,1,0,1,0,0|2,0,0]=4 6422 B13R2.162 Oc1ccc2cccc(O)c2c1 Amb8516929 [0,1,0,1,0,0|2,0,0]=4 6423 B13R2.162 Oc1cccc2ccc(Br)cc12 Amb17596078 [0,1,0,1,0,0|2,0,0]=4 6424 B13R2.162 Oc1cccc2ccc(Cl)cc12 Amb17594572 [0,1,0,1,0,0|2,0,0]=4 6425 B13R2.162 Oc1cccc2ccc(F)cc12 Amb18559372 [0,1,0,1,0,0|2,0,0]=4 6426 B13R2.162 Oc1cccc2ncc(Br)cc12 Amb21963515 [0,1,0,1,0,0|2,0,0]=4 6427 B13R2.162 Oc1cccc2ncc(Cl)cc12 Amb22494666 [0,1,0,1,0,0|2,0,0]=4 6428 B13R2.162 Oc1cccc2ncc(F)cc12 Amb22899341 [0,1,0,1,0,0|2,0,0]=4 6429 B13R2.162 Oc1cccc2ncc(I)cc12 Amb22494878 [0,1,0,1,0,0|2,0,0]=4 6430 B13R2.162 Oc1cnc2cccc(Br)c2c1 Amb22494956 [0,1,0,1,0,0|2,0,0]=4 6431 B13R2.162 Oc1cnc2cccc(Cl)c2c1 Amb24183754 [0,1,0,1,0,0|2,0,0]=4 6432 B13R2.162 Oc1cnc2cccc(F)c2c1 Amb24183767 [0,1,0,1,0,0|2,0,0]=4 6433 B13R2.162 Oc1cnc2cccc(I)c2c1 Amb26868844 [0,1,0,1,0,0|2,0,0]=4 6434 B13R2.162 Oc1cnc2cccc(O)c2c1 Amb26861197 [0,1,0,1,0,0|2,0,0]=4 6435 B13R2.567 O=CC1CC1c2ccccc2Cl Amb18636302 [0,1,0,1,0,0|0,0,2]=4 6436 B13R2.567 O=CC1CC1c2ccccc2F Amb18636293 [0,1,0,1,0,0|0,0,2]=4 6437 B13R2.4825 C=C1Cc2c(Br)cccc2C1=O Amb18063784 [0,1,0,1,0,0|0,0,2]=4 6438 B13R2.4825 C=C1Cc2c(C)cccc2C1=O Amb18063786 [0,1,0,1,0,0|0,0,2]=4 6439 B13R2.4825 C=C1Cc2c(Cl)cccc2C1=O Amb18063771 [0,1,0,1,0,0|0,0,2]=4 6440 B13R2.4825 C=C1Cc2c(F)cccc2C1=O Amb18063726 [0,1,0,1,0,0|0,0,2]=4 6441 B13R2.4825 CC1=Cc2c(F)cccc2C1=O Amb28202100 [0,1,0,1,0,0|0,0,0]=2 6442 B13R2.4825 CC1Cc2c(Br)cccc2C1=O Amb16187179 [0,1,0,1,0,0|0,0,2]=4 6443 B13R2.4825 CC1Cc2c(Cl)cccc2C1=O Amb17233770 [0,1,0,1,0,0|0,0,2]=4 6444 B13R2.4825 CC1Cc2c(F)cccc2C1=O Amb17232465 [0,1,0,1,0,0|0,0,2]=4 6445 B13R2.4825 CC1Oc2c(Cl)cccc2C1=O Amb18325737 [0,1,0,1,0,0|1,0,1]=4 6446 B13R2.4825 CC1Oc2c(F)cccc2C1=O Amb18798517 [0,1,0,1,0,0|1,0,1]=4 6447 B13R2.4825 CC1Oc2c(N)cccc2C1=O Amb33310033 [0,1,0,1,0,0|1,0,1]=4 6448 B13R2.4825 CN1Cc2c(Br)cccc2C1=O Amb15693066 [0,1,0,1,0,0|1,0,1]=4 6449 