0 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [0,0,0,0,0,0|2,0,2]=4 4 B10R1.15 C#CC(N)c1c[n]ccc1 Amb23448695 [0,0,0,0,0,0|3,0,1]=4 5 B10R1.15 C#CC(N)c1cc[n]cc1 Amb23448614 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.15 C#CC(N)c1cccc[n]1 Amb23448647 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [0,0,0,0,0,0|2,0,1]=3 8 B10R1.15 C#CC(O)c1cc[n]cc1 Amb21964740 [0,0,0,0,0,0|3,0,1]=4 9 B10R1.15 C#CC(O)c1cccc[n]1 Amb24653150 [0,0,0,0,0,0|3,0,1]=4 10 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.15 C#C[C@@H](O)c1cccc[n]1 Amb25125719 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [0,0,0,0,0,0|2,0,1]=3 13 B10R1.15 C#C[C@H](O)c1cc[n]cc1 Amb24379254 [0,0,0,0,0,0|3,0,1]=4 14 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [0,0,0,0,0,0|2,0,1]=3 15 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [0,0,0,0,0,0|1,0,1]=2 16 B10R1.15 C=C([Zn]Br)c1ccccc1 Amb22000417 [0,0,0,0,0,0|2,0,2]=4 17 B10R1.15 C=CB(O)c1c[n]ccc1 Amb25806197 [0,0,0,0,0,0|4,0,0]=4 18 B10R1.15 C=CC(=O)c1cc[n]cc1 Amb24482055 [0,0,0,0,0,0|3,0,1]=4 19 B10R1.15 C=CC(=O)c1ccc[n]c1 Amb25776729 [0,0,0,0,0,0|3,0,1]=4 20 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [0,0,0,0,0,0|2,0,1]=3 21 B10R1.15 C=CC(N)c1c[n][n]cc1 Amb24712905 [0,0,0,0,0,0|4,0,0]=4 22 B10R1.15 C=CC(N)c1cc[n]cc1 Amb25789567 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.15 C=CC(N)c1cccc[n]1 Amb24561652 [0,0,0,0,0,0|3,0,0]=3 24 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [0,0,0,0,0,0|2,0,0]=2 25 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [0,0,0,0,0,0|2,0,0]=2 26 B10R1.15 C=CC(O)c1c[n]cc[n]1 Amb24353873 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.15 C=CC(O)c1cc[n]c[n]1 Amb24382233 [0,0,0,0,0,0|4,0,0]=4 28 B10R1.15 C=CC(O)c1cc[n]cc1 Amb24546417 [0,0,0,0,0,0|3,0,0]=3 29 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [0,0,0,0,0,0|2,0,0]=2 30 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.15 C=C[C@@H](N)c1c[n]c[n]c1 Amb24453795 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.15 C=C[C@@H](N)c1c[n]cc[n]1 Amb25111962 [0,0,0,0,0,0|4,0,0]=4 33 B10R1.15 C=C[C@@H](N)c1cccc[n]1 Amb25146457 [0,0,0,0,0,0|3,0,0]=3 34 B10R1.15 C=C[C@@H](O)c1c[n]ccc1 Amb25335661 [0,0,0,0,0,0|3,0,0]=3 35 B10R1.15 C=C[C@@H](O)c1cccc[n]1 Amb25109191 [0,0,0,0,0,0|3,0,0]=3 36 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [0,0,0,0,0,0|2,0,0]=2 37 B10R1.15 C=C[C@H](N)c1c[n]c[n]c1 Amb25146246 [0,0,0,0,0,0|4,0,0]=4 38 B10R1.15 C=C[C@H](N)c1cccc[n]1 Amb25237215 [0,0,0,0,0,0|3,0,0]=3 39 B10R1.15 C=C[C@H](O)c1cccc[n]1 Amb24105810 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [0,0,0,0,0,0|2,0,0]=2 41 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [0,0,0,0,0,0|3,0,0]=3 42 B10R1.15 CC(=C=C)c1cccc[n]1 Amb24070034 [0,0,0,0,0,0|2,0,2]=4 43 B10R1.15 CC(=C=O)c1cc[n]cc1 Amb24100722 [0,0,0,0,0,0|1,0,2]=3 44 B10R1.15 CC(=C=O)c1ccc[n]c1 Amb24100577 [0,0,0,0,0,0|1,0,2]=3 45 B10R1.15 CC(=C=O)c1cccc[n]1 Amb24070206 [0,0,0,0,0,0|1,0,2]=3 46 B10R1.15 CC(=CBr)c1c[n]c[n]c1 Amb24635865 [0,0,0,0,0,0|3,0,1]=4 47 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [0,0,0,0,0,0|1,0,1]=2 48 B10R1.15 CC(C#N)c1c[n]cc[n]1 Amb24689696 [0,0,0,0,0,0|3,0,1]=4 49 B10R1.15 CC(C=O)C1CCC=CC1 Amb24640395 [0,0,0,0,0,0|0,0,4]=4 50 B10R1.15 CC(C=O)C1CCCC=C1 Amb18124527 [0,0,0,0,0,0|0,0,4]=4 51 B10R1.15 CC(C=O)C=1CCCCC1 Amb18124526 [0,0,0,0,0,0|0,0,4]=4 52 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [0,0,0,0,0,0|1,0,0]=1 53 B10R1.15 CC(CCl)c1c[n]ccc1 Amb24085112 [0,0,0,0,0,0|2,0,1]=3 54 B10R1.15 CC(CCl)c1cccc[n]1 Amb25791960 [0,0,0,0,0,0|2,0,1]=3 55 B10R1.15 CC(CN)c1c[n]c[n]c1 Amb18251160 [0,0,0,0,0,0|3,0,1]=4 56 B10R1.15 CC(CN)c1c[n]cc[n]1 Amb18832279 [0,0,0,0,0,0|3,0,1]=4 57 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [0,0,0,0,0,0|1,0,1]=2 58 B10R1.15 CC(CO)c1[n]ccc[n]1 Amb24397210 [0,0,0,0,0,0|2,0,2]=4 59 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [0,0,0,0,0,0|1,0,2]=3 60 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [0,0,0,0,0,0|1,0,2]=3 61 B10R1.15 CC(NN)c1[n]ccc[n]1 Amb25315935 [0,0,0,0,0,0|4,0,0]=4 62 B10R1.15 CC(NN)c1c[n]cc[n]1 Amb24615634 [0,0,0,0,0,0|4,0,0]=4 63 B10R1.15 CC(NN)c1c[n]ccc1 Amb21961486 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.15 CC(NN)c1cc[n]c[n]1 Amb25088979 [0,0,0,0,0,0|4,0,0]=4 65 B10R1.15 CC(NN)c1cc[n]cc1 Amb21961485 [0,0,0,0,0,0|3,0,0]=3 66 B10R1.15 CC(NN)c1cccc[n]1 Amb21961484 [0,0,0,0,0,0|3,0,0]=3 67 B10R1.15 CC(NO)c1cc[n]c[n]1 Amb25663214 [0,0,0,0,0,0|3,0,1]=4 68 B10R1.15 CC(ON)c1cc[n]cc1 Amb22397090 [0,0,0,0,0,0|3,0,0]=3 69 B10R1.15 CC(ON)c1cccc[n]1 Amb22397048 [0,0,0,0,0,0|3,0,0]=3 70 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [0,0,0,0,0,0|2,0,0]=2 73 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [0,0,0,0,0,0|1,0,1]=2 74 B10R1.15 CC(c1ccncc1)[N+]#[C-] Amb2235825 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [0,0,0,0,0,0|2,0,1]=3 76 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [0,0,0,0,0,0|3,0,1]=4 77 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [0,0,0,0,0,0|3,0,1]=4 78 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [0,0,0,0,0,0|1,0,3]=4 79 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [0,0,0,0,0,0|3,0,1]=4 80 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [0,0,0,0,0,0|2,0,1]=3 81 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [0,0,0,0,0,0|3,0,1]=4 82 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [0,0,0,0,0,0|3,0,1]=4 83 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [0,0,0,0,0,0|3,0,1]=4 84 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [0,0,0,0,0,0|2,0,1]=3 85 B10R1.15 CCC(c1ccccc1)N Amb1108026 [0,0,0,0,0,0|2,0,1]=3 86 B10R1.15 CCC(c1ccccn1)N Amb10607917 [0,0,0,0,0,0|3,0,1]=4 87 B10R1.15 CCC(c1cccnc1)N Amb10607957 [0,0,0,0,0,0|3,0,1]=4 88 B10R1.15 CCC(c1cccnc1)O Amb17231904 [0,0,0,0,0,0|3,0,1]=4 89 B10R1.15 CCC(c1ccncc1)O Amb16233288 [0,0,0,0,0,0|3,0,1]=4 90 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [0,0,0,0,0,0|3,0,1]=4 91 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [0,0,0,0,0,0|3,0,1]=4 92 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [0,0,0,0,0,0|3,0,1]=4 93 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [0,0,0,0,0,0|3,0,1]=4 94 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [0,0,0,0,0,0|3,0,1]=4 95 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [0,0,0,0,0,0|3,0,1]=4 96 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [0,0,0,0,0,0|3,0,1]=4 97 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [0,0,0,0,0,0|3,0,1]=4 98 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [0,0,0,0,0,0|3,0,1]=4 99 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [0,0,0,0,0,0|2,0,1]=3 100 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [0,0,0,0,0,0|3,0,1]=4 101 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [0,0,0,0,0,0|2,0,1]=3 102 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [0,0,0,0,0,0|2,0,1]=3 103 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [0,0,0,0,0,0|3,0,1]=4 104 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [0,0,0,0,0,0|2,0,1]=3 105 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [0,0,0,0,0,0|3,0,1]=4 106 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [0,0,0,0,0,0|3,0,1]=4 107 B10R1.15 CN(C#N)c1c[n]ccc1 Amb25147775 [0,0,0,0,0,0|3,0,1]=4 108 B10R1.15 CN(C#N)c1cc[n]cc1 Amb24362639 [0,0,0,0,0,0|3,0,1]=4 109 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [0,0,0,0,0,0|2,0,1]=3 110 B10R1.15 CN(C=O)c1[n]ccc[n]1 Amb24096787 [0,0,0,0,0,0|3,0,0]=3 111 B10R1.15 CN(C=O)c1cc[n]cc1 Amb24096778 [0,0,0,0,0,0|2,0,0]=2 112 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [0,0,0,0,0,0|2,0,1]=3 113 B10R1.15 CN(CO)c1cc[n]cc1 Amb24481124 [0,0,0,0,0,0|2,0,2]=4 114 B10R1.15 CN(N=O)c1[n]ccc[n]1 Amb24096788 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.15 CN(N=O)c1c[n]ccc1 Amb25254491 [0,0,0,0,0,0|3,0,0]=3 116 B10R1.15 CN(N=O)c1cc[n]c[n]1 Amb24096789 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.15 CN(N=O)c1cc[n]cc1 Amb25736812 [0,0,0,0,0,0|3,0,0]=3 118 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [0,0,0,0,0,0|1,0,0]=1 119 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [0,0,0,0,0,0|3,0,1]=4 120 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [0,0,0,0,0,0|3,0,1]=4 121 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [0,0,0,0,0,0|3,0,1]=4 122 B10R1.15 CNC(C)c1[n]ccc[n]1 Amb18949733 [0,0,0,0,0,0|4,0,0]=4 123 B10R1.15 CNC(C)c1c[n][n]cc1 Amb24556625 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.15 CNC(C)c1c[n]c[n]c1 Amb18286390 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.15 CNC(C)c1c[n]cc[n]1 Amb18949732 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.15 CNC(C)c1c[n]ccc1 Amb22587688 [0,0,0,0,0,0|3,0,0]=3 127 B10R1.15 CNC(C)c1cc[n]c[n]1 Amb22587685 [0,0,0,0,0,0|4,0,0]=4 128 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [0,0,0,0,0,0|3,0,0]=3 129 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [0,0,0,0,0,0|3,0,0]=3 130 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [0,0,0,0,0,0|3,0,0]=3 131 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [0,0,0,0,0,0|3,0,0]=3 132 B10R1.15 CNC(c1ccccc1)C Amb1215689 [0,0,0,0,0,0|2,0,0]=2 133 B10R1.15 CNC(c1ccccn1)C Amb10189608 [0,0,0,0,0,0|3,0,0]=3 134 B10R1.15 CNC(c1ccccn1)C Amb1115311 [0,0,0,0,0,0|3,0,0]=3 135 B10R1.15 CNC(c1cccnc1)C Amb10189690 [0,0,0,0,0,0|3,0,0]=3 136 B10R1.15 CNC(c1cccnc1)C Amb1121577 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.15 CNC(c1ccncc1)C Amb10189609 [0,0,0,0,0,0|3,0,0]=3 138 B10R1.15 CNC(c1ccncc1)C Amb1119143 [0,0,0,0,0,0|3,0,0]=3 139 B10R1.15 CNC(c1ccncn1)C Amb10608544 [0,0,0,0,0,0|4,0,0]=4 140 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [0,0,0,0,0,0|4,0,0]=4 141 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [0,0,0,0,0,0|3,0,0]=3 142 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [0,0,0,0,0,0|2,0,0]=2 143 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [0,0,0,0,0,0|2,0,0]=2 144 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [0,0,0,0,0,0|2,0,0]=2 145 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [0,0,0,0,0,0|3,0,0]=3 146 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [0,0,0,0,0,0|3,0,0]=3 147 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [0,0,0,0,0,0|2,0,2]=4 148 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [0,0,0,0,0,0|3,0,1]=4 149 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [0,0,0,0,0,0|3,0,1]=4 150 B10R1.15 COC(C)c1c[n][n]cc1 Amb24518776 [0,0,0,0,0,0|4,0,0]=4 151 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [0,0,0,0,0,0|3,0,0]=3 152 B10R1.15 COC(C)c1ccccc1 Amb23568513 [0,0,0,0,0,0|2,0,0]=2 153 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [0,0,0,0,0,0|3,0,0]=3 154 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [0,0,0,0,0,0|4,0,0]=4 155 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [0,0,0,0,0,0|4,0,0]=4 156 B10R1.15 COC(O)c1ccccc1 Amb25225981 [0,0,0,0,0,0|3,0,0]=3 157 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [0,0,0,0,0,0|3,0,1]=4 158 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [0,0,0,0,0,0|3,0,0]=3 159 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [0,0,0,0,0,0|3,0,0]=3 160 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [0,0,0,0,0,0|3,0,1]=4 161 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [0,0,0,0,0,0|3,0,1]=4 162 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [0,0,0,0,0,0|3,0,1]=4 163 B10R1.15 CSC(C)c1cc[n]cc1 Amb25829904 [0,0,0,0,0,0|3,0,0]=3 164 B10R1.15 C[C@@H](C=O)C=1CCCCC1 Amb25123222 [0,0,0,0,0,0|0,0,4]=4 165 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [0,0,0,0,0,0|0,0,0]=0 166 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [0,0,0,0,0,0|1,0,1]=2 167 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [0,0,0,0,0,0|1,0,1]=2 168 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [0,0,0,0,0,0|2,0,0]=2 169 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [0,0,0,0,0,0|1,0,1]=2 170 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [0,0,0,0,0,0|1,0,1]=2 171 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [0,0,0,0,0,0|2,0,0]=2 172 B10R1.15 C[C@H](C=O)C=1CCCCC1 Amb24653486 [0,0,0,0,0,0|0,0,4]=4 173 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [0,0,0,0,0,0|0,0,0]=0 174 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [0,0,0,0,0,0|1,0,1]=2 175 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [0,0,0,0,0,0|2,0,1]=3 176 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [0,0,0,0,0,0|1,0,1]=2 177 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [0,0,0,0,0,0|1,0,1]=2 178 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [0,0,0,0,0,0|1,1,1]=3 179 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [0,0,0,0,0,0|1,0,1]=2 180 B10R1.15 C\C(=C/C)\c1c[n]ccc1 Amb24085629 [0,0,0,0,0,0|2,0,1]=3 181 B10R1.15 C\C(=C/C)\c1cc[n]cc1 Amb24103190 [0,0,0,0,0,0|2,0,1]=3 182 B10R1.15 C\C(=C\Br)\c1cc[n]cc1 Amb24509735 [0,0,0,0,0,0|2,0,1]=3 183 B10R1.15 C\C(=C\Br)\c1cccc[n]1 Amb25248819 [0,0,0,0,0,0|2,0,1]=3 184 B10R1.15 C\C(=C\C)\c1cc[n]cc1 Amb24619216 [0,0,0,0,0,0|2,0,1]=3 185 B10R1.15 C\C(=C\C)\c1cccc[n]1 Amb24580985 [0,0,0,0,0,0|2,0,1]=3 186 B10R1.15 C\C(=C\N)\c1cccc[n]1 Amb24376247 [0,0,0,0,0,0|2,0,1]=3 187 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [0,0,0,0,0,0|1,0,1]=2 188 B10R1.15 C\C(=C\O)\c1cc[n]cc1 Amb24661195 [0,0,0,0,0,0|1,0,2]=3 189 B10R1.15 C\C(=C\O)\c1cccc[n]1 Amb24100288 [0,0,0,0,0,0|1,0,2]=3 190 B10R1.15 C\C(=N/N)\c1cccc[n]1 Amb22552431 [0,0,0,0,0,0|3,0,1]=4 191 B10R1.15 C\C(=N/[O-])\c1cccc[n]1 Amb19941776 [0,0,0,0,0,0|2,0,2]=4 192 B10R1.15 C\C(=N\C)\c1c[n]ccc1 Amb25230944 [0,0,0,0,0,0|3,0,1]=4 193 B10R1.15 C\C(=N\C)\c1cccc[n]1 Amb24433259 [0,0,0,0,0,0|3,0,1]=4 194 B10R1.15 C\C(=N\N)\c1cc[n]cc1 Amb25092436 [0,0,0,0,0,0|3,0,1]=4 195 B10R1.15 C\C(=N\N)\c1cccc[n]1 Amb22586427 [0,0,0,0,0,0|3,0,1]=4 196 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867755 [0,0,0,0,0,0|2,0,2]=4 197 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867825 [0,0,0,0,0,0|2,0,2]=4 198 B10R1.15 C\C(=N\[O-])\c1cccc[n]1 Amb21867883 [0,0,0,0,0,0|2,0,2]=4 199 B10R1.15 C\C(\C=O)=C/1\CCCC=C1 Amb25366614 [0,0,0,0,0,0|0,0,4]=4 200 B10R1.15 C\C(\C=O)=C\1/CCCC=C1 Amb25143470 [0,0,0,0,0,0|0,0,4]=4 201 B10R1.15 C\C=C(\N)/c1cccc[n]1 Amb25777355 [0,0,0,0,0,0|3,0,1]=4 202 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [0,0,0,0,0,0|3,0,1]=4 203 B10R1.15 C\[N+](=C\Cl)\c1cccc[n]1 Amb24487797 [0,0,0,0,0,0|3,0,0]=3 204 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [0,0,0,0,0,0|2,0,0]=2 205 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [0,0,0,0,0,0|2,0,1]=3 206 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [0,0,0,0,0,0|2,0,0]=2 207 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [0,0,0,0,0,0|2,0,1]=3 208 B10R1.15 ClCC(Cl)c1cccc[n]1 Amb24652322 [0,0,0,0,0,0|3,0,1]=4 209 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [0,0,0,0,0,0|1,0,1]=2 210 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [0,0,0,0,0,0|3,0,1]=4 211 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [0,0,0,0,0,0|2,0,1]=3 212 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [0,0,0,0,0,0|3,0,1]=4 213 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [0,0,0,0,0,0|2,0,1]=3 214 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [0,0,0,0,0,0|2,1,1]=4 215 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [0,0,0,0,0,0|2,0,1]=3 216 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [0,0,0,0,0,0|2,0,1]=3 217 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [0,0,0,0,0,0|2,0,2]=4 218 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [0,0,0,0,0,0|2,0,1]=3 219 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [0,0,0,0,0,0|2,0,1]=3 220 B10R1.15 FCC(c1ccccc1)N Amb2372575 [0,0,0,0,0,0|2,0,1]=3 221 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [0,0,0,0,0,0|2,0,1]=3 222 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [0,0,0,0,0,0|2,0,1]=3 223 B10R1.15 N#CC(=C)c1ccccc1 Amb17231856 [0,0,0,0,0,0|1,0,3]=4 224 B10R1.15 N#CC(Br)c1cccc[n]1 Amb25724948 [0,0,0,0,0,0|3,0,1]=4 225 B10R1.15 N#CC(Cl)c1c[n]ccc1 Amb18177240 [0,0,0,0,0,0|3,0,1]=4 226 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [0,0,0,0,0,0|2,0,1]=3 227 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [0,0,0,0,0,0|2,0,1]=3 228 B10R1.15 N#CC(O)c1cc[n]cc1 Amb24559121 [0,0,0,0,0,0|3,0,1]=4 229 B10R1.15 N#CC(c1ccccn1)N Amb1108541 [0,0,0,0,0,0|3,0,1]=4 230 B10R1.15 N#CC(c1cccnc1)N Amb1108979 [0,0,0,0,0,0|3,0,1]=4 231 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [0,0,0,0,0,0|2,0,1]=3 232 B10R1.15 N#C[C@@H](O)c1c[n]ccc1 Amb25320762 [0,0,0,0,0,0|3,0,1]=4 233 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [0,0,0,0,0,0|2,0,1]=3 234 B10R1.15 N#C[C@H](O)c1c[n]ccc1 Amb25837398 [0,0,0,0,0,0|3,0,1]=4 235 B10R1.15 N#C[C@H](O)c1cc[n]cc1 Amb24470652 [0,0,0,0,0,0|3,0,1]=4 236 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [0,0,0,0,0,0|2,0,1]=3 237 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [0,0,0,0,0,0|3,0,1]=4 238 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [0,0,0,0,0,0|2,0,1]=3 239 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [0,0,0,0,0,0|2,0,1]=3 240 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [0,0,0,0,0,0|2,0,1]=3 241 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [0,0,0,0,0,0|2,0,2]=4 242 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [0,0,0,0,0,0|2,0,2]=4 243 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [0,0,0,0,0,0|2,0,2]=4 244 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [0,0,0,0,0,0|2,0,2]=4 245 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [0,0,0,0,0,0|2,0,2]=4 246 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [0,0,0,0,0,0|1,1,1]=3 247 B10R1.15 NC(c1ccncc1)C#N Amb1108968 [0,0,0,0,0,0|3,0,1]=4 248 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [0,0,0,0,0,0|1,0,3]=4 249 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [0,0,0,0,0,0|2,0,2]=4 250 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [0,0,0,0,0,0|2,0,1]=3 251 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [0,0,0,0,0,0|3,0,1]=4 252 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [0,0,0,0,0,0|2,0,1]=3 253 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [0,0,0,0,0,0|3,0,1]=4 254 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [0,0,0,0,0,0|2,0,1]=3 255 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [0,0,0,0,0,0|3,0,1]=4 256 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [0,0,0,0,0,0|3,0,1]=4 257 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [0,0,0,0,0,0|2,0,1]=3 258 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [0,0,0,0,0,0|2,0,1]=3 259 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [0,0,0,0,0,0|2,0,1]=3 260 B10R1.15 NCC(c1ccccc1)C Amb1085937 [0,0,0,0,0,0|1,0,1]=2 261 B10R1.15 NCC(c1ccccc1)O Amb2383121 [0,0,0,0,0,0|2,0,1]=3 262 B10R1.15 NCC(c1ccccn1)O Amb1109027 [0,0,0,0,0,0|3,0,1]=4 263 B10R1.15 NCC(c1cccnc1)O Amb10068830 [0,0,0,0,0,0|3,0,1]=4 264 B10R1.15 NCC(c1cccnc1)O Amb1108854 [0,0,0,0,0,0|3,0,1]=4 265 B10R1.15 NCC(c1ccncc1)O Amb1108372 [0,0,0,0,0,0|3,0,1]=4 266 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [0,0,0,0,0,0|2,0,1]=3 267 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [0,0,0,0,0,0|2,0,1]=3 268 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [0,0,0,0,0,0|3,0,1]=4 269 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [0,0,0,0,0,0|3,0,1]=4 270 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [0,0,0,0,0,0|3,0,1]=4 271 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [0,0,0,0,0,0|3,0,1]=4 272 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [0,0,0,0,0,0|3,0,1]=4 273 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [0,0,0,0,0,0|2,0,1]=3 274 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [0,0,0,0,0,0|2,0,1]=3 275 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [0,0,0,0,0,0|2,0,1]=3 276 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [0,0,0,0,0,0|3,0,1]=4 277 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [0,0,0,0,0,0|2,0,1]=3 278 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [0,0,0,0,0,0|3,0,1]=4 279 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [0,0,0,0,0,0|3,0,1]=4 280 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [0,0,0,0,0,0|3,0,1]=4 281 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [0,0,0,0,0,0|1,0,1]=2 282 B10R1.15 NN(c1ccccc1)C#N Amb10552759 [0,0,0,0,0,0|3,0,1]=4 283 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [0,0,0,0,0,0|3,0,1]=4 284 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [0,0,0,0,0,0|3,0,1]=4 285 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [0,0,0,0,0,0|3,0,1]=4 286 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [0,0,0,0,0,0|3,0,1]=4 287 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [0,0,0,0,0,0|3,0,1]=4 288 B10R1.15 NNC(O)c1cc[n]cc1 Amb25215180 [0,0,0,0,0,0|4,0,0]=4 289 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [0,0,0,0,0,0|3,0,0]=3 290 B10R1.15 NNC(c1ccccc1)C Amb10610271 [0,0,0,0,0,0|2,0,0]=2 291 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [0,0,0,0,0,0|3,0,1]=4 292 B10R1.15 NOC(c1ccccc1)C Amb17089185 [0,0,0,0,0,0|2,0,0]=2 293 B10R1.15 N[C@@H](C#N)c1cc[n]cc1 Amb24427478 [0,0,0,0,0,0|3,0,1]=4 294 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [0,0,0,0,0,0|2,0,1]=3 295 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [0,0,0,0,0,0|2,0,1]=3 296 B10R1.15 N[C@@H](CF)c1cc[n]cc1 Amb24403138 [0,0,0,0,0,0|3,0,1]=4 297 B10R1.15 N[C@@H](CF)c1cccc[n]1 Amb25353862 [0,0,0,0,0,0|3,0,1]=4 298 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [0,0,0,0,0,0|2,0,1]=3 299 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [0,0,0,0,0,0|2,0,1]=3 300 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [0,0,0,0,0,0|2,0,2]=4 301 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [0,0,0,0,0,0|2,0,2]=4 302 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [0,0,0,0,0,0|2,0,2]=4 303 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [0,0,0,0,0,0|1,1,1]=3 304 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [0,0,0,0,0,0|2,0,1]=3 305 B10R1.15 N[C@H](C#N)c1cc[n]cc1 Amb24686779 [0,0,0,0,0,0|3,0,1]=4 306 B10R1.15 N[C@H](C#N)c1cccc[n]1 Amb24478523 [0,0,0,0,0,0|3,0,1]=4 307 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [0,0,0,0,0,0|2,0,1]=3 308 B10R1.15 N[C@H](CF)c1c[n]ccc1 Amb24509342 [0,0,0,0,0,0|3,0,1]=4 309 B10R1.15 N[C@H](CF)c1cc[n]cc1 Amb25677477 [0,0,0,0,0,0|3,0,1]=4 310 B10R1.15 N[C@H](CF)c1cccc[n]1 Amb25840493 [0,0,0,0,0,0|3,0,1]=4 311 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [0,0,0,0,0,0|2,0,2]=4 312 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [0,0,0,0,0,0|2,0,2]=4 313 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [0,0,0,0,0,0|1,1,1]=3 314 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [0,0,0,0,0,0|2,0,1]=3 315 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [0,0,0,0,0,0|1,0,2]=3 316 B10R1.15 N\C(=N/Br)\c1ccccc1 Amb25046590 [0,0,0,0,0,0|3,0,1]=4 317 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [0,0,0,0,0,0|3,0,1]=4 318 B10R1.15 N\C(=N\Cl)\c1ccccc1 Amb24571718 [0,0,0,0,0,0|3,0,1]=4 319 B10R1.15 N\C(=N\I)\c1ccccc1 Amb24599616 [0,0,0,0,0,0|3,0,1]=4 320 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [0,0,0,0,0,0|3,0,1]=4 321 B10R1.15 N\N=C(\c1ccncc1)/C Amb10552809 [0,0,0,0,0,0|3,0,1]=4 322 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [0,0,0,0,0,0|1,0,2]=3 323 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [0,0,0,0,0,0|2,0,2]=4 324 B10R1.15 O=C(C=O)c1c[n]cc[n]1 Amb25169317 [0,0,0,0,0,0|3,0,1]=4 325 B10R1.15 O=C(C=O)c1c[n]ccc1 Amb18642978 [0,0,0,0,0,0|2,0,1]=3 326 B10R1.15 O=C(C=O)c1cccc[n]1 Amb25066902 [0,0,0,0,0,0|2,0,1]=3 327 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [0,0,0,0,0,0|2,0,2]=4 328 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [0,0,0,0,0,0|2,0,1]=3 329 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [0,0,0,0,0,0|3,0,1]=4 330 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [0,0,0,0,0,0|0,0,2]=2 331 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [0,0,0,0,0,0|1,0,0]=1 332 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [0,0,0,0,0,0|1,0,0]=1 333 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [0,0,0,0,0,0|1,0,0]=1 334 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [0,0,0,0,0,0|1,0,0]=1 335 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [0,0,0,0,0,0|1,0,0]=1 336 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [0,0,0,0,0,0|3,0,1]=4 337 B10R1.15 O=P(O[Na])c1ccccc1 Amb22360738 [0,0,0,0,0,0|4,0,0]=4 338 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [0,0,0,0,0,0|3,0,1]=4 339 B10R1.15 OC(C=O)c1c[n]cc[n]1 Amb24363870 [0,0,0,0,0,0|3,0,0]=3 340 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [0,0,0,0,0,0|3,0,1]=4 341 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [0,0,0,0,0,0|3,0,1]=4 342 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [0,0,0,0,0,0|3,0,1]=4 343 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [0,0,0,0,0,0|2,0,1]=3 344 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [0,0,0,0,0,0|2,0,2]=4 345 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [0,0,0,0,0,0|1,0,2]=3 346 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [0,0,0,0,0,0|2,0,2]=4 347 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [0,0,0,0,0,0|2,0,2]=4 348 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [0,0,0,0,0,0|1,0,2]=3 349 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [0,0,0,0,0,0|1,0,2]=3 350 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [0,0,0,0,0,0|1,0,2]=3 351 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [0,0,0,0,0,0|1,0,2]=3 352 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [0,0,0,0,0,0|1,0,2]=3 353 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [0,0,0,0,0,0|2,0,2]=4 354 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [0,0,0,0,0,0|2,0,2]=4 355 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [0,0,0,0,0,0|2,0,0]=2 356 B10R1.15 ON(N=O)c1cccc[n]1 Amb25766021 [0,0,0,0,0,0|4,0,0]=4 357 B10R1.15 ON(N=O)c1ccccc1 Amb17666641 [0,0,0,0,0,0|3,0,0]=3 358 B10R1.15 ON(N=O)c1ccccc1 Amb22001406 [0,0,0,0,0,0|3,0,0]=3 359 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [0,0,0,0,0,0|2,0,2]=4 360 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [0,0,0,0,0,0|2,0,2]=4 361 B10R1.15 ONC(c1ccccc1)C Amb10605006 [0,0,0,0,0,0|1,0,1]=2 362 B10R1.15 ONC(c1ccccn1)C Amb10605008 [0,0,0,0,0,0|2,0,1]=3 363 B10R1.15 ONC(c1cccnc1)C Amb10605009 [0,0,0,0,0,0|2,0,1]=3 364 B10R1.15 ONC(c1ccncc1)C Amb10605014 [0,0,0,0,0,0|2,0,1]=3 365 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [0,0,0,0,0,0|2,0,2]=4 366 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [0,0,0,0,0,0|3,0,1]=4 367 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [0,0,0,0,0,0|2,0,1]=3 368 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [0,0,0,0,0,0|3,0,1]=4 369 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [0,0,0,0,0,0|2,0,1]=3 370 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [0,0,0,0,0,0|2,0,1]=3 371 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [0,0,0,0,0,0|2,0,1]=3 372 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [0,0,0,0,0,0|3,0,1]=4 373 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [0,0,0,0,0,0|3,0,1]=4 374 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [0,0,0,0,0,0|2,0,1]=3 375 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [0,0,0,0,0,0|3,0,1]=4 376 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [0,0,0,0,0,0|2,0,1]=3 377 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [0,0,0,0,0,0|2,0,1]=3 378 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [0,0,0,0,0,0|2,0,1]=3 379 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [0,0,0,0,0,0|2,0,1]=3 380 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [0,0,0,0,0,0|1,0,2]=3 381 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [0,0,0,0,0,0|2,0,2]=4 382 B10R1.15 O\N=C(/c1cccnc1)\C Amb10606945 [0,0,0,0,0,0|2,0,2]=4 383 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [0,0,0,0,0,0|1,0,2]=3 384 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [0,0,0,0,0,0|2,0,2]=4 385 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [0,0,0,0,0,0|2,0,2]=4 386 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [0,0,0,0,0,0|1,1,2]=4 387 B10R1.15 SCC(c1ccccc1)O Amb10608997 [0,0,0,0,0,0|1,1,1]=3 388 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [0,0,0,0,0,0|2,0,1]=3 389 B10R1.15 [Li]OS(=O)c1ccccc1 Amb22359261 [0,0,0,0,0,0|4,0,0]=4 390 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [0,0,0,0,0,0|2,0,2]=4 391 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [0,0,0,0,0,0|2,0,2]=4 392 B9R1.6 BrC(=C)c1ccccn1 Amb2447497 [1,0,0,0,0,0|2,0,1]=4 393 B9R1.6 BrC(Br)c1c[n]ccc1 Amb24747660 [1,0,0,0,0,0|3,0,0]=4 394 B9R1.6 C=C(Br)c1cc[n]cc1 Amb24710590 [1,0,0,0,0,0|2,0,1]=4 395 B9R1.6 C=C(Cl)c1cc[n]cc1 Amb24102656 [1,0,0,0,0,0|2,0,1]=4 396 B9R1.6 C=C(Cl)c1ccc[n]c1 Amb24085113 [1,0,0,0,0,0|2,0,1]=4 397 B9R1.6 C=C(Cl)c1cccc[n]1 Amb24069950 [1,0,0,0,0,0|2,0,1]=4 398 B9R1.6 C=C(F)c1cc[n]cc1 Amb20248442 [1,0,0,0,0,0|2,0,1]=4 399 B9R1.6 C=C(F)c1ccc[n]c1 Amb20248553 [1,0,0,0,0,0|2,0,1]=4 400 B9R1.6 C=C(F)c1cccc[n]1 Amb20248373 [1,0,0,0,0,0|2,0,1]=4 401 B9R1.6 C=C(F)c1ccccc1 Amb22738583 [1,0,0,0,0,0|1,0,1]=3 402 B9R1.6 C=C([Zn+])c1ccccc1 Amb22228006 [1,0,0,0,0,0|1,0,1]=3 403 B9R1.6 CB(C)c1c[n]ccc1 Amb25359854 [1,0,0,0,0,0|2,0,1]=4 404 B9R1.6 CC(=C)c1[n]ccc[n]1 Amb24084451 [1,0,0,0,0,0|2,0,1]=4 405 B9R1.6 CC(=C)c1c[n]c[n]c1 Amb25270716 [1,0,0,0,0,0|2,0,1]=4 406 B9R1.6 CC(=C)c1cc[n]cc1 Amb25126374 [1,0,0,0,0,0|1,0,1]=3 407 B9R1.6 CC(=C)c1cccc[n]1 Amb25077592 [1,0,0,0,0,0|1,0,1]=3 408 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [1,0,0,0,0,0|0,0,1]=2 409 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [1,0,0,0,0,0|0,0,1]=2 410 B9R1.6 CC(=N)c1cc[n]cc1 Amb24478617 [1,0,0,0,0,0|2,0,1]=4 411 B9R1.6 CC(=N)c1ccc[n]c1 Amb22170296 [1,0,0,0,0,0|2,0,1]=4 412 B9R1.6 CC(=O)C1=CC=CCS1 Amb24582465 [1,0,0,0,0,0|1,0,2]=4 413 B9R1.6 CC(=O)C1C=CNC=C1 Amb24707722 [1,0,0,0,0,0|1,0,2]=4 414 B9R1.6 CC(=O)C=1CCC=CC1 Amb22232236 [1,0,0,0,0,0|0,0,3]=4 415 B9R1.6 CC(=O)C=1CNC=CC1 Amb25700322 [1,0,0,0,0,0|1,0,2]=4 416 B9R1.6 CC(=O)[n+]1ccccc1 Amb24692607 [1,0,0,0,0,0|1,0,1]=3 417 B9R1.6 CC(=O)c1cc[n][n]c1 Amb19958070 [1,0,0,0,0,0|2,0,1]=4 418 B9R1.6 CC(=O)c1cc[n]c[n]1 Amb19959228 [1,0,0,0,0,0|2,0,1]=4 419 B9R1.6 CC(=O)c1ccc[nH+]c1 Amb10552777 [1,0,0,0,0,0|1,0,1]=3 420 B9R1.6 CC(=O)c1ccc[n][n]1 Amb20242017 [1,0,0,0,0,0|2,0,1]=4 421 B9R1.6 CC(=O)c1cccc[nH+]1 Amb10552776 [1,0,0,0,0,0|1,0,1]=3 422 B9R1.6 CC(Br)c1c[n]cc[n]1 Amb21862010 [1,0,0,0,0,0|3,0,0]=4 423 B9R1.6 CC(Br)c1cc[n]c[n]1 Amb24480125 [1,0,0,0,0,0|3,0,0]=4 424 B9R1.6 CC(C)C1=CCC=CN1 Amb25146142 [1,0,0,0,0,0|1,0,2]=4 425 B9R1.6 CC(C)C1C=CNC=C1 Amb25125845 [1,0,0,0,0,0|1,0,2]=4 426 B9R1.6 CC(C)c1[n]ccc[n]1 Amb24084521 [1,0,0,0,0,0|2,0,1]=4 427 B9R1.6 CC(C)c1c[n][n]cc1 Amb24697122 [1,0,0,0,0,0|2,0,1]=4 428 B9R1.6 CC(C)c1c[n]c[n]c1 Amb24071492 [1,0,0,0,0,0|2,0,1]=4 429 B9R1.6 CC(C)c1c[n]ccc1 Amb24320774 [1,0,0,0,0,0|1,0,1]=3 430 B9R1.6 CC(C)c1cc[n]c[n]1 Amb24070425 [1,0,0,0,0,0|2,0,1]=4 431 B9R1.6 CC(C)c1ccccc1 Amb24052959 [1,0,0,0,0,0|0,0,1]=2 432 B9R1.6 CC(Cl)c1c[n]cc[n]1 Amb20618636 [1,0,0,0,0,0|3,0,0]=4 433 B9R1.6 CC(Cl)c1cc[n]cc1 Amb19514972 [1,0,0,0,0,0|2,0,0]=3 434 B9R1.6 CC(F)c1ccccc1 Amb24555504 [1,0,0,0,0,0|1,0,0]=2 435 B9R1.6 CC(I)c1ccccc1 Amb24064714 [1,0,0,0,0,0|1,0,0]=2 436 B9R1.6 CC(N)C1C=CC=C=C1 Amb25346953 [1,0,0,0,0,0|1,0,2]=4 437 B9R1.6 CC(N)C=1C=CCC=C1 Amb24480325 [1,0,0,0,0,0|1,0,2]=4 438 B9R1.6 CC(N)c1[n]ccc[n]1 Amb22757229 [1,0,0,0,0,0|3,0,0]=4 439 B9R1.6 CC(N)c1c[n][n]cc1 Amb21964416 [1,0,0,0,0,0|3,0,0]=4 440 B9R1.6 CC(N)c1c[n][n]cc1 Amb22757188 [1,0,0,0,0,0|3,0,0]=4 441 B9R1.6 CC(N)c1c[n]cc[n]1 Amb18278310 [1,0,0,0,0,0|3,0,0]=4 442 B9R1.6 CC(N)c1c[n]ccc1 Amb22754521 [1,0,0,0,0,0|2,0,0]=3 443 B9R1.6 CC(N)c1cc[n]c[n]1 Amb22587681 [1,0,0,0,0,0|3,0,0]=4 444 B9R1.6 CC(N)c1cc[n]cc1 Amb19958395 [1,0,0,0,0,0|2,0,0]=3 445 B9R1.6 CC(N)c1cccc[n]1 Amb22265614 [1,0,0,0,0,0|2,0,0]=3 446 B9R1.6 CC(N)c1cccc[n]1 Amb24064899 [1,0,0,0,0,0|2,0,0]=3 447 B9R1.6 CC(O)c1[n]ccc[n]1 Amb22284841 [1,0,0,0,0,0|2,0,1]=4 448 B9R1.6 CC(O)c1c[n]c[n]c1 Amb22055840 [1,0,0,0,0,0|2,0,1]=4 449 B9R1.6 CC(O)c1cc[n]c[n]1 Amb24477841 [1,0,0,0,0,0|2,0,1]=4 450 B9R1.6 CC(S)c1c[n]cc[n]1 Amb22267831 [1,0,0,0,0,0|2,1,0]=4 451 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [1,0,0,0,0,0|1,0,0]=2 452 B9R1.6 CC(c1ccccn1)Cl Amb10610197 [1,0,0,0,0,0|2,0,0]=3 453 B9R1.6 CC(c1ccccn1)N Amb1102610 [1,0,0,0,0,0|2,0,0]=3 454 B9R1.6 CC(c1cccnc1)Br Amb10610142 [1,0,0,0,0,0|2,0,0]=3 455 B9R1.6 CC(c1cccnc1)Cl Amb13952205 [1,0,0,0,0,0|2,0,0]=3 456 B9R1.6 CC(c1cccnc1)N Amb1214297 [1,0,0,0,0,0|2,0,0]=3 457 B9R1.6 CC(c1ccncc1)Br Amb10610143 [1,0,0,0,0,0|2,0,0]=3 458 B9R1.6 CC(c1ccncc1)N Amb1152976 [1,0,0,0,0,0|2,0,0]=3 459 B9R1.6 CC(c1ccncn1)N Amb10608543 [1,0,0,0,0,0|3,0,0]=4 460 B9R1.6 CC(c1cnccn1)O Amb13952214 [1,0,0,0,0,0|2,0,1]=4 461 B9R1.6 CN(C)[n+]1ccccc1 Amb24382519 [1,0,0,0,0,0|2,0,1]=4 462 B9R1.6 CN(C)c1cc[nH+]cc1 Amb22411615 [1,0,0,0,0,0|2,0,1]=4 463 B9R1.6 CN(C)c1cc[nH+]cc1 Amb22734568 [1,0,0,0,0,0|2,0,1]=4 464 B9R1.6 CN(C)c1cc[n]cc1 Amb22349204 [1,0,0,0,0,0|2,0,1]=4 465 B9R1.6 CN(C)c1cccc[o+]1 Amb25095281 [1,0,0,0,0,0|2,0,1]=4 466 B9R1.6 CN(C)c1ccccc1 Amb22040069 [1,0,0,0,0,0|1,0,1]=3 467 B9R1.6 CN(N)c1c[n]ccc1 Amb24085137 [1,0,0,0,0,0|3,0,0]=4 468 B9R1.6 CN(N)c1cccc[n]1 Amb18642128 [1,0,0,0,0,0|3,0,0]=4 469 B9R1.6 CN(N)c1ccccc1 Amb22346095 [1,0,0,0,0,0|2,0,0]=3 470 B9R1.6 CN(N)c1ccccc1 Amb22754142 [1,0,0,0,0,0|2,0,0]=3 471 B9R1.6 CN(O)c1cc[n]cc1 Amb22522442 [1,0,0,0,0,0|2,0,1]=4 472 B9R1.6 CN(c1cc[nH+]cc1)C Amb10552846 [1,0,0,0,0,0|2,0,1]=4 473 B9R1.6 CN(c1cc[nH+]cc1)C Amb10552850 [1,0,0,0,0,0|2,0,1]=4 474 B9R1.6 CN(c1ccccc1)N Amb1153615 [1,0,0,0,0,0|2,0,0]=3 475 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [1,0,0,0,0,0|1,0,0]=2 476 B9R1.6 CP(C)c1ccccc1 Amb22369673 [1,0,0,0,0,0|1,0,1]=3 477 B9R1.6 CP(C)c1ccccc1 Amb24325382 [1,0,0,0,0,0|1,0,1]=3 478 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [1,0,0,0,0,0|2,0,0]=3 479 B9R1.6 CS(=O)c1c[n]c[n]c1 Amb24070822 [1,0,0,0,0,0|3,0,0]=4 480 B9R1.6 CS(=O)c1c[n]ccc1 Amb24102456 [1,0,0,0,0,0|2,0,0]=3 481 B9R1.6 CS(=O)c1cc[n]c[n]1 Amb24103017 [1,0,0,0,0,0|3,0,0]=4 482 B9R1.6 CS(=O)c1cc[n]cc1 Amb24103016 [1,0,0,0,0,0|2,0,0]=3 483 B9R1.6 CS(=O)c1cccc[n]1 Amb24562247 [1,0,0,0,0,0|2,0,0]=3 484 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [1,0,0,0,0,0|0,0,1]=2 485 B9R1.6 C[C@@H](Br)c1cccc[n]1 Amb25725731 [1,0,0,0,0,0|2,0,0]=3 486 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [1,0,0,0,0,0|1,0,0]=2 487 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [1,0,0,0,0,0|1,0,0]=2 488 B9R1.6 C[C@@H](N)c1c[n]c[n]c1 Amb23439227 [1,0,0,0,0,0|3,0,0]=4 489 B9R1.6 C[C@@H](N)c1c[n]c[n]c1 Amb25727204 [1,0,0,0,0,0|3,0,0]=4 490 B9R1.6 C[C@@H](N)c1c[n]cc[n]1 Amb22747093 [1,0,0,0,0,0|3,0,0]=4 491 B9R1.6 C[C@@H](N)c1cc[n]c[n]1 Amb18832953 [1,0,0,0,0,0|3,0,0]=4 492 B9R1.6 C[C@@H](N)c1cccc[n]1 Amb19514583 [1,0,0,0,0,0|2,0,0]=3 493 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [1,0,0,0,0,0|1,0,0]=2 494 B9R1.6 C[C@@H](O)c1[n]ccc[n]1 Amb25313724 [1,0,0,0,0,0|2,0,1]=4 495 B9R1.6 C[C@@H](O)c1c[n]cc[n]1 Amb19514758 [1,0,0,0,0,0|2,0,1]=4 496 B9R1.6 C[C@@H](O)c1cccc[n]1 Amb24087444 [1,0,0,0,0,0|1,0,1]=3 497 B9R1.6 C[C@@H](S)c1cccc[n]1 Amb25346958 [1,0,0,0,0,0|1,1,0]=3 498 B9R1.6 C[C@@H](c1ccccn1)O Amb13951167 [1,0,0,0,0,0|1,0,1]=3 499 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [1,0,0,0,0,0|1,0,0]=2 500 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [1,0,0,0,0,0|1,0,0]=2 501 B9R1.6 C[C@H](N)c1c[n]c[n]c1 Amb25691811 [1,0,0,0,0,0|3,0,0]=4 502 B9R1.6 C[C@H](N)c1cc[n]c[n]1 Amb24099656 [1,0,0,0,0,0|3,0,0]=4 503 B9R1.6 C[C@H](O)c1[n]ccc[n]1 Amb24428544 [1,0,0,0,0,0|2,0,1]=4 504 B9R1.6 C[C@H](O)c1c[n]c[n]c1 Amb25259575 [1,0,0,0,0,0|2,0,1]=4 505 B9R1.6 C[C@H](c1cccnc1)N Amb13951181 [1,0,0,0,0,0|2,0,0]=3 506 B9R1.6 C[C@H](c1ccncc1)N Amb13952719 [1,0,0,0,0,0|2,0,0]=3 507 B9R1.6 C[N+](C)=C1C=CNC=C1 Amb25364040 [1,0,0,0,0,0|2,0,1]=4 508 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [1,0,0,0,0,0|1,0,0]=2 509 B9R1.6 C[SiH](C)c1c[n]ccc1 Amb24085368 [1,0,0,0,0,0|1,1,1]=4 510 B9R1.6 C[SiH](C)c1cc[n]cc1 Amb24102972 [1,0,0,0,0,0|1,1,1]=4 511 B9R1.6 C[SiH](C)c1cccc[n]1 Amb22336977 [1,0,0,0,0,0|1,1,1]=4 512 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [1,0,0,0,0,0|0,1,1]=3 513 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [1,0,0,0,0,0|0,1,0]=2 514 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [1,0,0,0,0,0|1,0,1]=3 515 B9R1.6 ClC(Cl)c1cc[n]cc1 Amb25231961 [1,0,0,0,0,0|3,0,0]=4 516 B9R1.6 ClC(Cl)c1cccc[n]1 Amb22295832 [1,0,0,0,0,0|3,0,0]=4 517 B9R1.6 ClS(=O)c1ccccc1 Amb13881360 [1,0,0,0,0,0|2,0,0]=3 518 B9R1.6 Cl[As](Cl)c1ccccc1 Amb22734276 [1,0,0,0,0,0|3,0,0]=4 519 B9R1.6 Cl[C+](Cl)c1ccccc1 Amb22369050 [1,0,0,0,0,0|2,0,1]=4 520 B9R1.6 Cl[I](c1ccccc1)Cl Amb10071738 [1,0,0,0,0,0|3,0,0]=4 521 B9R1.6 FB(F)c1ccccc1 Amb24654946 [1,0,0,0,0,0|3,0,0]=4 522 B9R1.6 FC(=O)c1ccccc1 Amb10607152 [1,0,0,0,0,0|1,0,1]=3 523 B9R1.6 FC(F)c1cc[n]cc1 Amb19894457 [1,0,0,0,0,0|3,0,0]=4 524 B9R1.6 FC(F)c1cccc[n]1 Amb19894454 [1,0,0,0,0,0|3,0,0]=4 525 B9R1.6 FC(c1ccccc1)Cl Amb10838337 [1,0,0,0,0,0|2,0,0]=3 526 B9R1.6 FC(c1ccccc1)F Amb10606272 [1,0,0,0,0,0|2,0,0]=3 527 B9R1.6 FC(c1cccnc1)F Amb10605994 [1,0,0,0,0,0|3,0,0]=4 528 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [1,0,0,0,0,0|2,0,1]=4 529 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [1,0,0,0,0,0|2,0,1]=4 530 B9R1.6 NC(=O)c1cc[n]cc1 Amb24066211 [1,0,0,0,0,0|2,0,1]=4 531 B9R1.6 NC(=O)c1cccc[p]1 Amb25353307 [1,0,0,0,0,0|2,0,1]=4 532 B9R1.6 NC(=O)c1ccccn1 Amb1219876 [1,0,0,0,0,0|2,0,1]=4 533 B9R1.6 NC(=O)c1cccnc1 Amb16231206 [1,0,0,0,0,0|2,0,1]=4 534 B9R1.6 NC(F)c1ccccc1 Amb25059400 [1,0,0,0,0,0|2,0,0]=3 535 B9R1.6 NC(N)c1cc[n]cc1 Amb24079161 [1,0,0,0,0,0|3,0,0]=4 536 B9R1.6 NC(N)c1cccc[n]1 Amb24430144 [1,0,0,0,0,0|3,0,0]=4 537 B9R1.6 NC(O)c1c[n]ccc1 Amb25251813 [1,0,0,0,0,0|2,0,1]=4 538 B9R1.6 NC(O)c1cc[n]cc1 Amb25744601 [1,0,0,0,0,0|2,0,1]=4 539 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [1,0,0,0,0,0|1,0,1]=3 540 B9R1.6 O=C(Br)c1cc[n]cc1 Amb24536581 [1,0,0,0,0,0|2,0,1]=4 541 B9R1.6 O=C(Cl)c1cc[nH+]cc1 Amb21952993 [1,0,0,0,0,0|2,0,1]=4 542 B9R1.6 O=C(Cl)c1cccc[n]1 Amb22492448 [1,0,0,0,0,0|2,0,1]=4 543 B9R1.6 O=C(F)c1ccc[n]c1 Amb25146722 [1,0,0,0,0,0|2,0,1]=4 544 B9R1.6 O=N(=O)c1cc[n]cc1 Amb20621911 [1,0,0,0,0,0|3,0,0]=4 545 B9R1.6 O=S(Cl)c1c[n]ccc1 Amb25347198 [1,0,0,0,0,0|3,0,0]=4 546 B9R1.6 O=[13C](Cl)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054407 [1,0,0,0,0,0|1,0,1]=3 547 B9R1.6 O=[13C](Cl)c1ccccc1 Amb22167795 [1,0,0,0,0,0|1,0,1]=3 548 B9R1.6 OB(O)c1ccccc1 Amb22587706 [1,0,0,0,0,0|2,0,1]=4 549 B9R1.6 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054405 [1,0,0,0,0,0|1,0,1]=3 550 B9R1.6 OC(=O)[13c]1ccccc1 Amb22353371 [1,0,0,0,0,0|1,0,1]=3 551 B9R1.6 OC(=O)c1cc[13cH]cc1 Amb22367544 [1,0,0,0,0,0|1,0,1]=3 552 B9R1.6 OC(=O)c1ccccc1 Amb16232256 [1,0,0,0,0,0|1,0,1]=3 553 B9R1.6 OC(=O)c1ccccc1 Amb1935196 [1,0,0,0,0,0|1,0,1]=3 554 B9R1.6 OC(=O)c1ccccc1 Amb22002523 [1,0,0,0,0,0|1,0,1]=3 555 B9R1.6 OC(=O)c1ccccc1 Amb22279605 [1,0,0,0,0,0|1,0,1]=3 556 B9R1.6 OC(=O)c1ccccc1 Amb22336602 [1,0,0,0,0,0|1,0,1]=3 557 B9R1.6 OC(=O)c1ccccc1 Amb22338105 [1,0,0,0,0,0|1,0,1]=3 558 B9R1.6 OC(=O)c1ccccc1 Amb22351742 [1,0,0,0,0,0|1,0,1]=3 559 B9R1.6 OC(=O)c1ccccc1 Amb22472602 [1,0,0,0,0,0|1,0,1]=3 560 B9R1.6 OC(=O)c1ccccc1 Amb22491636 [1,0,0,0,0,0|1,0,1]=3 561 B9R1.6 OC(=O)c1ccccn1 Amb1227737 [1,0,0,0,0,0|2,0,1]=4 562 B9R1.6 OC(=O)c1cccnc1 Amb1195995 [1,0,0,0,0,0|2,0,1]=4 563 B9R1.6 OC(=S)c1ccccc1 Amb17942862 [1,0,0,0,0,0|1,0,2]=4 564 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [1,0,0,0,0,0|1,0,1]=3 565 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [1,0,0,0,0,0|1,0,1]=3 566 B9R1.6 OC(O)c1c[n]ccc1 Amb24102578 [1,0,0,0,0,0|2,0,1]=4 567 B9R1.6 OC(O)c1cc[n]cc1 Amb24070648 [1,0,0,0,0,0|2,0,1]=4 568 B9R1.6 OC(O)c1cccc[n]1 Amb24085037 [1,0,0,0,0,0|2,0,1]=4 569 B9R1.6 OC(P)c1ccccc1 Amb24448419 [1,0,0,0,0,0|1,0,1]=3 570 B9R1.6 OP(=O)c1ccccc1 Amb10571098 [1,0,0,0,0,0|2,0,0]=3 571 B9R1.6 OS(=O)c1c[n]ccc1 Amb24062548 [1,0,0,0,0,0|3,0,0]=4 572 B9R1.6 OS(=O)c1cc[n]cc1 Amb24099594 [1,0,0,0,0,0|3,0,0]=4 573 B9R1.6 OS(=O)c1ccccc1 Amb17939345 [1,0,0,0,0,0|2,0,0]=3 574 B9R1.6 O[12C](=O)[12c]1[12cH][12cH][12cH][12cH][12cH]1 Amb22338193 [1,0,0,0,0,0|1,0,1]=3 575 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367547 [1,0,0,0,0,0|1,0,1]=3 576 B9R1.6 O[13C](=O)[13c]1[13cH][13cH][13cH]n[13cH]1 Amb17618353 [1,0,0,0,0,0|2,0,1]=4 577 B9R1.6 O[13C](=O)c1ccccc1 Amb22338753 [1,0,0,0,0,0|1,0,1]=3 578 B9R1.6 O[14C](=O)c1ccccc1 Amb22352700 [1,0,0,0,0,0|1,0,1]=3 579 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [1,0,0,0,0,0|1,0,1]=3 580 B9R1.6 S=C(Cl)c1ccccc1 Amb25294215 [1,0,0,0,0,0|1,1,1]=4 581 B9R1.6 SC(=S)c1ccccc1 Amb22051683 [1,0,0,0,0,0|1,1,1]=4 582 B9R1.6 SC(S)c1ccccc1 Amb25716873 [1,0,0,0,0,0|1,1,0]=3 583 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [1,0,0,0,0,0|0,0,1]=2 584 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [1,0,0,0,0,0|0,0,1]=2 585 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [1,0,0,0,0,0|0,0,1]=2 586 B9R1.6 [15NH2]C(=O)c1ccc[n]c1 Amb22367445 [1,0,0,0,0,0|2,0,1]=4 587 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [1,0,0,0,0,0|1,0,1]=3 588 B9R1.6 [2H]C(=C)c1ccccc1 Amb22337758 [1,0,0,0,0,0|1,0,1]=3 589 B9R1.6 [2H]C(=O)c1ccccc1 Amb22043987 [1,0,0,0,0,0|1,0,1]=3 590 B9R1.6 [2H][13C](=O)c1ccccc1 Amb22369001 [1,0,0,0,0,0|1,0,1]=3 591 B9R1.6 [CH2-]C(=O)c1ccc[n]c1 Amb25692916 [1,0,0,0,0,0|1,0,2]=4 592 B9R1.6 [O-]C(=O)c1cc[n]cc1 Amb22730239 [1,0,0,0,0,0|2,0,1]=4 593 B9R1.6 [O-]C(=O)c1ccc[n]c1 Amb22043320 [1,0,0,0,0,0|2,0,1]=4 594 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22058087 [1,0,0,0,0,0|2,0,1]=4 595 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22411648 [1,0,0,0,0,0|2,0,1]=4 596 B9R1.6 [O-]C(=O)c1cccc[n]1 Amb22734923 [1,0,0,0,0,0|2,0,1]=4 597 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053472 [1,0,0,0,0,0|1,0,1]=3 598 B9R1.6 [O-]C(=O)c1ccccc1 Amb22053705 [1,0,0,0,0,0|1,0,1]=3 599 B9R1.6 [O-]C(=O)c1ccccc1 Amb22167689 [1,0,0,0,0,0|1,0,1]=3 600 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168438 [1,0,0,0,0,0|1,0,1]=3 601 B9R1.6 [O-]C(=O)c1ccccc1 Amb22168439 [1,0,0,0,0,0|1,0,1]=3 602 B9R1.6 [O-]C(=O)c1ccccc1 Amb22351958 [1,0,0,0,0,0|1,0,1]=3 603 B9R1.6 [O-]C(=O)c1ccccc1 Amb22353183 [1,0,0,0,0,0|1,0,1]=3 604 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732264 [1,0,0,0,0,0|1,0,1]=3 605 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732273 [1,0,0,0,0,0|1,0,1]=3 606 B9R1.6 [O-]C(=O)c1ccccc1 Amb22732500 [1,0,0,0,0,0|1,0,1]=3 607 B9R1.6 [O-]C(=O)c1ccccc1 Amb22734002 [1,0,0,0,0,0|1,0,1]=3 608 B9R1.6 [O-]P(=O)c1ccccc1 Amb21618955 [1,0,0,0,0,0|2,0,0]=3 609 B9R1.6 [O-]S(=O)c1cccc[n]1 Amb22751253 [1,0,0,0,0,0|3,0,0]=4 610 B9R1.6 [O-]S(=O)c1ccccc1 Amb10790483 [1,0,0,0,0,0|2,0,0]=3 611 B9R1.6 [O-]S(=O)c1ccccc1 Amb22043426 [1,0,0,0,0,0|2,0,0]=3 612 B9R1.6 [O-]S(=O)c1ccccc1 Amb22053867 [1,0,0,0,0,0|2,0,0]=3 613 B9R1.6 [O-]S(=O)c1ccccc1 Amb22352998 [1,0,0,0,0,0|2,0,0]=3 614 B9R1.6 [O-][15N+](=O)c1ccccc1 Amb22351461 [1,0,0,0,0,0|2,0,0]=3 615 B9R1.6 [O-][N+](=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351475 [1,0,0,0,0,0|2,0,0]=3 616 B9R1.6 [O-][N+](=O)[n+]1ccccc1 Amb10552465 [1,0,0,0,0,0|3,0,0]=4 617 B9R1.6 [O-][N+](=O)c1ccccc1 Amb24061309 [1,0,0,0,0,0|2,0,0]=3 618 B9R1.6 [O-][P](=O)c1ccccc1 Amb22731674 [1,0,0,0,0,0|2,0,0]=3 619 B9R1.6 [S-]C(=O)c1ccccc1 Amb10555187 [1,0,0,0,0,0|1,0,1]=3 620 B9R1.8 BOCc1cccc[n]1 Amb24406683 [1,0,0,0,0,0|3,0,0]=4 621 B9R1.8 BrC#Cc1ccccc1 Amb16233213 [1,0,0,0,0,0|1,0,2]=4 622 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [1,0,0,0,0,0|2,0,1]=4 623 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [1,0,0,0,0,0|2,0,1]=4 624 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [1,0,0,0,0,0|2,0,1]=4 625 B9R1.8 BrCCc1ccccn1 Amb1102303 [1,0,0,0,0,0|2,0,1]=4 626 B9R1.8 BrCCc1ccccn1 Amb17935743 [1,0,0,0,0,0|2,0,1]=4 627 B9R1.8 BrCNc1ccccc1 Amb25758335 [1,0,0,0,0,0|2,0,1]=4 628 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [1,0,0,0,0,0|2,0,0]=3 629 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [1,0,0,0,0,0|2,0,0]=3 630 B9R1.8 Br\C=C/c1c[n]ccc1 Amb24085678 [1,0,0,0,0,0|2,0,1]=4 631 B9R1.8 Br\C=C/c1cc[n]cc1 Amb25074029 [1,0,0,0,0,0|2,0,1]=4 632 B9R1.8 Br\C=C/c1cccc[n]1 Amb25200984 [1,0,0,0,0,0|2,0,1]=4 633 B9R1.8 Br\C=C/c1ccccc1 Amb24117456 [1,0,0,0,0,0|1,0,1]=3 634 B9R1.8 Br\C=C\c1c[n]ccc1 Amb24085662 [1,0,0,0,0,0|2,0,1]=4 635 B9R1.8 Br\C=C\c1cccc[n]1 Amb24546348 [1,0,0,0,0,0|2,0,1]=4 636 B9R1.8 C#CC[n+]1ccccc1 Amb2227878 [1,0,0,0,0,0|2,0,1]=4 637 B9R1.8 C#CCc1cc[n]cc1 Amb24478677 [1,0,0,0,0,0|2,0,1]=4 638 B9R1.8 C#CCc1cccc[n]1 Amb25759001 [1,0,0,0,0,0|2,0,1]=4 639 B9R1.8 C#CSc1ccccc1 Amb17940373 [1,0,0,0,0,0|2,0,1]=4 640 B9R1.8 C#C[I+]c1ccccc1 Amb19883870 [1,0,0,0,0,0|2,0,1]=4 641 B9R1.8 C=CC[n+]1ccccc1 Amb10554482 [1,0,0,0,0,0|2,0,0]=3 642 B9R1.8 C=CC[n+]1ccccc1 Amb10573243 [1,0,0,0,0,0|2,0,0]=3 643 B9R1.8 C=CCc1c[n]cc[n]1 Amb24365743 [1,0,0,0,0,0|3,0,0]=4 644 B9R1.8 C=CCc1c[n]ccc1 Amb24477831 [1,0,0,0,0,0|2,0,0]=3 645 B9R1.8 C=CCc1cc[n]c[n]1 Amb24091172 [1,0,0,0,0,0|3,0,0]=4 646 B9R1.8 C=CNc1ccccc1 Amb24476658 [1,0,0,0,0,0|2,0,0]=3 647 B9R1.8 C=COc1c[n]ccc1 Amb24085952 [1,0,0,0,0,0|3,0,0]=4 648 B9R1.8 C=COc1cc[n]cc1 Amb24091446 [1,0,0,0,0,0|3,0,0]=4 649 B9R1.8 C=COc1ccccc1 Amb10564213 [1,0,0,0,0,0|2,0,0]=3 650 B9R1.8 C=CSc1c[n]ccc1 Amb24102618 [1,0,0,0,0,0|3,0,0]=4 651 B9R1.8 C=CSc1cc[n]cc1 Amb24070689 [1,0,0,0,0,0|3,0,0]=4 652 B9R1.8 C=C\C=C\1/C=CC=CN1 Amb24691445 [1,0,0,0,0,0|2,0,1]=4 653 B9R1.8 C=NCc1c[n]ccc1 Amb24062506 [1,0,0,0,0,0|3,0,0]=4 654 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [1,0,0,0,0,0|2,0,1]=4 655 B9R1.8 CCCc1ccccc1 Amb2447143 [1,0,0,0,0,0|1,0,1]=3 656 B9R1.8 CCNc1ccccc1 Amb22731692 [1,0,0,0,0,0|2,0,1]=4 657 B9R1.8 CNCc1ccccn1 Amb10068750 [1,0,0,0,0,0|3,0,0]=4 658 B9R1.8 CNCc1ccccn1 Amb10576408 [1,0,0,0,0,0|3,0,0]=4 659 B9R1.8 CNCc1cccnc1 Amb10066918 [1,0,0,0,0,0|3,0,0]=4 660 B9R1.8 CNCc1cccnc1 Amb10576409 [1,0,0,0,0,0|3,0,0]=4 661 B9R1.8 CNCc1cccnc1 Amb1648828 [1,0,0,0,0,0|3,0,0]=4 662 B9R1.8 CNCc1ccncc1 Amb10068773 [1,0,0,0,0,0|3,0,0]=4 663 B9R1.8 CNCc1ccncc1 Amb10576211 [1,0,0,0,0,0|3,0,0]=4 664 B9R1.8 CNCc1ccncc1 Amb1115812 [1,0,0,0,0,0|3,0,0]=4 665 B9R1.8 CNNc1ccccc1 Amb20242875 [1,0,0,0,0,0|3,0,0]=4 666 B9R1.8 CNSc1ccccc1 Amb25811332 [1,0,0,0,0,0|3,0,0]=4 667 B9R1.8 COC[n+]1ccccc1 Amb25309455 [1,0,0,0,0,0|3,0,0]=4 668 B9R1.8 COCc1c[n]ccc1 Amb24106446 [1,0,0,0,0,0|3,0,0]=4 669 B9R1.8 COCc1cc[n]cc1 Amb24075931 [1,0,0,0,0,0|3,0,0]=4 670 B9R1.8 COPc1ccccc1 Amb22729661 [1,0,0,0,0,0|3,0,0]=4 671 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [1,0,0,0,0,0|3,0,0]=4 672 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [1,0,0,0,0,0|2,0,0]=3 673 B9R1.8 C\C=C/c1c[n]ccc1 Amb25147168 [1,0,0,0,0,0|2,0,1]=4 674 B9R1.8 C\C=C/c1cc[n]cc1 Amb25064785 [1,0,0,0,0,0|2,0,1]=4 675 B9R1.8 C\C=C\[n+]1ccccc1 Amb22485619 [1,0,0,0,0,0|2,0,1]=4 676 B9R1.8 C\C=C\c1c[n]ccc1 Amb25290985 [1,0,0,0,0,0|2,0,1]=4 677 B9R1.8 C\C=N\c1cccc[n]1 Amb24533295 [1,0,0,0,0,0|3,0,0]=4 678 B9R1.8 ClC#Cc1ccccc1 Amb17670521 [1,0,0,0,0,0|1,0,2]=4 679 B9R1.8 ClC=Pc1ccccc1 Amb24480023 [1,0,0,0,0,0|2,0,0]=3 680 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [1,0,0,0,0,0|2,0,1]=4 681 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [1,0,0,0,0,0|2,0,1]=4 682 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [1,0,0,0,0,0|2,0,1]=4 683 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [1,0,0,0,0,0|2,0,1]=4 684 B9R1.8 ClCCc1ccccn1 Amb1102254 [1,0,0,0,0,0|2,0,1]=4 685 B9R1.8 ClCNc1ccccc1 Amb25836772 [1,0,0,0,0,0|2,0,1]=4 686 B9R1.8 ClCOc1ccccc1 Amb22059503 [1,0,0,0,0,0|2,0,1]=4 687 B9R1.8 ClCPc1ccccc1 Amb25294535 [1,0,0,0,0,0|2,0,1]=4 688 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [1,0,0,0,0,0|1,1,1]=4 689 B9R1.8 ClSSc1ccccc1 Amb25248198 [1,0,0,0,0,0|3,0,0]=4 690 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [1,0,0,0,0,0|2,0,0]=3 691 B9R1.8 Cl[Zn]Cc1cccc[n]1 Amb22000362 [1,0,0,0,0,0|3,0,0]=4 692 B9R1.8 Cl\C=C/c1c[n]ccc1 Amb24085684 [1,0,0,0,0,0|2,0,1]=4 693 B9R1.8 Cl\C=C/c1cc[n]cc1 Amb24103276 [1,0,0,0,0,0|2,0,1]=4 694 B9R1.8 Cl\C=C/c1cccc[n]1 Amb24106765 [1,0,0,0,0,0|2,0,1]=4 695 B9R1.8 Cl\C=C\c1cccc[n]1 Amb24106741 [1,0,0,0,0,0|2,0,1]=4 696 B9R1.8 Cl\C=C\c1ccccc1 Amb10572872 [1,0,0,0,0,0|1,0,1]=3 697 B9R1.8 Cl\C=N\c1ccccc1 Amb24710175 [1,0,0,0,0,0|2,0,0]=3 698 B9R1.8 FC#Cc1ccccc1 Amb25080554 [1,0,0,0,0,0|1,0,2]=4 699 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [1,0,0,0,0,0|2,0,1]=4 700 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [1,0,0,0,0,0|2,0,1]=4 701 B9R1.8 FCCc1cccc[n]1 Amb24070130 [1,0,0,0,0,0|2,0,1]=4 702 B9R1.8 FCOc1ccccc1 Amb24099991 [1,0,0,0,0,0|2,0,1]=4 703 B9R1.8 F\C=C/c1cccc[n]1 Amb24106770 [1,0,0,0,0,0|2,0,1]=4 704 B9R1.8 F\C=C\c1ccccc1 Amb22641699 [1,0,0,0,0,0|1,0,1]=3 705 B9R1.8 ICCc1cccc[n]1 Amb24573930 [1,0,0,0,0,0|2,0,1]=4 706 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [1,0,0,0,0,0|2,0,0]=3 707 B9R1.8 I\C=C\c1c[n]ccc1 Amb24628558 [1,0,0,0,0,0|2,0,1]=4 708 B9R1.8 I\C=C\c1ccccc1 Amb24646418 [1,0,0,0,0,0|1,0,1]=3 709 B9R1.8 N#CC[n+]1ccccc1 Amb10554489 [1,0,0,0,0,0|2,0,1]=4 710 B9R1.8 N#COc1ccccc1 Amb15692860 [1,0,0,0,0,0|2,0,1]=4 711 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [1,0,0,0,0,0|1,0,1]=3 712 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [1,0,0,0,0,0|1,0,1]=3 713 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [1,0,0,0,0,0|1,0,1]=3 714 B9R1.8 N=CNc1cccc[n]1 Amb24073535 [1,0,0,0,0,0|3,0,0]=4 715 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [1,0,0,0,0,0|2,0,1]=4 716 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [1,0,0,0,0,0|2,0,1]=4 717 B9R1.8 NCCc1cccc[n]1 Amb24065228 [1,0,0,0,0,0|2,0,1]=4 718 B9R1.8 NCCc1cccc[n]1 Amb24066975 [1,0,0,0,0,0|2,0,1]=4 719 B9R1.8 NCCc1ccccc1 Amb17772283 [1,0,0,0,0,0|1,0,1]=3 720 B9R1.8 NCCc1ccccc1 Amb17843439 [1,0,0,0,0,0|1,0,1]=3 721 B9R1.8 NCCc1ccccc1 Amb22360716 [1,0,0,0,0,0|1,0,1]=3 722 B9R1.8 NCCc1ccccc1 Amb24325112 [1,0,0,0,0,0|1,0,1]=3 723 B9R1.8 NCCc1ccccc1 Amb24325408 [1,0,0,0,0,0|1,0,1]=3 724 B9R1.8 NCCc1ccccn1 Amb1156071 [1,0,0,0,0,0|2,0,1]=4 725 B9R1.8 NCCc1cccnc1 Amb1134784 [1,0,0,0,0,0|2,0,1]=4 726 B9R1.8 NCCc1cccnc1 Amb16230500 [1,0,0,0,0,0|2,0,1]=4 727 B9R1.8 NCCc1ccncc1 Amb1102164 [1,0,0,0,0,0|2,0,1]=4 728 B9R1.8 NCNc1ccccc1 Amb17117015 [1,0,0,0,0,0|2,0,1]=4 729 B9R1.8 NCOc1ccccc1 Amb25128781 [1,0,0,0,0,0|2,0,1]=4 730 B9R1.8 NCSc1ccccc1 Amb25128061 [1,0,0,0,0,0|2,0,1]=4 731 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [1,0,0,0,0,0|1,0,1]=3 732 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [1,0,0,0,0,0|3,0,0]=4 733 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [1,0,0,0,0,0|3,0,0]=4 734 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [1,0,0,0,0,0|3,0,0]=4 735 B9R1.8 NNCc1cccc[n]1 Amb19893254 [1,0,0,0,0,0|3,0,0]=4 736 B9R1.8 NNCc1ccccc1 Amb1105200 [1,0,0,0,0,0|2,0,0]=3 737 B9R1.8 NNCc1ccccc1 Amb16231890 [1,0,0,0,0,0|2,0,0]=3 738 B9R1.8 NNCc1ccccc1 Amb22492438 [1,0,0,0,0,0|2,0,0]=3 739 B9R1.8 NNCc1ccccn1 Amb1117330 [1,0,0,0,0,0|3,0,0]=4 740 B9R1.8 NNCc1cccnc1 Amb1121062 [1,0,0,0,0,0|3,0,0]=4 741 B9R1.8 NNCc1ccncc1 Amb1118337 [1,0,0,0,0,0|3,0,0]=4 742 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [1,0,0,0,0,0|3,0,0]=4 743 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [1,0,0,0,0,0|3,0,0]=4 744 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [1,0,0,0,0,0|3,0,0]=4 745 B9R1.8 NOCc1cccc[n]1 Amb18642195 [1,0,0,0,0,0|3,0,0]=4 746 B9R1.8 NOCc1ccccc1 Amb1154307 [1,0,0,0,0,0|2,0,0]=3 747 B9R1.8 NOCc1ccccc1 Amb16204809 [1,0,0,0,0,0|2,0,0]=3 748 B9R1.8 NOCc1ccccc1 Amb22489499 [1,0,0,0,0,0|2,0,0]=3 749 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [1,0,0,0,0,0|1,0,1]=3 750 B9R1.8 N\C=C/c1cc[n]cc1 Amb24068867 [1,0,0,0,0,0|2,0,1]=4 751 B9R1.8 N\C=C\c1cc[n]cc1 Amb24749618 [1,0,0,0,0,0|2,0,1]=4 752 B9R1.8 N\C=C\c1cccc[n]1 Amb24518526 [1,0,0,0,0,0|2,0,1]=4 753 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [1,0,0,0,0,0|2,0,0]=3 754 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [1,0,0,0,0,0|2,0,1]=4 755 B9R1.8 O=C=Cc1cc[n]cc1 Amb24100723 [1,0,0,0,0,0|1,0,2]=4 756 B9R1.8 O=C=Cc1cccc[n]1 Amb24070207 [1,0,0,0,0,0|1,0,2]=4 757 B9R1.8 O=C=Cc1ccccc1 Amb25348365 [1,0,0,0,0,0|0,0,2]=3 758 B9R1.8 O=C=Nc1ccccc1 Amb22336344 [1,0,0,0,0,0|1,0,1]=3 759 B9R1.8 O=CCc1[n]ccc[n]1 Amb24061341 [1,0,0,0,0,0|2,0,0]=3 760 B9R1.8 O=CCc1c[n]c[n]c1 Amb24634482 [1,0,0,0,0,0|2,0,0]=3 761 B9R1.8 O=CCc1c[n]cc[n]1 Amb25124492 [1,0,0,0,0,0|2,0,0]=3 762 B9R1.8 O=CCc1cc[n]c[n]1 Amb24099612 [1,0,0,0,0,0|2,0,0]=3 763 B9R1.8 O=CCc1ccc[n][n]1 Amb24682971 [1,0,0,0,0,0|2,0,0]=3 764 B9R1.8 O=CCc1ccccn1 Amb17089528 [1,0,0,0,0,0|1,0,0]=2 765 B9R1.8 O=CCc1ccncc1 Amb17089529 [1,0,0,0,0,0|1,0,0]=2 766 B9R1.8 