B13R2.4825 CN1Cc2c(Cl)cccc2C1=O Amb22500797 [0,1,0,1,0,0|1,0,1]=4 6450 B13R2.4825 CN1Cc2c(F)cccc2C1=O Amb22500794 [0,1,0,1,0,0|1,0,1]=4 6451 B13R2.4825 CN1Cc2c(I)cccc2C1=O Amb22500803 [0,1,0,1,0,0|1,0,1]=4 6452 B13R2.4825 CN1Cc2c(N)cccc2C1=O Amb17483371 [0,1,0,1,0,0|1,0,1]=4 6453 B13R2.4825 CN1Cc2c(O)cccc2C1=O Amb27813579 [0,1,0,1,0,0|1,0,1]=4 6454 B13R2.4825 CN1Oc2c(Br)cccc2C1=O Amb27225165 [0,1,0,1,0,0|2,0,0]=4 6455 B13R2.4825 Cc1cc2c(Br)cccc2n1C Amb18761491 [0,1,0,1,0,0|2,0,0]=4 6456 B13R2.4825 Cc1cc2c(F)occc2c1N Amb26357629 [0,1,0,1,0,0|2,0,0]=4 6457 B13R2.4825 Cc1cc2c(N)cccc2n1C Amb17570036 [0,1,0,1,0,0|2,0,0]=4 6458 B13R2.4825 Cc1cccc2c1CC(C)C2=O Amb17232325 [0,1,0,1,0,0|0,0,2]=4 6459 B13R2.4825 Cc1cccc2c1NC(=O)C2=O Amb6315565 [0,1,0,1,0,0|2,0,0]=4 6460 B13R2.4825 Cc1cccc2c1OC(C)C2=O Amb18798089 [0,1,0,1,0,0|1,0,1]=4 6461 B13R2.4825 Cc1oc2c(Br)cccc2c1C Amb25148644 [0,1,0,1,0,0|2,0,0]=4 6462 B13R2.4825 Cc1sc2c(Br)cccc2c1Br Amb27193984 [0,1,0,1,0,0|2,0,0]=4 6463 B13R2.4825 Cc1sc2c(Br)cccc2c1N Amb27846094 [0,1,0,1,0,0|2,0,0]=4 6464 B13R2.4825 Cc1sc2c(C)cccc2c1Cl Amb27488446 [0,1,0,1,0,0|2,0,0]=4 6465 B13R2.4825 Cc1sc2c(C)cccc2c1F Amb27963856 [0,1,0,1,0,0|2,0,0]=4 6466 B13R2.4825 Cc1sc2c(C)cccc2c1N Amb20667869 [0,1,0,1,0,0|2,0,0]=4 6467 B13R2.4825 Cc1sc2c(C)cccc2c1O Amb27224433 [0,1,0,1,0,0|1,0,1]=4 6468 B13R2.4825 Cc1sc2c(Cl)cccc2c1N Amb20667870 [0,1,0,1,0,0|2,0,0]=4 6469 B13R2.4825 Cc1sc2c(Cl)cccc2c1S Amb27793244 [0,1,0,1,0,0|1,1,0]=4 6470 B13R2.4825 Cc1sc2c(F)cccc2c1Cl Amb27846578 [0,1,0,1,0,0|2,0,0]=4 6471 B13R2.4825 Cc1sc2c(F)cccc2c1I Amb27782632 [0,1,0,1,0,0|2,0,0]=4 6472 B13R2.4825 Cc1sc2c(F)cccc2c1O Amb27202974 [0,1,0,1,0,0|1,0,1]=4 6473 B13R2.4825 Cc1sc2c(N)cccc2c1O Amb27210227 [0,1,0,1,0,0|1,0,1]=4 6474 B13R2.4825 Cc1sc2c(N)cccc2c1S Amb27881083 [0,1,0,1,0,0|1,1,0]=4 6475 B13R2.4825 Cc1sc2c(O)cccc2c1N Amb28134124 [0,1,0,1,0,0|2,0,0]=4 6476 B13R2.4825 