O=CNc1c[n]c[n]c1 Amb24095248 [1,0,0,0,0,0|3,0,0]=4 767 B9R1.8 O=CNc1c[n]cc[n]1 Amb24698276 [1,0,0,0,0,0|3,0,0]=4 768 B9R1.8 O=COc1c[n]ccc1 Amb25299157 [1,0,0,0,0,0|2,0,0]=3 769 B9R1.8 O=COc1ccccc1 Amb22002710 [1,0,0,0,0,0|1,0,0]=2 770 B9R1.8 O=C\C=C/1\C=CC=CN1 Amb24068319 [1,0,0,0,0,0|1,0,1]=3 771 B9R1.8 O=C\C=C/1\C=CNC=N1 Amb24068339 [1,0,0,0,0,0|2,0,1]=4 772 B9R1.8 O=C\C=C\1/C=CC=NN1 Amb24596682 [1,0,0,0,0,0|2,0,1]=4 773 B9R1.8 O=C\C=C\1/NC=CC=N1 Amb24100373 [1,0,0,0,0,0|2,0,1]=4 774 B9R1.8 O=S=Nc1cc[n]cc1 Amb25147155 [1,0,0,0,0,0|3,0,0]=4 775 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [1,0,0,0,0,0|1,0,2]=4 776 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [1,0,0,0,0,0|1,0,2]=4 777 B9R1.8 OCOc1ccccc1 Amb25847006 [1,0,0,0,0,0|1,0,2]=4 778 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [1,0,0,0,0,0|2,0,1]=4 779 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [1,0,0,0,0,0|2,0,1]=4 780 B9R1.8 ONCc1ccccc1 Amb22001943 [1,0,0,0,0,0|1,0,1]=3 781 B9R1.8 O\N=C\c1ccccc1 Amb2223191 [1,0,0,0,0,0|1,0,2]=4 782 B9R1.8 S=C=Cc1ccccc1 Amb24084687 [1,0,0,0,0,0|0,1,2]=4 783 B9R1.8 S=C=Nc1ccccc1 Amb1161696 [1,0,0,0,0,0|1,1,1]=4 784 B9R1.8 S=CNc1cccc[n]1 Amb25785094 [1,0,0,0,0,0|2,1,0]=4 785 B9R1.8 S=CNc1ccccc1 Amb25788857 [1,0,0,0,0,0|1,1,0]=3 786 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [1,0,0,0,0,0|1,1,1]=4 787 B9R1.8 SCCc1ccccn1 Amb17619707 [1,0,0,0,0,0|1,1,1]=4 788 B9R1.8 SCCc1ccncc1 Amb10552830 [1,0,0,0,0,0|1,1,1]=4 789 B9R1.8 [2H]C#Cc1ccccc1 Amb22351662 [1,0,0,0,0,0|1,0,2]=4 790 B9R1.8 [2H]\C=C/c1ccccc1 Amb22338396 [1,0,0,0,0,0|1,0,1]=3 791 B9R1.8 [2H]\C=C\c1ccccc1 Amb22351848 [1,0,0,0,0,0|1,0,1]=3 792 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [1,0,0,0,0,0|2,0,0]=3 793 B9R1.8 [C-]#[N+]Cc1ccccn1 Amb1981098 [1,0,0,0,0,0|3,0,0]=4 794 B9R1.8 [C-]#[N+]Cc1cccnc1 Amb1981058 [1,0,0,0,0,0|3,0,0]=4 795 B9R1.8 [C-]#[N+]Cc1ccncc1 Amb1981059 [1,0,0,0,0,0|3,0,0]=4 796 B9R1.8 [CH2-]\C=C\c1ccccc1 Amb22748801 [1,0,0,0,0,0|1,0,1]=3 797 B9R1.8 [Cu]C#Cc1ccccc1 Amb2480676 [1,0,0,0,0,0|1,0,2]=4 798 B9R1.8 [Li]C#Cc1ccccc1 Amb22336681 [1,0,0,0,0,0|1,0,2]=4 799 B9R1.8 [N-]=[N+]=Cc1ccccc1 Amb15692850 [1,0,0,0,0,0|2,0,1]=4 800 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [1,0,0,0,0,0|2,0,1]=4 801 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [1,0,0,0,0,0|1,0,1]=3 802 B11R1.7 BrCC(c1ccccc1)(C)C Amb17140754 [0,1,0,0,0,0|1,0,1]=3 803 B11R1.7 BrCC(c1ccccc1)(F)F Amb10839191 [0,1,0,0,0,0|2,0,1]=4 804 B11R1.7 C#CC(c1ccccc1)(O)C Amb1088912 [0,1,0,0,0,0|1,0,1]=3 805 B11R1.7 C#CC(c1ccccn1)(O)C Amb1094110 [0,1,0,0,0,0|2,0,1]=4 806 B11R1.7 C#CC(c1cccnc1)(O)C Amb1080934 [0,1,0,0,0,0|2,0,1]=4 807 B11R1.7 C#CC(c1ccncc1)(O)C Amb1094112 [0,1,0,0,0,0|2,0,1]=4 808 B11R1.7 C=C[Si](Cl)(Cl)c1ccccc1 Amb19894016 [0,1,0,0,0,0|2,1,0]=4 809 B11R1.7 CC(C)(C#C)c1ccccc1 Amb24106606 [0,1,0,0,0,0|1,0,1]=3 810 B11R1.7 CC(C)(C#N)c1c[n]ccc1 Amb25104614 [0,1,0,0,0,0|2,0,1]=4 811 B11R1.7 CC(C)(C=C)c1ccccc1 Amb24476101 [0,1,0,0,0,0|1,0,0]=2 812 B11R1.7 CC(C)(C=O)c1c[n]ccc1 Amb24084633 [0,1,0,0,0,0|1,0,0]=2 813 B11R1.7 CC(C)(CCl)c1cc[n]cc1 Amb24102653 [0,1,0,0,0,0|2,0,1]=4 814 B11R1.7 CC(C)(CCl)c1cccc[n]1 Amb24523051 [0,1,0,0,0,0|2,0,1]=4 815 B11R1.7 CC(C)(CN)c1ccncc1 Amb17748503 [0,1,0,0,0,0|2,0,1]=4 816 B11R1.7 CC(C)(CO)c1cc[n]cc1 Amb22372285 [0,1,0,0,0,0|1,0,2]=4 817 B11R1.7 CC(C)(N=C)c1cccc[n]1 Amb25032428 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.7 CC(C)(NN)c1ccccc1 Amb18644446 [0,1,0,0,0,0|2,0,0]=3 819 B11R1.7 CC(C)(NO)c1ccccc1 Amb25786374 [0,1,0,0,0,0|1,0,1]=3 820 B11R1.7 CC(Cl)(C#N)c1ccccc1 Amb18126433 [0,1,0,0,0,0|1,0,1]=3 821 B11R1.7 CC(Cl)(C=O)c1ccccc1 Amb18126588 [0,1,0,0,0,0|0,0,0]=1 822 B11R1.7 CC(Cl)(CN)c1ccccc1 Amb22360715 [0,1,0,0,0,0|1,0,1]=3 823 B11R1.7 CC(F)(C#N)c1cccc[n]1 Amb22546818 [0,1,0,0,0,0|2,0,1]=4 824 B11R1.7 CC(F)(C#N)c1ccccc1 Amb22546815 [0,1,0,0,0,0|1,0,1]=3 825 B11R1.7 CC(F)(CBr)c1ccccc1 Amb24064673 [0,1,0,0,0,0|1,0,1]=3 826 B11R1.7 CC(F)(CO)c1ccccc1 Amb24592102 [0,1,0,0,0,0|0,0,2]=3 827 B11R1.7 CC(N)(C#C)c1ccccc1 Amb24432861 [0,1,0,0,0,0|1,0,1]=3 828 B11R1.7 CC(N)(C=C)c1c[n]cc[n]1 Amb25126024 [0,1,0,0,0,0|3,0,0]=4 829 B11R1.7 CC(N)(C=C)c1cc[n]cc1 Amb24454629 [0,1,0,0,0,0|2,0,0]=3 830 B11R1.7 CC(N)(C=C)c1cccc[n]1 Amb25281610 [0,1,0,0,0,0|2,0,0]=3 831 B11R1.7 CC(N)(C=C)c1ccccc1 Amb18124851 [0,1,0,0,0,0|1,0,0]=2 832 B11R1.7 CC(N)(CN)c1cc[n]cc1 Amb23538716 [0,1,0,0,0,0|2,0,1]=4 833 B11R1.7 CC(N)(CN)c1ccccc1 Amb18286210 [0,1,0,0,0,0|1,0,1]=3 834 B11R1.7 CC(N)(CO)c1c[n]ccc1 Amb18951182 [0,1,0,0,0,0|1,0,2]=4 835 B11R1.7 CC(N)(CO)c1cc[n]cc1 Amb18281689 [0,1,0,0,0,0|1,0,2]=4 836 B11R1.7 CC(N)(CO)c1cccc[n]1 Amb18951181 [0,1,0,0,0,0|1,0,2]=4 837 B11R1.7 CC(N)(CS)c1ccccc1 Amb25049325 [0,1,0,0,0,0|0,1,1]=3 838 B11R1.7 CC(O)(C#N)c1cccc[n]1 Amb24084343 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.7 CC(O)(C=O)c1c[n]cc[n]1 Amb24391750 [0,1,0,0,0,0|2,0,0]=3 840 B11R1.7 CC(O)(CCl)c1cc[n]cc1 Amb24487912 [0,1,0,0,0,0|2,0,1]=4 841 B11R1.7 CC(O)(CCl)c1ccccc1 Amb25053941 [0,1,0,0,0,0|1,0,1]=3 842 B11R1.7 CC(O)(CN)c1c[n]ccc1 Amb18062788 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.7 CC(O)(CN)c1cc[n]cc1 Amb18562952 [0,1,0,0,0,0|2,0,1]=4 844 B11R1.7 CC(O)(CN)c1cccc[n]1 Amb18064991 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.7 CCC(C)(C)c1cccc[n]1 Amb24742288 [0,1,0,0,0,0|2,0,1]=4 846 B11R1.7 CCC(C)(N)c1c[n]ccc1 Amb18950468 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.7 CCC(F)(F)c1ccccc1 Amb20670157 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.7 CCC(N)(O)c1ccccc1 Amb24756540 [0,1,0,0,0,0|2,0,1]=4 849 B11R1.7 CC[C@@](C)(N)c1c[n]ccc1 Amb24472245 [0,1,0,0,0,0|2,0,1]=4 850 B11R1.7 CC[C@@](C)(N)c1cccc[n]1 Amb24637758 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.7 CC[C@](C)(N)c1c[n]ccc1 Amb24447529 [0,1,0,0,0,0|2,0,1]=4 852 B11R1.7 CC[C@](C)(N)c1cccc[n]1 Amb24486026 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.7 CN=[S@@](C)(=O)c1ccccc1 Amb22800519 [0,1,0,0,0,0|3,0,0]=4 854 B11R1.7 CNS(C)(=O)c1ccccc1 Amb17836794 [0,1,0,0,0,0|3,0,0]=4 855 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [0,1,0,0,0,0|3,0,0]=4 856 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [0,1,0,0,0,0|2,1,0]=4 857 B11R1.7 CP(=O)(CO)c1ccccc1 Amb24675382 [0,1,0,0,0,0|1,0,2]=4 858 B11R1.7 CP(=O)(NN)c1ccccc1 Amb24606114 [0,1,0,0,0,0|3,0,0]=4 859 B11R1.7 CSC(C)(C)c1ccccc1 Amb24752047 [0,1,0,0,0,0|2,0,0]=3 860 B11R1.7 C[C@@](F)(CO)c1ccccc1 Amb25800819 [0,1,0,0,0,0|0,0,2]=3 861 B11R1.7 C[C@@](N)(C=C)c1c[n]ccc1 Amb25084942 [0,1,0,0,0,0|2,0,0]=3 862 B11R1.7 C[C@@](N)(CF)c1ccccc1 Amb25151853 [0,1,0,0,0,0|1,0,1]=3 863 B11R1.7 C[C@@](N)(CO)c1ccccc1 Amb25743559 [0,1,0,0,0,0|0,0,2]=3 864 B11R1.7 C[C@](Cl)(C=O)c1ccccc1 Amb24379023 [0,1,0,0,0,0|0,0,0]=1 865 B11R1.7 C[C@](F)(C=O)c1ccccc1 Amb25695327 [0,1,0,0,0,0|0,0,0]=1 866 B11R1.7 C[C@](N)(C#N)c1c[n]ccc1 Amb25028219 [0,1,0,0,0,0|2,0,1]=4 867 B11R1.7 C[C@](N)(C#N)c1cccc[n]1 Amb24539784 [0,1,0,0,0,0|2,0,1]=4 868 B11R1.7 C[C@](N)(C#N)c1ccccc1 Amb25151854 [0,1,0,0,0,0|1,0,1]=3 869 B11R1.7 C[C@](N)(C=C)c1cc[n]cc1 Amb25151808 [0,1,0,0,0,0|2,0,0]=3 870 B11R1.7 C[C@](N)(C=C)c1cccc[n]1 Amb25281725 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.7 C[C@](N)(C=C)c1ccccc1 Amb25140300 [0,1,0,0,0,0|1,0,0]=2 872 B11R1.7 C[C@](N)(CO)c1cc[n]cc1 Amb25840870 [0,1,0,0,0,0|1,0,2]=4 873 B11R1.7 C[C@](N)(CO)c1ccccc1 Amb25119372 [0,1,0,0,0,0|0,0,2]=3 874 B11R1.7 C[C@](O)(CCl)c1ccccc1 Amb24711473 [0,1,0,0,0,0|1,0,1]=3 875 B11R1.7 C[C@](S)(CO)c1ccccc1 Amb25032597 [0,1,0,0,0,0|0,0,2]=3 876 B11R1.7 C[Si](C)(C#C)c1ccccc1 Amb22347902 [0,1,0,0,0,0|1,1,1]=4 877 B11R1.7 C[Si](C)(C=C)c1cccc[n]1 Amb22353731 [0,1,0,0,0,0|2,1,0]=4 878 B11R1.7 C[Si](C)(C=C)c1ccccc1 Amb19894173 [0,1,0,0,0,0|1,1,0]=3 879 B11R1.7 C[Si](C)(CBr)c1ccccc1 Amb24382689 [0,1,0,0,0,0|1,1,1]=4 880 B11R1.7 C[Si](C)(CO)c1ccccc1 Amb22347007 [0,1,0,0,0,0|0,1,2]=4 881 B11R1.7 C[Si](C)(O[Na])c1ccccc1 Amb22167049 [0,1,0,0,0,0|2,1,0]=4 882 B11R1.7 C[Si](Cl)(C=C)c1ccccc1 Amb19894009 [0,1,0,0,0,0|1,1,0]=3 883 B11R1.7 ClCC(Cl)(Cl)c1ccccc1 Amb24753856 [0,1,0,0,0,0|2,0,1]=4 884 B11R1.7 FC(F)(CCl)c1ccccc1 Amb20670164 [0,1,0,0,0,0|2,0,1]=4 885 B11R1.7 FC(F)(CS)c1ccccc1 Amb24382777 [0,1,0,0,0,0|1,1,1]=4 886 B11R1.7 N#CC(c1ccccc1)(Cl)Cl Amb10070311 [0,1,0,0,0,0|2,0,1]=4 887 B11R1.7 N#CC(c1ccccc1)(Cl)F Amb10841204 [0,1,0,0,0,0|2,0,1]=4 888 B11R1.7 N#CC(c1ccccc1)(F)F Amb2371944 [0,1,0,0,0,0|2,0,1]=4 889 B11R1.7 N#CC(c1ccccc1)(N)C Amb1126393 [0,1,0,0,0,0|1,0,1]=3 890 B11R1.7 N#CC(c1ccccn1)(N)C Amb1137852 [0,1,0,0,0,0|2,0,1]=4 891 B11R1.7 N#CC(c1ccncc1)(N)C Amb1139775 [0,1,0,0,0,0|2,0,1]=4 892 B11R1.7 N#CC(c1ccncc1)(O)C Amb10552958 [0,1,0,0,0,0|2,0,1]=4 893 B11R1.7 NCC(F)(F)c1ccccc1 Amb20247960 [0,1,0,0,0,0|2,0,1]=4 894 B11R1.7 NCC(c1ccccc1)(O)C Amb1993837 [0,1,0,0,0,0|1,0,1]=3 895 B11R1.7 NCC(c1ccccc1)(O)C Amb1993963 [0,1,0,0,0,0|1,0,1]=3 896 B11R1.7 NCC(c1ccccn1)(C)C Amb17106798 [0,1,0,0,0,0|2,0,1]=4 897 B11R1.7 NCC(c1cccnc1)(C)C Amb17106797 [0,1,0,0,0,0|2,0,1]=4 898 B11R1.7 O=CC(Cl)(Cl)c1ccccc1 Amb22447456 [0,1,0,0,0,0|1,0,0]=2 899 B11R1.7 O=CC(F)(F)c1cccc[n]1 Amb24725340 [0,1,0,0,0,0|2,0,0]=3 900 B11R1.7 O=CC(F)(F)c1ccccc1 Amb25758092 [0,1,0,0,0,0|1,0,0]=2 901 B11R1.7 O=CC(c1ccccc1)(C)C Amb17232040 [0,1,0,0,0,0|0,0,0]=1 902 B11R1.7 O=CC(c1ccccc1)(O)C Amb17593726 [0,1,0,0,0,0|0,0,0]=1 903 B11R1.7 OCC(F)(F)c1ccccc1 Amb24105388 [0,1,0,0,0,0|1,0,2]=4 904 B11R1.7 OCC(O)(O)c1ccccc1 Amb25149757 [0,1,0,0,0,0|1,0,2]=4 905 B11R1.7 OCC(c1ccccc1)(N)C Amb13951678 [0,1,0,0,0,0|0,0,2]=3 906 B11R1.7 OC[C@@](F)(Cl)c1ccccc1 Amb25092081 [0,1,0,0,0,0|1,0,2]=4 907 B11R1.7 [2H]C(C)(OC)c1ccccc1 Amb22365991 [0,1,0,0,0,0|2,0,0]=3 908 B11R1.7 [2H]C([2H])(C#N)c1ccccc1 Amb22367258 [0,1,0,0,0,0|2,0,1]=4 909 B11R1.7 [BH3-][P+](C)(CO)c1ccccc1 Amb25846843 [0,1,0,0,0,0|1,0,2]=4 910 B11R1.7 [BH3-][P@@+](C)(CO)c1ccccc1 Amb24363633 [0,1,0,0,0,0|1,0,2]=4 911 B11R1.12 BrC\C(=N/O)\c1ccccc1 Amb1047358 [0,1,0,0,0,0|1,0,2]=4 912 B11R1.12 C#CC(CN)c1ccccc1 Amb25843210 [0,1,0,0,0,0|1,0,1]=3 913 B11R1.12 C=C=C(CN)c1ccccc1 Amb25791349 [0,1,0,0,0,0|1,0,2]=4 914 B11R1.12 C=C=C(CO)c1ccccc1 Amb24362821 [0,1,0,0,0,0|1,0,2]=4 915 B11R1.12 C=CC(C#N)c1ccccc1 Amb21959375 [0,1,0,0,0,0|1,0,1]=3 916 B11R1.12 C=CC(C=O)c1ccccc1 Amb18644268 [0,1,0,0,0,0|0,0,1]=2 917 B11R1.12 C=CC(CBr)c1ccccc1 Amb25258851 [0,1,0,0,0,0|1,0,0]=2 918 B11R1.12 C=CC(CCl)c1ccccc1 Amb24411551 [0,1,0,0,0,0|1,0,0]=2 919 B11R1.12 C=CC(CN)c1ccccc1 Amb18644344 [0,1,0,0,0,0|1,0,0]=2 920 B11R1.12 C=CC(NN)c1c[n]ccc1 Amb24427177 [0,1,0,0,0,0|3,0,0]=4 921 B11R1.12 C=CC(NN)c1cc[n]cc1 Amb24420155 [0,1,0,0,0,0|3,0,0]=4 922 B11R1.12 C=CC(NN)c1ccccc1 Amb25287533 [0,1,0,0,0,0|2,0,0]=3 923 B11R1.12 C=CP(C=C)c1ccccc1 Amb22230595 [0,1,0,0,0,0|2,0,1]=4 924 B11R1.12 C=C[C@@H](CO)c1ccccc1 Amb25694117 [0,1,0,0,0,0|1,0,0]=2 925 B11R1.12 C=C[C@H](CO)c1ccccc1 Amb25711439 [0,1,0,0,0,0|1,0,0]=2 926 B11R1.12 CCC(C#N)c1c[n]ccc1 Amb18124802 [0,1,0,0,0,0|2,0,1]=4 927 B11R1.12 CCC(C=C)c1cc[n]cc1 Amb24102690 [0,1,0,0,0,0|2,0,0]=3 928 B11R1.12 CCC(C=C)c1ccccc1 Amb24485761 [0,1,0,0,0,0|1,0,0]=2 929 B11R1.12 CCC(CN)c1c[n]ccc1 Amb18251338 [0,1,0,0,0,0|2,0,1]=4 930 B11R1.12 CCC(CN)c1cccc[n]1 Amb25785396 [0,1,0,0,0,0|2,0,1]=4 931 B11R1.12 CCC(CO)c1c[n]ccc1 Amb25043708 [0,1,0,0,0,0|1,0,2]=4 932 B11R1.12 CCC(NC)c1cc[n]cc1 Amb18301849 [0,1,0,0,0,0|2,0,1]=4 933 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [0,1,0,0,0,0|1,0,1]=3 934 B11R1.12 CCC(NN)c1c[n]ccc1 Amb24484404 [0,1,0,0,0,0|3,0,0]=4 935 B11R1.12 CCC(NN)c1cc[n]cc1 Amb25324261 [0,1,0,0,0,0|3,0,0]=4 936 B11R1.12 CCC(NO)c1c[n]ccc1 Amb25344867 [0,1,0,0,0,0|2,0,1]=4 937 B11R1.12 CCC(NO)c1cc[n]cc1 Amb25150373 [0,1,0,0,0,0|2,0,1]=4 938 B11R1.12 CCC(SC)c1ccccc1 Amb24484978 [0,1,0,0,0,0|1,0,1]=3 939 B11R1.12 CCC(c1ccccc1)C=O Amb17138422 [0,1,0,0,0,0|0,0,0]=1 940 B11R1.12 CCC(c1ccccc1)CBr Amb17241352 [0,1,0,0,0,0|1,0,1]=3 941 B11R1.12 CCC(c1ccccc1)CN Amb2371100 [0,1,0,0,0,0|1,0,1]=3 942 B11R1.12 CCC(c1ccccc1)NC Amb1116786 [0,1,0,0,0,0|1,0,1]=3 943 B11R1.12 CCC(c1ccccc1)NO Amb10605010 [0,1,0,0,0,0|1,0,1]=3 944 B11R1.12 CCC(c1ccccn1)NC Amb10607918 [0,1,0,0,0,0|2,0,1]=4 945 B11R1.12 CCC(c1cccnc1)NC Amb10607958 [0,1,0,0,0,0|2,0,1]=4 946 B11R1.12 CCN(C#N)c1ccccc1 Amb25759456 [0,1,0,0,0,0|2,0,1]=4 947 B11R1.12 CCN(C=O)c1cc[n]cc1 Amb25330483 [0,1,0,0,0,0|2,0,0]=3 948 B11R1.12 CCN(C=O)c1cccc[n]1 Amb24096603 [0,1,0,0,0,0|2,0,0]=3 949 B11R1.12 CCN(C=O)c1ccccc1 Amb17672982 [0,1,0,0,0,0|1,0,0]=2 950 B11R1.12 CCN(CO)c1ccccc1 Amb20621228 [0,1,0,0,0,0|1,0,2]=4 951 B11R1.12 CCN(c1ccccc1)CC Amb10072363 [0,1,0,0,0,0|2,0,1]=4 952 B11R1.12 CCN(c1ccccc1)N=O Amb17618581 [0,1,0,0,0,0|2,0,0]=3 953 B11R1.12 CCP(CO)c1ccccc1 Amb25822323 [0,1,0,0,0,0|1,0,2]=4 954 B11R1.12 CC[C@@H](CCl)c1ccccc1 Amb25250668 [0,1,0,0,0,0|1,0,1]=3 955 B11R1.12 CC[C@@H](CN)c1ccccc1 Amb22746798 [0,1,0,0,0,0|1,0,1]=3 956 B11R1.12 CC[C@@H](NO)c1c[n]ccc1 Amb24486823 [0,1,0,0,0,0|2,0,1]=4 957 B11R1.12 CC[C@@H](NO)c1cc[n]cc1 Amb24445169 [0,1,0,0,0,0|2,0,1]=4 958 B11R1.12 CC[C@@H](NO)c1ccccc1 Amb25303906 [0,1,0,0,0,0|1,0,1]=3 959 B11R1.12 CC[C@H](C=O)c1ccccc1 Amb25731916 [0,1,0,0,0,0|0,0,0]=1 960 B11R1.12 CC[C@H](CO)c1ccccc1 Amb25684561 [0,1,0,0,0,0|0,0,2]=3 961 B11R1.12 CC[C@H](NO)c1cc[n]cc1 Amb25775891 [0,1,0,0,0,0|2,0,1]=4 962 B11R1.12 CC\C(=C/Cl)\c1ccccc1 Amb24373905 [0,1,0,0,0,0|1,0,1]=3 963 B11R1.12 CC\C(=C\Cl)\c1ccccc1 Amb25227191 [0,1,0,0,0,0|1,0,1]=3 964 B11R1.12 CC\C(=N\N)\c1ccccc1 Amb24396664 [0,1,0,0,0,0|2,0,1]=4 965 B11R1.12 CN=C(NN)c1ccccc1 Amb22447540 [0,1,0,0,0,0|2,0,1]=4 966 B11R1.12 CNC(C#C)c1cc[n]cc1 Amb24367596 [0,1,0,0,0,0|2,0,1]=4 967 B11R1.12 CNC(C#N)c1c[n]ccc1 Amb22551064 [0,1,0,0,0,0|2,0,1]=4 968 B11R1.12 CNC(C=C)c1[n]ccc[n]1 Amb25131975 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.12 CNC(C=C)c1cccc[n]1 Amb25341977 [0,1,0,0,0,0|2,0,0]=3 970 B11R1.12 CNC(C=C)c1ccccc1 Amb18124852 [0,1,0,0,0,0|1,0,0]=2 971 B11R1.12 CNC(CBr)c1ccccc1 Amb25095723 [0,1,0,0,0,0|1,0,1]=3 972 B11R1.12 CNC(CF)c1c[n]ccc1 Amb25270473 [0,1,0,0,0,0|2,0,1]=4 973 B11R1.12 CNC(CF)c1ccccc1 Amb23443830 [0,1,0,0,0,0|1,0,1]=3 974 B11R1.12 CNC(CN)c1c[n]ccc1 Amb18985333 [0,1,0,0,0,0|2,0,1]=4 975 B11R1.12 CNC(CN)c1cc[n]cc1 Amb18065359 [0,1,0,0,0,0|2,0,1]=4 976 B11R1.12 CNC(CO)c1cc[n]cc1 Amb18065364 [0,1,0,0,0,0|1,0,2]=4 977 B11R1.12 CNC(CO)c1cccc[n]1 Amb18065363 [0,1,0,0,0,0|1,0,2]=4 978 B11R1.12 CNC(CO)c1ccccc1 Amb18035932 [0,1,0,0,0,0|0,0,2]=3 979 B11R1.12 CNC(c1ccccc1)C#N Amb17621643 [0,1,0,0,0,0|1,0,1]=3 980 B11R1.12 CNC(c1ccccn1)C#N Amb17043382 [0,1,0,0,0,0|2,0,1]=4 981 B11R1.12 CNC(c1cccnc1)CO Amb17232101 [0,1,0,0,0,0|1,0,2]=4 982 B11R1.12 CNC(c1ccncc1)C#N Amb17043489 [0,1,0,0,0,0|2,0,1]=4 983 B11R1.12 CN[C@@H](CO)c1cccc[n]1 Amb25858487 [0,1,0,0,0,0|1,0,2]=4 984 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb22746483 [0,1,0,0,0,0|0,0,2]=3 985 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb23400921 [0,1,0,0,0,0|0,0,2]=3 986 B11R1.12 CN[C@H](CO)c1c[n]ccc1 Amb24745307 [0,1,0,0,0,0|1,0,2]=4 987 B11R1.12 CN[C@H](CO)c1cc[n]cc1 Amb24376255 [0,1,0,0,0,0|1,0,2]=4 988 B11R1.12 CN\C(=N\O)\c1ccccc1 Amb25293329 [0,1,0,0,0,0|1,0,2]=4 989 B11R1.12 COB(OC)c1ccccc1 Amb24103414 [0,1,0,0,0,0|3,0,0]=4 990 B11R1.12 COC(=C=O)c1c[n]ccc1 Amb24084533 [0,1,0,0,0,0|1,0,2]=4 991 B11R1.12 COC(=C=O)c1cccc[n]1 Amb24084532 [0,1,0,0,0,0|1,0,2]=4 992 B11R1.12 COC(C#C)c1ccccc1 Amb25242698 [0,1,0,0,0,0|1,0,1]=3 993 B11R1.12 COC(C#N)c1cccc[n]1 Amb25151169 [0,1,0,0,0,0|2,0,1]=4 994 B11R1.12 COC(C=C)c1ccccc1 Amb22002227 [0,1,0,0,0,0|1,0,0]=2 995 B11R1.12 COC(C=O)c1c[n]c[n]c1 Amb24738920 [0,1,0,0,0,0|2,0,0]=3 996 B11R1.12 COC(C=O)c1cccc[n]1 Amb25364326 [0,1,0,0,0,0|1,0,0]=2 997 B11R1.12 COC(C=O)c1ccccc1 Amb18125121 [0,1,0,0,0,0|0,0,0]=1 998 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [0,1,0,0,0,0|1,0,1]=3 999 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [0,1,0,0,0,0|1,0,1]=3 1000 B11R1.12 COC(CN)c1c[n]ccc1 Amb18980565 [0,1,0,0,0,0|2,0,1]=4 1001 B11R1.12 COC(CN)c1cc[n]cc1 Amb18980589 [0,1,0,0,0,0|2,0,1]=4 1002 B11R1.12 COC(CN)c1cccc[n]1 Amb18980548 [0,1,0,0,0,0|2,0,1]=4 1003 B11R1.12 COC(OC)c1cc[n]cc1 Amb24487039 [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.12 COC(OC)c1cccc[n]1 Amb25676282 [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.12 CO[C+](OC)c1ccccc1 Amb25369960 [0,1,0,0,0,0|2,0,1]=4 1006 B11R1.12 CO[C@@H](C=O)c1ccccc1 Amb25252891 [0,1,0,0,0,0|0,0,0]=1 1007 B11R1.12 CO[C@@H](CO)c1ccccc1 Amb21617903 [0,1,0,0,0,0|0,0,2]=3 1008 B11R1.12 CO[C@H](CBr)c1ccccc1 Amb24760200 [0,1,0,0,0,0|1,0,1]=3 1009 B11R1.12 CO\C(=C\Cl)\c1ccccc1 Amb24710342 [0,1,0,0,0,0|1,0,1]=3 1010 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [0,1,0,0,0,0|0,0,0]=1 1011 B11R1.12 CSC(CCl)c1ccccc1 Amb25701729 [0,1,0,0,0,0|1,0,1]=3 1012 B11R1.12 CSC(CN)c1c[n]ccc1 Amb18293257 [0,1,0,0,0,0|2,0,1]=4 1013 B11R1.12 CSC(CN)c1cc[n]cc1 Amb18980591 [0,1,0,0,0,0|2,0,1]=4 1014 B11R1.12 CSC(CN)c1cccc[n]1 Amb18293248 [0,1,0,0,0,0|2,0,1]=4 1015 B11R1.12 CSC(CN)c1ccccc1 Amb18979448 [0,1,0,0,0,0|1,0,1]=3 1016 B11R1.12 CSC(CO)c1ccccc1 Amb25854289 [0,1,0,0,0,0|0,0,2]=3 1017 B11R1.12 CS\C(=C\Cl)\c1ccccc1 Amb24511893 [0,1,0,0,0,0|1,0,1]=3 1018 B11R1.12 C\C=C(/C=O)\c1cc[n]cc1 Amb24418258 [0,1,0,0,0,0|1,0,1]=3 1019 B11R1.12 C\C=C(/C=O)\c1ccccc1 Amb18644269 [0,1,0,0,0,0|0,0,1]=2 1020 B11R1.12 C\C=C(/CBr)\c1ccccc1 Amb24356608 [0,1,0,0,0,0|1,0,1]=3 1021 B11R1.12 C\C=C(/CC)\c1cccc[n]1 Amb24101962 [0,1,0,0,0,0|2,0,1]=4 1022 B11R1.12 C\C=C(\C#N)/c1ccccc1 Amb24595488 [0,1,0,0,0,0|1,0,2]=4 1023 B11R1.12 C\C=C(\C=O)/c1cc[n]cc1 Amb24588747 [0,1,0,0,0,0|1,0,1]=3 1024 B11R1.12 C\C=C(\C=O)/c1ccccc1 Amb20242407 [0,1,0,0,0,0|0,0,1]=2 1025 B11R1.12 C\C=C(\CC)/c1cccc[n]1 Amb25152130 [0,1,0,0,0,0|2,0,1]=4 1026 B11R1.12 C\C=C(\CO)/c1ccccc1 Amb25084503 [0,1,0,0,0,0|1,0,1]=3 1027 B11R1.12 C\C=C(\c1ccccc1)/C#N Amb17231965 [0,1,0,0,0,0|1,0,2]=4 1028 B11R1.12 ClCC(CCl)c1ccccc1 Amb25284727 [0,1,0,0,0,0|1,0,1]=3 1029 B11R1.12 ClC\C(=N\O)\c1ccccc1 Amb10569199 [0,1,0,0,0,0|1,0,2]=4 1030 B11R1.12 Cl\C=C(/CCl)\c1ccccc1 Amb24426186 [0,1,0,0,0,0|1,0,1]=3 1031 B11R1.12 Cl\C=C(/c1ccccc1)\C=O Amb17594154 [0,1,0,0,0,0|0,0,2]=3 1032 B11R1.12 N#CC(C=O)c1[n]ccc[n]1 Amb25240008 [0,1,0,0,0,0|2,0,1]=4 1033 B11R1.12 N#CC(C=O)c1c[n]cc[n]1 Amb24725425 [0,1,0,0,0,0|2,0,1]=4 1034 B11R1.12 N#CC(C=O)c1c[n]ccc1 Amb25756954 [0,1,0,0,0,0|1,0,1]=3 1035 B11R1.12 N#CC(C=O)c1cc[n]c[n]1 Amb24099616 [0,1,0,0,0,0|2,0,1]=4 1036 B11R1.12 N#CC(C=O)c1cccc[n]1 Amb18124775 [0,1,0,0,0,0|1,0,1]=3 1037 B11R1.12 N#CC(CCl)c1cc[n]cc1 Amb25305136 [0,1,0,0,0,0|2,0,1]=4 1038 B11R1.12 N#CC(CCl)c1ccccc1 Amb24453755 [0,1,0,0,0,0|1,0,1]=3 1039 B11R1.12 N#CC(CO)c1cc[n]cc1 Amb25304360 [0,1,0,0,0,0|2,0,1]=4 1040 B11R1.12 N#CC(CO)c1cccc[n]1 Amb25229840 [0,1,0,0,0,0|2,0,1]=4 1041 B11R1.12 N#CC(c1ccccc1)C#N Amb10565903 [0,1,0,0,0,0|1,0,2]=4 1042 B11R1.12 N#CN(C=O)c1ccccc1 Amb22729897 [0,1,0,0,0,0|1,0,1]=3 1043 B11R1.12 N#CP(CCl)c1ccccc1 Amb25330201 [0,1,0,0,0,0|2,0,1]=4 1044 B11R1.12 N#C\C(=C/Cl)\c1ccccc1 Amb18645939 [0,1,0,0,0,0|1,0,2]=4 1045 B11R1.12 N#C\C(=C/[O-])\c1ccccc1 Amb19747722 [0,1,0,0,0,0|0,0,3]=4 1046 B11R1.12 N#C\C(=C\O)\c1ccccc1 Amb25052153 [0,1,0,0,0,0|0,0,3]=4 1047 B11R1.12 N#C\C(=C\[O-])\c1ccccc1 Amb22436167 [0,1,0,0,0,0|0,0,3]=4 1048 B11R1.12 N=CC(CO)c1ccccc1 Amb24361896 [0,1,0,0,0,0|1,0,0]=2 1049 B11R1.12 NCC(C#N)c1ccccc1 Amb18251298 [0,1,0,0,0,0|1,0,1]=3 1050 B11R1.12 NCC(CF)c1cccc[n]1 Amb25248780 [0,1,0,0,0,0|2,0,1]=4 1051 B11R1.12 NCC(CN)c1c[n]ccc1 Amb18065357 [0,1,0,0,0,0|2,0,1]=4 1052 B11R1.12 NCC(CN)c1cc[n]cc1 Amb18065358 [0,1,0,0,0,0|2,0,1]=4 1053 B11R1.12 NCC(CN)c1cccc[n]1 Amb18065356 [0,1,0,0,0,0|2,0,1]=4 1054 B11R1.12 NCC(CN)c1ccccc1 Amb18301720 [0,1,0,0,0,0|1,0,1]=3 1055 B11R1.12 NCC(CN)c1ccccc1 Amb22487374 [0,1,0,0,0,0|1,0,1]=3 1056 B11R1.12 NCC(CO)c1c[n]ccc1 Amb18644523 [0,1,0,0,0,0|1,0,2]=4 1057 B11R1.12 NCC(CO)c1cccc[n]1 Amb25265702 [0,1,0,0,0,0|1,0,2]=4 1058 B11R1.12 NCC(c1ccccc1)NC Amb10879686 [0,1,0,0,0,0|1,0,1]=3 1059 B11R1.12 NCC(c1ccccc1)OC Amb10609834 [0,1,0,0,0,0|1,0,1]=3 1060 B11R1.12 NC[C@H](CO)c1ccccc1 Amb22802423 [0,1,0,0,0,0|0,0,2]=3 1061 B11R1.12 NC\C(=C/Br)\c1ccccc1 Amb24401627 [0,1,0,0,0,0|1,0,1]=3 1062 B11R1.12 NC\C(=C\F)\c1ccccc1 Amb24538168 [0,1,0,0,0,0|1,0,1]=3 1063 B11R1.12 NC\C(=N/O)\c1ccccc1 Amb10606191 [0,1,0,0,0,0|1,0,2]=4 1064 B11R1.12 NC\C(=N\O)\c1ccccc1 Amb25368564 [0,1,0,0,0,0|1,0,2]=4 1065 B11R1.12 NNC(c1ccccc1)C#N Amb17399905 [0,1,0,0,0,0|2,0,1]=4 1066 B11R1.12 N\C=C(/C#N)\c1ccccc1 Amb24403322 [0,1,0,0,0,0|1,0,2]=4 1067 B11R1.12 N\C=C(/C=O)\c1ccccc1 Amb24468220 [0,1,0,0,0,0|0,0,2]=3 1068 B11R1.12 N\C=C(\C#N)/c1ccccc1 Amb24536254 [0,1,0,0,0,0|1,0,2]=4 1069 B11R1.12 N\C=C(\C=O)/c1ccccc1 Amb25103676 [0,1,0,0,0,0|0,0,2]=3 1070 B11R1.12 N\N=C(\CO)/c1ccccc1 Amb25032443 [0,1,0,0,0,0|2,0,1]=4 1071 B11R1.12 O=CC(C=O)c1c[n]ccc1 Amb24484725 [0,1,0,0,0,0|1,0,1]=3 1072 B11R1.12 O=CC(C=S)c1ccccc1 Amb25743009 [0,1,0,0,0,0|0,0,1]=2 1073 B11R1.12 O=CC(CF)c1ccccc1 Amb25243376 [0,1,0,0,0,0|0,0,0]=1 1074 B11R1.12 O=CC(c1ccccc1)C#N Amb1902648 [0,1,0,0,0,0|0,0,1]=2 1075 B11R1.12 O=CC(c1ccncc1)C=O Amb2503949 [0,1,0,0,0,0|1,0,1]=3 1076 B11R1.12 O=CN(CCl)c1ccccc1 Amb24619702 [0,1,0,0,0,0|1,0,0]=2 1077 B11R1.12 O=C[C-](C=O)c1cc[n]cc1 Amb24495322 [0,1,0,0,0,0|1,0,2]=4 1078 B11R1.12 O=C[C-]([n+]1ccccc1)C=O Amb1034867 [0,1,0,0,0,0|1,0,2]=4 1079 B11R1.12 O=C\C(=C/Br)\c1ccccc1 Amb25778114 [0,1,0,0,0,0|0,0,2]=3 1080 B11R1.12 O=C\C(=C/S)\c1ccccc1 Amb18126408 [0,1,0,0,0,0|0,0,2]=3 1081 B11R1.12 O=C\C(=C\Br)\c1ccccc1 Amb24634608 [0,1,0,0,0,0|0,0,2]=3 1082 B11R1.12 OCB(CO)c1ccccc1 Amb25149604 [0,1,0,0,0,0|1,0,2]=4 1083 B11R1.12 OCC(CF)c1ccccc1 Amb25149698 [0,1,0,0,0,0|0,0,2]=3 1084 B11R1.12 OCC(NO)c1c[n]ccc1 Amb25344594 [0,1,0,0,0,0|2,0,1]=4 1085 B11R1.12 OCC(NO)c1cc[n]cc1 Amb25801814 [0,1,0,0,0,0|2,0,1]=4 1086 B11R1.12 OCC(SO)c1ccccc1 Amb25740560 [0,1,0,0,0,0|1,0,1]=3 1087 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22231741 [0,1,0,0,0,0|0,0,1]=2 1088 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22232765 [0,1,0,0,0,0|0,0,1]=2 1089 B11R1.12 OCC(c1ccccc1)C#C Amb16185451 [0,1,0,0,0,0|1,0,1]=3 1090 B11R1.12 OCP(CO)c1ccccc1 Amb22733968 [0,1,0,0,0,0|1,0,2]=4 1091 B11R1.12 OC[C@@H](CBr)c1ccccc1 Amb25737363 [0,1,0,0,0,0|0,0,2]=3 1092 B11R1.12 OC[C@@H](NO)c1c[n]ccc1 Amb25704259 [0,1,0,0,0,0|2,0,1]=4 1093 B11R1.12 OC[C@@H](NO)c1cc[n]cc1 Amb24405000 [0,1,0,0,0,0|2,0,1]=4 1094 B11R1.12 OC[C@H](CBr)c1ccccc1 Amb25063645 [0,1,0,0,0,0|0,0,2]=3 1095 B11R1.12 OC[C@H](NO)c1cc[n]cc1 Amb25032385 [0,1,0,0,0,0|2,0,1]=4 1096 B11R1.12 OC[C@H](NO)c1ccccc1 Amb24340402 [0,1,0,0,0,0|1,0,1]=3 1097 B11R1.12 OC[C@H](c1ccccc1)OC Amb10807423 [0,1,0,0,0,0|0,0,2]=3 1098 B11R1.12 OC\C(=C\Cl)\c1ccccc1 Amb25179241 [0,1,0,0,0,0|1,0,1]=3 1099 B11R1.12 OC\C(=N\O)\c1ccccc1 Amb25133838 [0,1,0,0,0,0|1,0,2]=4 1100 B11R1.12 O\C=C(/c1ccccc1)\C#N Amb10069872 [0,1,0,0,0,0|0,0,3]=4 1101 B11R1.12 O\C=C(/c1ccncc1)\C=O Amb1019561 [0,1,0,0,0,0|1,0,2]=4 1102 B11R1.12 O\C=C(\C=O)/c1cccc[n]1 Amb24567220 [0,1,0,0,0,0|1,0,2]=4 1103 B11R1.12 O\C=C(\C=O)/c1ccccc1 Amb25092916 [0,1,0,0,0,0|0,0,2]=3 1104 B11R1.12 O\C=C(\c1ccccc1)/C#N Amb2417622 [0,1,0,0,0,0|0,0,3]=4 1105 B11R1.12 O\C=C(\c1ccccc1)/C=O Amb10576572 [0,1,0,0,0,0|0,0,2]=3 1106 B11R1.12 O\C=C(\c1ccncc1)/C=O Amb1101998 [0,1,0,0,0,0|1,0,2]=4 1107 B11R1.12 O\N=C(\CBr)/c1ccccc1 Amb22489773 [0,1,0,0,0,0|1,0,2]=4 1108 B11R1.12 [BH3-]NC(CO)c1ccccc1 Amb25343642 [0,1,0,0,0,0|2,0,0]=3 1109 B11R1.12 [BH3-]N[C@H](CO)c1ccccc1 Amb25149655 [0,1,0,0,0,0|2,0,0]=3 1110 B11R1.12 [C-]#[N+]C(CF)c1ccccc1 Amb25208024 [0,1,0,0,0,0|2,0,0]=3 1111 B11R1.12 [C-]#[N+]C(CO)c1ccccc1 Amb24475007 [0,1,0,0,0,0|2,0,0]=3 1112 B11R1.12 [C-]#[N+][C@H](CO)c1ccccc1 Amb25831880 [0,1,0,0,0,0|2,0,0]=3 1113 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,1,0,0,0,0|2,0,1]=4 1114 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,1,0,0,0,0|2,0,1]=4 1115 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,1,0,0,0,0|2,0,1]=4 1116 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,1,0,0,0,0|2,0,1]=4 1117 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,1,0,0,0,0|2,0,1]=4 1118 B11R1.16 C=C(N=C=O)c1ccccc1 Amb24740951 [0,1,0,0,0,0|0,0,3]=4 1119 B11R1.16 C=C=CC(=O)c1ccccc1 Amb25053112 [0,1,0,0,0,0|2,0,1]=4 1120 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,1,0,0,0,0|2,0,0]=3 1121 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,1,0,0,0,0|2,0,0]=3 1122 B11R1.16 C=C=C[C@H](O)c1c[n]ccc1 Amb25152161 [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,1,0,0,0,0|2,0,1]=4 1124 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,1,0,0,0,0|2,0,0]=3 1125 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [0,1,0,0,0,0|3,0,0]=4 1129 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,1,0,0,0,0|2,0,0]=3 1130 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [0,1,0,0,0,0|3,0,0]=4 1131 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,1,0,0,0,0|2,0,0]=3 1132 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,1,0,0,0,0|2,0,0]=3 1133 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,1,0,0,0,0|2,0,0]=3 1134 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,1,0,0,0,0|3,0,0]=4 1135 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,1,0,0,0,0|3,0,0]=4 1136 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [0,1,0,0,0,0|3,0,0]=4 1137 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [0,1,0,0,0,0|3,0,0]=4 1138 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,1,0,0,0,0|2,0,0]=3 1139 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,1,0,0,0,0|2,0,0]=3 1140 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,1,0,0,0,0|2,0,0]=3 1141 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [0,1,0,0,0,0|3,0,0]=4 1144 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,1,0,0,0,0|3,0,0]=4 1146 B11R1.16 C=CNC(=O)c1ccccc1 Amb24096819 [0,1,0,0,0,0|2,0,1]=4 1147 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,1,0,0,0,0|2,0,1]=4 1148 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,1,0,0,0,0|2,0,1]=4 1149 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,1,0,0,0,0|2,0,1]=4 1150 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,1,0,0,0,0|2,0,1]=4 1151 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,1,0,0,0,0|1,0,1]=3 1152 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,1,0,0,0,0|1,0,1]=3 1153 B11R1.16 CC(CC#N)c1cc[n]cc1 Amb18124804 [0,1,0,0,0,0|2,0,1]=4 1154 B11R1.16 CC(CC#N)c1cccc[n]1 Amb25073965 [0,1,0,0,0,0|2,0,1]=4 1155 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [0,1,0,0,0,0|2,0,0]=3 1156 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,1,0,0,0,0|1,0,0]=2 1157 B11R1.16 CC(CC=O)c1c[n]cc[n]1 Amb24591956 [0,1,0,0,0,0|2,0,0]=3 1158 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [0,1,0,0,0,0|1,0,0]=2 1159 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [0,1,0,0,0,0|1,0,0]=2 1160 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [0,1,0,0,0,0|2,0,1]=4 1161 B11R1.16 CC(CCN)c1cc[n]cc1 Amb18293553 [0,1,0,0,0,0|2,0,1]=4 1162 B11R1.16 CC(CCN)c1cccc[n]1 Amb18981390 [0,1,0,0,0,0|2,0,1]=4 1163 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,1,0,0,0,0|1,0,1]=3 1164 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,1,0,0,0,0|1,0,2]=4 1165 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [0,1,0,0,0,0|2,0,1]=4 1166 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,1,0,0,0,0|1,0,1]=3 1167 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,1,0,0,0,0|1,0,1]=3 1168 B11R1.16 CC(N=C=O)c1c[n]c[n]c1 Amb24070711 [0,1,0,0,0,0|2,0,1]=4 1169 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,1,0,0,0,0|2,0,0]=3 1170 B11R1.16 CC(NC#N)c1c[n]ccc1 Amb24445387 [0,1,0,0,0,0|2,0,1]=4 1171 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,1,0,0,0,0|0,1,0]=2 1172 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,1,0,0,0,0|1,0,0]=2 1173 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,1,0,0,0,0|1,0,0]=2 1174 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,1,0,0,0,0|0,0,0]=1 1175 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,1,0,0,0,0|0,0,2]=3 1176 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,1,0,0,0,0|1,0,1]=3 1177 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,1,0,0,0,0|1,0,0]=2 1178 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [0,1,0,0,0,0|1,0,0]=2 1179 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,1,0,0,0,0|1,0,1]=3 1180 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [0,1,0,0,0,0|0,0,1]=2 1181 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,1,0,0,0,0|2,0,0]=3 1182 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,1,0,0,0,0|2,0,1]=4 1183 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,1,0,0,0,0|2,0,1]=4 1184 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,1,0,0,0,0|2,0,1]=4 1185 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,1,0,0,0,0|2,0,1]=4 1186 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,1,0,0,0,0|2,0,1]=4 1187 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,1,0,0,0,0|2,0,1]=4 1188 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,1,0,0,0,0|2,0,1]=4 1189 B11R1.16 CCNC(C)c1cc[n]cc1 Amb19515613 [0,1,0,0,0,0|2,0,1]=4 1190 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,1,0,0,0,0|1,0,1]=3 1191 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [0,1,0,0,0,0|2,0,1]=4 1192 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,1,0,0,0,0|1,0,1]=3 1193 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [0,1,0,0,0,0|2,0,1]=4 1194 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,1,0,0,0,0|1,0,1]=3 1195 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,1,0,0,0,0|2,0,1]=4 1196 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [0,1,0,0,0,0|2,0,1]=4 1197 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,1,0,0,0,0|2,0,1]=4 1198 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,1,0,0,0,0|2,0,1]=4 1199 B11R1.16 CN(CC=C)c1cccc[n]1 Amb25072101 [0,1,0,0,0,0|3,0,0]=4 1200 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.16 CN(N=C=O)c1ccccc1 Amb25242708 [0,1,0,0,0,0|1,0,1]=3 1203 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,1,0,0,0,0|1,0,0]=2 1204 B11R1.16 CN(\N=C\N)c1ccccc1 Amb25840394 [0,1,0,0,0,0|2,0,0]=3 1205 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,1,0,0,0,0|2,0,1]=4 1206 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,1,0,0,0,0|1,0,1]=3 1211 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,1,0,0,0,0|2,0,1]=4 1213 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,1,0,0,0,0|1,0,1]=3 1214 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,1,0,0,0,0|2,0,1]=4 1216 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,1,0,0,0,0|3,0,0]=4 1217 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,1,0,0,0,0|0,0,2]=3 1218 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,1,0,0,0,0|1,0,2]=4 1219 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,1,0,0,0,0|1,0,2]=4 1220 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,1,0,0,0,0|1,0,2]=4 1221 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,1,0,0,0,0|1,0,2]=4 1222 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,1,0,0,0,0|1,0,2]=4 1223 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,1,0,0,0,0|1,0,2]=4 1224 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,1,0,0,0,0|1,0,2]=4 1225 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,1,0,0,0,0|1,0,2]=4 1226 B11R1.16 CONC(C)c1cccc[n]1 Amb25793754 [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,1,0,0,0,0|1,0,1]=3 1228 B11R1.16 CO\N=C(\c1ccccc1)/C Amb10572535 [0,1,0,0,0,0|1,0,2]=4 1229 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,1,0,0,0,0|0,1,1]=3 1231 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,1,0,0,0,0|1,1,1]=4 1232 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,1,0,0,0,0|1,1,1]=4 1233 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,1,0,0,0,0|1,1,1]=4 1234 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,1,0,0,0,0|1,0,1]=3 1235 B11R1.16 C[C@@H](N=[N+]=[N-])c1c[n]ccc1 Amb25107225 [0,1,0,0,0,0|3,0,0]=4 1236 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [0,1,0,0,0,0|2,0,0]=3 1237 B11R1.16 C[C@@H](NC#N)c1cccc[n]1 Amb24415395 [0,1,0,0,0,0|2,0,1]=4 1238 B11R1.16 C[C@@H](NC=O)c1c[n]ccc1 Amb24390688 [0,1,0,0,0,0|1,0,0]=2 1239 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,1,0,0,0,0|0,0,0]=1 1240 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,1,0,0,0,0|1,0,1]=3 1241 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,1,0,0,0,0|0,0,2]=3 1242 B11R1.16 C[C@H](N=[N+]=[N-])c1c[n]ccc1 Amb24476074 [0,1,0,0,0,0|3,0,0]=4 1243 B11R1.16 C[C@H](N=[N+]=[N-])c1cccc[n]1 Amb24509550 [0,1,0,0,0,0|3,0,0]=4 1244 B11R1.16 C[C@H](NC=O)c1c[n]ccc1 Amb24709803 [0,1,0,0,0,0|1,0,0]=2 1245 B11R1.16 C[C@H](NC=O)c1cc[n]cc1 Amb25071847 [0,1,0,0,0,0|1,0,0]=2 1246 B11R1.16 C[C@H](NC=O)c1cccc[n]1 Amb25782398 [0,1,0,0,0,0|1,0,0]=2 1247 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,1,0,0,0,0|0,0,0]=1 1248 B11R1.16 C\C(=C/C=O)\c1cc[n]cc1 Amb25735690 [0,1,0,0,0,0|1,0,1]=3 1249 B11R1.16 C\C(=C/C=O)\c1cccc[n]1 Amb18124820 [0,1,0,0,0,0|1,0,1]=3 1250 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,1,0,0,0,0|1,0,1]=3 1251 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,1,0,0,0,0|1,0,1]=3 1252 B11R1.16 C\C(=C/CO)\c1cccc[n]1 Amb24373086 [0,1,0,0,0,0|1,0,2]=4 1253 B11R1.16 C\C(=C\C#N)\c1cc[n]cc1 Amb25265477 [0,1,0,0,0,0|2,0,1]=4 1254 B11R1.16 C\C(=C\C#N)\c1ccc[n]c1 Amb24360312 [0,1,0,0,0,0|2,0,1]=4 1255 B11R1.16 C\C(=C\C#N)\c1cccc[n]1 Amb24623183 [0,1,0,0,0,0|2,0,1]=4 1256 B11R1.16 C\C(=C\C#N)\c1ccccc1 Amb25720664 [0,1,0,0,0,0|1,0,1]=3 1257 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [0,1,0,0,0,0|0,0,1]=2 1258 B11R1.16 C\C(=C\CC)\c1cccc[n]1 Amb24101998 [0,1,0,0,0,0|2,0,1]=4 1259 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,1,0,0,0,0|1,0,1]=3 1260 B11R1.16 C\C(=C\CN)\c1cc[n]cc1 Amb25145811 [0,1,0,0,0,0|2,0,1]=4 1261 B11R1.16 C\C(=C\CN)\c1cccc[n]1 Amb24538112 [0,1,0,0,0,0|2,0,1]=4 1262 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,1,0,0,0,0|1,0,1]=3 1263 B11R1.16 C\C(=C\CO)\c1cccc[n]1 Amb24563551 [0,1,0,0,0,0|1,0,2]=4 1264 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [0,1,0,0,0,0|2,0,1]=4 1265 B11R1.16 C\C(=N\OC)\c1ccccc1 Amb25189562 [0,1,0,0,0,0|1,0,2]=4 1266 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,1,0,0,0,0|2,0,1]=4 1268 B11R1.16 C\C=C\C(C)c1cc[n]cc1 Amb24571960 [0,1,0,0,0,0|2,0,0]=3 1269 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [0,1,0,0,0,0|3,0,0]=4 1271 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,1,0,0,0,0|2,0,0]=3 1272 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,1,0,0,0,0|2,0,0]=3 1273 B11R1.16 C\C=N/C(=O)c1ccccc1 Amb24072877 [0,1,0,0,0,0|2,0,1]=4 1274 B11R1.16 C\C=N\C(=O)c1ccccc1 Amb24563950 [0,1,0,0,0,0|2,0,1]=4 1275 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,1,0,0,0,0|2,0,1]=4 1276 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,1,0,0,0,0|2,0,1]=4 1277 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,1,0,0,0,0|1,0,1]=3 1278 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,1,0,0,0,0|2,0,1]=4 1279 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,1,0,0,0,0|2,0,1]=4 1280 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,1,0,0,0,0|2,0,1]=4 1281 B11R1.16 ClC\C=C(\Br)/c1ccccc1 Amb25777111 [0,1,0,0,0,0|2,0,1]=4 1282 B11R1.16 Cl\C=C\C(=O)c1ccccc1 Amb17594153 [0,1,0,0,0,0|2,0,1]=4 1283 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,1,0,0,0,0|2,0,0]=3 1284 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,1,0,0,0,0|2,0,1]=4 1285 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,1,0,0,0,0|2,0,1]=4 1286 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,1,0,0,0,0|2,0,1]=4 1287 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,1,0,0,0,0|2,0,1]=4 1288 B11R1.16 N#C\C=C(\c1ccccc1)/Br Amb17595559 [0,1,0,0,0,0|2,0,1]=4 1289 B11R1.16 N#C\C=C(\c1ccccc1)/Cl Amb1107219 [0,1,0,0,0,0|2,0,1]=4 1290 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,1,0,0,0,0|2,0,1]=4 1291 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,1,0,0,0,0|2,0,1]=4 1292 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,1,0,0,0,0|2,0,1]=4 1293 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,1,0,0,0,0|1,0,2]=4 1294 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,1,0,0,0,0|2,0,1]=4 1295 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,1,0,0,0,0|2,0,1]=4 1296 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,1,0,0,0,0|2,0,1]=4 1297 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,1,0,0,0,0|2,0,1]=4 1298 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,1,0,0,0,0|2,0,1]=4 1299 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,1,0,0,0,0|2,0,1]=4 1300 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,1,0,0,0,0|2,0,1]=4 1301 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,1,0,0,0,0|2,0,1]=4 1302 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,1,0,0,0,0|2,0,1]=4 1303 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,1,0,0,0,0|2,0,1]=4 1304 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,1,0,0,0,0|2,0,1]=4 1305 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,1,0,0,0,0|2,0,1]=4 1306 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,1,0,0,0,0|2,0,1]=4 1307 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,1,0,0,0,0|2,0,1]=4 1308 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,1,0,0,0,0|1,0,2]=4 1309 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,1,0,0,0,0|1,0,2]=4 1310 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,1,0,0,0,0|1,0,2]=4 1311 B11R1.16 N\C(=C\C=O)\c1ccccc1 Amb24514799 [0,1,0,0,0,0|1,0,1]=3 1312 B11R1.16 N\C=C/C(=O)c1ccccc1 Amb24706769 [0,1,0,0,0,0|2,0,1]=4 1313 B11R1.16 N\C=C\C(=O)c1ccccc1 Amb25730024 [0,1,0,0,0,0|2,0,1]=4 1314 B11R1.16 O=C(C=C=O)c1cccc[n]1 Amb24469990 [0,1,0,0,0,0|2,0,1]=4 1315 B11R1.16 O=C(C=C=O)c1ccccc1 Amb24737519 [0,1,0,0,0,0|1,0,1]=3 1316 B11R1.16 O=C(C=S=O)c1ccccc1 Amb25713057 [0,1,0,0,0,0|1,0,1]=3 1317 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,1,0,0,0,0|1,0,2]=4 1318 B11R1.16 O=C(NC=O)c1c[n]ccc1 Amb24062384 [0,1,0,0,0,0|2,0,1]=4 1319 B11R1.16 O=C(NC=O)c1ccccc1 Amb24096618 [0,1,0,0,0,0|1,0,1]=3 1320 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb22330589 [0,1,0,0,0,0|1,0,1]=3 1321 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb24121236 [0,1,0,0,0,0|1,0,1]=3 1322 B11R1.16 O=C(\C=C/Cl)c1ccccc1 Amb25723188 [0,1,0,0,0,0|2,0,1]=4 1323 B11R1.16 O=C(\C=N\Cl)c1ccccc1 Amb25319928 [0,1,0,0,0,0|2,0,1]=4 1324 B11R1.16 O=C(\N=C\S)c1ccccc1 Amb24485844 [0,1,0,0,0,0|1,1,1]=4 1325 B11R1.16 O=C(c1ccccc1)C=[N+]=[N-] Amb16233231 [0,1,0,0,0,0|2,0,1]=4 1326 B11R1.16 O=C=NS(=O)c1ccccc1 Amb24608566 [0,1,0,0,0,0|2,0,1]=4 1327 B11R1.16 O=CC=C(c1ccccc1)Cl Amb17232626 [0,1,0,0,0,0|1,0,1]=3 1328 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,1,0,0,0,0|1,0,1]=3 1329 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,1,0,0,0,0|1,0,0]=2 1330 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,1,0,0,0,0|1,0,0]=2 1331 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,1,0,0,0,0|2,0,0]=3 1332 B11R1.16 O=CNC(c1ccccn1)C Amb10070157 [0,1,0,0,0,0|1,0,0]=2 1333 B11R1.16 O=CNC(c1cccnc1)C Amb10070156 [0,1,0,0,0,0|1,0,0]=2 1334 B11R1.16 O=CNC(c1ccncc1)C Amb10070155 [0,1,0,0,0,0|1,0,0]=2 1335 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,1,0,0,0,0|1,0,0]=2 1336 B11R1.16 O=C\C=C(/Cl)\c1ccc[n]c1 Amb24378408 [0,1,0,0,0,0|2,0,1]=4 1337 B11R1.16 O=C\C=C(/F)\c1ccccc1 Amb18125100 [0,1,0,0,0,0|1,0,1]=3 1338 B11R1.16 O=C\C=C(/S)\c1ccccc1 Amb18646120 [0,1,0,0,0,0|1,0,1]=3 1339 B11R1.16 O=C\C=C(\Br)/c1ccccc1 Amb25084228 [0,1,0,0,0,0|1,0,1]=3 1340 B11R1.16 O=C\C=C(\Cl)/c1ccc[n]c1 Amb24617722 [0,1,0,0,0,0|2,0,1]=4 1341 B11R1.16 O=C\C=C(\Cl)/c1ccccc1 Amb19884139 [0,1,0,0,0,0|1,0,1]=3 1342 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [0,1,0,0,0,0|0,0,1]=2 1343 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,1,0,0,0,0|1,0,1]=3 1344 B11R1.16 OC(CC=O)c1c[n]c[n]c1 Amb24597490 [0,1,0,0,0,0|3,0,0]=4 1345 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [0,1,0,0,0,0|2,0,0]=3 1346 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,1,0,0,0,0|1,0,0]=2 1347 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,1,0,0,0,0|2,0,1]=4 1348 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,1,0,0,0,0|1,1,1]=4 1349 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,1,0,0,0,0|1,0,2]=4 1350 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [0,1,0,0,0,0|2,0,1]=4 1351 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,1,0,0,0,0|1,0,2]=4 1352 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,1,0,0,0,0|1,0,2]=4 1353 B11R1.16 OC\C=C(\Cl)/c1ccccc1 Amb24748632 [0,1,0,0,0,0|1,0,2]=4 1354 B11R1.16 OC\C=C(\F)/c1ccccc1 Amb24355216 [0,1,0,0,0,0|1,0,2]=4 1355 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,1,0,0,0,0|1,0,2]=4 1356 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,1,0,0,0,0|1,0,2]=4 1357 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [0,1,0,0,0,0|2,0,0]=3 1358 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,1,0,0,0,0|1,0,0]=2 1359 B11R1.16 O\C=C\C(=S)c1ccccc1 Amb24645164 [0,1,0,0,0,0|1,0,2]=4 1360 B11R1.16 O\N=C/C(=O)c1ccccc1 Amb25767720 [0,1,0,0,0,0|1,0,2]=4 1361 B11R1.16 O\N=C\C(O)c1cccc[n]1 Amb25077983 [0,1,0,0,0,0|2,0,1]=4 1362 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,1,0,0,0,0|1,0,1]=3 1363 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,1,0,0,0,0|1,1,1]=4 1364 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [0,1,0,0,0,0|3,0,0]=4 1365 B11R1.16 [O-]/C=C\C(=O)c1ccccc1 Amb17843402 [0,1,0,0,0,0|1,0,2]=4 1366 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,1,0,0,0,0|2,0,1]=4 1367 B11R1.16 [O-]\C=C/C(=O)c1ccccc1 Amb2385893 [0,1,0,0,0,0|1,0,2]=4 1368 B11R1.16 [O-]\C=C\C(=O)c1ccccc1 Amb22360915 [0,1,0,0,0,0|1,0,2]=4 1369 B11R1.22 BrCC(c1ccc(cc1)Br)C Amb17280742 [0,1,0,0,0,0|1,0,1]=3 1370 B11R1.22 BrCC(c1ccc(cc1)Br)O Amb17206111 [0,1,0,0,0,0|2,0,1]=4 1371 B11R1.22 BrCC(c1ccc(cc1)C)C Amb17241353 [0,1,0,0,0,0|1,0,1]=3 1372 B11R1.22 BrCC(c1ccc(cc1)C)O Amb17206106 [0,1,0,0,0,0|2,0,1]=4 1373 B11R1.22 BrCC(c1ccc(cc1)Cl)C Amb17251213 [0,1,0,0,0,0|1,0,1]=3 1374 B11R1.22 BrCC(c1ccc(cc1)Cl)O Amb17206112 [0,1,0,0,0,0|2,0,1]=4 1375 B11R1.22 BrCC(c1ccc(cc1)F)C Amb17242467 [0,1,0,0,0,0|1,0,1]=3 1376 B11R1.22 BrCC(c1ccc(cc1)F)O Amb17206113 [0,1,0,0,0,0|2,0,1]=4 1377 B11R1.22 Brc1ccc(cc1)C(Br)CBr Amb22359843 [0,1,0,0,0,0|2,0,1]=4 1378 B11R1.22 C#CC(N)c1ccc(Br)cc1 Amb23448689 [0,1,0,0,0,0|2,0,1]=4 1379 B11R1.22 C#CC(N)c1ccc(Cl)cc1 Amb23448687 [0,1,0,0,0,0|2,0,1]=4 1380 B11R1.22 C#CC(N)c1ccc(F)cc1 Amb23448688 [0,1,0,0,0,0|2,0,1]=4 1381 B11R1.22 C#CC(N)c1ccc(I)cc1 Amb25063655 [0,1,0,0,0,0|2,0,1]=4 1382 B11R1.22 C#CC(N)c1ccc(O)cc1 Amb23448692 [0,1,0,0,0,0|2,0,1]=4 1383 B11R1.22 C#CC(O)c1ccc(Br)cc1 Amb24742850 [0,1,0,0,0,0|2,0,1]=4 1384 B11R1.22 C#CC(O)c1ccc(F)cc1 Amb24398936 [0,1,0,0,0,0|2,0,1]=4 1385 B11R1.22 C#CC(O)c1ccc(I)cc1 Amb24718833 [0,1,0,0,0,0|2,0,1]=4 1386 B11R1.22 C#CC(O)c1ccc(N)cc1 Amb24551050 [0,1,0,0,0,0|2,0,1]=4 1387 B11R1.22 C#CC(O)c1ccc(O)cc1 Amb24102683 [0,1,0,0,0,0|2,0,1]=4 1388 B11R1.22 C#C[C@@H](N)c1ccc(Cl)cc1 Amb25701576 [0,1,0,0,0,0|2,0,1]=4 1389 B11R1.22 C#C[C@@H](O)c1ccc(Br)cc1 Amb24677231 [0,1,0,0,0,0|2,0,1]=4 1390 B11R1.22 C#C[C@H](N)c1ccc(Br)cc1 Amb24669041 [0,1,0,0,0,0|2,0,1]=4 1391 B11R1.22 C#C[C@H](N)c1ccc(F)cc1 Amb24610399 [0,1,0,0,0,0|2,0,1]=4 1392 B11R1.22 C#C[C@H](O)c1ccc(Br)cc1 Amb25781977 [0,1,0,0,0,0|2,0,1]=4 1393 B11R1.22 C=C(C=O)c1ccc(O)cc1 Amb24484762 [0,1,0,0,0,0|0,0,2]=3 1394 B11R1.22 C=CC(=O)c1ccc(Br)cc1 Amb18066306 [0,1,0,0,0,0|2,0,1]=4 1395 B11R1.22 C=CC(=O)c1ccc(Cl)cc1 Amb18563779 [0,1,0,0,0,0|2,0,1]=4 1396 B11R1.22 C=CC(=O)c1ccc(F)cc1 Amb18065313 [0,1,0,0,0,0|2,0,1]=4 1397 B11R1.22 C=CC(=O)c1ccc(I)cc1 Amb24567537 [0,1,0,0,0,0|2,0,1]=4 1398 B11R1.22 C=CC(=O)c1ccc(O)cc1 Amb24121488 [0,1,0,0,0,0|2,0,1]=4 1399 B11R1.22 C=CC(Cl)c1ccc(F)cc1 Amb24557784 [0,1,0,0,0,0|2,0,0]=3 1400 B11R1.22 C=CC(N)c1ccc(Br)cc1 Amb25040400 [0,1,0,0,0,0|2,0,0]=3 1401 B11R1.22 C=CC(N)c1ccc(Cl)c[n]1 Amb25189099 [0,1,0,0,0,0|3,0,0]=4 1402 B11R1.22 C=CC(N)c1ccc(Cl)cc1 Amb24406555 [0,1,0,0,0,0|2,0,0]=3 1403 B11R1.22 C=CC(N)c1ccc(F)[n]c1 Amb25063821 [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.22 C=CC(N)c1ccc(I)[n]c1 Amb24668852 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.22 C=CC(N)c1ccc(I)c[n]1 Amb25148982 [0,1,0,0,0,0|3,0,0]=4 1406 B11R1.22 C=CC(N)c1ccc(N)c[n]1 Amb24485757 [0,1,0,0,0,0|3,0,0]=4 1407 B11R1.22 C=CC(N)c1ccc(O)cc1 Amb24485760 [0,1,0,0,0,0|2,0,0]=3 1408 B11R1.22 C=CC(N)c1ccc(S)cc1 Amb24411430 [0,1,0,0,0,0|2,0,0]=3 1409 B11R1.22 C=CC(O)c1ccc(Br)c[n]1 Amb25100700 [0,1,0,0,0,0|3,0,0]=4 1410 B11R1.22 C=CC(O)c1ccc(Cl)c[n]1 Amb25740706 [0,1,0,0,0,0|3,0,0]=4 1411 B11R1.22 C=CC(O)c1ccc(O)cc1 Amb18125114 [0,1,0,0,0,0|2,0,0]=3 1412 B11R1.22 C=C[C@@H](N)c1ccc(Br)cc1 Amb24664188 [0,1,0,0,0,0|2,0,0]=3 1413 B11R1.22 C=C[C@@H](N)c1ccc(Cl)cc1 Amb24359603 [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.22 C=C[C@@H](N)c1ccc(F)[n]c1 Amb24538253 [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.22 C=C[C@@H](N)c1ccc(I)[n]c1 Amb25680995 [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.22 C=C[C@@H](N)c1ccc(N)[n]c1 Amb24484470 [0,1,0,0,0,0|3,0,0]=4 1417 B11R1.22 C=C[C@@H](N)c1ccc(N)c[n]1 Amb25791567 [0,1,0,0,0,0|3,0,0]=4 1418 B11R1.22 C=C[C@@H](N)c1ccc(O)cc1 Amb24763811 [0,1,0,0,0,0|2,0,0]=3 1419 B11R1.22 C=C[C@@H](N)c1ccc(S)[n]c1 Amb25152739 [0,1,0,0,0,0|3,0,0]=4 1420 B11R1.22 C=C[C@@H](N)c1ccc(S)cc1 Amb25152819 [0,1,0,0,0,0|2,0,0]=3 1421 B11R1.22 C=C[C@@H](O)c1ccc(Cl)cc1 Amb25188682 [0,1,0,0,0,0|2,0,0]=3 1422 B11R1.22 C=C[C@@H](O)c1ccc(F)cc1 Amb24642863 [0,1,0,0,0,0|2,0,0]=3 1423 B11R1.22 C=C[C@H](N)c1ccc(Br)cc1 Amb24427728 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.22 C=C[C@H](N)c1ccc(Cl)[n]c1 Amb25281385 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.22 C=C[C@H](N)c1ccc(F)[n]c1 Amb25139739 [0,1,0,0,0,0|3,0,0]=4 1426 B11R1.22 C=C[C@H](N)c1ccc(F)cc1 Amb24592593 [0,1,0,0,0,0|2,0,0]=3 1427 B11R1.22 C=C[C@H](N)c1ccc(N)cc1 Amb25853074 [0,1,0,0,0,0|2,0,0]=3 1428 B11R1.22 C=C[C@H](N)c1ccc(O)c[n]1 Amb24585117 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.22 C=C[C@H](N)c1ccc(O)cc1 Amb24504902 [0,1,0,0,0,0|2,0,0]=3 1430 B11R1.22 C=C[C@H](N)c1ccc(S)cc1 Amb24665702 [0,1,0,0,0,0|2,0,0]=3 1431 B11R1.22 C=C[C@H](O)c1ccc(O)cc1 Amb25143379 [0,1,0,0,0,0|2,0,0]=3 1432 B11R1.22 CC(=NO)c1ccc(O)cc1 Amb24324955 [0,1,0,0,0,0|1,0,2]=4 1433 B11R1.22 CC(C#N)c1ccc(Cl)[n]c1 Amb19944616 [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.22 CC(C#N)c1ccc(Cl)c[n]1 Amb25337477 [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.22 CC(C#N)c1ccc(F)c[n]1 Amb24431322 [0,1,0,0,0,0|2,0,1]=4 1436 B11R1.22 CC(C=C)c1ccc(O)cc1 Amb18124918 [0,1,0,0,0,0|1,0,0]=2 1437 B11R1.22 CC(C=O)c1ccc(F)c[n]1 Amb25788282 [0,1,0,0,0,0|1,0,0]=2 1438 B11R1.22 CC(C=O)c1ccc(O)cc1 Amb18125109 [0,1,0,0,0,0|0,0,0]=1 1439 B11R1.22 CC(CC)c1ccc(Br)[n]c1 Amb24320464 [0,1,0,0,0,0|2,0,1]=4 1440 B11R1.22 CC(CC)c1ccc(Cl)[n]c1 Amb24558910 [0,1,0,0,0,0|2,0,1]=4 1441 B11R1.22 CC(CC)c1ccc(N)[n]c1 Amb18831286 [0,1,0,0,0,0|2,0,1]=4 1442 B11R1.22 CC(CCl)c1ccc(I)cc1 Amb25032418 [0,1,0,0,0,0|1,0,1]=3 1443 B11R1.22 CC(CN)c1ccc(Br)cc1 Amb24183885 [0,1,0,0,0,0|1,0,1]=3 1444 B11R1.22 CC(CN)c1ccc(Cl)[n]c1 Amb25187594 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.22 CC(CN)c1ccc(Cl)cc1 Amb22234779 [0,1,0,0,0,0|1,0,1]=3 1446 B11R1.22 CC(CN)c1ccc(F)c[n]1 Amb25151891 [0,1,0,0,0,0|2,0,1]=4 1447 B11R1.22 CC(CN)c1ccc(I)cc1 Amb25092171 [0,1,0,0,0,0|1,0,1]=3 1448 B11R1.22 CC(CN)c1ccc(N)cc1 Amb18251327 [0,1,0,0,0,0|1,0,1]=3 1449 B11R1.22 CC(CN)c1ccc(O)[n]c1 Amb25374046 [0,1,0,0,0,0|2,0,1]=4 1450 B11R1.22 CC(CN)c1ccc(O)cc1 Amb19957319 [0,1,0,0,0,0|1,0,1]=3 1451 B11R1.22 CC(CN)c1ccc(S)cc1 Amb25124018 [0,1,0,0,0,0|1,0,1]=3 1452 B11R1.22 CC(CO)c1ccc(Br)c[n]1 Amb25678479 [0,1,0,0,0,0|1,0,2]=4 1453 B11R1.22 CC(CO)c1ccc(Cl)[n]c1 Amb25201855 [0,1,0,0,0,0|1,0,2]=4 1454 B11R1.22 CC(CO)c1ccc(F)c[n]1 Amb25129979 [0,1,0,0,0,0|1,0,2]=4 1455 B11R1.22 CC(CO)c1ccc(N)cc1 Amb24740868 [0,1,0,0,0,0|0,0,2]=3 1456 B11R1.22 CC(CO)c1ccc(O)cc1 Amb18125400 [0,1,0,0,0,0|0,0,2]=3 1457 B11R1.22 CC(CO)c1ccc(cc1)[*] Amb22045258 [0,1,0,0,0,0|0,0,2]=3 1458 B11R1.22 CC(NN)c1ccc(Br)c[n]1 Amb25703500 [0,1,0,0,0,0|3,0,0]=4 1459 B11R1.22 CC(NN)c1ccc(F)c[n]1 Amb25226426 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.22 CC(NO)c1ccc(F)c[n]1 Amb25847153 [0,1,0,0,0,0|2,0,1]=4 1461 B11R1.22 CC(c1ccc(cc1)Br)C#N Amb17089240 [0,1,0,0,0,0|1,0,1]=3 1462 B11R1.22 CC(c1ccc(cc1)Cl)C#N Amb17089239 [0,1,0,0,0,0|1,0,1]=3 1463 B11R1.22 CC(c1ccc(cc1)Cl)[N+]#[C-] Amb2235817 [0,1,0,0,0,0|2,0,0]=3 1464 B11R1.22 CC(c1ccc(cc1)O)C#N Amb17593672 [0,1,0,0,0,0|1,0,1]=3 1465 B11R1.22 CCC(C)c1ccc(Br)c[n]1 Amb24320381 [0,1,0,0,0,0|2,0,1]=4 1466 B11R1.22 CCC(C)c1ccc(Cl)cc1 Amb25715889 [0,1,0,0,0,0|1,0,1]=3 1467 B11R1.22 CCC(C)c1ccc(N)c[n]1 Amb18831279 [0,1,0,0,0,0|2,0,1]=4 1468 B11R1.22 CCC(C)c1ccc(O)c[n]1 Amb24475935 [0,1,0,0,0,0|2,0,1]=4 1469 B11R1.22 CCC(N)c1ccc(Cl)cc1 Amb22904363 [0,1,0,0,0,0|2,0,1]=4 1470 B11R1.22 CCC(N)c1ccc(F)cc1 Amb21955200 [0,1,0,0,0,0|2,0,1]=4 1471 B11R1.22 CCC(N)c1ccc(I)cc1 Amb24695228 [0,1,0,0,0,0|2,0,1]=4 1472 B11R1.22 CCC(N)c1ccc(N)cc1 Amb24102643 [0,1,0,0,0,0|2,0,1]=4 1473 B11R1.22 CCC(c1ccc(cc1)Br)N Amb1106008 [0,1,0,0,0,0|2,0,1]=4 1474 B11R1.22 CCC(c1ccc(cc1)Br)O Amb1110057 [0,1,0,0,0,0|2,0,1]=4 1475 B11R1.22 CCC(c1ccc(cc1)C)N Amb10778749 [0,1,0,0,0,0|2,0,1]=4 1476 B11R1.22 CCC(c1ccc(cc1)C)O Amb1110039 [0,1,0,0,0,0|2,0,1]=4 1477 B11R1.22 CCC(c1ccc(cc1)Cl)N Amb1995281 [0,1,0,0,0,0|2,0,1]=4 1478 B11R1.22 CCC(c1ccc(cc1)Cl)O Amb1109844 [0,1,0,0,0,0|2,0,1]=4 1479 B11R1.22 CCC(c1ccc(cc1)F)N Amb1108504 [0,1,0,0,0,0|2,0,1]=4 1480 B11R1.22 CCC(c1ccc(cc1)F)O Amb1111265 [0,1,0,0,0,0|2,0,1]=4 1481 B11R1.22 CCC(c1ccc(cc1)O)N Amb1117697 [0,1,0,0,0,0|2,0,1]=4 1482 B11R1.22 CCC(c1ccc(cc1)O)N Amb17622108 [0,1,0,0,0,0|2,0,1]=4 1483 B11R1.22 CCC(c1ccc(cc1)O)O Amb1111179 [0,1,0,0,0,0|2,0,1]=4 1484 B11R1.22 CC[C@@H](C)c1ccc(N)cc1 Amb24103200 [0,1,0,0,0,0|1,0,1]=3 1485 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb23440385 [0,1,0,0,0,0|2,0,1]=4 1486 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22288632 [0,1,0,0,0,0|2,0,1]=4 1487 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22747472 [0,1,0,0,0,0|2,0,1]=4 1488 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb22298536 [0,1,0,0,0,0|2,0,1]=4 1489 B11R1.22 CC[C@@H](N)c1ccc(I)cc1 Amb25364125 [0,1,0,0,0,0|2,0,1]=4 1490 B11R1.22 CC[C@@H](N)c1ccc(O)cc1 Amb25247808 [0,1,0,0,0,0|2,0,1]=4 1491 B11R1.22 CC[C@@H](N)c1ccc(S)cc1 Amb25295395 [0,1,0,0,0,0|2,0,1]=4 1492 B11R1.22 CC[C@@H](O)c1ccc(Br)cc1 Amb20241514 [0,1,0,0,0,0|2,0,1]=4 1493 B11R1.22 CC[C@@H](O)c1ccc(Cl)cc1 Amb20240761 [0,1,0,0,0,0|2,0,1]=4 1494 B11R1.22 CC[C@@H](O)c1ccc(F)cc1 Amb20240757 [0,1,0,0,0,0|2,0,1]=4 1495 B11R1.22 CC[C@@H](O)c1ccc(I)cc1 Amb25204389 [0,1,0,0,0,0|2,0,1]=4 1496 B11R1.22 CC[C@@H](O)c1ccc(O)cc1 Amb25345214 [0,1,0,0,0,0|2,0,1]=4 1497 B11R1.22 CC[C@H](N)c1ccc(Br)cc1 Amb24718653 [0,1,0,0,0,0|2,0,1]=4 1498 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb22288689 [0,1,0,0,0,0|2,0,1]=4 1499 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb25848651 [0,1,0,0,0,0|2,0,1]=4 1500 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb22298579 [0,1,0,0,0,0|2,0,1]=4 1501 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb24477560 [0,1,0,0,0,0|2,0,1]=4 1502 B11R1.22 CC[C@H](N)c1ccc(N)cc1 Amb25368363 [0,1,0,0,0,0|2,0,1]=4 1503 B11R1.22 CC[C@H](N)c1ccc(O)cc1 Amb24758224 [0,1,0,0,0,0|2,0,1]=4 1504 B11R1.22 CC[C@H](O)c1ccc(Cl)cc1 Amb19889432 [0,1,0,0,0,0|2,0,1]=4 1505 B11R1.22 CC[C@H](O)c1ccc(I)cc1 Amb25732463 [0,1,0,0,0,0|2,0,1]=4 1506 B11R1.22 CN(C#N)c1ccc(F)cc1 Amb25304741 [0,1,0,0,0,0|2,0,1]=4 1507 B11R1.22 CN(C=N)c1ccc(O)cc1 Amb24072410 [0,1,0,0,0,0|2,0,0]=3 1508 B11R1.22 CN(C=O)c1ccc(Br)cc1 Amb24444598 [0,1,0,0,0,0|1,0,0]=2 1509 B11R1.22 CN(C=O)c1ccc(Cl)cc1 Amb22731030 [0,1,0,0,0,0|1,0,0]=2 1510 B11R1.22 CN(C=O)c1ccc(F)cc1 Amb24072394 [0,1,0,0,0,0|1,0,0]=2 1511 B11R1.22 CN(CC)c1ccc(Cl)cc1 Amb24066026 [0,1,0,0,0,0|2,0,1]=4 1512 B11R1.22 CN(CC)c1ccc(F)cc1 Amb25163174 [0,1,0,0,0,0|2,0,1]=4 1513 B11R1.22 CN(CC)c1ccc(I)cc1 Amb25681250 [0,1,0,0,0,0|2,0,1]=4 1514 B11R1.22 CN(CO)c1ccc(Cl)cc1 Amb24618646 [0,1,0,0,0,0|1,0,2]=4 1515 B11R1.22 CN(N=O)c1ccc(F)cc1 Amb25113471 [0,1,0,0,0,0|2,0,0]=3 1516 B11R1.22 CN(c1ccc(cc1)O)C#N Amb17593690 [0,1,0,0,0,0|2,0,1]=4 1517 B11R1.22 CNC(C)c1ccc(Cl)[n]c1 Amb24419929 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.22 CNC(C)c1ccc(Cl)c[n]1 Amb25141809 [0,1,0,0,0,0|3,0,0]=4 1519 B11R1.22 CNC(C)c1ccc(Cl)cc1 Amb22587853 [0,1,0,0,0,0|2,0,0]=3 1520 B11R1.22 CNC(C)c1ccc(F)[n]c1 Amb24443751 [0,1,0,0,0,0|3,0,0]=4 1521 B11R1.22 CNC(c1ccc(cc1)Br)C Amb1128441 [0,1,0,0,0,0|2,0,0]=3 1522 B11R1.22 CNC(c1ccc(cc1)C)C Amb1120227 [0,1,0,0,0,0|2,0,0]=3 1523 B11R1.22 CNC(c1ccc(cc1)Cl)C Amb1136258 [0,1,0,0,0,0|2,0,0]=3 1524 B11R1.22 CNC(c1ccc(cc1)F)C Amb2371534 [0,1,0,0,0,0|2,0,0]=3 1525 B11R1.22 CNC(c1ccc(cc1)O)C Amb1118673 [0,1,0,0,0,0|2,0,0]=3 1526 B11R1.22 CN[C@@H](C)c1ccc(Br)c[n]1 Amb25691471 [0,1,0,0,0,0|3,0,0]=4 1527 B11R1.22 