Cc1sc2c(S)cccc2c1Br Amb27493212 [0,1,0,1,0,0|2,0,0]=4 6477 B13R2.4825 Cc1sc2c(S)cccc2c1F Amb27252421 [0,1,0,1,0,0|2,0,0]=4 6478 B13R2.4825 Nc1cccc2c1NC(=O)C2=O Amb27243910 [0,1,0,1,0,0|2,0,0]=4 6479 B13R2.4825 O=C1Cc2c(F)cccc2C1=O Amb28127142 [0,1,0,1,0,0|1,0,1]=4 6480 B13R2.4825 O=C1Nc2c(Br)cccc2C1=O Amb1103377 [0,1,0,1,0,0|2,0,0]=4 6481 B13R2.4825 O=C1Nc2c(Cl)cccc2C1=O Amb6486658 [0,1,0,1,0,0|2,0,0]=4 6482 B13R2.4825 O=C1Nc2c(F)cccc2C1=O Amb6549905 [0,1,0,1,0,0|2,0,0]=4 6483 B13R2.4825 O=C1Nc2c(I)cccc2C1=O Amb33543163 [0,1,0,1,0,0|2,0,0]=4 6484 B13R2.4825 O=C1Nc2c(O)cccc2C1=O Amb27590902 [0,1,0,1,0,0|2,0,0]=4 6485 B13R2.4825 O=C1Sc2c(Br)cccc2C1=O Amb27624710 [0,1,0,1,0,0|2,0,0]=4 6486 B13R2.4825 O=C1Sc2c(Cl)cccc2C1=O Amb28435410 [0,1,0,1,0,0|2,0,0]=4 6487 B13R2.5225 Oc1ccccc1C=C2CCC2 Amb28122416 [0,1,0,1,0,0|1,0,1]=4 6488 B13R3.1970 c1ccc2cc3c(cc2c1)C3 Amb27186095 [0,0,0,2,0,0|1,0,0]=3 6489 B13R3.1970 c1cnc2cc3c(cc2c1)C3 Amb27595606 [0,0,0,2,0,0|2,0,0]=4 6490 B13R3.274 O=C1c2ccccc2C3CC13 Amb24533047 [0,0,0,2,0,0|0,0,2]=4 6491 B13R3.28 c1cnc2c3c(ccc2c1)C3 Amb27781113 [0,0,0,2,0,0|2,0,0]=4 6492 B9R1.12 C=C\C=C\c1cccs1 Amb26418485 [1,0,0,0,1,0|2,0,0]=4 6493 B9R1.12 C=C\C=C\c1ccsc1 Amb26569661 [1,0,0,0,1,0|2,0,0]=4 6494 B9R1.12 O=C\C=C/c1ccco1 Amb27590405 [1,0,0,0,1,0|1,0,0]=3 6495 B9R1.12 O=C\C=C\c1ccco1 Amb33870988 [1,0,0,0,1,0|1,0,0]=3 6496 B9R1.12 O=C\C=C\c1cccs1 Amb17334164 [1,0,0,0,1,0|1,0,0]=3 6497 B9R1.12 O=C\C=C\c1ccns1 Amb35719811 [1,0,0,0,1,0|2,0,0]=4 6498 B9R1.12 O=C\C=C\c1ccoc1 Amb33136412 [1,0,0,0,1,0|1,0,0]=3 6499 B9R1.12 O=C\C=C\c1ccon1 Amb33197559 [1,0,0,0,1,0|2,0,0]=4 6500 B9R1.12 O=C\C=C\c1ccsc1 Amb18643292 [1,0,0,0,1,0|1,0,0]=3 6501 B9R1.12 O=C\C=C\c1cnco1 Amb33414801 [1,0,0,0,1,0|2,0,0]=4 6502 B9R1.12 O=C\C=C\c1cncs1 Amb33079492 [1,0,0,0,1,0|2,0,0]=4 6503 B9R1.12 O=C\C=C\c1cscn1 Amb25299918 [1,0,0,0,1,0|2,0,0]=4 6504 B9R1.12 O=C\C=C\c1nccs1 Amb33359384 [1,0,0,0,1,0|2,0,0]=4 6505 B9R1.12 O=C\C=C\n1cccn1 Amb18642043 [1,0,0,0,1,0|2,0,0]=4 6506 B9R1.6 C=C(Br)c1ccccc1 Amb8516473 [1,0,0,0,1,0|1,0,0]=3 6507 B9R1.6 C=C(Br)c1ccccn1 Amb2447497 [1,0,0,0,1,0|2,0,0]=4 6508 B9R1.6 C=C(Br)c1ccncc1 Amb24710590 [1,0,0,0,1,0|2,0,0]=4 6509 B9R1.6 C=C(C)c1ccccc1 Amb8394996 [1,0,0,0,1,0|0,0,0]=2 6510 B9R1.6 C=C(C)c1ccccn1 Amb25077592 [1,0,0,0,1,0|1,0,0]=3 6511 B9R1.6 C=C(C)c1cccnc1 Amb26389581 [1,0,0,0,1,0|1,0,0]=3 6512 B9R1.6 C=C(C)c1cccnn1 Amb32641600 [1,0,0,0,1,0|2,0,0]=4 6513 B9R1.6 C=C(C)c1ccncc1 Amb25126374 [1,0,0,0,1,0|1,0,0]=3 6514 B9R1.6 C=C(C)c1cnccn1 Amb26942610 [1,0,0,0,1,0|2,0,0]=4 6515 B9R1.6 C=C(Cl)c1ccccc1 Amb27775278 [1,0,0,0,1,0|1,0,0]=3 6516 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,0,0,1,0|1,0,0]=3 6517 B9R1.6 C=C(F)c1ccccn1 Amb20248373 [1,0,0,0,1,0|2,0,0]=4 6518 B9R1.6 C=C(F)c1ccncc1 Amb20248442 [1,0,0,0,1,0|2,0,0]=4 6519 B9R1.6 CC(=N)c1cccnc1 Amb22170296 [1,0,0,0,1,0|2,0,0]=4 6520 B9R1.6 CC(=O)C1C=CC=CN1 Amb27849933 [1,0,0,0,1,0|1,0,1]=4 6521 B9R1.6 CC(=O)c1ccccc1 Amb2792761 [1,0,0,0,1,0|0,0,0]=2 6522 B9R1.6 CC(=O)c1ccccn1 Amb932786 [1,0,0,0,1,0|1,0,0]=3 6523 B9R1.6 CC(=O)c1cccnc1 Amb2610530 [1,0,0,0,1,0|1,0,0]=3 6524 B9R1.6 CC(=O)c1cccnn1 Amb20242017 [1,0,0,0,1,0|2,0,0]=4 6525 B9R1.6 CC(=O)c1ccncc1 Amb2792762 [1,0,0,0,1,0|1,0,0]=3 6526 B9R1.6 CC(=O)c1ccncn1 Amb19959228 [1,0,0,0,1,0|2,0,0]=4 6527 B9R1.6 CC(=O)c1ccnnc1 Amb19958070 [1,0,0,0,1,0|2,0,0]=4 6528 B9R1.6 CC(=O)c1cnccn1 Amb2684281 [1,0,0,0,1,0|2,0,0]=4 6529 B9R1.6 CC(=O)c1cncnc1 Amb8631038 [1,0,0,0,1,0|2,0,0]=4 6530 B9R1.6 CC(=O)c1ncccn1 Amb33534997 [1,0,0,0,1,0|2,0,0]=4 6531 B9R1.6 CC(Br)c1ccccc1 Amb5716854 [1,0,0,0,1,0|1,0,1]=4 6532 B9R1.6 CC(C)c1ccccc1 Amb2793016 [1,0,0,0,1,0|0,0,2]=4 6533 B9R1.6 CC(C)c1ccccc1 Amb33524021 [1,0,0,0,1,0|0,0,2]=4 6534 B9R1.6 CC(Cl)c1ccccc1 Amb5716855 [1,0,0,0,1,0|1,0,1]=4 6535 B9R1.6 CC(N)c1ccccc1 Amb5716844 [1,0,0,0,1,0|1,0,1]=4 6536 B9R1.6 CC(O)c1ccccc1 Amb3940114 [1,0,0,0,1,0|0,0,2]=4 6537 B9R1.6 CC(S)c1ccccc1 Amb6256013 [1,0,0,0,1,0|0,1,1]=4 6538 B9R1.6 CN(C)c1ccccc1 Amb2793014 [1,0,0,0,1,0|1,0,1]=4 6539 B9R1.6 CN(N)c1ccccc1 Amb1153615 [1,0,0,0,1,0|2,0,0]=4 6540 B9R1.6 CN(N)c1ccccc1 Amb22754142 [1,0,0,0,1,0|2,0,0]=4 6541 B9R1.6 CN(N)c1ccccc1 Amb33172726 [1,0,0,0,1,0|2,0,0]=4 6542 B9R1.6 CN(N)c1ccccc1 Amb9677307 [1,0,0,0,1,0|2,0,0]=4 6543 B9R1.6 CN(O)c1ccccc1 Amb28245898 [1,0,0,0,1,0|1,0,1]=4 6544 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [1,0,0,0,1,0|2,0,0]=4 6545 B9R1.6 CS(=O)c1ccccc1 Amb8516154 [1,0,0,0,1,0|1,0,0]=3 6546 B9R1.6 CS(=O)c1ccccn1 Amb24562247 [1,0,0,0,1,0|2,0,0]=4 6547 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [1,0,0,0,1,0|1,0,1]=4 6548 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [1,0,0,0,1,0|1,0,1]=4 6549 B9R1.6 C[C@@H](N)c1ccccc1 Amb3940166 [1,0,0,0,1,0|1,0,1]=4 6550 B9R1.6 C[C@@H](O)c1ccccc1 Amb6366772 [1,0,0,0,1,0|0,0,2]=4 6551 B9R1.6 C[C@@H](S)c1ccccc1 Amb28069838 [1,0,0,0,1,0|0,1,1]=4 6552 B9R1.6 C[C@H](N)c1ccccc1 Amb2725550 [1,0,0,0,1,0|1,0,1]=4 6553 B9R1.6 C[C@H](O)c1ccccc1 Amb4021849 [1,0,0,0,1,0|0,0,2]=4 6554 B9R1.6 C[C@H](S)c1ccccc1 Amb25935694 [1,0,0,0,1,0|0,1,1]=4 6555 B9R1.6 C[S+](C)c1ccccc1 Amb27958149 [1,0,0,0,1,0|1,0,1]=4 6556 B9R1.6 C[Si](C)c1ccccc1 Amb33781101 [1,0,0,0,1,0|0,1,1]=4 6557 B9R1.6 N=C(Cl)c1ccccc1 Amb28285285 [1,0,0,0,1,0|2,0,0]=4 6558 B9R1.6 N=C(N)c1ccccc1 Amb10068704 [1,0,0,0,1,0|2,0,0]=4 6559 B9R1.6 N=C(N)c1ccccc1 Amb2371546 [1,0,0,0,1,0|2,0,0]=4 6560 B9R1.6 N=C(N)c1ccccc1 Amb6337518 [1,0,0,0,1,0|2,0,0]=4 6561 B9R1.6 NC(=O)[n+]1ccccc1 Amb27806689 [1,0,0,0,1,0|2,0,0]=4 6562 B9R1.6 NC(=O)c1ccc[nH+]c1 Amb8465811 [1,0,0,0,1,0|2,0,0]=4 6563 B9R1.6 NC(=O)c1ccccc1 Amb6399766 [1,0,0,0,1,0|1,0,0]=3 6564 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [1,0,0,0,1,0|2,0,0]=4 6565 B9R1.6 NC(=O)c1cccnc1 