CN[C@@H](C)c1ccc(Br)cc1 Amb23440431 [0,1,0,0,0,0|2,0,0]=3 1528 B11R1.22 CN[C@@H](C)c1ccc(Cl)[n]c1 Amb24572867 [0,1,0,0,0,0|3,0,0]=4 1529 B11R1.22 CN[C@@H](C)c1ccc(Cl)c[n]1 Amb25697042 [0,1,0,0,0,0|3,0,0]=4 1530 B11R1.22 CN[C@@H](C)c1ccc(Cl)cc1 Amb24487722 [0,1,0,0,0,0|2,0,0]=3 1531 B11R1.22 CN[C@@H](C)c1ccc(N)[n]c1 Amb25152737 [0,1,0,0,0,0|3,0,0]=4 1532 B11R1.22 CN[C@@H](C)c1ccc(S)cc1 Amb25074093 [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.22 CN[C@@H](c1ccc(cc1)F)C Amb10839225 [0,1,0,0,0,0|2,0,0]=3 1534 B11R1.22 CN[C@H](C)c1ccc(Br)cc1 Amb25055666 [0,1,0,0,0,0|2,0,0]=3 1535 B11R1.22 CN[C@H](C)c1ccc(Cl)c[n]1 Amb24487660 [0,1,0,0,0,0|3,0,0]=4 1536 B11R1.22 CN[C@H](C)c1ccc(Cl)cc1 Amb24657259 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.22 CN[C@H](C)c1ccc(F)c[n]1 Amb24364678 [0,1,0,0,0,0|3,0,0]=4 1538 B11R1.22 CN[C@H](C)c1ccc(N)[n]c1 Amb25839756 [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.22 CN[C@H](C)c1ccc(N)c[n]1 Amb24408910 [0,1,0,0,0,0|3,0,0]=4 1540 B11R1.22 CN[C@H](C)c1ccc(O)[n]c1 Amb25151173 [0,1,0,0,0,0|3,0,0]=4 1541 B11R1.22 CN[C@H](c1ccc(cc1)F)C Amb10841308 [0,1,0,0,0,0|2,0,0]=3 1542 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [0,1,0,0,0,0|2,0,0]=3 1543 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [0,1,0,0,0,0|2,0,0]=3 1545 B11R1.22 COC(C)c1ccc(O)cc1 Amb18644512 [0,1,0,0,0,0|2,0,0]=3 1546 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [0,1,0,0,0,0|2,0,0]=3 1547 B11R1.22 COC(O)c1ccc(O)cc1 Amb25714240 [0,1,0,0,0,0|3,0,0]=4 1548 B11R1.22 CO[C@H](C)c1ccc(Br)cc1 Amb25739065 [0,1,0,0,0,0|2,0,0]=3 1549 B11R1.22 CSC(C)c1ccc(Br)cc1 Amb25145250 [0,1,0,0,0,0|2,0,0]=3 1550 B11R1.22 CSC(C)c1ccc(F)cc1 Amb25848053 [0,1,0,0,0,0|2,0,0]=3 1551 B11R1.22 CSC(C)c1ccc(N)cc1 Amb18282128 [0,1,0,0,0,0|2,0,0]=3 1552 B11R1.22 C[C@@H](C=O)c1ccc(F)cc1 Amb24374733 [0,1,0,0,0,0|0,0,0]=1 1553 B11R1.22 C[C@@H](CN)c1ccc(Cl)cc1 Amb24372884 [0,1,0,0,0,0|1,0,1]=3 1554 B11R1.22 C[C@@H](CO)c1ccc(F)cc1 Amb24068206 [0,1,0,0,0,0|0,0,2]=3 1555 B11R1.22 C[C@@H](NO)c1ccc(Cl)cc1 Amb24543655 [0,1,0,0,0,0|1,0,1]=3 1556 B11R1.22 C[C@@H](NO)c1ccc(O)cc1 Amb25151826 [0,1,0,0,0,0|1,0,1]=3 1557 B11R1.22 C[C@H](C#N)c1ccc(F)cc1 Amb24068261 [0,1,0,0,0,0|1,0,1]=3 1558 B11R1.22 C[C@H](C=O)c1ccc(F)cc1 Amb24486078 [0,1,0,0,0,0|0,0,0]=1 1559 B11R1.22 C[C@H](CN)c1ccc(Br)cc1 Amb25313073 [0,1,0,0,0,0|1,0,1]=3 1560 B11R1.22 C[C@H](CN)c1ccc(Cl)cc1 Amb25360662 [0,1,0,0,0,0|1,0,1]=3 1561 B11R1.22 C[C@H](CN)c1ccc(O)cc1 Amb24486024 [0,1,0,0,0,0|1,0,1]=3 1562 B11R1.22 C[C@H](CO)c1ccc(Cl)cc1 Amb25149776 [0,1,0,0,0,0|0,0,2]=3 1563 B11R1.22 C[C@H](CO)c1ccc(F)cc1 Amb24068260 [0,1,0,0,0,0|0,0,2]=3 1564 B11R1.22 C[C@H](NO)c1ccc(Cl)cc1 Amb25089385 [0,1,0,0,0,0|1,0,1]=3 1565 B11R1.22 C[C@H](NO)c1ccc(F)cc1 Amb24455607 [0,1,0,0,0,0|1,0,1]=3 1566 B11R1.22 C\C(=C/C)\c1ccc(N)cc1 Amb25834627 [0,1,0,0,0,0|1,0,1]=3 1567 B11R1.22 C\C(=C/C)\c1ccc(O)cc1 Amb25807631 [0,1,0,0,0,0|1,0,1]=3 1568 B11R1.22 C\C(=C\C)\c1ccc(N)cc1 Amb24574842 [0,1,0,0,0,0|1,0,1]=3 1569 B11R1.22 C\C(=C\Cl)\c1ccc(Cl)cc1 Amb25760820 [0,1,0,0,0,0|1,0,1]=3 1570 B11R1.22 C\C(=C\O)\c1ccc(Cl)cc1 Amb22499026 [0,1,0,0,0,0|0,0,2]=3 1571 B11R1.22 C\C(=N/N)\c1ccc(O)cc1 Amb24378459 [0,1,0,0,0,0|2,0,1]=4 1572 B11R1.22 C\C(=N\N)\c1ccc(Cl)cc1 Amb25130298 [0,1,0,0,0,0|2,0,1]=4 1573 B11R1.22 C\C(=N\N)\c1ccc(F)cc1 Amb25306186 [0,1,0,0,0,0|2,0,1]=4 1574 B11R1.22 C\C(=N\N)\c1ccc(N)cc1 Amb25687644 [0,1,0,0,0,0|2,0,1]=4 1575 B11R1.22 C\C(=N\O)\c1ccc(Cl)cc1 Amb19767547 [0,1,0,0,0,0|1,0,2]=4 1576 B11R1.22 C\C(=N\O)\c1ccc(F)cc1 Amb22735392 [0,1,0,0,0,0|1,0,2]=4 1577 B11R1.22 C\C=C(/Cl)\c1ccc(O)cc1 Amb25371858 [0,1,0,0,0,0|2,0,1]=4 1578 B11R1.22 C\C=C(/O)\c1ccc(F)cc1 Amb24100278 [0,1,0,0,0,0|2,0,1]=4 1579 B11R1.22 C\C=C(\Cl)/c1ccc(O)cc1 Amb24697857 [0,1,0,0,0,0|2,0,1]=4 1580 B11R1.22 Cc1ccc([n]c1)C(C)CO Amb25357671 [0,1,0,0,0,0|1,0,2]=4 1581 B11R1.22 Cc1ccc([n]c1)C(O)C=C Amb25136432 [0,1,0,0,0,0|3,0,0]=4 1582 B11R1.22 Cc1ccc([n]c1)[C@@H](C)NC Amb25268944 [0,1,0,0,0,0|3,0,0]=4 1583 B11R1.22 Cc1ccc(c[n]1)C(C)NC Amb25740903 [0,1,0,0,0,0|3,0,0]=4 1584 B11R1.22 Cc1ccc(c[n]1)[C@@H](N)C=C Amb24667322 [0,1,0,0,0,0|3,0,0]=4 1585 B11R1.22 Cc1ccc(cc1)C(=O)C=C Amb18063916 [0,1,0,0,0,0|2,0,1]=4 1586 B11R1.22 Cc1ccc(cc1)C(Br)C#N Amb25254161 [0,1,0,0,0,0|2,0,1]=4 1587 B11R1.22 Cc1ccc(cc1)C(Br)CO Amb25857366 [0,1,0,0,0,0|1,0,2]=4 1588 B11R1.22 Cc1ccc(cc1)C(C)CC Amb24064768 [0,1,0,0,0,0|1,0,1]=3 1589 B11R1.22 Cc1ccc(cc1)C(Cl)C#N Amb18788421 [0,1,0,0,0,0|2,0,1]=4 1590 B11R1.22 Cc1ccc(cc1)C(Cl)C=O Amb24557831 [0,1,0,0,0,0|1,0,0]=2 1591 B11R1.22 Cc1ccc(cc1)C(F)C#N Amb25334785 [0,1,0,0,0,0|2,0,1]=4 1592 B11R1.22 Cc1ccc(cc1)C(N)C#C Amb23448686 [0,1,0,0,0,0|2,0,1]=4 1593 B11R1.22 Cc1ccc(cc1)C(N)C#N Amb19114099 [0,1,0,0,0,0|2,0,1]=4 1594 B11R1.22 Cc1ccc(cc1)C(N)C=C Amb24603780 [0,1,0,0,0,0|2,0,0]=3 1595 B11R1.22 Cc1ccc(cc1)C(N)CF Amb25326298 [0,1,0,0,0,0|2,0,1]=4 1596 B11R1.22 Cc1ccc(cc1)C(O)CN Amb20668083 [0,1,0,0,0,0|2,0,1]=4 1597 B11R1.22 Cc1ccc(cc1)C(O)CO Amb18563446 [0,1,0,0,0,0|1,0,2]=4 1598 B11R1.22 Cc1ccc(cc1)N(C)C#N Amb24687585 [0,1,0,0,0,0|2,0,1]=4 1599 B11R1.22 Cc1ccc(cc1)N(C)C=O Amb24323385 [0,1,0,0,0,0|1,0,0]=2 1600 B11R1.22 Cc1ccc(cc1)N(C)CC Amb25189550 [0,1,0,0,0,0|2,0,1]=4 1601 B11R1.22 Cc1ccc(cc1)N(C)CO Amb25792347 [0,1,0,0,0,0|1,0,2]=4 1602 B11R1.22 Cc1ccc(cc1)[C@@H](C)CO Amb25847636 [0,1,0,0,0,0|0,0,2]=3 1603 B11R1.22 Cc1ccc(cc1)[C@@H](C)NO Amb25715423 [0,1,0,0,0,0|1,0,1]=3 1604 B11R1.22 Cc1ccc(cc1)[C@@H](N)CC Amb22288701 [0,1,0,0,0,0|2,0,1]=4 1605 B11R1.22 Cc1ccc(cc1)[C@@H](N)CO Amb22756871 [0,1,0,0,0,0|1,0,2]=4 1606 B11R1.22 Cc1ccc(cc1)[C@@H](O)C=C Amb24700830 [0,1,0,0,0,0|2,0,0]=3 1607 B11R1.22 Cc1ccc(cc1)[C@@H](O)C=O Amb24620161 [0,1,0,0,0,0|1,0,0]=2 1608 B11R1.22 Cc1ccc(cc1)[C@@H](O)CC Amb25289840 [0,1,0,0,0,0|2,0,1]=4 1609 B11R1.22 Cc1ccc(cc1)[C@@H](O)CN Amb24700467 [0,1,0,0,0,0|2,0,1]=4 1610 B11R1.22 Cc1ccc(cc1)[C@@H](O)CO Amb24486772 [0,1,0,0,0,0|1,0,2]=4 1611 B11R1.22 Cc1ccc(cc1)[C@H](Br)C#N Amb25189162 [0,1,0,0,0,0|2,0,1]=4 1612 B11R1.22 Cc1ccc(cc1)[C@H](C)CN Amb24622476 [0,1,0,0,0,0|1,0,1]=3 1613 B11R1.22 Cc1ccc(cc1)[C@H](N)C#N Amb24486976 [0,1,0,0,0,0|2,0,1]=4 1614 B11R1.22 Cc1ccc(cc1)[C@H](N)C=C Amb25145828 [0,1,0,0,0,0|2,0,0]=3 1615 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22284758 [0,1,0,0,0,0|2,0,1]=4 1616 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22288651 [0,1,0,0,0,0|2,0,1]=4 1617 B11R1.22 Cc1ccc(cc1)[C@H](N)CF Amb25121578 [0,1,0,0,0,0|2,0,1]=4 1618 B11R1.22 Cc1ccc(cc1)[C@H](N)CN Amb24674173 [0,1,0,0,0,0|2,0,1]=4 1619 B11R1.22 Cc1ccc(cc1)[C@H](N)CO Amb24453198 [0,1,0,0,0,0|1,0,2]=4 1620 B11R1.22 Cc1ccc(cc1)[C@H](O)C#C Amb25129724 [0,1,0,0,0,0|2,0,1]=4 1621 B11R1.22 Cc1ccc(cc1)[C@H](O)C=O Amb25718968 [0,1,0,0,0,0|1,0,0]=2 1622 B11R1.22 Cc1ccc(cc1)[C@H](O)CBr Amb25276421 [0,1,0,0,0,0|2,0,1]=4 1623 B11R1.22 Cc1ccc(cc1)[C@H](O)CN Amb20241479 [0,1,0,0,0,0|2,0,1]=4 1624 B11R1.22 Cc1ccc(cc1)[C@H](O)CO Amb25140042 [0,1,0,0,0,0|1,0,2]=4 1625 B11R1.22 Cc1ccc(cc1)\C(\N)=C\O Amb24698175 [0,1,0,0,0,0|1,0,2]=4 1626 B11R1.22 ClCC(c1ccc(cc1)Br)C Amb17251214 [0,1,0,0,0,0|1,0,1]=3 1627 B11R1.22 ClCC(c1ccc(cc1)Br)O Amb17196014 [0,1,0,0,0,0|2,0,1]=4 1628 B11R1.22 ClCC(c1ccc(cc1)C)C Amb17232692 [0,1,0,0,0,0|1,0,1]=3 1629 B11R1.22 ClCC(c1ccc(cc1)C)O Amb17194483 [0,1,0,0,0,0|2,0,1]=4 1630 B11R1.22 ClCC(c1ccc(cc1)Cl)C Amb17234620 [0,1,0,0,0,0|1,0,1]=3 1631 B11R1.22 ClCC(c1ccc(cc1)Cl)O Amb17194627 [0,1,0,0,0,0|2,0,1]=4 1632 B11R1.22 ClCC(c1ccc(cc1)F)C Amb17232923 [0,1,0,0,0,0|1,0,1]=3 1633 B11R1.22 ClCC(c1ccc(cc1)F)O Amb17194492 [0,1,0,0,0,0|2,0,1]=4 1634 B11R1.22 ClCC(c1ccc(cc1)O)O Amb17594337 [0,1,0,0,0,0|2,0,1]=4 1635 B11R1.22 ClC[C@@H](c1ccc(cc1)F)O Amb16231704 [0,1,0,0,0,0|2,0,1]=4 1636 B11R1.22 Clc1ccc(cc1)C(Br)CBr Amb22336834 [0,1,0,0,0,0|2,0,1]=4 1637 B11R1.22 Clc1ccc(cc1)C(Cl)CCl Amb24714666 [0,1,0,0,0,0|2,0,1]=4 1638 B11R1.22 FC(CBr)c1ccc(Cl)cc1 Amb22325255 [0,1,0,0,0,0|2,0,1]=4 1639 B11R1.22 FC(CCl)c1ccc(Cl)cc1 Amb24487860 [0,1,0,0,0,0|2,0,1]=4 1640 B11R1.22 FCC(c1ccc(cc1)F)N Amb2372602 [0,1,0,0,0,0|2,0,1]=4 1641 B11R1.22 Fc1ccc(cc1)C(Cl)CF Amb25138804 [0,1,0,0,0,0|2,0,1]=4 1642 B11R1.22 Fc1ccc(cc1)C(F)CBr Amb24053884 [0,1,0,0,0,0|2,0,1]=4 1643 B11R1.22 Fc1ccc(cc1)C(F)CCl Amb24487865 [0,1,0,0,0,0|2,0,1]=4 1644 B11R1.22 Fc1ccc(cc1)\C(\Cl)=C\Cl Amb24740726 [0,1,0,0,0,0|2,0,1]=4 1645 B11R1.22 N#CC(Br)c1ccc(F)cc1 Amb24728347 [0,1,0,0,0,0|2,0,1]=4 1646 B11R1.22 N#CC(Cl)c1ccc(Br)cc1 Amb23596606 [0,1,0,0,0,0|2,0,1]=4 1647 B11R1.22 N#CC(Cl)c1ccc(Cl)cc1 Amb19045949 [0,1,0,0,0,0|2,0,1]=4 1648 B11R1.22 N#CC(Cl)c1ccc(F)cc1 Amb18183573 [0,1,0,0,0,0|2,0,1]=4 1649 B11R1.22 N#CC(F)c1ccc(F)cc1 Amb24095654 [0,1,0,0,0,0|2,0,1]=4 1650 B11R1.22 N#C[C@@H](O)c1ccc(Cl)cc1 Amb24309141 [0,1,0,0,0,0|2,0,1]=4 1651 B11R1.22 N#C[C@@H](O)c1ccc(F)cc1 Amb24068253 [0,1,0,0,0,0|2,0,1]=4 1652 B11R1.22 N#C[C@H](Br)c1ccc(Cl)cc1 Amb24653878 [0,1,0,0,0,0|2,0,1]=4 1653 B11R1.22 N#C[C@H](O)c1ccc(Br)cc1 Amb20241608 [0,1,0,0,0,0|2,0,1]=4 1654 B11R1.22 N#C[C@H](O)c1ccc(F)cc1 Amb24068200 [0,1,0,0,0,0|2,0,1]=4 1655 B11R1.22 NC(=S=O)c1ccc(Cl)cc1 Amb24373813 [0,1,0,0,0,0|2,0,1]=4 1656 B11R1.22 NC(C#N)c1ccc(F)cc1 Amb19895510 [0,1,0,0,0,0|2,0,1]=4 1657 B11R1.22 NC(C#N)c1ccc(I)cc1 Amb25687354 [0,1,0,0,0,0|2,0,1]=4 1658 B11R1.22 NC(CF)c1ccc(Br)cc1 Amb20247218 [0,1,0,0,0,0|2,0,1]=4 1659 B11R1.22 NC(CO)c1ccc(F)cc1 Amb19279201 [0,1,0,0,0,0|1,0,2]=4 1660 B11R1.22 NC(CO)c1ccc(I)cc1 Amb25696543 [0,1,0,0,0,0|1,0,2]=4 1661 B11R1.22 NC(CO)c1ccc(O)cc1 Amb18951204 [0,1,0,0,0,0|1,0,2]=4 1662 B11R1.22 NC(NO)c1ccc(F)cc1 Amb25351640 [0,1,0,0,0,0|2,0,1]=4 1663 B11R1.22 NC(c1ccc(cc1)Br)C#N Amb1127793 [0,1,0,0,0,0|2,0,1]=4 1664 B11R1.22 NC(c1ccc(cc1)C)C#N Amb1135752 [0,1,0,0,0,0|2,0,1]=4 1665 B11R1.22 NC(c1ccc(cc1)Cl)C#N Amb1108637 [0,1,0,0,0,0|2,0,1]=4 1666 B11R1.22 NC(c1ccc(cc1)Cl)C#N Amb13951747 [0,1,0,0,0,0|2,0,1]=4 1667 B11R1.22 NC(c1ccc(cc1)F)C#N Amb1154608 [0,1,0,0,0,0|2,0,1]=4 1668 B11R1.22 NC(c1ccc(cc1)O)C#N Amb1139261 [0,1,0,0,0,0|2,0,1]=4 1669 B11R1.22 NCC(F)c1ccc(Br)cc1 Amb23454846 [0,1,0,0,0,0|2,0,1]=4 1670 B11R1.22 NCC(F)c1ccc(F)cc1 Amb24084159 [0,1,0,0,0,0|2,0,1]=4 1671 B11R1.22 NCC(N)c1ccc(O)cc1 Amb24102625 [0,1,0,0,0,0|2,0,1]=4 1672 B11R1.22 NCC(O)c1ccc(Br)cc1 Amb22234871 [0,1,0,0,0,0|2,0,1]=4 1673 B11R1.22 NCC(O)c1ccc(I)cc1 Amb25098773 [0,1,0,0,0,0|2,0,1]=4 1674 B11R1.22 NCC(c1ccc(cc1)Br)C Amb17087284 [0,1,0,0,0,0|1,0,1]=3 1675 B11R1.22 NCC(c1ccc(cc1)C)O Amb1108558 [0,1,0,0,0,0|2,0,1]=4 1676 B11R1.22 NCC(c1ccc(cc1)Cl)O Amb1108621 [0,1,0,0,0,0|2,0,1]=4 1677 B11R1.22 NCC(c1ccc(cc1)F)C Amb10610291 [0,1,0,0,0,0|1,0,1]=3 1678 B11R1.22 NCC(c1ccc(cc1)F)O Amb10808445 [0,1,0,0,0,0|2,0,1]=4 1679 B11R1.22 NCC(c1ccc(cc1)F)O Amb1108388 [0,1,0,0,0,0|2,0,1]=4 1680 B11R1.22 NCC(c1ccc(cc1)O)O Amb1108209 [0,1,0,0,0,0|2,0,1]=4 1681 B11R1.22 NC[C@@H](N)c1ccc(F)cc1 Amb25145726 [0,1,0,0,0,0|2,0,1]=4 1682 B11R1.22 NC[C@@H](O)c1ccc(Br)cc1 Amb24486093 [0,1,0,0,0,0|2,0,1]=4 1683 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb20241481 [0,1,0,0,0,0|2,0,1]=4 1684 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb24092980 [0,1,0,0,0,0|2,0,1]=4 1685 B11R1.22 NC[C@@H](O)c1ccc(F)cc1 Amb24092981 [0,1,0,0,0,0|2,0,1]=4 1686 B11R1.22 NC[C@@H](O)c1ccc(I)cc1 Amb25058833 [0,1,0,0,0,0|2,0,1]=4 1687 B11R1.22 NC[C@@H](O)c1ccc(O)cc1 Amb25027908 [0,1,0,0,0,0|2,0,1]=4 1688 B11R1.22 NC[C@H](Cl)c1ccc(F)cc1 Amb24629251 [0,1,0,0,0,0|2,0,1]=4 1689 B11R1.22 NC[C@H](N)c1ccc(Br)cc1 Amb25195303 [0,1,0,0,0,0|2,0,1]=4 1690 B11R1.22 NC[C@H](N)c1ccc(Cl)cc1 Amb24357703 [0,1,0,0,0,0|2,0,1]=4 1691 B11R1.22 NC[C@H](N)c1ccc(I)cc1 Amb25738672 [0,1,0,0,0,0|2,0,1]=4 1692 B11R1.22 NC[C@H](N)c1ccc(O)cc1 Amb24411422 [0,1,0,0,0,0|2,0,1]=4 1693 B11R1.22 NNC(c1ccc(cc1)Br)C Amb13951417 [0,1,0,0,0,0|2,0,0]=3 1694 B11R1.22 NNC(c1ccc(cc1)Cl)C Amb13952413 [0,1,0,0,0,0|2,0,0]=3 1695 B11R1.22 NOC(c1ccc(cc1)Br)C Amb17089195 [0,1,0,0,0,0|2,0,0]=3 1696 B11R1.22 NOC(c1ccc(cc1)C)C Amb17089186 [0,1,0,0,0,0|2,0,0]=3 1697 B11R1.22 NOC(c1ccc(cc1)Cl)C Amb17089194 [0,1,0,0,0,0|2,0,0]=3 1698 B11R1.22 NOC(c1ccc(cc1)F)C Amb17089193 [0,1,0,0,0,0|2,0,0]=3 1699 B11R1.22 N[C@@H](CF)c1ccc(Cl)cc1 Amb25687523 [0,1,0,0,0,0|2,0,1]=4 1700 B11R1.22 N[C@@H](CF)c1ccc(I)cc1 Amb25139932 [0,1,0,0,0,0|2,0,1]=4 1701 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb23440363 [0,1,0,0,0,0|1,0,2]=4 1702 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb24469233 [0,1,0,0,0,0|1,0,2]=4 1703 B11R1.22 N[C@@H](CO)c1ccc(Cl)cc1 Amb22756882 [0,1,0,0,0,0|1,0,2]=4 1704 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22745476 [0,1,0,0,0,0|1,0,2]=4 1705 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22746546 [0,1,0,0,0,0|1,0,2]=4 1706 B11R1.22 N[C@@H](CO)c1ccc(O)cc1 Amb24103158 [0,1,0,0,0,0|1,0,2]=4 1707 B11R1.22 N[C@@H](CO)c1ccc(S)cc1 Amb24433405 [0,1,0,0,0,0|1,0,2]=4 1708 B11R1.22 N[C@H](C#N)c1ccc(F)cc1 Amb24729685 [0,1,0,0,0,0|2,0,1]=4 1709 B11R1.22 N[C@H](C#N)c1ccc(I)cc1 Amb25151684 [0,1,0,0,0,0|2,0,1]=4 1710 B11R1.22 N[C@H](C#N)c1ccc(O)cc1 Amb25172769 [0,1,0,0,0,0|2,0,1]=4 1711 B11R1.22 N[C@H](CF)c1ccc(O)cc1 Amb25049371 [0,1,0,0,0,0|2,0,1]=4 1712 B11R1.22 N[C@H](CO)c1ccc(Br)cc1 Amb25844082 [0,1,0,0,0,0|1,0,2]=4 1713 B11R1.22 N[C@H](CO)c1ccc(F)cc1 Amb24569357 [0,1,0,0,0,0|1,0,2]=4 1714 B11R1.22 N[C@H](CO)c1ccc(O)cc1 Amb24103172 [0,1,0,0,0,0|1,0,2]=4 1715 B11R1.22 N\C(=C\O)\c1ccc(Cl)cc1 Amb25149722 [0,1,0,0,0,0|1,0,2]=4 1716 B11R1.22 N\N=C(/c1ccc(cc1)Br)\C Amb10552972 [0,1,0,0,0,0|2,0,1]=4 1717 B11R1.22 Nc1ccc(cc1)C(F)CN Amb24679205 [0,1,0,0,0,0|2,0,1]=4 1718 B11R1.22 Nc1ccc(cc1)C(N)=S=O Amb25761374 [0,1,0,0,0,0|2,0,1]=4 1719 B11R1.22 Nc1ccc(cc1)C(N)CN Amb23556416 [0,1,0,0,0,0|2,0,1]=4 1720 B11R1.22 Nc1ccc(cc1)C(O)C#N Amb24068506 [0,1,0,0,0,0|2,0,1]=4 1721 B11R1.22 Nc1ccc(cc1)C(O)CN Amb25052395 [0,1,0,0,0,0|2,0,1]=4 1722 B11R1.22 Nc1ccc(cc1)C(O)CO Amb18959900 [0,1,0,0,0,0|1,0,2]=4 1723 B11R1.22 Nc1ccc(cc1)[C@@H](N)CN Amb25840302 [0,1,0,0,0,0|2,0,1]=4 1724 B11R1.22 Nc1ccc(cc1)[C@H](N)CN Amb24485780 [0,1,0,0,0,0|2,0,1]=4 1725 B11R1.22 Nc1ccc(cc1)[C@H](N)CO Amb24587066 [0,1,0,0,0,0|1,0,2]=4 1726 B11R1.22 Nc1ccc(cc1)[C@H](O)CO Amb25288972 [0,1,0,0,0,0|1,0,2]=4 1727 B11R1.22 O=C(C=O)c1ccc(F)c[n]1 Amb25272074 [0,1,0,0,0,0|2,0,1]=4 1728 B11R1.22 O=CC(=O)c1ccc(cc1)Br Amb10067934 [0,1,0,0,0,0|1,0,1]=3 1729 B11R1.22 O=CC(=O)c1ccc(cc1)C Amb10067935 [0,1,0,0,0,0|1,0,1]=3 1730 B11R1.22 O=CC(=O)c1ccc(cc1)Cl Amb10067933 [0,1,0,0,0,0|1,0,1]=3 1731 B11R1.22 O=CC(=O)c1ccc(cc1)O Amb10069044 [0,1,0,0,0,0|1,0,1]=3 1732 B11R1.22 O=CC(F)c1ccc(Cl)cc1 Amb24453194 [0,1,0,0,0,0|1,0,0]=2 1733 B11R1.22 O=CC(F)c1ccc(F)cc1 Amb25145864 [0,1,0,0,0,0|1,0,0]=2 1734 B11R1.22 O=CC(c1ccc(cc1)Br)C Amb17140753 [0,1,0,0,0,0|0,0,0]=1 1735 B11R1.22 O=CC(c1ccc(cc1)C)C Amb10844730 [0,1,0,0,0,0|0,0,0]=1 1736 B11R1.22 O=CC(c1ccc(cc1)Cl)C Amb17138645 [0,1,0,0,0,0|0,0,0]=1 1737 B11R1.22 O=CC(c1ccc(cc1)F)C Amb17138438 [0,1,0,0,0,0|0,0,0]=1 1738 B11R1.22 OC(C=O)c1ccc(Cl)cc1 Amb24476083 [0,1,0,0,0,0|1,0,0]=2 1739 B11R1.22 OC(C=O)c1ccc(F)cc1 Amb24632682 [0,1,0,0,0,0|1,0,0]=2 1740 B11R1.22 OC(CBr)c1ccc(I)cc1 Amb24675806 [0,1,0,0,0,0|2,0,1]=4 1741 B11R1.22 OC(CCl)c1ccc(I)cc1 Amb25148100 [0,1,0,0,0,0|2,0,1]=4 1742 B11R1.22 OC(CF)c1ccc(Br)cc1 Amb24654008 [0,1,0,0,0,0|2,0,1]=4 1743 B11R1.22 OC(CF)c1ccc(F)cc1 Amb25682730 [0,1,0,0,0,0|2,0,1]=4 1744 B11R1.22 OC(CI)c1ccc(Br)cc1 Amb25725604 [0,1,0,0,0,0|2,0,1]=4 1745 B11R1.22 OCC(Cl)c1ccc(Cl)cc1 Amb19888410 [0,1,0,0,0,0|1,0,2]=4 1746 B11R1.22 OCC(F)c1ccc(Cl)cc1 Amb24340475 [0,1,0,0,0,0|1,0,2]=4 1747 B11R1.22 OCC(F)c1ccc(F)cc1 Amb24387742 [0,1,0,0,0,0|1,0,2]=4 1748 B11R1.22 OCC(O)c1ccc(Br)cc1 Amb18570007 [0,1,0,0,0,0|1,0,2]=4 1749 B11R1.22 OCC(O)c1ccc(Cl)cc1 Amb18563992 [0,1,0,0,0,0|1,0,2]=4 1750 B11R1.22 OCC(O)c1ccc(F)cc1 Amb18065446 [0,1,0,0,0,0|1,0,2]=4 1751 B11R1.22 OCC(c1ccc(cc1)Br)C Amb17241865 [0,1,0,0,0,0|0,0,2]=3 1752 B11R1.22 OCC(c1ccc(cc1)Br)N Amb17242181 [0,1,0,0,0,0|1,0,2]=4 1753 B11R1.22 OCC(c1ccc(cc1)Br)N Amb2236272 [0,1,0,0,0,0|1,0,2]=4 1754 B11R1.22 OCC(c1ccc(cc1)C)C Amb17232071 [0,1,0,0,0,0|0,0,2]=3 1755 B11R1.22 OCC(c1ccc(cc1)C)N Amb2236213 [0,1,0,0,0,0|1,0,2]=4 1756 B11R1.22 OCC(c1ccc(cc1)Cl)C Amb17232795 [0,1,0,0,0,0|0,0,2]=3 1757 B11R1.22 OCC(c1ccc(cc1)Cl)N Amb17232854 [0,1,0,0,0,0|1,0,2]=4 1758 B11R1.22 OCC(c1ccc(cc1)Cl)N Amb2236321 [0,1,0,0,0,0|1,0,2]=4 1759 B11R1.22 OCC(c1ccc(cc1)F)C Amb17232131 [0,1,0,0,0,0|0,0,2]=3 1760 B11R1.22 OC[C@@H](F)c1ccc(Br)cc1 Amb25789468 [0,1,0,0,0,0|1,0,2]=4 1761 B11R1.22 OC[C@@H](F)c1ccc(Cl)cc1 Amb24387743 [0,1,0,0,0,0|1,0,2]=4 1762 B11R1.22 OC[C@@H](O)c1ccc(Cl)cc1 Amb22745594 [0,1,0,0,0,0|1,0,2]=4 1763 B11R1.22 OC[C@H](F)c1ccc(F)cc1 Amb24407567 [0,1,0,0,0,0|1,0,2]=4 1764 B11R1.22 ON(C=O)c1ccc(Cl)cc1 Amb25265277 [0,1,0,0,0,0|2,0,0]=3 1765 B11R1.22 ONC(c1ccc(cc1)Br)C Amb17089212 [0,1,0,0,0,0|1,0,1]=3 1766 B11R1.22 ONC(c1ccc(cc1)C)C Amb17089203 [0,1,0,0,0,0|1,0,1]=3 1767 B11R1.22 ONC(c1ccc(cc1)Cl)C Amb17089211 [0,1,0,0,0,0|1,0,1]=3 1768 B11R1.22 ONC(c1ccc(cc1)F)C Amb17089210 [0,1,0,0,0,0|1,0,1]=3 1769 B11R1.22 O[C@@H](CBr)c1ccc(Cl)cc1 Amb25856283 [0,1,0,0,0,0|2,0,1]=4 1770 B11R1.22 O[C@@H](CBr)c1ccc(F)cc1 Amb25695505 [0,1,0,0,0,0|2,0,1]=4 1771 B11R1.22 O[C@@H](CCl)c1ccc(I)cc1 Amb25115222 [0,1,0,0,0,0|2,0,1]=4 1772 B11R1.22 O[C@H](C=O)c1ccc(Cl)cc1 Amb24736407 [0,1,0,0,0,0|1,0,0]=2 1773 B11R1.22 O[C@H](CBr)c1ccc(Br)cc1 Amb24719506 [0,1,0,0,0,0|2,0,1]=4 1774 B11R1.22 O[C@H](CBr)c1ccc(Cl)cc1 Amb25151783 [0,1,0,0,0,0|2,0,1]=4 1775 B11R1.22 O[C@H](CBr)c1ccc(F)cc1 Amb25835098 [0,1,0,0,0,0|2,0,1]=4 1776 B11R1.22 O[C@H](CF)c1ccc(F)cc1 Amb25714715 [0,1,0,0,0,0|2,0,1]=4 1777 B11R1.22 O\N=C(\c1ccc(cc1)Cl)/C Amb2423966 [0,1,0,0,0,0|1,0,2]=4 1778 B11R1.22 Oc1ccc(cc1)C(O)C=O Amb18125348 [0,1,0,0,0,0|1,0,0]=2 1779 B11R1.22 Oc1ccc(cc1)C(O)CF Amb24564100 [0,1,0,0,0,0|2,0,1]=4 1780 B11R1.22 Oc1ccc(cc1)C(O)CO Amb18644612 [0,1,0,0,0,0|1,0,2]=4 1781 B11R1.22 Oc1ccc(cc1)N(O)N=O Amb25713021 [0,1,0,0,0,0|3,0,0]=4 1782 B11R1.22 Oc1ccc(cc1)[C@H](O)CO Amb25335306 [0,1,0,0,0,0|1,0,2]=4 1783 B11R1.22 [15NH2][13CH2][13CH](c1ccc(cc1)O)O Amb17618816 [0,1,0,0,0,0|2,0,1]=4 1784 B11R1.23 BrCC(c1cccc(c1)Cl)O Amb16231782 [0,1,0,0,0,0|2,0,1]=4 1785 B11R1.23 BrC[C@H](c1cccc(c1)F)O Amb16233175 [0,1,0,0,0,0|2,0,1]=4 1786 B11R1.23 C#CC(N)c1cccc(Br)c1 Amb23448700 [0,1,0,0,0,0|2,0,1]=4 1787 B11R1.23 C#CC(N)c1cccc(Cl)c1 Amb23448699 [0,1,0,0,0,0|2,0,1]=4 1788 B11R1.23 C#CC(N)c1cccc(F)c1 Amb23448698 [0,1,0,0,0,0|2,0,1]=4 1789 B11R1.23 C#CC(N)c1cccc(O)c1 Amb23448701 [0,1,0,0,0,0|2,0,1]=4 1790 B11R1.23 C#CC(O)c1cccc(Br)c1 Amb25803823 [0,1,0,0,0,0|2,0,1]=4 1791 B11R1.23 C#CC(O)c1cccc(Cl)c1 Amb25817943 [0,1,0,0,0,0|2,0,1]=4 1792 B11R1.23 C#CC(O)c1cccc(F)c1 Amb24424134 [0,1,0,0,0,0|2,0,1]=4 1793 B11R1.23 C#C[C@@H](O)c1cccc(F)c1 Amb25114708 [0,1,0,0,0,0|2,0,1]=4 1794 B11R1.23 C#C[C@H](N)c1cccc(F)c1 Amb25789463 [0,1,0,0,0,0|2,0,1]=4 1795 B11R1.23 C#C[C@H](O)c1cccc(Cl)c1 Amb24412200 [0,1,0,0,0,0|2,0,1]=4 1796 B11R1.23 C#C[C@H](O)c1cccc(F)c1 Amb25374105 [0,1,0,0,0,0|2,0,1]=4 1797 B11R1.23 C=CC(=O)c1cccc(Cl)c1 Amb25783480 [0,1,0,0,0,0|2,0,1]=4 1798 B11R1.23 C=CC(=O)c1cccc(N)c1 Amb25291745 [0,1,0,0,0,0|2,0,1]=4 1799 B11R1.23 C=CC(=O)c1cccc(O)c1 Amb18124877 [0,1,0,0,0,0|2,0,1]=4 1800 B11R1.23 C=CC(N)c1c[n]cc(I)c1 Amb25058094 [0,1,0,0,0,0|3,0,0]=4 1801 B11R1.23 C=CC(N)c1c[n]cc(O)c1 Amb24426868 [0,1,0,0,0,0|3,0,0]=4 1802 B11R1.23 C=CC(N)c1cc(Cl)cc[n]1 Amb25169454 [0,1,0,0,0,0|3,0,0]=4 1803 B11R1.23 C=CC(N)c1cc(N)[n]cc1 Amb25121089 [0,1,0,0,0,0|3,0,0]=4 1804 B11R1.23 C=CC(N)c1cc(N)c[n]c1 Amb24470636 [0,1,0,0,0,0|3,0,0]=4 1805 B11R1.23 C=CC(N)c1cc[n]c(Br)c1 Amb25149327 [0,1,0,0,0,0|3,0,0]=4 1806 B11R1.23 C=CC(N)c1cc[n]c(Cl)c1 Amb25070833 [0,1,0,0,0,0|3,0,0]=4 1807 B11R1.23 C=CC(N)c1cc[n]c(F)c1 Amb24484419 [0,1,0,0,0,0|3,0,0]=4 1808 B11R1.23 C=CC(N)c1cc[n]c(O)c1 Amb25698327 [0,1,0,0,0,0|3,0,0]=4 1809 B11R1.23 C=CC(N)c1cccc(Br)[n]1 Amb25149328 [0,1,0,0,0,0|3,0,0]=4 1810 B11R1.23 C=CC(N)c1cccc(Br)c1 Amb25100092 [0,1,0,0,0,0|2,0,0]=3 1811 B11R1.23 C=CC(N)c1cccc(I)c1 Amb25147904 [0,1,0,0,0,0|2,0,0]=3 1812 B11R1.23 C=CC(N)c1cccc(N)[n]1 Amb24484521 [0,1,0,0,0,0|3,0,0]=4 1813 B11R1.23 C=CC(N)c1cccc(O)[n]1 Amb24484541 [0,1,0,0,0,0|3,0,0]=4 1814 B11R1.23 C=CC(N)c1cccc(O)c1 Amb25843257 [0,1,0,0,0,0|2,0,0]=3 1815 B11R1.23 C=CC(N)c1cccc(S)c1 Amb25341581 [0,1,0,0,0,0|2,0,0]=3 1816 B11R1.23 C=CC(O)c1c[n]cc(F)c1 Amb25237336 [0,1,0,0,0,0|3,0,0]=4 1817 B11R1.23 C=CC(O)c1cccc(Br)[n]1 Amb25195614 [0,1,0,0,0,0|3,0,0]=4 1818 B11R1.23 C=CC(O)c1cccc(Br)c1 Amb24382525 [0,1,0,0,0,0|2,0,0]=3 1819 B11R1.23 C=CC(O)c1cccc(F)c1 Amb24696558 [0,1,0,0,0,0|2,0,0]=3 1820 B11R1.23 C=C[C@@H](N)c1c[n]cc(Br)c1 Amb25083079 [0,1,0,0,0,0|3,0,0]=4 1821 B11R1.23 C=C[C@@H](N)c1c[n]cc(Cl)c1 Amb24484471 [0,1,0,0,0,0|3,0,0]=4 1822 B11R1.23 C=C[C@@H](N)c1c[n]cc(F)c1 Amb24401939 [0,1,0,0,0,0|3,0,0]=4 1823 B11R1.23 C=C[C@@H](N)c1c[n]cc(O)c1 Amb24484472 [0,1,0,0,0,0|3,0,0]=4 1824 B11R1.23 C=C[C@@H](N)c1cc(Cl)cc[n]1 Amb25195822 [0,1,0,0,0,0|3,0,0]=4 1825 B11R1.23 C=C[C@@H](N)c1cc(N)[n]cc1 Amb25076612 [0,1,0,0,0,0|3,0,0]=4 1826 B11R1.23 C=C[C@@H](N)c1cc(N)c[n]c1 Amb24444713 [0,1,0,0,0,0|3,0,0]=4 1827 B11R1.23 C=C[C@@H](N)c1cc[n]c(Cl)c1 Amb25758289 [0,1,0,0,0,0|3,0,0]=4 1828 B11R1.23 C=C[C@@H](N)c1cc[n]c(O)c1 Amb25689745 [0,1,0,0,0,0|3,0,0]=4 1829 B11R1.23 C=C[C@@H](N)c1cccc(Br)[n]1 Amb25282442 [0,1,0,0,0,0|3,0,0]=4 1830 B11R1.23 C=C[C@@H](N)c1cccc(Cl)[n]1 Amb24533041 [0,1,0,0,0,0|3,0,0]=4 1831 B11R1.23 C=C[C@@H](N)c1cccc(Cl)c1 Amb25836350 [0,1,0,0,0,0|2,0,0]=3 1832 B11R1.23 C=C[C@@H](N)c1cccc(F)[n]1 Amb25694408 [0,1,0,0,0,0|3,0,0]=4 1833 B11R1.23 C=C[C@@H](N)c1cccc(I)[n]1 Amb24727262 [0,1,0,0,0,0|3,0,0]=4 1834 B11R1.23 C=C[C@@H](N)c1cccc(I)c1 Amb25202127 [0,1,0,0,0,0|2,0,0]=3 1835 B11R1.23 C=C[C@@H](N)c1cccc(N)[n]1 Amb25837903 [0,1,0,0,0,0|3,0,0]=4 1836 B11R1.23 C=C[C@@H](N)c1cccc(S)c1 Amb25689770 [0,1,0,0,0,0|2,0,0]=3 1837 B11R1.23 C=C[C@@H](O)c1cccc(Cl)c1 Amb25132853 [0,1,0,0,0,0|2,0,0]=3 1838 B11R1.23 C=C[C@H](N)c1c[n]cc(Br)c1 Amb25800255 [0,1,0,0,0,0|3,0,0]=4 1839 B11R1.23 C=C[C@H](N)c1cc(Cl)cc[n]1 Amb25365938 [0,1,0,0,0,0|3,0,0]=4 1840 B11R1.23 C=C[C@H](N)c1cc(N)c[n]c1 Amb24451977 [0,1,0,0,0,0|3,0,0]=4 1841 B11R1.23 C=C[C@H](N)c1cccc(Cl)[n]1 Amb24484447 [0,1,0,0,0,0|3,0,0]=4 1842 B11R1.23 C=C[C@H](N)c1cccc(F)c1 Amb25141508 [0,1,0,0,0,0|2,0,0]=3 1843 B11R1.23 C=C[C@H](N)c1cccc(I)[n]1 Amb24399478 [0,1,0,0,0,0|3,0,0]=4 1844 B11R1.23 C=C[C@H](N)c1cccc(I)c1 Amb25859354 [0,1,0,0,0,0|2,0,0]=3 1845 B11R1.23 C=C[C@H](N)c1cccc(N)[n]1 Amb25292162 [0,1,0,0,0,0|3,0,0]=4 1846 B11R1.23 C=C[C@H](N)c1cccc(O)[n]1 Amb25347810 [0,1,0,0,0,0|3,0,0]=4 1847 B11R1.23 C=C[C@H](N)c1cccc(O)c1 Amb25757424 [0,1,0,0,0,0|2,0,0]=3 1848 B11R1.23 C=C[C@H](O)c1cc(O)ccc1 Amb24454636 [0,1,0,0,0,0|2,0,0]=3 1849 B11R1.23 CC(=NN)c1cccc(O)c1 Amb20668066 [0,1,0,0,0,0|2,0,1]=4 1850 B11R1.23 CC(=NO)c1cccc(F)c1 Amb18799448 [0,1,0,0,0,0|1,0,2]=4 1851 B11R1.23 CC(C#N)c1cccc(Br)c1 Amb18130624 [0,1,0,0,0,0|1,0,1]=3 1852 B11R1.23 CC(C#N)c1cccc(N)c1 Amb18124791 [0,1,0,0,0,0|1,0,1]=3 1853 B11R1.23 CC(C#N)c1cccc(O)c1 Amb25807604 [0,1,0,0,0,0|1,0,1]=3 1854 B11R1.23 CC(C=C)[n+]1cc(C)ccc1 Amb25122430 [0,1,0,0,0,0|2,0,0]=3 1855 B11R1.23 CC(C=C)[n+]1cc(O)ccc1 Amb25042555 [0,1,0,0,0,0|2,0,0]=3 1856 B11R1.23 CC(C=O)c1cccc(Br)c1 Amb18657407 [0,1,0,0,0,0|0,0,0]=1 1857 B11R1.23 CC(C=O)c1cccc(Cl)c1 Amb22059526 [0,1,0,0,0,0|0,0,0]=1 1858 B11R1.23 CC(C=O)c1cccc(F)c1 Amb24100538 [0,1,0,0,0,0|0,0,0]=1 1859 B11R1.23 CC(CBr)c1cc(Br)ccc1 Amb25717190 [0,1,0,0,0,0|1,0,1]=3 1860 B11R1.23 CC(CBr)c1cccc(Cl)c1 Amb24682607 [0,1,0,0,0,0|1,0,1]=3 1861 B11R1.23 CC(CBr)c1cccc(F)c1 Amb25678488 [0,1,0,0,0,0|1,0,1]=3 1862 B11R1.23 CC(CC)c1c[n]cc(Br)c1 Amb24320780 [0,1,0,0,0,0|2,0,1]=4 1863 B11R1.23 CC(CC)c1c[n]cc(N)c1 Amb18201843 [0,1,0,0,0,0|2,0,1]=4 1864 B11R1.23 CC(CC)c1c[n]cc(O)c1 Amb24320785 [0,1,0,0,0,0|2,0,1]=4 1865 B11R1.23 CC(CC)c1cc[n]c(Br)c1 Amb24320456 [0,1,0,0,0,0|2,0,1]=4 1866 B11R1.23 CC(CC)c1cc[n]c(N)c1 Amb18125183 [0,1,0,0,0,0|2,0,1]=4 1867 B11R1.23 CC(CCl)c1cc(Cl)ccc1 Amb24389754 [0,1,0,0,0,0|1,0,1]=3 1868 B11R1.23 CC(CCl)c1cccc(F)c1 Amb24485968 [0,1,0,0,0,0|1,0,1]=3 1869 B11R1.23 CC(CN)c1c[n]cc(F)c1 Amb18251435 [0,1,0,0,0,0|2,0,1]=4 1870 B11R1.23 CC(CN)c1cccc(Br)c1 Amb18174810 [0,1,0,0,0,0|1,0,1]=3 1871 B11R1.23 CC(CO)C=1CC(=O)C=CC1 Amb19958939 [0,1,0,0,0,0|0,0,3]=4 1872 B11R1.23 CC(CO)c1cccc(Br)c1 Amb25377089 [0,1,0,0,0,0|0,0,2]=3 1873 B11R1.23 CC(CO)c1cccc(Cl)c1 Amb22059525 [0,1,0,0,0,0|0,0,2]=3 1874 B11R1.23 CC(CO)c1cccc(F)c1 Amb24485967 [0,1,0,0,0,0|0,0,2]=3 1875 B11R1.23 CC(NN)c1cc[n]c(Cl)c1 Amb25292151 [0,1,0,0,0,0|3,0,0]=4 1876 B11R1.23 CC(NN)c1cccc(O)c1 Amb22751722 [0,1,0,0,0,0|2,0,0]=3 1877 B11R1.23 CC(NO)c1cc(O)ccc1 Amb25122376 [0,1,0,0,0,0|1,0,1]=3 1878 B11R1.23 CC(NO)c1cccc(Br)c1 Amb25700249 [0,1,0,0,0,0|1,0,1]=3 1879 B11R1.23 CC(c1cccc(n1)Br)CC Amb10600437 [0,1,0,0,0,0|2,0,1]=4 1880 B11R1.23 CCC(Br)c1cc(Br)ccc1 Amb25330622 [0,1,0,0,0,0|2,0,1]=4 1881 B11R1.23 CCC(Br)c1cccc(F)c1 Amb25116208 [0,1,0,0,0,0|2,0,1]=4 1882 B11R1.23 CCC(C)c1cc(Br)cc[n]1 Amb24320477 [0,1,0,0,0,0|2,0,1]=4 1883 B11R1.23 CCC(C)c1cc(F)cc[n]1 Amb24319241 [0,1,0,0,0,0|2,0,1]=4 1884 B11R1.23 CCC(C)c1cc(N)cc[n]1 Amb24320479 [0,1,0,0,0,0|2,0,1]=4 1885 B11R1.23 CCC(C)c1cccc(Br)c1 Amb24321311 [0,1,0,0,0,0|1,0,1]=3 1886 B11R1.23 CCC(C)c1cccc(F)[n]1 Amb24319193 [0,1,0,0,0,0|2,0,1]=4 1887 B11R1.23 CCC(C)c1cccc(I)c1 Amb25217267 [0,1,0,0,0,0|1,0,1]=3 1888 B11R1.23 CCC(C)c1cccc(N)[n]1 Amb18201878 [0,1,0,0,0,0|2,0,1]=4 1889 B11R1.23 CCC(C)c1cccc(O)c1 Amb18644439 [0,1,0,0,0,0|1,0,1]=3 1890 B11R1.23 CCC(Cl)c1cccc(Br)c1 Amb25698929 [0,1,0,0,0,0|2,0,1]=4 1891 B11R1.23 CCC(N)c1cc(N)ccc1 Amb22754502 [0,1,0,0,0,0|2,0,1]=4 1892 B11R1.23 CCC(N)c1cccc(S)c1 Amb25716248 [0,1,0,0,0,0|2,0,1]=4 1893 B11R1.23 CCC(O)c1cc(O)ccc1 Amb18125404 [0,1,0,0,0,0|2,0,1]=4 1894 B11R1.23 CCC(O)c1cccc(F)c1 Amb18035934 [0,1,0,0,0,0|2,0,1]=4 1895 B11R1.23 CCC(O)c1cccc(I)c1 Amb25841716 [0,1,0,0,0,0|2,0,1]=4 1896 B11R1.23 CCC(O)c1cccc(N)c1 Amb18644476 [0,1,0,0,0,0|2,0,1]=4 1897 B11R1.23 CCC(S)c1cccc(Br)c1 Amb25853905 [0,1,0,0,0,0|2,0,1]=4 1898 B11R1.23 CCC(c1cccc(c1)Br)O Amb1111136 [0,1,0,0,0,0|2,0,1]=4 1899 B11R1.23 CCC(c1cccc(c1)C)N Amb17232059 [0,1,0,0,0,0|2,0,1]=4 1900 B11R1.23 CCC(c1cccc(c1)C)O Amb17232070 [0,1,0,0,0,0|2,0,1]=4 1901 B11R1.23 CCC(c1cccc(c1)Cl)N Amb1126296 [0,1,0,0,0,0|2,0,1]=4 1902 B11R1.23 CCC(c1cccc(c1)F)N Amb10839631 [0,1,0,0,0,0|2,0,1]=4 1903 B11R1.23 CC[C@@H](N)c1cc(N)ccc1 Amb25707453 [0,1,0,0,0,0|2,0,1]=4 1904 B11R1.23 CC[C@@H](N)c1cccc(Br)c1 Amb24533197 [0,1,0,0,0,0|2,0,1]=4 1905 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22232293 [0,1,0,0,0,0|2,0,1]=4 1906 