Amb2609940 [1,0,0,0,1,0|2,0,0]=4 6566 B9R1.6 NC(=O)c1ccncc1 Amb5721989 [1,0,0,0,1,0|2,0,0]=4 6567 B9R1.6 NC(=S)c1ccccc1 Amb6338789 [1,0,0,0,1,0|1,1,0]=4 6568 B9R1.6 NS(=O)c1ccccc1 Amb26487323 [1,0,0,0,1,0|2,0,0]=4 6569 B9R1.6 O=C(Br)c1ccccc1 Amb8513573 [1,0,0,0,1,0|1,0,0]=3 6570 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [1,0,0,0,1,0|2,0,0]=4 6571 B9R1.6 O=C(Cl)c1ccccc1 Amb3939302 [1,0,0,0,1,0|1,0,0]=3 6572 B9R1.6 O=C(Cl)c1ccccn1 Amb22492448 [1,0,0,0,1,0|2,0,0]=4 6573 B9R1.6 O=C(Cl)c1ccccn1 Amb2690341 [1,0,0,0,1,0|2,0,0]=4 6574 B9R1.6 O=C(Cl)c1ccccn1 Amb3939534 [1,0,0,0,1,0|2,0,0]=4 6575 B9R1.6 O=C(Cl)c1cccnc1 Amb33531191 [1,0,0,0,1,0|2,0,0]=4 6576 B9R1.6 O=C(Cl)c1cccnc1 Amb839669 [1,0,0,0,1,0|2,0,0]=4 6577 B9R1.6 O=C(Cl)c1ccncc1 Amb2707217 [1,0,0,0,1,0|2,0,0]=4 6578 B9R1.6 O=C(Cl)c1ccncc1 Amb2720189 [1,0,0,0,1,0|2,0,0]=4 6579 B9R1.6 O=C(F)c1ccccc1 Amb10607152 [1,0,0,0,1,0|1,0,0]=3 6580 B9R1.6 O=C(O)c1ccccc1 Amb1935196 [1,0,0,0,1,0|1,0,0]=3 6581 B9R1.6 O=C(O)c1ccccc1 Amb22002523 [1,0,0,0,1,0|1,0,0]=3 6582 B9R1.6 O=C(O)c1ccccc1 Amb22336602 [1,0,0,0,1,0|1,0,0]=3 6583 B9R1.6 O=C(O)c1ccccc1 Amb22351742 [1,0,0,0,1,0|1,0,0]=3 6584 B9R1.6 O=C(O)c1ccccn1 Amb1227737 [1,0,0,0,1,0|2,0,0]=4 6585 B9R1.6 O=C(O)c1ccccn1 Amb4035065 [1,0,0,0,1,0|2,0,0]=4 6586 B9R1.6 O=C(O)c1cccnc1 Amb1195995 [1,0,0,0,1,0|2,0,0]=4 6587 B9R1.6 O=C(O)c1ccncc1 Amb2609990 [1,0,0,0,1,0|2,0,0]=4 6588 B9R1.6 O=C(S)c1ccccc1 Amb8513358 [1,0,0,0,1,0|1,0,0]=3 6589 B9R1.6 O=C([O-])c1ccccc1 Amb22053472 [1,0,0,0,1,0|1,0,0]=3 6590 B9R1.6 O=C([O-])c1ccccc1 Amb22168438 [1,0,0,0,1,0|1,0,0]=3 6591 B9R1.6 O=C([O-])c1ccccc1 Amb8387740 [1,0,0,0,1,0|1,0,0]=3 6592 B9R1.6 O=C([O-])c1ccccc1 Amb8513916 [1,0,0,0,1,0|1,0,0]=3 6593 B9R1.6 O=C([O-])c1ccccc1 Amb8517378 [1,0,0,0,1,0|1,0,0]=3 6594 B9R1.6 O=C([O-])c1ccccn1 Amb22058087 [1,0,0,0,1,0|2,0,0]=4 6595 B9R1.6 O=C([O-])c1ccccn1 Amb22734923 [1,0,0,0,1,0|2,0,0]=4 6596 B9R1.6 O=C([O-])c1ccccn1 Amb8393579 [1,0,0,0,1,0|2,0,0]=4 6597 B9R1.6 O=C([O-])c1ccccn1 Amb8393582 [1,0,0,0,1,0|2,0,0]=4 6598 B9R1.6 O=C([O-])c1ccncc1 Amb22730239 [1,0,0,0,1,0|2,0,0]=4 6599 B9R1.6 O=I(=O)c1ccccc1 Amb9679129 [1,0,0,0,1,0|2,0,0]=4 6600 B9R1.6 O=S(Cl)c1ccccc1 Amb13881360 [1,0,0,0,1,0|2,0,0]=4 6601 B9R1.6 O=S(O)c1ccccc1 Amb17939345 [1,0,0,0,1,0|2,0,0]=4 6602 B9R1.6 O=S([O-])c1ccccc1 Amb2684569 [1,0,0,0,1,0|2,0,0]=4 6603 B9R1.6 O=S([O-])c1ccccc1 Amb28536248 [1,0,0,0,1,0|2,0,0]=4 6604 B9R1.6 O=[N+]([O-])c1ccccc1 Amb2793077 [1,0,0,0,1,0|2,0,0]=4 6605 B9R1.6 O=[PH](O)c1ccccc1 Amb3371978 [1,0,0,0,1,0|2,0,0]=4 6606 B9R1.6 O=[Se](O)c1ccccc1 Amb4138617 [1,0,0,0,1,0|2,0,0]=4 6607 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,0,0,1,0|1,0,1]=4 6608 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,0,0,1,0|1,1,0]=4 6609 B9R1.6 S=C(S)c1ccccc1 Amb22051683 [1,0,0,0,1,0|1,1,0]=4 6610 B9R1.13 C=C(C)Cc1ccco1 Amb24673621 [1,0,0,0,1,0|1,0,1]=4 6611 B9R1.13 C=C(C)Cc1cccs1 Amb27413817 [1,0,0,0,1,0|1,0,1]=4 6612 B9R1.13 C=C(C)Cn1cccc1 Amb27454576 [1,0,0,0,1,0|1,0,1]=4 6613 B9R1.13 CC(=O)Cc1ccco1 Amb5751052 [1,0,0,0,1,0|1,0,1]=4 6614 B9R1.13 CC(=O)Cc1cccs1 Amb3429447 [1,0,0,0,1,0|1,0,1]=4 6615 B9R1.13 CC(=O)Cc1ccoc1 Amb25713513 [1,0,0,0,1,0|1,0,1]=4 6616 B9R1.13 CC(=O)Cc1ccsc1 Amb6744886 [1,0,0,0,1,0|1,0,1]=4 6617 B9R1.13 CC(=O)Nc1ccco1 Amb2611741 [1,0,0,0,1,0|2,0,0]=4 6618 B9R1.13 CC(=O)Nc1cccs1 Amb2228309 [1,0,0,0,1,0|2,0,0]=4 6619 B9R1.13 CC(=O)Nc1ccsc1 Amb4036279 [1,0,0,0,1,0|2,0,0]=4 6620 B9R1.13 CC(=O)Oc1ccco1 Amb27614492 [1,0,0,0,1,0|2,0,0]=4 6621 B9R1.13 CC(=O)Oc1ccsc1 Amb28138065 [1,0,0,0,1,0|2,0,0]=4 6622 B9R1.13 CC(=O)On1cccc1 Amb28366433 [1,0,0,0,1,0|2,0,0]=4 6623 B9R1.13 CC(=O)Sc1ccsc1 Amb24727644 [1,0,0,0,1,0|2,0,0]=4 6624 B9R1.13 CC(=O)\C=C1/C=CCO1 Amb27186200 [1,0,0,0,1,0|1,0,1]=4 6625 B9R1.13 CC(=O)\C=C1\CC=CO1 Amb28326023 [1,0,0,0,1,0|1,0,1]=4 