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22288625 [0,1,0,0,0,0|2,0,1]=4 1907 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb22288627 [0,1,0,0,0,0|2,0,1]=4 1908 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb24426877 [0,1,0,0,0,0|2,0,1]=4 1909 B11R1.23 CC[C@@H](N)c1cccc(O)c1 Amb25074061 [0,1,0,0,0,0|2,0,1]=4 1910 B11R1.23 CC[C@@H](O)c1cccc(Br)c1 Amb25048807 [0,1,0,0,0,0|2,0,1]=4 1911 B11R1.23 CC[C@@H](O)c1cccc(Cl)c1 Amb24477555 [0,1,0,0,0,0|2,0,1]=4 1912 B11R1.23 CC[C@H](N)c1cc(N)ccc1 Amb25169299 [0,1,0,0,0,0|2,0,1]=4 1913 B11R1.23 CC[C@H](N)c1cccc(Cl)c1 Amb22232288 [0,1,0,0,0,0|2,0,1]=4 1914 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb22288686 [0,1,0,0,0,0|2,0,1]=4 1915 B11R1.23 CC[C@H](N)c1cccc(I)c1 Amb25288823 [0,1,0,0,0,0|2,0,1]=4 1916 B11R1.23 CC[C@H](N)c1cccc(O)c1 Amb24460783 [0,1,0,0,0,0|2,0,1]=4 1917 B11R1.23 CC[C@H](N)c1cccc(S)c1 Amb25726439 [0,1,0,0,0,0|2,0,1]=4 1918 B11R1.23 CC[C@H](O)c1cc(O)ccc1 Amb24484509 [0,1,0,0,0,0|2,0,1]=4 1919 B11R1.23 CC[C@H](O)c1cccc(F)c1 Amb24447234 [0,1,0,0,0,0|2,0,1]=4 1920 B11R1.23 CN(C#N)c1cccc(Cl)c1 Amb24354230 [0,1,0,0,0,0|2,0,1]=4 1921 B11R1.23 CN(C#N)c1cccc(N)c1 Amb24746739 [0,1,0,0,0,0|2,0,1]=4 1922 B11R1.23 CN(C=O)c1cccc(F)c1 Amb24072195 [0,1,0,0,0,0|1,0,0]=2 1923 B11R1.23 CN(C=O)c1cccc(N)c1 Amb24072128 [0,1,0,0,0,0|1,0,0]=2 1924 B11R1.23 CN(C=O)c1cccc(O)c1 Amb24463968 [0,1,0,0,0,0|1,0,0]=2 1925 B11R1.23 CN(CC)c1cccc(Br)c1 Amb25711222 [0,1,0,0,0,0|2,0,1]=4 1926 B11R1.23 CN(CC)c1cccc(Cl)c1 Amb25332688 [0,1,0,0,0,0|2,0,1]=4 1927 B11R1.23 CN(CC)c1cccc(F)c1 Amb25163175 [0,1,0,0,0,0|2,0,1]=4 1928 B11R1.23 CN(CC)c1cccc(O)c1 Amb18125288 [0,1,0,0,0,0|2,0,1]=4 1929 B11R1.23 CN(OC)c1cccc(Cl)c1 Amb20620735 [0,1,0,0,0,0|3,0,0]=4 1930 B11R1.23 CNC(C)c1c[n]cc(Cl)c1 Amb24743368 [0,1,0,0,0,0|3,0,0]=4 1931 B11R1.23 CNC(C)c1c[n]cc(F)c1 Amb18283046 [0,1,0,0,0,0|3,0,0]=4 1932 B11R1.23 CNC(C)c1c[n]cc(I)c1 Amb24375948 [0,1,0,0,0,0|3,0,0]=4 1933 B11R1.23 CNC(C)c1cc(Cl)cc[n]1 Amb25053435 [0,1,0,0,0,0|3,0,0]=4 1934 B11R1.23 CNC(C)c1cc[n]c(Br)c1 Amb25117656 [0,1,0,0,0,0|3,0,0]=4 1935 B11R1.23 CNC(C)c1cc[n]c(Cl)c1 Amb25124839 [0,1,0,0,0,0|3,0,0]=4 1936 B11R1.23 CNC(C)c1cc[n]c(N)c1 Amb24484674 [0,1,0,0,0,0|3,0,0]=4 1937 B11R1.23 CNC(C)c1cc[n]c(O)c1 Amb25731283 [0,1,0,0,0,0|3,0,0]=4 1938 B11R1.23 CNC(C)c1cccc(Cl)[n]1 Amb24484672 [0,1,0,0,0,0|3,0,0]=4 1939 B11R1.23 CNC(C)c1cccc(O)c1 Amb19514938 [0,1,0,0,0,0|2,0,0]=3 1940 B11R1.23 CNC(C)c1cccc(S)c1 Amb24465363 [0,1,0,0,0,0|2,0,0]=3 1941 B11R1.23 CNC(O)c1cc(O)ccc1 Amb24466291 [0,1,0,0,0,0|3,0,0]=4 1942 B11R1.23 CNC(c1cccc(c1)Br)C Amb1131184 [0,1,0,0,0,0|2,0,0]=3 1943 B11R1.23 CNC(c1cccc(c1)Cl)C Amb1135714 [0,1,0,0,0,0|2,0,0]=3 1944 B11R1.23 CNC(c1cccc(c1)O)C Amb1112055 [0,1,0,0,0,0|2,0,0]=3 1945 B11R1.23 CN[C@@H](C)c1c[n]cc(Cl)c1 Amb25226803 [0,1,0,0,0,0|3,0,0]=4 1946 B11R1.23 CN[C@@H](C)c1c[n]cc(I)c1 Amb25826444 [0,1,0,0,0,0|3,0,0]=4 1947 B11R1.23 CN[C@@H](C)c1cc(Br)cc[n]1 Amb24417885 [0,1,0,0,0,0|3,0,0]=4 1948 B11R1.23 CN[C@@H](C)c1cc(I)cc[n]1 Amb25040517 [0,1,0,0,0,0|3,0,0]=4 1949 B11R1.23 CN[C@@H](C)c1cc(N)cc[n]1 Amb25675972 [0,1,0,0,0,0|3,0,0]=4 1950 B11R1.23 CN[C@@H](C)c1cc[n]c(F)c1 Amb25064662 [0,1,0,0,0,0|3,0,0]=4 1951 B11R1.23 CN[C@@H](C)c1cc[n]c(O)c1 Amb25736294 [0,1,0,0,0,0|3,0,0]=4 1952 B11R1.23 CN[C@@H](C)c1cccc(Br)[n]1 Amb24538314 [0,1,0,0,0,0|3,0,0]=4 1953 B11R1.23 CN[C@@H](C)c1cccc(Br)c1 Amb25147856 [0,1,0,0,0,0|2,0,0]=3 1954 B11R1.23 CN[C@@H](C)c1cccc(I)c1 Amb24716589 [0,1,0,0,0,0|2,0,0]=3 1955 B11R1.23 CN[C@@H](C)c1cccc(N)c1 Amb25100891 [0,1,0,0,0,0|2,0,0]=3 1956 B11R1.23 CN[C@@H](C)c1cccc(O)[n]1 Amb25172787 [0,1,0,0,0,0|3,0,0]=4 1957 B11R1.23 CN[C@@H](C)c1cccc(S)c1 Amb24486636 [0,1,0,0,0,0|2,0,0]=3 1958 B11R1.23 CN[C@@H](c1cccc(c1)F)C Amb10840583 [0,1,0,0,0,0|2,0,0]=3 1959 B11R1.23 CN[C@H](C)c1c[n]cc(F)c1 Amb25835867 [0,1,0,0,0,0|3,0,0]=4 1960 B11R1.23 CN[C@H](C)c1cc(Cl)cc[n]1 Amb24553825 [0,1,0,0,0,0|3,0,0]=4 1961 B11R1.23 CN[C@H](C)c1cc(I)cc[n]1 Amb25270699 [0,1,0,0,0,0|3,0,0]=4 1962 B11R1.23 CN[C@H](C)c1cc(N)cc[n]1 Amb25172778 [0,1,0,0,0,0|3,0,0]=4 1963 B11R1.23 CN[C@H](C)c1cc[n]c(F)c1 Amb25774340 [0,1,0,0,0,0|3,0,0]=4 1964 B11R1.23 CN[C@H](C)c1cccc(Br)[n]1 Amb25828948 [0,1,0,0,0,0|3,0,0]=4 1965 B11R1.23 CN[C@H](C)c1cccc(Br)c1 Amb25056176 [0,1,0,0,0,0|2,0,0]=3 1966 B11R1.23 CN[C@H](C)c1cccc(Cl)[n]1 Amb24678337 [0,1,0,0,0,0|3,0,0]=4 1967 B11R1.23 CN[C@H](C)c1cccc(I)[n]1 Amb24551671 [0,1,0,0,0,0|3,0,0]=4 1968 B11R1.23 CN[C@H](C)c1cccc(I)c1 Amb24468187 [0,1,0,0,0,0|2,0,0]=3 1969 B11R1.23 CN[C@H](C)c1cccc(N)c1 Amb25794176 [0,1,0,0,0,0|2,0,0]=3 1970 B11R1.23 CN[C@H](C)c1cccc(O)[n]1 Amb24625694 [0,1,0,0,0,0|3,0,0]=4 1971 B11R1.23 CN[C@H](c1cccc(c1)F)C Amb10838861 [0,1,0,0,0,0|2,0,0]=3 1972 B11R1.23 COC(C)c1cc(Cl)cc[n]1 Amb25196040 [0,1,0,0,0,0|3,0,0]=4 1973 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [0,1,0,0,0,0|2,0,0]=3 1974 B11R1.23 COC(c1cccc(c1)N)C Amb13952800 [0,1,0,0,0,0|2,0,0]=3 1975 B11R1.23 CSC(C)c1cccc(N)c1 Amb18282127 [0,1,0,0,0,0|2,0,0]=3 1976 B11R1.23 C[C@@H](CN)c1cccc(Br)c1 Amb24642637 [0,1,0,0,0,0|1,0,1]=3 1977 B11R1.23 C[C@@H](CN)c1cccc(Cl)c1 Amb24749885 [0,1,0,0,0,0|1,0,1]=3 1978 B11R1.23 C[C@@H](NO)c1cccc(Br)c1 Amb25775914 [0,1,0,0,0,0|1,0,1]=3 1979 B11R1.23 C[C@@H](NO)c1cccc(Cl)c1 Amb24488035 [0,1,0,0,0,0|1,0,1]=3 1980 B11R1.23 C[C@@H](NO)c1cccc(F)c1 Amb25125912 [0,1,0,0,0,0|1,0,1]=3 1981 B11R1.23 C[C@H](CO)c1cccc(F)c1 Amb25341759 [0,1,0,0,0,0|0,0,2]=3 1982 B11R1.23 C[C@H](NO)c1cccc(Cl)c1 Amb25304262 [0,1,0,0,0,0|1,0,1]=3 1983 B11R1.23 C[C@H](NO)c1cccc(F)c1 Amb24686588 [0,1,0,0,0,0|1,0,1]=3 1984 B11R1.23 C\C(=C/C)\c1cc(F)ccc1 Amb25837290 [0,1,0,0,0,0|1,0,1]=3 1985 B11R1.23 C\C(=C\C)\c1cc(Br)ccc1 Amb25674836 [0,1,0,0,0,0|1,0,1]=3 1986 B11R1.23 C\C(=N/N)\c1cccc(O)c1 Amb24484530 [0,1,0,0,0,0|2,0,1]=4 1987 B11R1.23 C\C(=N/O)\c1cccc(Cl)c1 Amb25187132 [0,1,0,0,0,0|1,0,2]=4 1988 B11R1.23 C\C(=N\N)\c1cc(N)ccc1 Amb25138243 [0,1,0,0,0,0|2,0,1]=4 1989 B11R1.23 C\C(=N\N)\c1cccc(F)c1 Amb25667632 [0,1,0,0,0,0|2,0,1]=4 1990 B11R1.23 C\C(=N\O)\c1cccc(Br)c1 Amb22261517 [0,1,0,0,0,0|1,0,2]=4 1991 B11R1.23 C\C(=N\O)\c1cccc(F)c1 Amb24362016 [0,1,0,0,0,0|1,0,2]=4 1992 B11R1.23 C\C=C(/C)\c1cccc(C)[n]1 Amb24101959 [0,1,0,0,0,0|2,0,1]=4 1993 B11R1.23 Cc1c[n]cc(c1)C(C)CN Amb25260685 [0,1,0,0,0,0|2,0,1]=4 1994 B11R1.23 Cc1cc([n]cc1)C(N)C=C Amb24484497 [0,1,0,0,0,0|3,0,0]=4 1995 B11R1.23 Cc1cc([n]cc1)[C@@H](N)C=C Amb24401102 [0,1,0,0,0,0|3,0,0]=4 1996 B11R1.23 Cc1cc([n]cc1)[C@H](N)C=C Amb25757865 [0,1,0,0,0,0|3,0,0]=4 1997 B11R1.23 Cc1cc(c[n]c1)C(O)C=O Amb25303705 [0,1,0,0,0,0|2,0,0]=3 1998 B11R1.23 Cc1cc(c[n]c1)[C@H](N)C=C Amb25757587 [0,1,0,0,0,0|3,0,0]=4 1999 B11R1.23 Cc1cc(cc[n]1)C(C)CN Amb18201826 [0,1,0,0,0,0|2,0,1]=4 2000 B11R1.23 Cc1cc(cc[n]1)C(O)C=C Amb25148256 [0,1,0,0,0,0|3,0,0]=4 2001 B11R1.23 Cc1cc(cc[n]1)[C@@H](N)C=C Amb24655625 [0,1,0,0,0,0|3,0,0]=4 2002 B11R1.23 Cc1cc(cc[n]1)[C@H](C)NC Amb24509272 [0,1,0,0,0,0|3,0,0]=4 2003 B11R1.23 Cc1cc(cc[n]1)[C@H](N)C=C Amb25809551 [0,1,0,0,0,0|3,0,0]=4 2004 B11R1.23 Cc1cc(ccc1)C(=C)C=O Amb24509586 [0,1,0,0,0,0|0,0,2]=3 2005 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb18124885 [0,1,0,0,0,0|1,0,1]=3 2006 B11R1.23 Cc1cc(ccc1)C(=O)C=O Amb24055227 [0,1,0,0,0,0|1,0,1]=3 2007 B11R1.23 Cc1cc(ccc1)C(Br)C#N Amb24418437 [0,1,0,0,0,0|2,0,1]=4 2008 B11R1.23 Cc1cc(ccc1)C(Cl)C#N Amb18788414 [0,1,0,0,0,0|2,0,1]=4 2009 B11R1.23 Cc1cc(ccc1)C(Cl)CCl Amb24487933 [0,1,0,0,0,0|2,0,1]=4 2010 B11R1.23 Cc1cc(ccc1)C(F)CN Amb25151821 [0,1,0,0,0,0|2,0,1]=4 2011 B11R1.23 Cc1cc(ccc1)C(F)CO Amb25788942 [0,1,0,0,0,0|1,0,2]=4 2012 B11R1.23 Cc1cc(ccc1)C(N)=S=O Amb24727111 [0,1,0,0,0,0|2,0,1]=4 2013 B11R1.23 Cc1cc(ccc1)C(N)C#C Amb23448697 [0,1,0,0,0,0|2,0,1]=4 2014 B11R1.23 Cc1cc(ccc1)C(N)CF Amb25103802 [0,1,0,0,0,0|2,0,1]=4 2015 B11R1.23 Cc1cc(ccc1)C(N)CN Amb22585672 [0,1,0,0,0,0|2,0,1]=4 2016 B11R1.23 Cc1cc(ccc1)C(O)C#C Amb25095022 [0,1,0,0,0,0|2,0,1]=4 2017 B11R1.23 Cc1cc(ccc1)C(O)CCl Amb25059095 [0,1,0,0,0,0|2,0,1]=4 2018 B11R1.23 Cc1cc(ccc1)C(O)CF Amb25228079 [0,1,0,0,0,0|2,0,1]=4 2019 B11R1.23 Cc1cc(ccc1)C(O)CN Amb22235050 [0,1,0,0,0,0|2,0,1]=4 2020 B11R1.23 Cc1cc(ccc1)C(O)CO Amb24116522 [0,1,0,0,0,0|1,0,2]=4 2021 B11R1.23 Cc1cc(ccc1)[C@@H](F)CO Amb25190296 [0,1,0,0,0,0|1,0,2]=4 2022 B11R1.23 Cc1cc(ccc1)[C@@H](N)C=C Amb25117908 [0,1,0,0,0,0|2,0,0]=3 2023 B11R1.23 Cc1cc(ccc1)[C@@H](N)CF Amb25251606 [0,1,0,0,0,0|2,0,1]=4 2024 B11R1.23 Cc1cc(ccc1)[C@@H](N)CO Amb22756883 [0,1,0,0,0,0|1,0,2]=4 2025 B11R1.23 Cc1cc(ccc1)[C@@H](O)C#N Amb25145294 [0,1,0,0,0,0|2,0,1]=4 2026 B11R1.23 Cc1cc(ccc1)[C@@H](O)C=C Amb25345124 [0,1,0,0,0,0|2,0,0]=3 2027 B11R1.23 Cc1cc(ccc1)[C@H](N)C#C Amb24604178 [0,1,0,0,0,0|2,0,1]=4 2028 B11R1.23 Cc1cc(ccc1)[C@H](N)C=C Amb25339039 [0,1,0,0,0,0|2,0,0]=3 2029 B11R1.23 Cc1cc(ccc1)[C@H](N)CF Amb24472618 [0,1,0,0,0,0|2,0,1]=4 2030 B11R1.23 Cc1cc(ccc1)[C@H](N)CN Amb24710735 [0,1,0,0,0,0|2,0,1]=4 2031 B11R1.23 Cc1cc(ccc1)[C@H](O)C#C Amb25149560 [0,1,0,0,0,0|2,0,1]=4 2032 B11R1.23 Cc1cc(ccc1)[C@H](O)C#N Amb25790013 [0,1,0,0,0,0|2,0,1]=4 2033 B11R1.23 Cc1cc(ccc1)[C@H](O)C=C Amb25769183 [0,1,0,0,0,0|2,0,0]=3 2034 B11R1.23 Cc1cc(ccc1)[C@H](O)CCl Amb25765754 [0,1,0,0,0,0|2,0,1]=4 2035 B11R1.23 Cc1cc(ccc1)\C(\C)=N/N Amb25052007 [0,1,0,0,0,0|2,0,1]=4 2036 B11R1.23 Cc1cc(ccc1)\C(\C)=N\O Amb24509086 [0,1,0,0,0,0|1,0,2]=4 2037 B11R1.23 Cc1cc[n]c(c1)C(C)C=C Amb24100510 [0,1,0,0,0,0|2,0,0]=3 2038 B11R1.23 Cc1cc[n]c(c1)C(C)NC Amb25772996 [0,1,0,0,0,0|3,0,0]=4 2039 B11R1.23 Cc1cc[n]c(c1)C(C)NN Amb25742047 [0,1,0,0,0,0|3,0,0]=4 2040 B11R1.23 Cc1cc[n]c(c1)[C@@H](C)NC Amb25373994 [0,1,0,0,0,0|3,0,0]=4 2041 B11R1.23 Cc1cccc([n]1)C(C)CC Amb24085060 [0,1,0,0,0,0|2,0,1]=4 2042 B11R1.23 Cc1cccc([n]1)C(C)NC Amb24477620 [0,1,0,0,0,0|3,0,0]=4 2043 B11R1.23 Cc1cccc([n]1)C(C)NN Amb25728319 [0,1,0,0,0,0|3,0,0]=4 2044 B11R1.23 Cc1cccc([n]1)C(C)ON Amb25130503 [0,1,0,0,0,0|3,0,0]=4 2045 B11R1.23 Cc1cccc([n]1)C(N)C=C Amb24485743 [0,1,0,0,0,0|3,0,0]=4 2046 B11R1.23 Cc1cccc([n]1)C(O)C=C Amb25803173 [0,1,0,0,0,0|3,0,0]=4 2047 B11R1.23 Cc1cccc([n]1)[C@@H](C)NC Amb25063333 [0,1,0,0,0,0|3,0,0]=4 2048 B11R1.23 Cc1cccc(c1)C(Br)CC Amb25131128 [0,1,0,0,0,0|2,0,1]=4 2049 B11R1.23 Cc1cccc(c1)C(C)C=O Amb24380067 [0,1,0,0,0,0|0,0,0]=1 2050 B11R1.23 Cc1cccc(c1)C(C)CBr Amb25694936 [0,1,0,0,0,0|1,0,1]=3 2051 B11R1.23 Cc1cccc(c1)C(C)CC Amb22755118 [0,1,0,0,0,0|1,0,1]=3 2052 B11R1.23 Cc1cccc(c1)C(C)CO Amb24674558 [0,1,0,0,0,0|0,0,2]=3 2053 B11R1.23 Cc1cccc(c1)C(C)NN Amb18787419 [0,1,0,0,0,0|2,0,0]=3 2054 B11R1.23 Cc1cccc(c1)C(Cl)CC Amb24739513 [0,1,0,0,0,0|2,0,1]=4 2055 B11R1.23 Cc1cccc(c1)C(O)OC Amb24661117 [0,1,0,0,0,0|3,0,0]=4 2056 B11R1.23 Cc1cccc(c1)C(S)CC Amb25703808 [0,1,0,0,0,0|2,0,1]=4 2057 B11R1.23 Cc1cccc(c1)N(C)C=O Amb24613981 [0,1,0,0,0,0|1,0,0]=2 2058 B11R1.23 Cc1cccc(c1)N(C)CC Amb24689118 [0,1,0,0,0,0|2,0,1]=4 2059 B11R1.23 Cc1cccc(c1)[C@@H](C)NC Amb24377657 [0,1,0,0,0,0|2,0,0]=3 2060 B11R1.23 Cc1cccc(c1)[C@@H](N)CC Amb22298573 [0,1,0,0,0,0|2,0,1]=4 2061 B11R1.23 Cc1cccc(c1)[C@@H](O)CC Amb25794428 [0,1,0,0,0,0|2,0,1]=4 2062 B11R1.23 Cc1cccc(c1)[C@H](C)CO Amb25220127 [0,1,0,0,0,0|0,0,2]=3 2063 B11R1.23 Cc1cccc(c1)[C@H](C)NO Amb25126106 [0,1,0,0,0,0|1,0,1]=3 2064 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb22298529 [0,1,0,0,0,0|2,0,1]=4 2065 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb25145723 [0,1,0,0,0,0|2,0,1]=4 2066 B11R1.23 Cc1cccc(c1)[C@H](O)CC Amb25151427 [0,1,0,0,0,0|2,0,1]=4 2067 B11R1.23 ClC[C@@H](c1cccc(c1)Cl)O Amb16231706 [0,1,0,0,0,0|2,0,1]=4 2068 B11R1.23 FCC(Cl)c1cc(Cl)ccc1 Amb24373155 [0,1,0,0,0,0|2,0,1]=4 2069 B11R1.23 FCC(c1cccc(c1)Br)N Amb2372610 [0,1,0,0,0,0|2,0,1]=4 2070 B11R1.23 FCC(c1cccc(c1)Cl)N Amb2372608 [0,1,0,0,0,0|2,0,1]=4 2071 B11R1.23 Fc1cccc(c1)C(Cl)CF Amb24487867 [0,1,0,0,0,0|2,0,1]=4 2072 B11R1.23 N#CC(Br)c1cc(Br)ccc1 Amb25365923 [0,1,0,0,0,0|2,0,1]=4 2073 B11R1.23 N#CC(Br)c1cccc(F)c1 Amb25790533 [0,1,0,0,0,0|2,0,1]=4 2074 B11R1.23 N#CC(Cl)c1cc(Cl)ccc1 Amb18319213 [0,1,0,0,0,0|2,0,1]=4 2075 B11R1.23 N#CC(Cl)c1cccc(Br)c1 Amb23596604 [0,1,0,0,0,0|2,0,1]=4 2076 B11R1.23 N#CC(Cl)c1cccc(F)c1 Amb18789160 [0,1,0,0,0,0|2,0,1]=4 2077 B11R1.23 N#CC(F)c1cc(F)ccc1 Amb25277401 [0,1,0,0,0,0|2,0,1]=4 2078 B11R1.23 N#CC(O)c1cccc(I)c1 Amb25187652 [0,1,0,0,0,0|2,0,1]=4 2079 B11R1.23 N#CC(c1cccc(c1)Br)N Amb1131851 [0,1,0,0,0,0|2,0,1]=4 2080 B11R1.23 N#CC(c1cccc(c1)C)N Amb1108777 [0,1,0,0,0,0|2,0,1]=4 2081 B11R1.23 N#CC(c1cccc(c1)Cl)N Amb1108083 [0,1,0,0,0,0|2,0,1]=4 2082 B11R1.23 N#CC(c1cccc(c1)F)N Amb1108195 [0,1,0,0,0,0|2,0,1]=4 2083 B11R1.23 N#CC(c1cccc(c1)O)N Amb1139267 [0,1,0,0,0,0|2,0,1]=4 2084 B11R1.23 N#C[C@@H](O)c1cc(O)ccc1 Amb25132132 [0,1,0,0,0,0|2,0,1]=4 2085 B11R1.23 N#C[C@@H](O)c1cccc(F)c1 Amb25342130 [0,1,0,0,0,0|2,0,1]=4 2086 B11R1.23 N#C[C@H](O)c1cccc(F)c1 Amb24068199 [0,1,0,0,0,0|2,0,1]=4 2087 B11R1.23 NC(C#N)c1cccc(I)c1 Amb24488043 [0,1,0,0,0,0|2,0,1]=4 2088 B11R1.23 NC(CF)c1cccc(Cl)c1 Amb22270179 [0,1,0,0,0,0|2,0,1]=4 2089 B11R1.23 NC(CF)c1cccc(I)c1 Amb25687298 [0,1,0,0,0,0|2,0,1]=4 2090 B11R1.23 NC(CF)c1cccc(O)c1 Amb24488065 [0,1,0,0,0,0|2,0,1]=4 2091 B11R1.23 NC(CO)c1cc(O)ccc1 Amb18281703 [0,1,0,0,0,0|1,0,2]=4 2092 B11R1.23 NC(CO)c1cccc(Br)c1 Amb20668144 [0,1,0,0,0,0|1,0,2]=4 2093 B11R1.23 NC(CO)c1cccc(Cl)c1 Amb19374550 [0,1,0,0,0,0|1,0,2]=4 2094 B11R1.23 NC(CO)c1cccc(F)c1 Amb19374122 [0,1,0,0,0,0|1,0,2]=4 2095 B11R1.23 NC(CO)c1cccc(I)c1 Amb25147935 [0,1,0,0,0,0|1,0,2]=4 2096 B11R1.23 NC(CO)c1cccc(S)c1 Amb24485787 [0,1,0,0,0,0|1,0,2]=4 2097 B11R1.23 NCC(Cl)c1cc(Cl)ccc1 Amb25741499 [0,1,0,0,0,0|2,0,1]=4 2098 B11R1.23 NCC(F)c1cc(F)ccc1 Amb24084158 [0,1,0,0,0,0|2,0,1]=4 2099 B11R1.23 NCC(F)c1cccc(Br)c1 Amb23454841 [0,1,0,0,0,0|2,0,1]=4 2100 B11R1.23 NCC(F)c1cccc(Cl)c1 Amb25151836 [0,1,0,0,0,0|2,0,1]=4 2101 B11R1.23 NCC(N)c1cccc(Br)c1 Amb22585480 [0,1,0,0,0,0|2,0,1]=4 2102 B11R1.23 NCC(N)c1cccc(Cl)c1 Amb22585493 [0,1,0,0,0,0|2,0,1]=4 2103 B11R1.23 NCC(N)c1cccc(F)c1 Amb22585496 [0,1,0,0,0,0|2,0,1]=4 2104 B11R1.23 NCC(N)c1cccc(I)c1 Amb22585497 [0,1,0,0,0,0|2,0,1]=4 2105 B11R1.23 NCC(N)c1cccc(O)c1 Amb25680093 [0,1,0,0,0,0|2,0,1]=4 2106 B11R1.23 NCC(O)c1cccc(Br)c1 Amb19515816 [0,1,0,0,0,0|2,0,1]=4 2107 B11R1.23 NCC(O)c1cccc(I)c1 Amb22585763 [0,1,0,0,0,0|2,0,1]=4 2108 B11R1.23 NCC(O)c1cccc(I)c1 Amb25116809 [0,1,0,0,0,0|2,0,1]=4 2109 B11R1.23 NCC(c1cccc(c1)C)C Amb17232058 [0,1,0,0,0,0|1,0,1]=3 2110 B11R1.23 NCC(c1cccc(c1)C)O Amb1108715 [0,1,0,0,0,0|2,0,1]=4 2111 B11R1.23 NCC(c1cccc(c1)Cl)C Amb17079281 [0,1,0,0,0,0|1,0,1]=3 2112 B11R1.23 NCC(c1cccc(c1)Cl)O Amb1108889 [0,1,0,0,0,0|2,0,1]=4 2113 B11R1.23 NCC(c1cccc(c1)F)C Amb13951272 [0,1,0,0,0,0|1,0,1]=3 2114 B11R1.23 NCC(c1cccc(c1)F)O Amb1108497 [0,1,0,0,0,0|2,0,1]=4 2115 B11R1.23 NC[C@@H](N)c1cccc(Br)c1 Amb22406459 [0,1,0,0,0,0|2,0,1]=4 2116 B11R1.23 NC[C@@H](N)c1cccc(F)c1 Amb25300278 [0,1,0,0,0,0|2,0,1]=4 2117 B11R1.23 NC[C@@H](N)c1cccc(I)c1 Amb25189321 [0,1,0,0,0,0|2,0,1]=4 2118 B11R1.23 NC[C@@H](N)c1cccc(O)c1 Amb24693568 [0,1,0,0,0,0|2,0,1]=4 2119 B11R1.23 NC[C@@H](O)c1cc(O)ccc1 Amb22800805 [0,1,0,0,0,0|2,0,1]=4 2120 B11R1.23 NC[C@@H](O)c1cccc(Br)c1 Amb25362852 [0,1,0,0,0,0|2,0,1]=4 2121 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241268 [0,1,0,0,0,0|2,0,1]=4 2122 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241482 [0,1,0,0,0,0|2,0,1]=4 2123 B11R1.23 NC[C@@H](O)c1cccc(F)c1 Amb24651917 [0,1,0,0,0,0|2,0,1]=4 2124 B11R1.23 NC[C@H](N)c1cccc(Br)c1 Amb22406446 [0,1,0,0,0,0|2,0,1]=4 2125 B11R1.23 NC[C@H](N)c1cccc(I)c1 Amb24399298 [0,1,0,0,0,0|2,0,1]=4 2126 B11R1.23 NC[C@H](N)c1cccc(O)c1 Amb25145725 [0,1,0,0,0,0|2,0,1]=4 2127 B11R1.23 NC[C@H](O)c1cccc(Br)c1 Amb25306093 [0,1,0,0,0,0|2,0,1]=4 2128 B11R1.23 NC[C@H](O)c1cccc(F)c1 Amb25306092 [0,1,0,0,0,0|2,0,1]=4 2129 B11R1.23 N[C@@H](C#N)c1cccc(Cl)c1 Amb25704370 [0,1,0,0,0,0|2,0,1]=4 2130 B11R1.23 N[C@@H](C#N)c1cccc(F)c1 Amb25216090 [0,1,0,0,0,0|2,0,1]=4 2131 B11R1.23 N[C@@H](C#N)c1cccc(O)c1 Amb25733272 [0,1,0,0,0,0|2,0,1]=4 2132 B11R1.23 N[C@@H](CF)c1cccc(Br)c1 Amb25151825 [0,1,0,0,0,0|2,0,1]=4 2133 B11R1.23 N[C@@H](CF)c1cccc(Cl)c1 Amb25214549 [0,1,0,0,0,0|2,0,1]=4 2134 B11R1.23 N[C@@H](CF)c1cccc(O)c1 Amb24554182 [0,1,0,0,0,0|2,0,1]=4 2135 B11R1.23 N[C@@H](CO)c1cccc(Br)c1 Amb22756526 [0,1,0,0,0,0|1,0,2]=4 2136 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb20242612 [0,1,0,0,0,0|1,0,2]=4 2137 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb23440437 [0,1,0,0,0,0|1,0,2]=4 2138 B11R1.23 N[C@@H](CO)c1cccc(F)c1 Amb22756437 [0,1,0,0,0,0|1,0,2]=4 2139 B11R1.23 N[C@@H](CO)c1cccc(I)c1 Amb23439874 [0,1,0,0,0,0|1,0,2]=4 2140 B11R1.23 N[C@@H](CO)c1cccc(I)c1 Amb25784595 [0,1,0,0,0,0|1,0,2]=4 2141 B11R1.23 N[C@H](C#N)c1cccc(Br)c1 Amb24395320 [0,1,0,0,0,0|2,0,1]=4 2142 B11R1.23 N[C@H](C#N)c1cccc(Cl)c1 Amb25709766 [0,1,0,0,0,0|2,0,1]=4 2143 B11R1.23 N[C@H](C#N)c1cccc(F)c1 Amb24413664 [0,1,0,0,0,0|2,0,1]=4 2144 B11R1.23 N[C@H](CF)c1cccc(Br)c1 Amb25151696 [0,1,0,0,0,0|2,0,1]=4 2145 B11R1.23 N[C@H](CF)c1cccc(Cl)c1 Amb24623067 [0,1,0,0,0,0|2,0,1]=4 2146 B11R1.23 N[C@H](CF)c1cccc(O)c1 Amb25341320 [0,1,0,0,0,0|2,0,1]=4 2147 B11R1.23 N[C@H](CO)c1cc(O)ccc1 Amb25028057 [0,1,0,0,0,0|1,0,2]=4 2148 B11R1.23 N[C@H](CO)c1cccc(Cl)c1 Amb25084835 [0,1,0,0,0,0|1,0,2]=4 2149 B11R1.23 N\C(=C\O)\c1cccc(F)c1 Amb25098587 [0,1,0,0,0,0|1,0,2]=4 2150 B11R1.23 Nc1cc(ccc1)C(O)CO Amb18285028 [0,1,0,0,0,0|1,0,2]=4 2151 B11R1.23 Nc1cccc(c1)C(N)CN Amb24744365 [0,1,0,0,0,0|2,0,1]=4 2152 B11R1.23 Nc1cccc(c1)C(N)CO Amb25843786 [0,1,0,0,0,0|1,0,2]=4 2153 B11R1.23 Nc1cccc(c1)C(O)CN Amb24106017 [0,1,0,0,0,0|2,0,1]=4 2154 B11R1.23 Nc1cccc(c1)[C@@H](N)CO Amb25064777 [0,1,0,0,0,0|1,0,2]=4 2155 B11R1.23 Nc1cccc(c1)[C@H](N)CN Amb25373857 [0,1,0,0,0,0|2,0,1]=4 2156 B11R1.23 Nc1cccc(c1)[C@H](N)CO Amb24710656 [0,1,0,0,0,0|1,0,2]=4 2157 B11R1.23 O=C(C=O)c1cc(Br)ccc1 Amb20671217 [0,1,0,0,0,0|1,0,1]=3 2158 B11R1.23 O=C(C=O)c1cc(Cl)ccc1 Amb18126569 [0,1,0,0,0,0|1,0,1]=3 2159 B11R1.23 O=C(C=O)c1cc(F)c[n]c1 Amb24758374 [0,1,0,0,0,0|2,0,1]=4 2160 B11R1.23 O=CC(=O)c1cccc(c1)Br Amb10067951 [0,1,0,0,0,0|1,0,1]=3 2161 B11R1.23 O=CC(=O)c1cccc(c1)Cl Amb10067952 [0,1,0,0,0,0|1,0,1]=3 2162 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10605526 [0,1,0,0,0,0|1,0,1]=3 2163 B11R1.23 O=CC(=O)c1cccc(c1)F Amb10982490 [0,1,0,0,0,0|1,0,1]=3 2164 B11R1.23 OC(C=O)c1cccc(F)c1 Amb25725746 [0,1,0,0,0,0|1,0,0]=2 2165 B11R1.23 OC(CBr)c1cc(Br)ccc1 Amb24757789 [0,1,0,0,0,0|2,0,1]=4 2166 B11R1.23 OC(CBr)c1cccc(F)c1 Amb25737937 [0,1,0,0,0,0|2,0,1]=4 2167 B11R1.23 OC(CCl)c1cc(Cl)ccc1 Amb19888402 [0,1,0,0,0,0|2,0,1]=4 2168 B11R1.23 OC(CF)c1cccc(Cl)c1 Amb24457870 [0,1,0,0,0,0|2,0,1]=4 2169 B11R1.23 OCC(Cl)c1cc(Cl)ccc1 Amb19888392 [0,1,0,0,0,0|1,0,2]=4 2170 B11R1.23 OCC(F)c1cc(F)ccc1 Amb24055411 [0,1,0,0,0,0|1,0,2]=4 2171 B11R1.23 OCC(O)c1cccc(Br)c1 Amb24123027 [0,1,0,0,0,0|1,0,2]=4 2172 B11R1.23 OCC(O)c1cccc(Cl)c1 Amb24116517 [0,1,0,0,0,0|1,0,2]=4 2173 B11R1.23 OCC(O)c1cccc(F)c1 Amb24123033 [0,1,0,0,0,0|1,0,2]=4 2174 B11R1.23 OCC(c1cccc(c1)Br)N Amb17242180 [0,1,0,0,0,0|1,0,2]=4 2175 B11R1.23 OCC(c1cccc(c1)C)N Amb17232091 [0,1,0,0,0,0|1,0,2]=4 2176 B11R1.23 OCC(c1cccc(c1)Cl)N Amb17232853 [0,1,0,0,0,0|1,0,2]=4 2177 B11R1.23 OC[C@@H](F)c1cccc(Cl)c1 Amb25190307 [0,1,0,0,0,0|1,0,2]=4 2178 B11R1.23 OC[C@@H](O)c1cccc(Cl)c1 Amb22745596 [0,1,0,0,0,0|1,0,2]=4 2179 B11R1.23 OC[C@@H](O)c1cccc(F)c1 Amb24486691 [0,1,0,0,0,0|1,0,2]=4 2180 B11R1.23 OC[C@H](F)c1cccc(Cl)c1 Amb24661231 [0,1,0,0,0,0|1,0,2]=4 2181 B11R1.23 OC[C@H](O)c1cccc(Cl)c1 Amb25230571 [0,1,0,0,0,0|1,0,2]=4 2182 B11R1.23 ONC(c1cccc(c1)N)C Amb10606961 [0,1,0,0,0,0|1,0,1]=3 2183 B11R1.23 O[C@@H](CBr)c1cccc(Cl)c1 Amb25261630 [0,1,0,0,0,0|2,0,1]=4 2184 B11R1.23 O[C@@H](CBr)c1cccc(F)c1 Amb25058326 [0,1,0,0,0,0|2,0,1]=4 2185 B11R1.23 O[C@@H](CCl)c1cccc(Br)c1 Amb25151785 [0,1,0,0,0,0|2,0,1]=4 2186 B11R1.23 O[C@@H](CF)c1cc(F)ccc1 Amb25704260 [0,1,0,0,0,0|2,0,1]=4 2187 B11R1.23 O[C@@H](CF)c1cccc(Cl)c1 Amb24682035 [0,1,0,0,0,0|2,0,1]=4 2188 B11R1.23 O[C@H](CBr)c1cccc(Cl)c1 Amb24428258 [0,1,0,0,0,0|2,0,1]=4 2189 B11R1.23 O[C@H](CCl)c1cc(Cl)ccc1 Amb20241519 [0,1,0,0,0,0|2,0,1]=4 2190 B11R1.23 O[C@H](CCl)c1cccc(Br)c1 Amb25782368 [0,1,0,0,0,0|2,0,1]=4 2191 B11R1.23 O[C@H](CCl)c1cccc(F)c1 Amb24433202 [0,1,0,0,0,0|2,0,1]=4 2192 B11R1.23 O[C@H](CF)c1cc(F)ccc1 Amb24486716 [0,1,0,0,0,0|2,0,1]=4 2193 B11R1.23 O\C=C(\O)/c1cc(O)ccc1 Amb24606550 [0,1,0,0,0,0|1,0,2]=4 2194 B11R1.23 Oc1cc(ccc1)C(=O)C=O Amb18125054 [0,1,0,0,0,0|1,0,1]=3 2195 B11R1.23 Oc1cccc(c1)C(O)CCl Amb24433894 [0,1,0,0,0,0|2,0,1]=4 2196 B11R1.23 Oc1cccc(c1)C(O)CF Amb24501864 [0,1,0,0,0,0|2,0,1]=4 2197 B11R1.23 Oc1cccc(c1)C(O)CO Amb25087164 [0,1,0,0,0,0|1,0,2]=4 2198 B11R1.23 Oc1cccc(c1)[C@@H](O)CCl Amb24562223 [0,1,0,0,0,0|2,0,1]=4 2199 B11R1.23 Oc1cccc(c1)[C@H](O)CF Amb24486794 [0,1,0,0,0,0|2,0,1]=4 2200 B11R1.23 [C-]#[N+]C(c1cccc(c1)Cl)C Amb2235818 [0,1,0,0,0,0|2,0,0]=3 2201 B11R1.23 [NH3+]CC(c1cccc(c1)Cl)O Amb10553101 [0,1,0,0,0,0|2,0,1]=4 2202 B11R1.36 BrC(Br)=C(Br)c1ccccc1 Amb20246913 [0,1,0,0,0,0|2,0,1]=4 2203 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [0,1,0,0,0,0|1,0,0]=2 2204 B11R1.36 C(=C(c1ccccc1)[2H])([2H])[2H] Amb16185561 [0,1,0,0,0,0|2,0,1]=4 2205 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,1,0,0,0,0|2,0,1]=4 2206 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,1,0,0,0,0|0,0,2]=3 2207 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [0,1,0,0,0,0|1,0,2]=4 2208 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [0,1,0,0,0,0|1,0,2]=4 2209 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [0,1,0,0,0,0|1,0,2]=4 2210 B11R1.36 C=C(F)C(=O)c1ccccc1 Amb25347602 [0,1,0,0,0,0|2,0,1]=4 2211 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [0,1,0,0,0,0|2,0,0]=3 2212 B11R1.36 CC(=C)C(N)c1cc[n]cc1 Amb25149238 [0,1,0,0,0,0|3,0,0]=4 2213 B11R1.36 CC(=C)C(N)c1ccc[n]c1 Amb25297470 [0,1,0,0,0,0|3,0,0]=4 2214 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [0,1,0,0,0,0|2,0,0]=3 2215 B11R1.36 CC(=C)C(O)c1cc[n]cc1 Amb24447288 [0,1,0,0,0,0|3,0,0]=4 2216 B11R1.36 CC(=C)C(O)c1ccc[n]c1 Amb25687146 [0,1,0,0,0,0|3,0,0]=4 2217 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [0,1,0,0,0,0|2,0,1]=4 2218 B11R1.36 CC(=N)N(C)c1ccccc1 Amb24432936 [0,1,0,0,0,0|2,0,0]=3 2219 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,1,0,0,0,0|0,0,2]=3 2220 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [0,1,0,0,0,0|2,0,1]=4 2221 B11R1.36 CC(=O)C(F)c1cc[n]cc1 Amb25739565 [0,1,0,0,0,0|2,0,0]=3 2222 B11R1.36 CC(=O)C(N)c1cccc[n]1 Amb25082427 [0,1,0,0,0,0|2,0,0]=3 2223 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,1,0,0,0,0|1,0,0]=2 2224 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [0,1,0,0,0,0|2,0,0]=3 2225 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [0,1,0,0,0,0|2,0,0]=3 2226 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [0,1,0,0,0,0|1,0,0]=2 2227 B11R1.36 CC(=O)C(c1ccccn1)Cl Amb17477809 [0,1,0,0,0,0|2,0,0]=3 2228 B11R1.36 CC(=O)C(c1cccnc1)Cl Amb17477811 [0,1,0,0,0,0|2,0,0]=3 2229 B11R1.36 CC(=O)N(C)c1[n]ccc[n]1 Amb24484056 [0,1,0,0,0,0|3,0,0]=4 2230 B11R1.36 CC(=O)N(C)c1c[n]cc[n]1 Amb25220782 [0,1,0,0,0,0|3,0,0]=4 2231 B11R1.36 CC(=O)N(C)c1cc[n]c[n]1 Amb25098245 [0,1,0,0,0,0|3,0,0]=4 2232 B11R1.36 CC(=O)N(C)c1cc[n]cc1 Amb25049376 [0,1,0,0,0,0|2,0,0]=3 2233 B11R1.36 CC(=O)N(C)c1cccc[n]1 Amb24096739 [0,1,0,0,0,0|2,0,0]=3 2234 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,1,0,0,0,0|2,0,0]=3 2235 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [0,1,0,0,0,0|1,0,0]=2 2236 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,1,0,0,0,0|1,0,0]=2 2237 B11R1.36 CC(=S)N(C)c1cccc[n]1 Amb24096740 [0,1,0,0,0,0|2,1,0]=4 2238 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [0,1,0,0,0,0|2,0,1]=4 2239 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [0,1,0,0,0,0|2,0,1]=4 2240 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [0,1,0,0,0,0|2,0,1]=4 2241 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [0,1,0,0,0,0|2,0,1]=4 2242 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [0,1,0,0,0,0|2,0,1]=4 2243 B11R1.36 CC(C(C)Br)c1c[n]ccc1 Amb24594038 [0,1,0,0,0,0|2,0,1]=4 2244 B11R1.36 CC(C(C)Br)c1cccc[n]1 Amb24585036 [0,1,0,0,0,0|2,0,1]=4 2245 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [0,1,0,0,0,0|1,0,1]=3 2246 B11R1.36 CC(C(C)Cl)c1c[n]ccc1 Amb24660277 [0,1,0,0,0,0|2,0,1]=4 2247 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [0,1,0,0,0,0|1,0,1]=3 2248 B11R1.36 CC(C(C)N)c1c[n]ccc1 Amb18201853 [0,1,0,0,0,0|2,0,1]=4 2249 B11R1.36 CC(C(C)N)c1cc[n]cc1 Amb18201858 [0,1,0,0,0,0|2,0,1]=4 2250 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [0,1,0,0,0,0|1,0,1]=3 2251 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [0,1,0,0,0,0|1,0,1]=3 2252 B11R1.36 CC(C(Cl)Cl)c1ccccc1 Amb24390914 [0,1,0,0,0,0|1,0,1]=3 2253 B11R1.36 CC(C(F)F)c1ccccc1 Amb20669786 [0,1,0,0,0,0|1,0,1]=3 2254 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [0,1,0,0,0,0|1,0,0]=2 2255 B11R1.36 CC(C(N)=O)c1c[n]c[n]c1 Amb24704219 [0,1,0,0,0,0|2,0,0]=3 2256 B11R1.36 CC(C(N)=O)c1c[n]cc[n]1 Amb25708509 [0,1,0,0,0,0|2,0,0]=3 2257 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [0,1,0,0,0,0|1,0,0]=2 2258 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,1,0,0,0,0|0,0,0]=1 2259 B11R1.36 CC(C(N)=S)c1cccc[n]1 Amb22397083 [0,1,0,0,0,0|1,1,0]=3 2260 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [0,1,0,0,0,0|1,0,0]=2 2261 B11R1.36 CC(C(O)=O)c1c[n]c[n]c1 Amb18962092 [0,1,0,0,0,0|2,0,0]=3 2262 B11R1.36 CC(C(O)=O)c1c[n]cc[n]1 Amb24070205 [0,1,0,0,0,0|2,0,0]=3 2263 B11R1.36 CC(C(O)=O)c1cc[n]c[n]1 Amb18201427 [0,1,0,0,0,0|2,0,0]=3 2264 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [0,1,0,0,0,0|1,0,0]=2 2265 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [0,1,0,0,0,0|1,0,0]=2 2266 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [0,1,0,0,0,0|1,0,0]=2 2267 B11R1.36 CC(C(c1ccccn1)C)C Amb10573727 [0,1,0,0,0,0|2,0,1]=4 2268 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [0,1,0,0,0,0|2,0,1]=4 2269 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [0,1,0,0,0,0|2,0,1]=4 2270 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [0,1,0,0,0,0|2,0,1]=4 2271 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [0,1,0,0,0,0|2,0,1]=4 2272 B11R1.36 CC(C)N(C)c1ccccc1 Amb24096678 [0,1,0,0,0,0|2,0,1]=4 2273 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [0,1,0,0,0,0|2,0,1]=4 2274 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [0,1,0,0,0,0|2,0,1]=4 2275 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [0,1,0,0,0,0|2,0,1]=4 2276 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [0,1,0,0,0,0|2,0,1]=4 2277 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [0,1,0,0,0,0|2,0,1]=4 2278 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [0,1,0,0,0,0|2,0,1]=4 2279 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [0,1,0,0,0,0|2,0,1]=4 2280 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [0,1,0,0,0,0|2,0,1]=4 2281 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [0,1,0,0,0,0|2,0,1]=4 2282 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [0,1,0,0,0,0|2,0,1]=4 2283 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [0,1,0,0,0,0|1,0,2]=4 2284 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [0,1,0,0,0,0|1,0,2]=4 2285 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [0,1,0,0,0,0|1,0,2]=4 2286 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [0,1,0,0,0,0|1,0,2]=4 2287 B11R1.36 CC(c1cc[n]cc1)[N+]([O-])=O Amb24620457 [0,1,0,0,0,0|2,0,0]=3 2288 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [0,1,0,0,0,0|0,0,0]=1 2289 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [0,1,0,0,0,0|0,1,0]=2 2290 B11R1.36 CN(C(N)=N)c1ccccc1 Amb19148904 [0,1,0,0,0,0|2,0,0]=3 2291 B11R1.36 CN(C(N)=O)c1ccc[n]c1 Amb25352855 [0,1,0,0,0,0|2,0,0]=3 2292 B11R1.36 CN(C(S)=S)c1ccccc1 Amb24732198 [0,1,0,0,0,0|1,1,0]=3 2293 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [0,1,0,0,0,0|3,0,0]=4 2294 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [0,1,0,0,0,0|3,0,0]=4 2295 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [0,1,0,0,0,0|3,0,0]=4 2296 B11R1.36 CN(c1cccc[n]1)[N+]([O-])=O Amb25794224 [0,1,0,0,0,0|3,0,0]=4 2297 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [0,1,0,0,0,0|1,0,0]=2 2298 B11R1.36 CN(c1ccccc1)C(=S)N Amb1132381 [0,1,0,0,0,0|1,1,0]=3 2299 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [0,1,0,0,0,0|2,0,0]=3 2300 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [0,1,0,0,0,0|1,0,1]=3 2301 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [0,1,0,0,0,0|1,0,1]=3 2302 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [0,1,0,0,0,0|0,1,0]=2 2303 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [0,1,0,0,0,0|2,0,1]=4 2304 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [0,1,0,0,0,0|2,0,1]=4 2305 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [0,1,0,0,0,0|2,0,1]=4 2306 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [0,1,0,0,0,0|2,0,1]=4 2307 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [0,1,0,0,0,0|2,0,1]=4 2308 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [0,1,0,0,0,0|1,0,2]=4 2309 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [0,1,0,0,0,0|1,0,2]=4 2310 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [0,1,0,0,0,0|1,0,2]=4 2311 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [0,1,0,0,0,0|1,0,2]=4 2312 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [0,1,0,0,0,0|1,0,2]=4 2313 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [0,1,0,0,0,0|1,0,2]=4 2314 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [0,1,0,0,0,0|1,0,2]=4 2315 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [0,1,0,0,0,0|1,0,1]=3 2316 B11R1.36 C[C@@H](c1cccc[n]1)N(C)C Amb25858370 [0,1,0,0,0,0|3,0,0]=4 2317 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [0,1,0,0,0,0|2,0,0]=3 2318 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [0,1,0,0,0,0|0,0,2]=3 2319 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [0,1,0,0,0,0|2,0,1]=4 2320 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [0,1,0,0,0,0|2,0,1]=4 2321 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [0,1,0,0,0,0|2,0,1]=4 2322 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [0,1,0,0,0,0|1,0,1]=3 2323 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [0,1,0,0,0,0|0,0,2]=3 2324 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [0,1,0,0,0,0|2,0,1]=4 2325 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [0,1,0,0,0,0|2,0,1]=4 2326 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [0,1,0,0,0,0|2,0,1]=4 2327 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [0,1,0,0,0,0|2,0,1]=4 2328 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [0,1,0,0,0,0|2,0,1]=4 2329 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [0,1,0,0,0,0|2,0,1]=4 2330 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [0,1,0,0,0,0|2,0,1]=4 2331 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [0,1,0,0,0,0|2,0,1]=4 2332 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [0,1,0,0,0,0|2,0,1]=4 2333 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [0,1,0,0,0,0|1,0,2]=4 2334 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [0,1,0,0,0,0|1,0,2]=4 2335 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [0,1,0,0,0,0|1,0,2]=4 2336 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [0,1,0,0,0,0|1,0,2]=4 2337 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [0,1,0,0,0,0|1,0,2]=4 2338 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,1,0,0,0,0|1,0,2]=4 2339 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [0,1,0,0,0,0|1,0,1]=3 2340 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [0,1,0,0,0,0|2,0,1]=4 2341 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [0,1,0,0,0,0|1,0,1]=3 2342 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [0,1,0,0,0,0|2,0,1]=4 2343 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [0,1,0,0,0,0|1,0,0]=2 2344 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [0,1,0,0,0,0|2,0,1]=4 2345 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [0,1,0,0,0,0|2,0,1]=4 2346 B11R1.36 ClC(c1ccncc1)C(=O)C Amb17477810 [0,1,0,0,0,0|2,0,0]=3 2347 B11R1.36 FC(=C(F)F)c1ccccc1 Amb10839818 [0,1,0,0,0,0|2,0,1]=4 2348 B11R1.36 FC(C(Cl)Cl)c1ccccc1 Amb25362359 [0,1,0,0,0,0|2,0,1]=4 2349 B11R1.36 FC(Cl)C(Cl)c1ccccc1 Amb24470147 [0,1,0,0,0,0|2,0,1]=4 2350 B11R1.36 FC(F)=C(Br)c1ccccc1 Amb22008100 [0,1,0,0,0,0|2,0,1]=4 2351 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [0,1,0,0,0,0|2,0,1]=4 2352 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [0,1,0,0,0,0|2,0,1]=4 2353 B11R1.36 F\C(=C(\Cl)/F)\c1ccccc1 Amb13952905 [0,1,0,0,0,0|2,0,1]=4 2354 B11R1.36 F\C(\c1ccccc1)=C(\F)/Cl Amb25776764 [0,1,0,0,0,0|2,0,1]=4 2355 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,1,0,0,0,0|1,0,1]=3 2356 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [0,1,0,0,0,0|2,0,0]=3 2357 B11R1.36 N=C(c1ccccc1)C(=N)Cl Amb25236876 [0,1,0,0,0,0|2,0,1]=4 2358 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [0,1,0,0,0,0|2,0,0]=3 2359 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [0,1,0,0,0,0|2,0,0]=3 2360 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [0,1,0,0,0,0|2,0,0]=3 2361 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [0,1,0,0,0,0|2,0,0]=3 2362 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,1,0,0,0,0|1,0,1]=3 2363 B11R1.36 NC(=O)C(=O)c1c[n]ccc1 Amb18063199 [0,1,0,0,0,0|2,0,1]=4 2364 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,1,0,0,0,0|1,0,1]=3 2365 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,1,0,0,0,0|1,0,0]=2 2366 B11R1.36 NC(=O)C(Cl)c1ccc[n]c1 Amb18185667 [0,1,0,0,0,0|2,0,0]=3 2367 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [0,1,0,0,0,0|1,0,0]=2 2368 B11R1.36 NC(=O)C(O)c1c[n]c[n]c1 Amb24552586 [0,1,0,0,0,0|3,0,0]=4 2369 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [0,1,0,0,0,0|2,0,0]=3 2370 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [0,1,0,0,0,0|2,0,0]=3 2371 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [0,1,0,0,0,0|2,0,0]=3 2372 B11R1.36 NC(=O)C(c1ccccn1)N Amb17334311 [0,1,0,0,0,0|2,0,0]=3 2373 B11R1.36 NC(=O)C(c1cccnc1)N Amb17334312 [0,1,0,0,0,0|2,0,0]=3 2374 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [0,1,0,0,0,0|2,0,0]=3 2375 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,1,0,0,0,0|2,0,0]=3 2376 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [0,1,0,0,0,0|1,0,0]=2 2377 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,1,0,0,0,0|1,0,0]=2 2378 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,1,0,0,0,0|1,0,0]=2 2379 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [0,1,0,0,0,0|1,0,0]=2 2380 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [0,1,0,0,0,0|1,0,0]=2 2381 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,1,0,0,0,0|1,0,0]=2 2382 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,1,0,0,0,0|1,0,0]=2 2383 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [0,1,0,0,0,0|1,1,0]=3 2384 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,1,0,0,0,0|1,0,0]=2 2385 B11R1.36 NC(C(Cl)Cl)c1ccccc1 Amb25299414 [0,1,0,0,0,0|2,0,1]=4 2386 B11R1.36 NC(C(O)=O)c1[n]ccc[n]1 Amb24738404 [0,1,0,0,0,0|3,0,0]=4 2387 B11R1.36 NC(C(O)=O)c1c[n]c[n]c1 Amb24485788 [0,1,0,0,0,0|3,0,0]=4 2388 B11R1.36 NC(C(O)=O)c1c[n]cc[n]1 Amb22899538 [0,1,0,0,0,0|3,0,0]=4 2389 B11R1.36 NC(C(O)=O)c1ccc[n][n]1 Amb18201157 [0,1,0,0,0,0|3,0,0]=4 2390 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [0,1,0,0,0,0|2,0,0]=3 2391 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [0,1,0,0,0,0|1,0,0]=2 2392 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [0,1,0,0,0,0|1,0,0]=2 2393 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,1,0,0,0,0|1,0,0]=2 2394 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [0,1,0,0,0,0|2,0,1]=4 2395 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [0,1,0,0,0,0|2,0,0]=3 2396 B11R1.36 NC(c1ccncc1)C(=O)N Amb17334313 [0,1,0,0,0,0|2,0,0]=3 2397 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,1,0,0,0,0|1,0,0]=2 2398 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,1,0,0,0,0|1,0,0]=2 2399 B11R1.36 N[C@@H](C(O)=O)c1c[n]c[n]c1 Amb24485751 [0,1,0,0,0,0|3,0,0]=4 2400 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [0,1,0,0,0,0|2,0,0]=3 2401 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,1,0,0,0,0|1,0,0]=2 2402 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [0,1,0,0,0,0|1,0,0]=2 2403 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [0,1,0,0,0,0|2,0,1]=4 2404 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [0,1,0,0,0,0|1,0,0]=2 2405 B11R1.36 N[C@H](C(F)F)c1ccccc1 Amb24485821 [0,1,0,0,0,0|2,0,1]=4 2406 B11R1.36 N[C@H](C(O)=O)c1c[n]c[n]c1 Amb24484501 [0,1,0,0,0,0|3,0,0]=4 2407 B11R1.36 N[C@H](c1ccccc1)P(O)O Amb25301291 [0,1,0,0,0,0|2,0,1]=4 2408 B11R1.36 O=C(C(=S)Cl)c1ccccc1 Amb24096825 [0,1,0,0,0,0|1,1,1]=4 2409 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [0,1,0,0,0,0|1,0,0]=2 2410 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [0,1,0,0,0,0|2,0,1]=4 2411 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,1,0,0,0,0|1,0,1]=3 2412 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,1,0,0,0,0|1,0,1]=3 2413 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,1,0,0,0,0|1,0,1]=3 2414 B11R1.36 OB(O)C(Cl)c1ccccc1 Amb24468112 [0,1,0,0,0,0|2,0,1]=4 2415 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [0,1,0,0,0,0|2,0,1]=4 2416 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [0,1,0,0,0,0|2,0,1]=4 2417 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [0,1,0,0,0,0|2,0,1]=4 2418 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [0,1,0,0,0,0|2,0,1]=4 2419 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [0,1,0,0,0,0|2,0,0]=3 2420 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [0,1,0,0,0,0|2,0,0]=3 2421 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [0,1,0,0,0,0|2,0,0]=3 2422 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [0,1,0,0,0,0|2,0,0]=3 2423 B11R1.36 OC(=O)C(F)c1c[n]cc[n]1 Amb25358269 [0,1,0,0,0,0|3,0,0]=4 2424 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [0,1,0,0,0,0|2,0,0]=3 2425 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [0,1,0,0,0,0|2,0,0]=3 2426 B11R1.36 OC(=O)C(O)c1c[n]cc[n]1 Amb18200877 [0,1,0,0,0,0|3,0,0]=4 2427 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,1,0,0,0,0|2,0,0]=3 2428 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,1,0,0,0,0|2,0,0]=3 2429 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,1,0,0,0,0|2,0,0]=3 2430 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,1,0,0,0,0|2,0,0]=3 2431 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,1,0,0,0,0|1,0,0]=2 2432 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,1,0,0,0,0|1,0,0]=2 2433 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,1,0,0,0,0|1,0,0]=2 2434 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [0,1,0,0,0,0|2,0,0]=3 2435 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,1,0,0,0,0|1,0,0]=2 2436 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,1,0,0,0,0|2,0,0]=3 2437 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,1,0,0,0,0|1,0,0]=2 2438 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,1,0,0,0,0|2,0,0]=3 2439 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,1,0,0,0,0|1,0,0]=2 2440 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,1,0,0,0,0|1,0,0]=2 2441 B11R1.36 OC(C(F)Cl)c1ccccc1 Amb24509297 [0,1,0,0,0,0|2,0,1]=4 2442 B11R1.36 OC(C(F)F)c1ccccc1 Amb19895457 [0,1,0,0,0,0|2,0,1]=4 2443 B11R1.36 OC(c1c[n]ccc1)P(O)=O Amb24502009 [0,1,0,0,0,0|3,0,0]=4 2444 B11R1.36 OC(c1ccccc1)=C(Cl)Cl Amb24101433 [0,1,0,0,0,0|2,0,1]=4 2445 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [0,1,0,0,0,0|2,0,0]=3 2446 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,1,0,0,0,0|1,0,0]=2 2447 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [0,1,0,0,0,0|2,0,1]=4 2448 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,1,0,0,0,0|2,0,0]=3 2449 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,1,0,0,0,0|1,0,0]=2 2450 B11R1.36 O[C@@H](C(F)Cl)c1ccccc1 Amb25028097 [0,1,0,0,0,0|2,0,1]=4 2451 B11R1.36 O[C@@H]([C@H](F)Cl)c1ccccc1 Amb24390849 [0,1,0,0,0,0|2,0,1]=4 2452 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,1,0,0,0,0|1,0,0]=2 2453 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [0,1,0,0,0,0|2,0,1]=4 2454 B11R1.36 O[C@H](C(F)Cl)c1ccccc1 Amb24487906 [0,1,0,0,0,0|2,0,1]=4 2455 B11R1.36 O[C@H](C(F)F)c1ccccc1 Amb24623094 [0,1,0,0,0,0|2,0,1]=4 2456 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [0,1,0,0,0,0|2,0,1]=4 2457 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [0,1,0,0,0,0|1,0,0]=2 2458 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,1,0,0,0,0|1,0,0]=2 2459 B11R1.36 [O-]C(=O)C(O)c1cccc[n]1 Amb23452663 [0,1,0,0,0,0|2,0,0]=3 2460 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,1,0,0,0,0|1,0,0]=2 2461 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,1,0,0,0,0|1,0,0]=2 2462 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [0,1,0,0,0,0|2,0,0]=3 2463 B11R1.36 [O-]P(=O)C(c1cccnc1)O Amb1089262 [0,1,0,0,0,0|3,0,0]=4 2464 B11R1.222 BrC[C@@H](c1ccccc1F)O Amb16233246 [0,1,0,0,0,0|2,0,1]=4 2465 B11R1.222 C#CC(N)c1ccccc1Br Amb23448711 [0,1,0,0,0,0|2,0,1]=4 2466 B11R1.222 C#CC(N)c1ccccc1Cl Amb23448710 [0,1,0,0,0,0|2,0,1]=4 2467 B11R1.222 C#CC(N)c1ccccc1F Amb23448709 [0,1,0,0,0,0|2,0,1]=4 2468 B11R1.222 C#CC(N)c1ccccc1I Amb25118811 [0,1,0,0,0,0|2,0,1]=4 2469 B11R1.222 C#CC(N)c1ccccc1O Amb23448712 [0,1,0,0,0,0|2,0,1]=4 2470 B11R1.222 C#CC(O)c1ccccc1F Amb24711208 [0,1,0,0,0,0|2,0,1]=4 2471 B11R1.222 C#CC(O)c1ccccc1N Amb24470752 [0,1,0,0,0,0|2,0,1]=4 2472 B11R1.222 C#C[C@@H](O)c1ccccc1Cl Amb25130921 [0,1,0,0,0,0|2,0,1]=4 2473 B11R1.222 C#C[C@H](O)c1ccccc1Cl Amb25763975 [0,1,0,0,0,0|2,0,1]=4 2474 B11R1.222 C#C[C@H](O)c1ccccc1F Amb25792658 [0,1,0,0,0,0|2,0,1]=4 2475 B11R1.222 C=C(C=C)c1ccccc1O Amb25144658 [0,1,0,0,0,0|1,0,2]=4 2476 B11R1.222 C=CC(=O)c1ccccc1Cl Amb25307612 [0,1,0,0,0,0|2,0,1]=4 2477 B11R1.222 C=CC(=O)c1ccccc1O Amb17593686 [0,1,0,0,0,0|2,0,1]=4 2478 B11R1.222 C=CC(N)c1[n]cccc1Cl Amb25744579 [0,1,0,0,0,0|3,0,0]=4 2479 B11R1.222 C=CC(N)c1[n]cccc1F Amb25314349 [0,1,0,0,0,0|3,0,0]=4 2480 B11R1.222 C=CC(N)c1[n]cccc1N Amb25800352 [0,1,0,0,0,0|3,0,0]=4 2481 B11R1.222 C=CC(N)c1c[n]ccc1Br Amb25147920 [0,1,0,0,0,0|3,0,0]=4 2482 B11R1.222 C=CC(N)c1c[n]ccc1Cl Amb24392881 [0,1,0,0,0,0|3,0,0]=4 2483 B11R1.222 C=CC(N)c1c[n]ccc1N Amb25809040 [0,1,0,0,0,0|3,0,0]=4 2484 B11R1.222 C=CC(N)c1cc[n]cc1Cl Amb25850617 [0,1,0,0,0,0|3,0,0]=4 2485 B11R1.222 C=CC(N)c1cc[n]cc1F Amb24341340 [0,1,0,0,0,0|3,0,0]=4 2486 B11R1.222 C=CC(N)c1cc[n]cc1N Amb25314365 [0,1,0,0,0,0|3,0,0]=4 2487 B11R1.222 C=CC(N)c1ccc[n]c1Br Amb25849675 [0,1,0,0,0,0|3,0,0]=4 2488 B11R1.222 C=CC(N)c1ccc[n]c1S Amb25311850 [0,1,0,0,0,0|3,0,0]=4 2489 B11R1.222 C=CC(N)c1ccccc1Br Amb25856652 [0,1,0,0,0,0|2,0,0]=3 2490 B11R1.222 C=CC(N)c1ccccc1Cl Amb25798367 [0,1,0,0,0,0|2,0,0]=3 2491 B11R1.222 C=CC(N)c1ccccc1N Amb25843316 [0,1,0,0,0,0|2,0,0]=3 2492 B11R1.222 C=CC(N)c1ccccc1O Amb24484534 [0,1,0,0,0,0|2,0,0]=3 2493 B11R1.222 C=CC(N)c1ccccc1S Amb24484533 [0,1,0,0,0,0|2,0,0]=3 2494 B11R1.222 C=CC(O)c1[n]cccc1Cl Amb25760681 [0,1,0,0,0,0|3,0,0]=4 2495 B11R1.222 C=CC(O)c1cc[n]cc1Cl Amb24340414 [0,1,0,0,0,0|3,0,0]=4 2496 B11R1.222 C=CC(O)c1cc[n]cc1F Amb25855888 [0,1,0,0,0,0|3,0,0]=4 2497 B11R1.222 C=CC(O)c1ccccc1Cl Amb25208356 [0,1,0,0,0,0|2,0,0]=3 2498 B11R1.222 C=CC(O)c1ccccc1F Amb25208364 [0,1,0,0,0,0|2,0,0]=3 2499 B11R1.222 C=CC(O)c1ccccc1N Amb25104594 [0,1,0,0,0,0|2,0,0]=3 2500 B11R1.222 C=CC(O)c1ccccc1O Amb18644420 [0,1,0,0,0,0|2,0,0]=3 2501 B11R1.222 C=CS(=O)c1ccccc1N Amb25217629 [0,1,0,0,0,0|3,0,0]=4 2502 B11R1.222 C=C[C@@H](N)c1[n]cccc1F Amb24551028 [0,1,0,0,0,0|3,0,0]=4 2503 B11R1.222 C=C[C@@H](N)c1[n]cccc1N Amb25719407 [0,1,0,0,0,0|3,0,0]=4 2504 B11R1.222 C=C[C@@H](N)c1c[n]ccc1N Amb25144013 [0,1,0,0,0,0|3,0,0]=4 2505 B11R1.222 C=C[C@@H](N)c1cc[n]cc1Br Amb24616811 [0,1,0,0,0,0|3,0,0]=4 2506 B11R1.222 C=C[C@@H](N)c1ccc[n]c1S Amb24691629 [0,1,0,0,0,0|3,0,0]=4 2507 B11R1.222 C=C[C@@H](N)c1ccccc1N Amb25096846 [0,1,0,0,0,0|2,0,0]=3 2508 B11R1.222 C=C[C@@H](N)c1ccccc1O Amb25145731 [0,1,0,0,0,0|2,0,0]=3 2509 B11R1.222 C=C[C@@H](O)c1ccccc1F Amb24461194 [0,1,0,0,0,0|2,0,0]=3 2510 B11R1.222 C=C[C@H](N)c1[n]cccc1F Amb24484448 [0,1,0,0,0,0|3,0,0]=4 2511 B11R1.222 C=C[C@H](N)c1cc[n]cc1Br Amb24436060 [0,1,0,0,0,0|3,0,0]=4 2512 B11R1.222 C=C[C@H](N)c1cc[n]cc1Cl Amb25120964 [0,1,0,0,0,0|3,0,0]=4 2513 B11R1.222 C=C[C@H](N)c1cc[n]cc1F Amb25841106 [0,1,0,0,0,0|3,0,0]=4 2514 B11R1.222 C=C[C@H](N)c1ccc[n]c1O Amb25757279 [0,1,0,0,0,0|3,0,0]=4 2515 B11R1.222 C=C[C@H](N)c1ccccc1Br Amb25147895 [0,1,0,0,0,0|2,0,0]=3 2516 B11R1.222 C=C[C@H](N)c1ccccc1Cl Amb24624102 [0,1,0,0,0,0|2,0,0]=3 2517 B11R1.222 C=C[C@H](N)c1ccccc1O Amb24538251 [0,1,0,0,0,0|2,0,0]=3 2518 B11R1.222 C=C[C@H](N)c1ccccc1S Amb24378936 [0,1,0,0,0,0|2,0,0]=3 2519 B11R1.222 CC(=C=C)c1ccccc1O Amb25188735 [0,1,0,0,0,0|1,0,2]=4 2520 B11R1.222 CC(=NO)c1ccccc1N Amb24059902 [0,1,0,0,0,0|1,0,2]=4 2521 B11R1.222 CC(C#N)c1[n]cccc1Br Amb25208560 [0,1,0,0,0,0|2,0,1]=4 2522 B11R1.222 CC(C#N)c1ccccc1Br Amb18131118 [0,1,0,0,0,0|1,0,1]=3 2523 B11R1.222 CC(C#N)c1ccccc1Cl Amb18126434 [0,1,0,0,0,0|1,0,1]=3 2524 B11R1.222 CC(C#N)c1ccccc1I Amb24683473 [0,1,0,0,0,0|1,0,1]=3 2525 B11R1.222 CC(C#N)c1ccccc1N Amb25368325 [0,1,0,0,0,0|1,0,1]=3 2526 B11R1.222 CC(C#N)c1ccccc1O Amb25718410 [0,1,0,0,0,0|1,0,1]=3 2527 B11R1.222 CC(C=C)c1ccccc1N Amb18124835 [0,1,0,0,0,0|1,0,0]=2 2528 B11R1.222 CC(C=C)c1ccccc1O Amb18124915 [0,1,0,0,0,0|1,0,0]=2 2529 B11R1.222 CC(C=O)c1ccccc1Br Amb25103832 [0,1,0,0,0,0|0,0,0]=1 2530 B11R1.222 CC(C=O)c1ccccc1F Amb24070131 [0,1,0,0,0,0|0,0,0]=1 2531 B11R1.222 CC(C=O)c1ccccc1O Amb18125106 [0,1,0,0,0,0|0,0,0]=1 2532 B11R1.222 CC(CBr)c1ccccc1Cl Amb25148944 [0,1,0,0,0,0|1,0,1]=3 2533 B11R1.222 CC(CCl)c1ccccc1Br Amb25055326 [0,1,0,0,0,0|1,0,1]=3 2534 B11R1.222 CC(CCl)c1ccccc1F Amb25098050 [0,1,0,0,0,0|1,0,1]=3 2535 B11R1.222 CC(CN)N1C=CC=CC1=O Amb18542686 [0,1,0,0,0,0|2,0,1]=4 2536 B11R1.222 CC(CN)c1[n]cccc1Br Amb24486134 [0,1,0,0,0,0|2,0,1]=4 2537 B11R1.222 CC(CN)c1cc[n]cc1F Amb25677090 [0,1,0,0,0,0|2,0,1]=4 2538 B11R1.222 CC(CN)c1ccccc1Br Amb18174811 [0,1,0,0,0,0|1,0,1]=3 2539 B11R1.222 CC(CN)c1ccccc1I Amb24558935 [0,1,0,0,0,0|1,0,1]=3 2540 B11R1.222 CC(CN)c1ccccc1N Amb24069931 [0,1,0,0,0,0|1,0,1]=3 2541 B11R1.222 CC(CN)c1ccccc1O Amb25100841 [0,1,0,0,0,0|1,0,1]=3 2542 B11R1.222 CC(CO)c1[n]cccc1Cl Amb24383834 [0,1,0,0,0,0|1,0,2]=4 2543 B11R1.222 CC(CO)c1ccccc1Br Amb24453441 [0,1,0,0,0,0|0,0,2]=3 2544 B11R1.222 CC(CO)c1ccccc1I Amb25140003 [0,1,0,0,0,0|0,0,2]=3 2545 B11R1.222 CC(NN)c1[n]cccc1Br Amb24741357 [0,1,0,0,0,0|3,0,0]=4 2546 B11R1.222 CC(NN)c1[n]cccc1Cl Amb25190529 [0,1,0,0,0,0|3,0,0]=4 2547 B11R1.222 CC(NN)c1cc[n]cc1Br Amb25216749 [0,1,0,0,0,0|3,0,0]=4 2548 B11R1.222 CC(NN)c1ccc[n]c1Cl Amb25843836 [0,1,0,0,0,0|3,0,0]=4 2549 B11R1.222 CC(NN)c1ccccc1N Amb25235230 [0,1,0,0,0,0|2,0,0]=3 2550 B11R1.222 CC(NO)c1ccccc1Br Amb25354525 [0,1,0,0,0,0|1,0,1]=3 2551 B11R1.222 CC(NO)c1ccccc1Cl Amb25782559 [0,1,0,0,0,0|1,0,1]=3 2552 B11R1.222 CC(NO)c1ccccc1O Amb25728343 [0,1,0,0,0,0|1,0,1]=3 2553 B11R1.222 CCC(Br)c1ccccc1Br Amb25797706 [0,1,0,0,0,0|2,0,1]=4 2554 B11R1.222 CCC(C)c1[n]cccc1Br Amb24320822 [0,1,0,0,0,0|2,0,1]=4 2555 B11R1.222 CCC(C)c1[n]cccc1N Amb18201845 [0,1,0,0,0,0|2,0,1]=4 2556 B11R1.222 CCC(C)c1c[n]ccc1Br Amb24320591 [0,1,0,0,0,0|2,0,1]=4 2557 B11R1.222 CCC(C)c1c[n]ccc1N Amb24320593 [0,1,0,0,0,0|2,0,1]=4 2558 B11R1.222 CCC(C)c1cc[n]cc1Br Amb24321010 [0,1,0,0,0,0|2,0,1]=4 2559 B11R1.222 CCC(C)c1cc[n]cc1N Amb18831281 [0,1,0,0,0,0|2,0,1]=4 2560 B11R1.222 CCC(C)c1ccc[n]c1Br Amb24319292 [0,1,0,0,0,0|2,0,1]=4 2561 B11R1.222 CCC(C)c1ccc[n]c1Cl Amb24319293 [0,1,0,0,0,0|2,0,1]=4 2562 B11R1.222 CCC(C)c1ccc[n]c1N Amb18201848 [0,1,0,0,0,0|2,0,1]=4 2563 B11R1.222 CCC(C)c1ccc[n]c1O Amb24319294 [0,1,0,0,0,0|2,0,1]=4 2564 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [0,1,0,0,0,0|1,0,1]=3 2565 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [0,1,0,0,0,0|1,0,1]=3 2566 B11R1.222 CCC(Cl)c1ccccc1Br Amb25028217 [0,1,0,0,0,0|2,0,1]=4 2567 B11R1.222 CCC(Cl)c1ccccc1F Amb24440580 [0,1,0,0,0,0|2,0,1]=4 2568 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [0,1,0,0,0,0|2,0,1]=4 2569 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [0,1,0,0,0,0|2,0,1]=4 2570 B11R1.222 CCC(N)c1ccccc1N Amb24069932 [0,1,0,0,0,0|2,0,1]=4 2571 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [0,1,0,0,0,0|2,0,1]=4 2572 B11R1.222 CCC(N)c1ccccc1S Amb25225261 [0,1,0,0,0,0|2,0,1]=4 2573 B11R1.222 CCC(O)c1ccccc1I Amb25214528 [0,1,0,0,0,0|2,0,1]=4 2574 B11R1.222 CCC(O)c1ccccc1N Amb18125284 [0,1,0,0,0,0|2,0,1]=4 2575 B11R1.222 CCC(c1ccccc1C)N Amb17232057 [0,1,0,0,0,0|2,0,1]=4 2576 B11R1.222 CCC(c1ccccc1C)O Amb17232069 [0,1,0,0,0,0|2,0,1]=4 2577 B11R1.222 CCC(c1ccccc1Cl)N Amb17232736 [0,1,0,0,0,0|2,0,1]=4 2578 B11R1.222 CCC(c1ccccc1Cl)O Amb17232794 [0,1,0,0,0,0|2,0,1]=4 2579 B11R1.222 CCC(c1ccccc1F)N Amb10840595 [0,1,0,0,0,0|2,0,1]=4 2580 B11R1.222 CCC(c1ccccc1O)N Amb1118100 [0,1,0,0,0,0|2,0,1]=4 2581 B11R1.222 CCC(c1ccccc1O)O Amb1111067 [0,1,0,0,0,0|2,0,1]=4 2582 B11R1.222 CC[C@@H](C)c1ccccc1N Amb24101983 [0,1,0,0,0,0|1,0,1]=3 2583 B11R1.222 CC[C@@H](N)c1ccccc1Br Amb25095650 [0,1,0,0,0,0|2,0,1]=4 2584 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb22298516 [0,1,0,0,0,0|2,0,1]=4 2585 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [0,1,0,0,0,0|2,0,1]=4 2586 B11R1.222 CC[C@@H](N)c1ccccc1I Amb24383024 [0,1,0,0,0,0|2,0,1]=4 2587 B11R1.222 CC[C@@H](N)c1ccccc1O Amb24477566 [0,1,0,0,0,0|2,0,1]=4 2588 B11R1.222 CC[C@@H](N)c1ccccc1S Amb24726023 [0,1,0,0,0,0|2,0,1]=4 2589 B11R1.222 CC[C@@H](O)c1ccccc1F Amb25719414 [0,1,0,0,0,0|2,0,1]=4 2590 B11R1.222 CC[C@@H](O)c1ccccc1O Amb24477561 [0,1,0,0,0,0|2,0,1]=4 2591 B11R1.222 CC[C@H](N)c1ccccc1Br Amb25149042 [0,1,0,0,0,0|2,0,1]=4 2592 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [0,1,0,0,0,0|2,0,1]=4 2593 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb24616798 [0,1,0,0,0,0|2,0,1]=4 2594 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [0,1,0,0,0,0|2,0,1]=4 2595 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [0,1,0,0,0,0|2,0,1]=4 2596 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [0,1,0,0,0,0|2,0,1]=4 2597 B11R1.222 CN(C=O)c1ccccc1F Amb24360998 [0,1,0,0,0,0|1,0,0]=2 2598 B11R1.222 CN(C=O)c1ccccc1N Amb24096451 [0,1,0,0,0,0|1,0,0]=2 2599 B11R1.222 CN(C=O)c1ccccc1O Amb24072010 [0,1,0,0,0,0|1,0,0]=2 2600 B11R1.222 CN(CC)c1ccccc1I Amb25226039 [0,1,0,0,0,0|2,0,1]=4 2601 B11R1.222 CN(CC)c1ccccc1O Amb24079727 [0,1,0,0,0,0|2,0,1]=4 2602 B11R1.222 CN(N=O)c1ccc[n]c1N Amb25302640 [0,1,0,0,0,0|3,0,0]=4 2603 B11R1.222 CNC(C)c1[n]cccc1Cl Amb25108235 [0,1,0,0,0,0|3,0,0]=4 2604 B11R1.222 CNC(C)c1[n]cccc1N Amb25694718 [0,1,0,0,0,0|3,0,0]=4 2605 B11R1.222 CNC(C)c1c[n]ccc1N Amb24365604 [0,1,0,0,0,0|3,0,0]=4 2606 B11R1.222 CNC(C)c1cc[n]cc1Br Amb24670146 [0,1,0,0,0,0|3,0,0]=4 2607 B11R1.222 CNC(C)c1cc[n]cc1Cl Amb25350499 [0,1,0,0,0,0|3,0,0]=4 2608 B11R1.222 CNC(C)c1cc[n]cc1O Amb25329720 [0,1,0,0,0,0|3,0,0]=4 2609 B11R1.222 CNC(C)c1ccc[n]c1N Amb25088680 [0,1,0,0,0,0|3,0,0]=4 2610 B11R1.222 CNC(C)c1ccccc1N Amb23557762 [0,1,0,0,0,0|2,0,0]=3 2611 B11R1.222 CNC(c1ccccc1Br)C Amb1138040 [0,1,0,0,0,0|2,0,0]=3 2612 B11R1.222 CNC(c1ccccc1C)C Amb1112420 [0,1,0,0,0,0|2,0,0]=3 2613 B11R1.222 CNC(c1ccccc1Cl)C Amb1127237 [0,1,0,0,0,0|2,0,0]=3 2614 B11R1.222 CNC(c1ccccc1F)C Amb1116429 [0,1,0,0,0,0|2,0,0]=3 2615 B11R1.222 CNC(c1ccccc1O)C Amb1118530 [0,1,0,0,0,0|2,0,0]=3 2616 B11R1.222 CN[C@@H](C)c1[n]cccc1Cl Amb25808769 [0,1,0,0,0,0|3,0,0]=4 2617 B11R1.222 CN[C@@H](C)c1[n]cccc1F Amb24601411 [0,1,0,0,0,0|3,0,0]=4 2618 B11R1.222 CN[C@@H](C)c1[n]cccc1N Amb24648687 [0,1,0,0,0,0|3,0,0]=4 2619 B11R1.222 CN[C@@H](C)c1c[n]ccc1Br Amb25147950 [0,1,0,0,0,0|3,0,0]=4 2620 B11R1.222 CN[C@@H](C)c1c[n]ccc1Cl Amb24467504 [0,1,0,0,0,0|3,0,0]=4 2621 B11R1.222 CN[C@@H](C)c1c[n]ccc1N Amb25279342 [0,1,0,0,0,0|3,0,0]=4 2622 B11R1.222 CN[C@@H](C)c1c[n]ccc1O Amb24699146 [0,1,0,0,0,0|3,0,0]=4 2623 B11R1.222 CN[C@@H](C)c1cc[n]cc1Cl Amb25104695 [0,1,0,0,0,0|3,0,0]=4 2624 B11R1.222 CN[C@@H](C)c1cc[n]cc1N Amb24417704 [0,1,0,0,0,0|3,0,0]=4 2625 B11R1.222 CN[C@@H](C)c1ccc[n]c1N Amb25738329 [0,1,0,0,0,0|3,0,0]=4 2626 B11R1.222 CN[C@@H](C)c1ccccc1Br Amb25147831 [0,1,0,0,0,0|2,0,0]=3 2627 B11R1.222 CN[C@@H](C)c1ccccc1O Amb24365222 [0,1,0,0,0,0|2,0,0]=3 2628 B11R1.222 CN[C@@H](C)c1ccccc1S Amb25335644 [0,1,0,0,0,0|2,0,0]=3 2629 B11R1.222 CN[C@@H](c1ccccc1F)C Amb10840582 [0,1,0,0,0,0|2,0,0]=3 2630 B11R1.222 CN[C@H](C)c1[n]cccc1F Amb25072817 [0,1,0,0,0,0|3,0,0]=4 2631 B11R1.222 CN[C@H](C)c1[n]cccc1O Amb25743565 [0,1,0,0,0,0|3,0,0]=4 2632 B11R1.222 CN[C@H](C)c1c[n]ccc1N Amb25028087 [0,1,0,0,0,0|3,0,0]=4 2633 B11R1.222 CN[C@H](C)c1c[n]ccc1O Amb24665784 [0,1,0,0,0,0|3,0,0]=4 2634 B11R1.222 CN[C@H](C)c1cc[n]cc1Cl Amb25339445 [0,1,0,0,0,0|3,0,0]=4 2635 B11R1.222 CN[C@H](C)c1cc[n]cc1F Amb25169443 [0,1,0,0,0,0|3,0,0]=4 2636 B11R1.222 CN[C@H](C)c1ccc[n]c1N Amb25803699 [0,1,0,0,0,0|3,0,0]=4 2637 B11R1.222 CN[C@H](C)c1ccccc1O Amb25214643 [0,1,0,0,0,0|2,0,0]=3 2638 B11R1.222 CN[C@H](C)c1ccccc1S