6626 B9R1.13 CC(C)=Cn1cccc1 Amb27267470 [1,0,0,0,1,0|1,0,1]=4 6627 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [0,0,0,0,2,0|1,0,1]=4 6628 B9R1.11 CC(C=O)c1cccs1 Amb17138391 [0,0,0,0,2,0|1,0,1]=4 6629 B9R1.11 CC(C=O)c1ccoc1 Amb25888686 [0,0,0,0,2,0|1,0,1]=4 6630 B9R1.11 CC(C=O)c1ccsc1 Amb18643620 [0,0,0,0,2,0|1,0,1]=4 6631 B9R1.11 CC(CO)=C1C=CC=C1 Amb27981717 [0,0,0,0,2,0|0,0,2]=4 6632 B9R1.11 C[C@@H](C=O)c1ccoc1 Amb27256198 [0,0,0,0,2,0|1,0,1]=4 6633 B9R1.11 C[C@H](C=O)n1cccc1 Amb27486177 [0,0,0,0,2,0|1,0,1]=4 6634 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,0,0,0,2,0|2,0,0]=4 6635 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [0,0,0,0,2,0|2,0,0]=4 6636 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [0,0,0,0,2,0|2,0,0]=4 6637 B11R1.742 CC(=O)CC1=CC=CCC=C1 Amb28144151 [1,0,0,0,0,1|0,0,1]=3 6638 B11R1.742 O=C(O)CC1=CC=CC=CC1 Amb27392309 [1,0,0,0,0,1|1,0,1]=4 6639 B13R1.718 C=C(C=O)COCc1ccccc1 Amb8392637 [0,0,0,0,0,2|0,0,2]=4 6640 B13R1.718 CC(C=O)CNCc1ccccc1 Amb27748669 [0,0,0,0,0,2|0,0,2]=4 6641 B13R1.718 CC(C=O)COCc1ccccc1 Amb18128219 [0,0,0,0,0,2|0,0,2]=4 6642 B13R1.718 C\C(=C/C=C/c1ccccc1)CBr Amb28140679 [0,0,0,0,0,2|1,0,1]=4 6643 B13R1.718 C\C(=C/C=C/c1ccccc1)CCl Amb27455495 [0,0,0,0,0,2|1,0,1]=4 6644 B13R1.718 C\C(=C\Cl)CNCc1ccccc1 Amb27402978 [0,0,0,0,0,2|1,0,1]=4 6645 B13R1.718 C\C(=C\Cl)COCc1ccccc1 Amb27179200 [0,0,0,0,0,2|1,0,1]=4 6646 B13R1.718 C\C(C=O)=C/C#Cc1ccccc1 Amb28076967 [0,0,0,0,0,2|0,0,0]=2 6647 B13R1.718 C\C(C=O)=C/C=C/c1ccccc1 Amb18126919 [0,0,0,0,0,2|0,0,0]=2 6648 B13R1.718 C\C(C=O)=N/NCc1ccccc1 Amb18127759 [0,0,0,0,0,2|0,0,1]=3 6649 B13R1.718 O=C\C(F)=C/C=C/c1ccccc1 Amb27629668 [0,0,0,0,0,2|1,0,0]=3 6650 B13R1.718 O=C\C(F)=C/NCc1ccccc1 Amb27440483 [0,0,0,0,0,2|1,0,0]=3 6651 B13R1.718 O=C\C(F)=C\C=C\c1ccccc1 Amb27974016 [0,0,0,0,0,2|1,0,0]=3 6652 B13R1.718 O=C\C(O)=C\C=C\c1ccccc1 Amb18127198 [0,0,0,0,0,2|1,0,0]=3