Amb25152711 [0,1,0,0,0,0|2,0,0]=3 2639 B11R1.222 CN[C@H](c1ccccc1F)C Amb10838815 [0,1,0,0,0,0|2,0,0]=3 2640 B11R1.222 COC(C)c1c[n]ccc1Br Amb25369505 [0,1,0,0,0,0|3,0,0]=4 2641 B11R1.222 COC(C)c1cc[n]cc1Br Amb24614184 [0,1,0,0,0,0|3,0,0]=4 2642 B11R1.222 COC(C)c1ccccc1N Amb24468018 [0,1,0,0,0,0|2,0,0]=3 2643 B11R1.222 COC(C)c1ccccc1O Amb18125398 [0,1,0,0,0,0|2,0,0]=3 2644 B11R1.222 CSC(C)c1ccccc1Br Amb25706771 [0,1,0,0,0,0|2,0,0]=3 2645 B11R1.222 C[C@@H](C=C)c1ccccc1N Amb24377049 [0,1,0,0,0,0|1,0,0]=2 2646 B11R1.222 C[C@H](C=O)c1ccccc1F Amb24068258 [0,1,0,0,0,0|0,0,0]=1 2647 B11R1.222 C[C@H](NO)c1ccccc1F Amb25841617 [0,1,0,0,0,0|1,0,1]=3 2648 B11R1.222 C\C(=C/Br)\c1ccccc1O Amb25188598 [0,1,0,0,0,0|1,0,1]=3 2649 B11R1.222 C\C(=C/C)\c1ccccc1N Amb18124838 [0,1,0,0,0,0|1,0,1]=3 2650 B11R1.222 C\C(=C/C)\c1ccccc1O Amb18124922 [0,1,0,0,0,0|1,0,1]=3 2651 B11R1.222 C\C(=C/Cl)\c1ccccc1O Amb24711474 [0,1,0,0,0,0|1,0,1]=3 2652 B11R1.222 C\C(=C\Br)\c1ccccc1O Amb24582490 [0,1,0,0,0,0|1,0,1]=3 2653 B11R1.222 C\C(=C\C)\c1ccccc1O Amb25707041 [0,1,0,0,0,0|1,0,1]=3 2654 B11R1.222 C\C(=C\Cl)\c1ccccc1Cl Amb24617318 [0,1,0,0,0,0|1,0,1]=3 2655 B11R1.222 C\C(=C\Cl)\c1ccccc1O Amb24635743 [0,1,0,0,0,0|1,0,1]=3 2656 B11R1.222 C\C(=N\N)\c1ccccc1Br Amb24475633 [0,1,0,0,0,0|2,0,1]=4 2657 B11R1.222 C\C(=N\N)\c1ccccc1Cl Amb25136727 [0,1,0,0,0,0|2,0,1]=4 2658 B11R1.222 C\C(=N\N)\c1ccccc1I Amb25847489 [0,1,0,0,0,0|2,0,1]=4 2659 B11R1.222 C\C(=N\N)\c1ccccc1N Amb25680036 [0,1,0,0,0,0|2,0,1]=4 2660 B11R1.222 C\C(=N\O)\c1ccccc1F Amb25702063 [0,1,0,0,0,0|1,0,2]=4 2661 B11R1.222 C\C(\C=C)=C/1\C=CC=CC1=O Amb24590949 [0,1,0,0,0,0|1,0,1]=3 2662 B11R1.222 C\C=C(/C)\c1[n]cccc1C Amb24101957 [0,1,0,0,0,0|2,0,1]=4 2663 B11R1.222 C\C=C(\C)/c1[n]cccc1C Amb24101996 [0,1,0,0,0,0|2,0,1]=4 2664 B11R1.222 Cc1[n]cccc1[C@@H](C)NC Amb24707790 [0,1,0,0,0,0|3,0,0]=4 2665 B11R1.222 Cc1[n]cccc1[C@@H](N)C=C Amb24469515 [0,1,0,0,0,0|3,0,0]=4 2666 B11R1.222 Cc1c[n]ccc1C(C)CO Amb25092078 [0,1,0,0,0,0|1,0,2]=4 2667 B11R1.222 Cc1c[n]ccc1C(C)NC Amb25766466 [0,1,0,0,0,0|3,0,0]=4 2668 B11R1.222 Cc1c[n]ccc1[C@@H](C)CC Amb24103204 [0,1,0,0,0,0|2,0,1]=4 2669 B11R1.222 Cc1c[n]ccc1[C@H](N)C=C Amb24569447 [0,1,0,0,0,0|3,0,0]=4 2670 B11R1.222 Cc1cc[n]cc1C(C)CN Amb18201825 [0,1,0,0,0,0|2,0,1]=4 2671 B11R1.222 Cc1cc[n]cc1C(N)C=C Amb24484424 [0,1,0,0,0,0|3,0,0]=4 2672 B11R1.222 Cc1cc[n]cc1C(O)C=C Amb24658197 [0,1,0,0,0,0|3,0,0]=4 2673 B11R1.222 Cc1cc[n]cc1[C@@H](C)NC Amb24487511 [0,1,0,0,0,0|3,0,0]=4 2674 B11R1.222 Cc1cc[n]cc1[C@H](N)C=C Amb24418259 [0,1,0,0,0,0|3,0,0]=4 2675 B11R1.222 Cc1ccc[n]c1C(=O)C=O Amb24456619 [0,1,0,0,0,0|2,0,1]=4 2676 B11R1.222 Cc1ccc[n]c1C(C)NC Amb18283561 [0,1,0,0,0,0|3,0,0]=4 2677 B11R1.222 Cc1ccc[n]c1C(C)NN Amb25241710 [0,1,0,0,0,0|3,0,0]=4 2678 B11R1.222 Cc1ccc[n]c1N(C)C=O Amb24096745 [0,1,0,0,0,0|2,0,0]=3 2679 B11R1.222 Cc1ccccc1C(=O)C=O Amb18124884 [0,1,0,0,0,0|1,0,1]=3 2680 B11R1.222 Cc1ccccc1C(C)C=O Amb18124932 [0,1,0,0,0,0|0,0,0]=1 2681 B11R1.222 Cc1ccccc1C(C)CBr Amb25148992 [0,1,0,0,0,0|1,0,1]=3 2682 B11R1.222 Cc1ccccc1C(C)CO Amb25129854 [0,1,0,0,0,0|0,0,2]=3 2683 B11R1.222 Cc1ccccc1C(C)NO Amb24405514 [0,1,0,0,0,0|1,0,1]=3 2684 B11R1.222 Cc1ccccc1C(C)SC Amb24676514 [0,1,0,0,0,0|2,0,0]=3 2685 B11R1.222 Cc1ccccc1C(Cl)C#N Amb18788420 [0,1,0,0,0,0|2,0,1]=4 2686 B11R1.222 Cc1ccccc1C(Cl)CC Amb24388659 [0,1,0,0,0,0|2,0,1]=4 2687 B11R1.222 Cc1ccccc1C(F)C#N Amb24698783 [0,1,0,0,0,0|2,0,1]=4 2688 B11R1.222 Cc1ccccc1C(F)C=O Amb24713681 [0,1,0,0,0,0|1,0,0]=2 2689 B11R1.222 Cc1ccccc1C(F)CN Amb25151822 [0,1,0,0,0,0|2,0,1]=4 2690 B11R1.222 Cc1ccccc1C(N)=S=O Amb25731984 [0,1,0,0,0,0|2,0,1]=4 2691 B11R1.222 Cc1ccccc1C(N)C#C Amb23448706 [0,1,0,0,0,0|2,0,1]=4 2692 B11R1.222 Cc1ccccc1C(N)C=C Amb25214607 [0,1,0,0,0,0|2,0,0]=3 2693 B11R1.222 Cc1ccccc1C(N)CF Amb24603875 [0,1,0,0,0,0|2,0,1]=4 2694 B11R1.222 Cc1ccccc1C(O)CBr Amb24106267 [0,1,0,0,0,0|2,0,1]=4 2695 B11R1.222 Cc1ccccc1C(O)CCl Amb24104159 [0,1,0,0,0,0|2,0,1]=4 2696 B11R1.222 Cc1ccccc1C(O)CF Amb24661131 [0,1,0,0,0,0|2,0,1]=4 2697 B11R1.222 Cc1ccccc1N(C)C#N Amb25282558 [0,1,0,0,0,0|2,0,1]=4 2698 B11R1.222 Cc1ccccc1N(C)C=O Amb24323384 [0,1,0,0,0,0|1,0,0]=2 2699 B11R1.222 Cc1ccccc1[C@@H](C)NC Amb24746717 [0,1,0,0,0,0|2,0,0]=3 2700 B11R1.222 Cc1ccccc1[C@@H](N)C#C Amb25228427 [0,1,0,0,0,0|2,0,1]=4 2701 B11R1.222 Cc1ccccc1[C@@H](N)C=C Amb25843231 [0,1,0,0,0,0|2,0,0]=3 2702 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb22298563 [0,1,0,0,0,0|2,0,1]=4 2703 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb25145851 [0,1,0,0,0,0|2,0,1]=4 2704 B11R1.222 Cc1ccccc1[C@@H](O)C#C Amb25680684 [0,1,0,0,0,0|2,0,1]=4 2705 B11R1.222 Cc1ccccc1[C@@H](O)C=C Amb24466187 [0,1,0,0,0,0|2,0,0]=3 2706 B11R1.222 Cc1ccccc1[C@@H](O)C=O Amb24722747 [0,1,0,0,0,0|1,0,0]=2 2707 B11R1.222 Cc1ccccc1[C@@H](O)CN Amb24100213 [0,1,0,0,0,0|2,0,1]=4 2708 B11R1.222 Cc1ccccc1[C@H](C)NO Amb24436797 [0,1,0,0,0,0|1,0,1]=3 2709 B11R1.222 Cc1ccccc1[C@H](N)CC Amb22298520 [0,1,0,0,0,0|2,0,1]=4 2710 B11R1.222 Cc1ccccc1[C@H](N)CC Amb25335271 [0,1,0,0,0,0|2,0,1]=4 2711 B11R1.222 Cc1ccccc1[C@H](N)CF Amb24659258 [0,1,0,0,0,0|2,0,1]=4 2712 B11R1.222 Cc1ccccc1\C(\C)=N/N Amb25831938 [0,1,0,0,0,0|2,0,1]=4 2713 B11R1.222 Cc1ccccc1\C(\C)=N/O Amb25783575 [0,1,0,0,0,0|1,0,2]=4 2714 B11R1.222 Clc1ccccc1C(Br)CBr Amb25377170 [0,1,0,0,0,0|2,0,1]=4 2715 B11R1.222 Clc1ccccc1C(Br)CCl Amb25721011 [0,1,0,0,0,0|2,0,1]=4 2716 B11R1.222 FCC(c1ccccc1F)N Amb2372611 [0,1,0,0,0,0|2,0,1]=4 2717 B11R1.222 N#CC(Br)c1ccccc1F Amb24682726 [0,1,0,0,0,0|2,0,1]=4 2718 B11R1.222 N#CC(Cl)c1ccccc1Br Amb23596602 [0,1,0,0,0,0|2,0,1]=4 2719 B11R1.222 N#CC(Cl)c1ccccc1Cl Amb18319214 [0,1,0,0,0,0|2,0,1]=4 2720 B11R1.222 N#CC(Cl)c1ccccc1F Amb18183572 [0,1,0,0,0,0|2,0,1]=4 2721 B11R1.222 N#CC(F)c1ccccc1F Amb25280009 [0,1,0,0,0,0|2,0,1]=4 2722 B11R1.222 N#CC(c1ccccc1C)N Amb1108016 [0,1,0,0,0,0|2,0,1]=4 2723 B11R1.222 N#CC(c1ccccc1Cl)N Amb1108380 [0,1,0,0,0,0|2,0,1]=4 2724 B11R1.222 N#CC(c1ccccc1Cl)N Amb13952248 [0,1,0,0,0,0|2,0,1]=4 2725 B11R1.222 N#CC(c1ccccc1F)N Amb1108950 [0,1,0,0,0,0|2,0,1]=4 2726 B11R1.222 N#CC(c1ncccc1N)C Amb17605524 [0,1,0,0,0,0|2,0,1]=4 2727 B11R1.222 N#C[C@@H](O)c1ccccc1F Amb24068252 [0,1,0,0,0,0|2,0,1]=4 2728 B11R1.222 N#C[C@H](O)c1ccccc1Br Amb24487094 [0,1,0,0,0,0|2,0,1]=4 2729 B11R1.222 N#C[C@H](O)c1ccccc1F Amb24068198 [0,1,0,0,0,0|2,0,1]=4 2730 B11R1.222 N=CN(O)c1ccccc1F Amb24071993 [0,1,0,0,0,0|3,0,0]=4 2731 B11R1.222 NC(C#N)c1ccccc1F Amb19514728 [0,1,0,0,0,0|2,0,1]=4 2732 B11R1.222 NC(CBr)c1ccccc1F Amb25095798 [0,1,0,0,0,0|2,0,1]=4 2733 B11R1.222 NC(CF)c1ccccc1I Amb25825371 [0,1,0,0,0,0|2,0,1]=4 2734 B11R1.222 NC(CF)c1ccccc1O Amb24488040 [0,1,0,0,0,0|2,0,1]=4 2735 B11R1.222 NC(CO)c1ccccc1Br Amb23596558 [0,1,0,0,0,0|1,0,2]=4 2736 B11R1.222 NC(CO)c1ccccc1F Amb19374114 [0,1,0,0,0,0|1,0,2]=4 2737 B11R1.222 NC(CO)c1ccccc1I Amb25738482 [0,1,0,0,0,0|1,0,2]=4 2738 B11R1.222 NC(CO)c1ccccc1O Amb24069930 [0,1,0,0,0,0|1,0,2]=4 2739 B11R1.222 NC(CO)c1ccccc1S Amb25828013 [0,1,0,0,0,0|1,0,2]=4 2740 B11R1.222 NCC(F)c1ccccc1Br Amb23454845 [0,1,0,0,0,0|2,0,1]=4 2741 B11R1.222 NCC(F)c1ccccc1Cl Amb24392618 [0,1,0,0,0,0|2,0,1]=4 2742 B11R1.222 NCC(N)c1ccccc1O Amb24746712 [0,1,0,0,0,0|2,0,1]=4 2743 B11R1.222 NCC(N)c1ccccc1S Amb25207598 [0,1,0,0,0,0|2,0,1]=4 2744 B11R1.222 NCC(O)c1ccccc1Br Amb22587182 [0,1,0,0,0,0|2,0,1]=4 2745 B11R1.222 NCC(O)c1ccccc1I Amb22234793 [0,1,0,0,0,0|2,0,1]=4 2746 B11R1.222 NCC(c1ccccc1Br)O Amb2383122 [0,1,0,0,0,0|2,0,1]=4 2747 B11R1.222 NCC(c1ccccc1C)O Amb10068895 [0,1,0,0,0,0|2,0,1]=4 2748 B11R1.222 NCC(c1ccccc1C)O Amb1108095 [0,1,0,0,0,0|2,0,1]=4 2749 B11R1.222 NCC(c1ccccc1Cl)C Amb17232735 [0,1,0,0,0,0|1,0,1]=3 2750 B11R1.222 NCC(c1ccccc1Cl)O Amb1108010 [0,1,0,0,0,0|2,0,1]=4 2751 B11R1.222 NCC(c1ccccc1F)O Amb1108863 [0,1,0,0,0,0|2,0,1]=4 2752 B11R1.222 NCC(c1ccccc1I)O Amb2383126 [0,1,0,0,0,0|2,0,1]=4 2753 B11R1.222 NCC(c1ccccc1O)O Amb1108822 [0,1,0,0,0,0|2,0,1]=4 2754 B11R1.222 NC[C@@H](N)c1ccccc1I Amb25149025 [0,1,0,0,0,0|2,0,1]=4 2755 B11R1.222 NC[C@@H](N)c1ccccc1S Amb25169297 [0,1,0,0,0,0|2,0,1]=4 2756 B11R1.222 NC[C@@H](O)c1ccccc1Br Amb24415174 [0,1,0,0,0,0|2,0,1]=4 2757 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241478 [0,1,0,0,0,0|2,0,1]=4 2758 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241480 [0,1,0,0,0,0|2,0,1]=4 2759 B11R1.222 NC[C@H](N)c1ccccc1Cl Amb25189262 [0,1,0,0,0,0|2,0,1]=4 2760 B11R1.222 NC[C@H](N)c1ccccc1F Amb25145861 [0,1,0,0,0,0|2,0,1]=4 2761 B11R1.222 NC[C@H](N)c1ccccc1S Amb25152768 [0,1,0,0,0,0|2,0,1]=4 2762 B11R1.222 NC[C@H](O)c1ccccc1Br Amb25686880 [0,1,0,0,0,0|2,0,1]=4 2763 B11R1.222 N[C@@H](C#N)c1ccccc1Cl Amb24488082 [0,1,0,0,0,0|2,0,1]=4 2764 B11R1.222 N[C@@H](C#N)c1ccccc1F Amb25188863 [0,1,0,0,0,0|2,0,1]=4 2765 B11R1.222 N[C@@H](C#N)c1ccccc1O Amb25728414 [0,1,0,0,0,0|2,0,1]=4 2766 B11R1.222 N[C@@H](CF)c1ccccc1Br Amb25085243 [0,1,0,0,0,0|2,0,1]=4 2767 B11R1.222 N[C@@H](CF)c1ccccc1F Amb24487040 [0,1,0,0,0,0|2,0,1]=4 2768 B11R1.222 N[C@@H](CF)c1ccccc1I Amb25341316 [0,1,0,0,0,0|2,0,1]=4 2769 B11R1.222 N[C@@H](CO)c1ccccc1Cl Amb22756886 [0,1,0,0,0,0|1,0,2]=4 2770 B11R1.222 N[C@@H](CO)c1ccccc1F Amb22756438 [0,1,0,0,0,0|1,0,2]=4 2771 B11R1.222 N[C@@H](CO)c1ccccc1I Amb24640454 [0,1,0,0,0,0|1,0,2]=4 2772 B11R1.222 N[C@@H](CO)c1ccccc1S Amb25348434 [0,1,0,0,0,0|1,0,2]=4 2773 B11R1.222 N[C@H](C#N)c1ccccc1Br Amb25132729 [0,1,0,0,0,0|2,0,1]=4 2774 B11R1.222 N[C@H](C#N)c1ccccc1Cl Amb25089420 [0,1,0,0,0,0|2,0,1]=4 2775 B11R1.222 N[C@H](C#N)c1ccccc1I Amb25324471 [0,1,0,0,0,0|2,0,1]=4 2776 B11R1.222 N[C@H](C#N)c1ccccc1O Amb25677374 [0,1,0,0,0,0|2,0,1]=4 2777 B11R1.222 N[C@H](CF)c1ccccc1F Amb25125365 [0,1,0,0,0,0|2,0,1]=4 2778 B11R1.222 N[C@H](CF)c1ccccc1I Amb25089289 [0,1,0,0,0,0|2,0,1]=4 2779 B11R1.222 N[C@H](CF)c1ccccc1O Amb24369522 [0,1,0,0,0,0|2,0,1]=4 2780 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb25228430 [0,1,0,0,0,0|1,0,2]=4 2781 B11R1.222 N[C@H](CO)c1ccccc1F Amb24349743 [0,1,0,0,0,0|1,0,2]=4 2782 B11R1.222 N[C@H](CO)c1ccccc1I Amb25314281 [0,1,0,0,0,0|1,0,2]=4 2783 B11R1.222 N[C@H](CO)c1ccccc1O Amb24383657 [0,1,0,0,0,0|1,0,2]=4 2784 B11R1.222 Nc1ccccc1C(O)C#N Amb25789458 [0,1,0,0,0,0|2,0,1]=4 2785 B11R1.222 Nc1ccccc1C(O)CN Amb24400559 [0,1,0,0,0,0|2,0,1]=4 2786 B11R1.222 Nc1ccccc1C(O)CO Amb18959890 [0,1,0,0,0,0|1,0,2]=4 2787 B11R1.222 Nc1ccccc1[C@@H](N)CN Amb25151189 [0,1,0,0,0,0|2,0,1]=4 2788 B11R1.222 Nc1ccccc1[C@H](N)CN Amb25027869 [0,1,0,0,0,0|2,0,1]=4 2789 B11R1.222 Nc1ccccc1[C@H](N)CO Amb25063331 [0,1,0,0,0,0|1,0,2]=4 2790 B11R1.222 O=C(C=O)c1ccccc1Br Amb18131520 [0,1,0,0,0,0|1,0,1]=3 2791 B11R1.222 O=C(C=O)c1ccccc1Cl Amb18126568 [0,1,0,0,0,0|1,0,1]=3 2792 B11R1.222 O=C(C=O)c1ccccc1F Amb22011841 [0,1,0,0,0,0|1,0,1]=3 2793 B11R1.222 O=CC(=O)c1ccccc1F Amb10838623 [0,1,0,0,0,0|1,0,1]=3 2794 B11R1.222 O=CC(Br)c1ccccc1Cl Amb25353890 [0,1,0,0,0,0|1,0,0]=2 2795 B11R1.222 O=CC(F)c1ccccc1Cl Amb25083135 [0,1,0,0,0,0|1,0,0]=2 2796 B11R1.222 O=CC(F)c1ccccc1F Amb24392460 [0,1,0,0,0,0|1,0,0]=2 2797 B11R1.222 OC(C=O)c1cc[n]cc1F Amb25716409 [0,1,0,0,0,0|2,0,0]=3 2798 B11R1.222 OC(C=O)c1ccccc1F Amb24625145 [0,1,0,0,0,0|1,0,0]=2 2799 B11R1.222 OC(CBr)c1ccccc1Br Amb25741136 [0,1,0,0,0,0|2,0,1]=4 2800 B11R1.222 OC(CBr)c1ccccc1Cl Amb24081185 [0,1,0,0,0,0|2,0,1]=4 2801 B11R1.222 OC(CCl)c1ccccc1Cl Amb25726431 [0,1,0,0,0,0|2,0,1]=4 2802 B11R1.222 OC(CCl)c1ccccc1F Amb25306094 [0,1,0,0,0,0|2,0,1]=4 2803 B11R1.222 OC(CF)c1ccccc1F Amb24688002 [0,1,0,0,0,0|2,0,1]=4 2804 B11R1.222 OC(CI)c1ccccc1Br Amb24555966 [0,1,0,0,0,0|2,0,1]=4 2805 B11R1.222 OCC(F)c1ccccc1Cl Amb25145452 [0,1,0,0,0,0|1,0,2]=4 2806 B11R1.222 OCC(O)c1ccccc1Br Amb24123020 [0,1,0,0,0,0|1,0,2]=4 2807 B11R1.222 OCC(O)c1ccccc1Cl Amb24123046 [0,1,0,0,0,0|1,0,2]=4 2808 B11R1.222 OCC(O)c1ccccc1F Amb24123031 [0,1,0,0,0,0|1,0,2]=4 2809 B11R1.222 OCC(c1ccccc1Cl)N Amb17232852 [0,1,0,0,0,0|1,0,2]=4 2810 B11R1.222 OCC(c1ccccc1F)N Amb2236319 [0,1,0,0,0,0|1,0,2]=4 2811 B11R1.222 OCC(c1ccccc1F)N Amb2236915 [0,1,0,0,0,0|1,0,2]=4 2812 B11R1.222 OC[C@@H](O)c1ccccc1F Amb24402438 [0,1,0,0,0,0|1,0,2]=4 2813 B11R1.222 OC[C@H](F)c1ccccc1Cl Amb25292140 [0,1,0,0,0,0|1,0,2]=4 2814 B11R1.222 OC[C@H](O)c1ccccc1Cl Amb25776080 [0,1,0,0,0,0|1,0,2]=4 2815 B11R1.222 OC[C@H](O)c1ccccc1F Amb25720140 [0,1,0,0,0,0|1,0,2]=4 2816 B11R1.222 O[C@@H](CBr)c1ccccc1Br Amb25357117 [0,1,0,0,0,0|2,0,1]=4 2817 B11R1.222 O[C@@H](CCl)c1ccccc1Cl Amb25060772 [0,1,0,0,0,0|2,0,1]=4 2818 B11R1.222 O[C@H](CBr)c1ccccc1Br Amb25272153 [0,1,0,0,0,0|2,0,1]=4 2819 B11R1.222 O[C@H](CCl)c1ccccc1Cl Amb24509305 [0,1,0,0,0,0|2,0,1]=4 2820 B11R1.222 O[C@H](CCl)c1ccccc1F Amb25361770 [0,1,0,0,0,0|2,0,1]=4 2821 B11R1.222 O[C@H](CF)c1ccccc1Br Amb25151841 [0,1,0,0,0,0|2,0,1]=4 2822 B11R1.222 O[C@H](CF)c1ccccc1F Amb24454550 [0,1,0,0,0,0|2,0,1]=4 2823 B11R1.222 O\N=C(\c1ccccc1O)/C Amb2436546 [0,1,0,0,0,0|1,0,2]=4 2824 B11R1.222 Oc1ccccc1C(=O)C=O Amb25269559 [0,1,0,0,0,0|1,0,1]=3 2825 B11R1.222 Oc1ccccc1C(F)C=O Amb25062510 [0,1,0,0,0,0|1,0,0]=2 2826 B11R1.222 Oc1ccccc1C(O)CO Amb24646646 [0,1,0,0,0,0|1,0,2]=4 2827 B11R1.222 Oc1ccccc1[C@H](O)CO Amb25830555 [0,1,0,0,0,0|1,0,2]=4 2828 B9R0.8 CC(C=C)C(=C)\C=C\CO Amb25057780 [0,0,1,0,0,0|2,0,1]=4 2829 B9R0.8 CC(C=C)C(Br)\C=C\C=C Amb25365164 [0,0,1,0,0,0|2,0,1]=4 2830 B9R0.8 CC(C=C)C(O)\C=C\C=C Amb25045782 [0,0,1,0,0,0|2,0,1]=4 2831 B9R0.8 CC(C=O)C(=O)OCC=C Amb18643846 [0,0,1,0,0,0|2,0,1]=4 2832 B9R0.46 CCC(C)\C=C\C=C/C=O Amb18643327 [0,0,1,0,0,0|2,0,1]=4 2833 B11R2.1 BrC1C=Cc2ccccc21 Amb25101590 [0,0,0,1,0,0|2,0,0]=3 2834 B11R2.1 BrC1N=Nc2ccccc21 Amb20246825 [0,0,0,1,0,0|3,0,0]=4 2835 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [0,0,0,1,0,0|3,0,0]=4 2836 B11R2.1 Br[n]1c[n]c2ccccc12 Amb25146351 [0,0,0,1,0,0|3,0,0]=4 2837 B11R2.1 Brc1c[nH]c2c1cccc2 Amb2447679 [0,0,0,1,0,0|2,0,1]=4 2838 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [0,0,0,1,0,0|1,0,1]=3 2839 B11R2.1 CC1C=Cc2ccc[n]c21 Amb25261434 [0,0,0,1,0,0|2,0,0]=3 2840 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [0,0,0,1,0,0|1,0,0]=2 2841 B11R2.1 CC1CCc2[n]cccc21 Amb24071595 [0,0,0,1,0,0|2,0,1]=4 2842 B11R2.1 CC1CCc2c[n]ccc21 Amb25691244 [0,0,0,1,0,0|2,0,1]=4 2843 B11R2.1 CC1CNc2ccccc21 Amb20241016 [0,0,0,1,0,0|1,0,1]=3 2844 B11R2.1 CC1COc2ccc[n]c21 Amb24102372 [0,0,0,1,0,0|1,0,2]=4 2845 B11R2.1 CC1CSc2ccccc12 Amb17939280 [0,0,0,1,0,0|0,1,1]=3 2846 B11R2.1 CC1N=Nc2[n]cccc21 Amb24082859 [0,0,0,1,0,0|3,0,0]=4 2847 B11R2.1 CC1NCc2ccccc21 Amb20623497 [0,0,0,1,0,0|2,0,0]=3 2848 B11R2.1 CC1OCc2cc[n]cc21 Amb24102361 [0,0,0,1,0,0|3,0,0]=4 2849 B11R2.1 CC1SCc2ccccc21 Amb24092837 [0,0,0,1,0,0|2,0,0]=3 2850 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [0,0,0,1,0,0|2,0,1]=4 2851 B11R2.1 CN1CNc2ccccc12 Amb25260683 [0,0,0,1,0,0|2,0,1]=4 2852 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [0,0,0,1,0,0|1,0,1]=3 2853 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [0,0,0,1,0,0|2,0,0]=3 2854 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [0,0,0,1,0,0|2,0,0]=3 2855 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [0,0,0,1,0,0|1,1,1]=4 2856 B11R2.1 C[n+]1cc[n]2ccccc12 Amb22443983 [0,0,0,1,0,0|3,0,0]=4 2857 B11R2.1 C[n+]1csc2c1cccc2 Amb1147462 [0,0,0,1,0,0|1,1,0]=3 2858 B11R2.1 C[n]1c[n]c2[n]cccc12 Amb19958069 [0,0,0,1,0,0|3,0,0]=4 2859 B11R2.1 C[n]1c[n]c2c[n]ccc12 Amb23580211 [0,0,0,1,0,0|3,0,0]=4 2860 B11R2.1 C[n]1c[n]c2cc[n]cc12 Amb24086413 [0,0,0,1,0,0|3,0,0]=4 2861 B11R2.1 C[n]1ccc2[n]cccc12 Amb22900982 [0,0,0,1,0,0|3,0,0]=4 2862 B11R2.1 C[n]1ccc2cc[n]cc12 Amb20671418 [0,0,0,1,0,0|3,0,0]=4 2863 B11R2.1 Cc1[nH][n]c2ccccc21 Amb19316313 [0,0,0,1,0,0|2,0,1]=4 2864 B11R2.1 Cc1[nH]nc2c1cccc2 Amb15691959 [0,0,0,1,0,0|2,0,1]=4 2865 B11R2.1 Cc1[s][n]c2ccccc21 Amb25275391 [0,0,0,1,0,0|2,0,1]=4 2866 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [0,0,0,1,0,0|1,0,1]=3 2867 B11R2.1 Cc1c[nH]c2c1nccc2 Amb15692260 [0,0,0,1,0,0|2,0,1]=4 2868 B11R2.1 Cc1c[nH]c2c[n]ccc21 Amb22499601 [0,0,0,1,0,0|2,0,1]=4 2869 B11R2.1 Cc1c[nH]c2cc[n]cc21 Amb21963356 [0,0,0,1,0,0|2,0,1]=4 2870 B11R2.1 Cc1c[n]c2cccc[n]21 Amb21960684 [0,0,0,1,0,0|2,0,1]=4 2871 B11R2.1 Cc1c[s]c2c[n]ccc21 Amb25774421 [0,0,0,1,0,0|1,1,1]=4 2872 B11R2.1 Cc1c[s]c2cc[n]cc21 Amb25068027 [0,0,0,1,0,0|1,1,1]=4 2873 B11R2.1 Cc1c[s]c2ccc[n]c21 Amb25707938 [0,0,0,1,0,0|1,1,1]=4 2874 B11R2.1 Cc1cc[n]2ccccc21 Amb24709297 [0,0,0,1,0,0|2,0,1]=4 2875 B11R2.1 Cc1coc2[n]cccc21 Amb21963399 [0,0,0,1,0,0|1,0,2]=4 2876 B11R2.1 Cc1coc2c[n]ccc21 Amb22494706 [0,0,0,1,0,0|1,0,2]=4 2877 B11R2.1 Cc1coc2cc[n]cc21 Amb22494707 [0,0,0,1,0,0|1,0,2]=4 2878 B11R2.1 Cc1coc2ccc[n]c21 Amb22494708 [0,0,0,1,0,0|1,0,2]=4 2879 B11R2.1 Cc1csc2[n+]1cccc2 Amb10552959 [0,0,0,1,0,0|1,1,1]=4 2880 B11R2.1 ClC1C=Nc2ccccc21 Amb24078935 [0,0,0,1,0,0|2,0,0]=3 2881 B11R2.1 Cl[C@@H]1C=Cc2ccccc21 Amb24518031 [0,0,0,1,0,0|2,0,0]=3 2882 B11R2.1 Cl[C@H]1C=Cc2ccccc21 Amb25783948 [0,0,0,1,0,0|2,0,0]=3 2883 B11R2.1 Cl[n]1c[n]c2ccccc12 Amb24351571 [0,0,0,1,0,0|3,0,0]=4 2884 B11R2.1 Clc1c[nH]c2ccccc12 Amb17672708 [0,0,0,1,0,0|2,0,1]=4 2885 B11R2.1 Clc1coc2ccccc21 Amb21963868 [0,0,0,1,0,0|1,0,2]=4 2886 B11R2.1 Cn1ccc2c1nccc2 Amb10602466 [0,0,0,1,0,0|3,0,0]=4 2887 B11R2.1 Cn1cnc2c1cccc2 Amb10562077 [0,0,0,1,0,0|2,0,0]=3 2888 B11R2.1 FC1CCc2ccccc21 Amb25311534 [0,0,0,1,0,0|2,0,1]=4 2889 B11R2.1 FC1CNc2ccccc21 Amb20242176 [0,0,0,1,0,0|2,0,1]=4 2890 B11R2.1 FC1NCc2ccccc21 Amb22504231 [0,0,0,1,0,0|3,0,0]=4 2891 B11R2.1 Fc1c[nH]c2c1cccc2 Amb10841217 [0,0,0,1,0,0|2,0,1]=4 2892 B11R2.1 Fc1coc2ccccc21 Amb24409168 [0,0,0,1,0,0|1,0,2]=4 2893 B11R2.1 Ic1c[nH]c2c1cccc2 Amb17134442 [0,0,0,1,0,0|2,0,1]=4 2894 B11R2.1 Ic1c[s]c2ccccc21 Amb22002561 [0,0,0,1,0,0|1,1,1]=4 2895 B11R2.1 Ic1coc2ccccc21 Amb24622374 [0,0,0,1,0,0|1,0,2]=4 2896 B11R2.1 NC1C=Cc2c1cccc2 Amb17470367 [0,0,0,1,0,0|2,0,0]=3 2897 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [0,0,0,1,0,0|2,0,1]=4 2898 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [0,0,0,1,0,0|2,0,1]=4 2899 B11R2.1 NC1CCc2ccccc21 Amb24078253 [0,0,0,1,0,0|2,0,1]=4 2900 B11R2.1 NC1CNc2ccccc21 Amb24555894 [0,0,0,1,0,0|2,0,1]=4 2901 B11R2.1 NC1COc2c1cccc2 Amb13951643 [0,0,0,1,0,0|1,0,2]=4 2902 B11R2.1 NC1COc2c1cccc2 Amb2383232 [0,0,0,1,0,0|1,0,2]=4 2903 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [0,0,0,1,0,0|2,0,1]=4 2904 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [0,0,0,1,0,0|1,0,2]=4 2905 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [0,0,0,1,0,0|1,0,2]=4 2906 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [0,0,0,1,0,0|2,0,1]=4 2907 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [0,0,0,1,0,0|1,0,2]=4 2908 B11R2.1 Nc1c[s]c2ccccc21 Amb19957699 [0,0,0,1,0,0|1,1,1]=4 2909 B11R2.1 Nc1coc2ccccc21 Amb24371464 [0,0,0,1,0,0|1,0,2]=4 2910 B11R2.1 Nc1csc2c1cccc2 Amb13890519 [0,0,0,1,0,0|1,1,1]=4 2911 B11R2.1 Nn1ccc2c1cccc2 Amb16233739 [0,0,0,1,0,0|3,0,0]=4 2912 B11R2.1 O=C1C=Cc2c1cccc2 Amb10603436 [0,0,0,1,0,0|2,0,1]=4 2913 B11R2.1 O=S1C=Nc2ccccc12 Amb24479722 [0,0,0,1,0,0|3,0,0]=4 2914 B11R2.1 O=[s]1ccc2ccccc12 Amb24078341 [0,0,0,1,0,0|3,0,0]=4 2915 B11R2.1 OC1C=Cc2ccccc21 Amb24479258 [0,0,0,1,0,0|2,0,0]=3 2916 B11R2.1 OC1COc2ccccc21 Amb24104532 [0,0,0,1,0,0|1,0,2]=4 2917 B11R2.1 OC1OCc2ccccc21 Amb21858794 [0,0,0,1,0,0|3,0,0]=4 2918 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [0,0,0,1,0,0|2,0,1]=4 2919 B11R2.1 O[C@H]1C=Cc2ccccc21 Amb24748284 [0,0,0,1,0,0|2,0,0]=3 2920 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [0,0,0,1,0,0|2,0,1]=4 2921 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [0,0,0,1,0,0|1,1,1]=4 2922 B11R2.1 O[n+]1c[nH]c2ccccc12 Amb24729556 [0,0,0,1,0,0|3,0,0]=4 2923 B11R2.1 Oc1coc2ccccc21 Amb24097480 [0,0,0,1,0,0|1,0,2]=4 2924 B11R2.1 Sc1c[s]c2ccccc21 Amb24396652 [0,0,0,1,0,0|1,1,1]=4 2925 B11R2.1 Sc1coc2ccccc21 Amb24061893 [0,0,0,1,0,0|1,0,2]=4 2926 B11R2.1 [O-][N+]1=CCc2ccccc12 Amb25338460 [0,0,0,1,0,0|3,0,0]=4 2927 B11R2.1 [Ti+3]C1C=Cc2ccccc21 Amb22053615 [0,0,0,1,0,0|2,0,0]=3 2928 B11R2.4 BrC1CC1c2ccc[n]c2 Amb24411334 [0,0,0,1,0,0|2,0,1]=4 2929 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [0,0,0,1,0,0|1,0,1]=3 2930 B11R2.4 Br[C@@H]1C[C@H]1c2cc[n]cc2 Amb24673977 [0,0,0,1,0,0|2,0,1]=4 2931 B11R2.4 Br[C@@H]1C[C@H]1c2cccc[n]2 Amb25840547 [0,0,0,1,0,0|2,0,1]=4 2932 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [0,0,0,1,0,0|1,0,1]=3 2933 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [0,0,0,1,0,0|1,0,0]=2 2934 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [0,0,0,1,0,0|1,0,1]=3 2935 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [0,0,0,1,0,0|2,0,1]=4 2936 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [0,0,0,1,0,0|2,0,1]=4 2937 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [0,0,0,1,0,0|3,0,0]=4 2938 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [0,0,0,1,0,0|2,0,1]=4 2939 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [0,0,0,1,0,0|2,0,1]=4 2940 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [0,0,0,1,0,0|2,0,1]=4 2941 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [0,0,0,1,0,0|1,0,1]=3 2942 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [0,0,0,1,0,0|1,0,1]=3 2943 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [0,0,0,1,0,0|1,0,1]=3 2944 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [0,0,0,1,0,0|1,0,1]=3 2945 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [0,0,0,1,0,0|1,0,1]=3 2946 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [0,0,0,1,0,0|2,0,1]=4 2947 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [0,0,0,1,0,0|2,0,0]=3 2948 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [0,0,0,1,0,0|1,0,1]=3 2949 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [0,0,0,1,0,0|1,0,1]=3 2950 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [0,0,0,1,0,0|1,0,1]=3 2951 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [0,0,0,1,0,0|1,0,1]=3 2952 B11R2.4 N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24604839 [0,0,0,1,0,0|2,0,1]=4 2953 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [0,0,0,1,0,0|1,0,1]=3 2954 B11R2.4 O=C1C=C1c2ccccc2 Amb24722866 [0,0,0,1,0,0|0,0,2]=3 2955 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [0,0,0,1,0,0|0,0,0]=1 2956 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [0,0,0,1,0,0|0,0,2]=3 2957 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [0,0,0,1,0,0|0,0,2]=3 2958 B11R2.40 BrC1(CC1)c2ccccc2 Amb24743023 [0,0,0,1,0,0|2,0,1]=4 2959 B11R2.40 CC1(CC1)c2ccccc2 Amb24613075 [0,0,0,1,0,0|1,0,1]=3 2960 B11R2.40 CC1(CO1)c2c[n]ccc2 Amb25683724 [0,0,0,1,0,0|1,0,2]=4 2961 B11R2.40 CC1(CO1)c2cccc[n]2 Amb24070157 [0,0,0,1,0,0|1,0,2]=4 2962 B11R2.40 ClC1(CC1)c2ccccc2 Amb17872674 [0,0,0,1,0,0|2,0,1]=4 2963 B11R2.40 ClC1(N=N1)c2ccccc2 Amb25264184 [0,0,0,1,0,0|3,0,0]=4 2964 B11R2.40 NC1(CC1)c2ccccc2 Amb1095038 [0,0,0,1,0,0|2,0,1]=4 2965 B11R2.40 OC1(CC1)c2ccccc2 Amb19374887 [0,0,0,1,0,0|2,0,1]=4 2966 B11R2.54 CC1C(O)c2ccccc21 Amb25686146 [0,0,0,1,0,0|0,0,2]=3 2967 B11R2.54 C[C-]1C(=O)c2cccc[n+]21 Amb24422427 [0,0,0,1,0,0|1,0,1]=3 2968 B11R2.54 Cl[C@@H]1[C@@H](Cl)c2ccccc21 Amb25320925 [0,0,0,1,0,0|2,0,1]=4 2969 B11R2.54 Cl[C@@H]1[C@H](Cl)c2ccccc21 Amb25798902 [0,0,0,1,0,0|2,0,1]=4 2970 B11R2.54 Cl[C@H]1[C@H](Cl)c2ccccc21 Amb25245323 [0,0,0,1,0,0|2,0,1]=4 2971 B11R2.54 O=C1C(Cl)c2ccccc21 Amb21948336 [0,0,0,1,0,0|1,0,0]=2 2972 B11R2.54 O=C1c2cc[n]cc2C1=O Amb24606585 [0,0,0,1,0,0|2,0,1]=4 2973 B11R2.54 O=C1c2ccccc2C1=O Amb18048412 [0,0,0,1,0,0|1,0,1]=3 2974 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [0,0,0,1,0,0|3,0,0]=4 2975 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [0,0,0,1,0,0|2,0,0]=3 2976 B11R2.239 C1CC=C1c2cccc[n]2 Amb24069951 [0,0,0,1,0,0|2,0,1]=4 2977 B11R2.239 C1CCC1c2cc[n]cc2 Amb22898826 [0,0,0,1,0,0|2,0,1]=4 2978 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [0,0,0,1,0,0|3,0,0]=4 2979 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [0,0,0,1,0,0|2,0,0]=3 2980 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [0,0,0,1,0,0|3,0,0]=4 2981 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [0,0,0,1,0,0|2,0,0]=3 2982 B11R2.239 C1NCC1c2c[n]ccc2 Amb19516797 [0,0,0,1,0,0|2,0,1]=4 2983 B11R2.239 C1NCC1c2c[n]ccc2 Amb20620349 [0,0,0,1,0,0|2,0,1]=4 2984 B11R2.239 C1NCC1c2cc[n]cc2 Amb19516821 [0,0,0,1,0,0|2,0,1]=4 2985 B11R2.239 C1NCC1c2cc[n]cc2 Amb20620350 [0,0,0,1,0,0|2,0,1]=4 2986 B11R2.239 C1NCC1c2cc[n]cc2 Amb22749029 [0,0,0,1,0,0|2,0,1]=4 2987 B11R2.239 C1NCC1c2cccc[n]2 Amb19516701 [0,0,0,1,0,0|2,0,1]=4 2988 B11R2.239 C1OCC1c2cccc[n]2 Amb24100566 [0,0,0,1,0,0|1,0,2]=4 2989 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [0,0,0,1,0,0|0,0,2]=3 2990 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [0,0,0,1,0,0|1,0,1]=3 2991 B11R2.239 N1CC(C1)c2ccccn2 Amb15695195 [0,0,0,1,0,0|2,0,1]=4 2992 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [0,0,0,1,0,0|1,0,0]=2 2993 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [0,0,0,1,0,0|1,0,1]=3 2994 B11R2.988 COC1Cc2ccccc21 Amb24455687 [0,0,0,1,0,0|2,0,0]=3 2995 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [0,0,0,1,0,0|1,0,1]=3 2996 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [0,0,0,1,0,0|1,0,1]=3 2997 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [0,0,0,1,0,0|1,0,1]=3 2998 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [0,0,0,1,0,0|1,0,1]=3 2999 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [0,0,0,1,0,0|2,0,0]=3 3000 B11R2.988 O=CC1=Cc2ccccc21 Amb24632962 [0,0,0,1,0,0|0,0,2]=3 3001 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [0,0,0,1,0,0|0,0,0]=1 3002 B9R1.11 BrCC(c1cccs1)C Amb17238292 [0,0,0,0,1,0|2,0,1]=4 3003 B9R1.11 C=C(C=O)c1ccoc1 Amb24708336 [0,0,0,0,1,0|1,0,2]=4 3004 B9R1.11 C=CC(N)c1ccc[nH]1 Amb24477837 [0,0,0,0,1,0|3,0,0]=4 3005 B9R1.11 C=CC(N)c1cocc1 Amb25287949 [0,0,0,0,1,0|3,0,0]=4 3006 B9R1.11 C=CC(O)c1c[nH]cc1 Amb25767547 [0,0,0,0,1,0|3,0,0]=4 3007 B9R1.11 C=CC(O)c1c[s]cc1 Amb24427764 [0,0,0,0,1,0|3,0,0]=4 3008 B9R1.11 C=CC(O)c1ccc[s]1 Amb25123773 [0,0,0,0,1,0|3,0,0]=4 3009 B9R1.11 C=CC(O)c1ccco1 Amb24332569 [0,0,0,0,1,0|3,0,0]=4 3010 B9R1.11 C=CC(O)c1cocc1 Amb25794051 [0,0,0,0,1,0|3,0,0]=4 3011 B9R1.11 C=C[C@@H](N)c1c[nH]cc1 Amb25836251 [0,0,0,0,1,0|3,0,0]=4 3012 B9R1.11 C=C[C@@H](O)c1ccco1 Amb25074343 [0,0,0,0,1,0|3,0,0]=4 3013 B9R1.11 C=C[C@H](N)c1c[nH]cc1 Amb25218900 [0,0,0,0,1,0|3,0,0]=4 3014 B9R1.11 C=C[C@H](N)c1c[s]cc1 Amb24477861 [0,0,0,0,1,0|3,0,0]=4 3015 B9R1.11 C=C[C@H](N)c1ccc[s]1 Amb24693080 [0,0,0,0,1,0|3,0,0]=4 3016 B9R1.11 C=C[C@H](N)c1cocc1 Amb25111620 [0,0,0,0,1,0|3,0,0]=4 3017 B9R1.11 C=C[C@H](O)c1ccc[s]1 Amb25084312 [0,0,0,0,1,0|3,0,0]=4 3018 B9R1.11 C=C[C@H](O)c1ccco1 Amb25056767 [0,0,0,0,1,0|3,0,0]=4 3019 B9R1.11 C=C[C@H](O)c1cocc1 Amb24732477 [0,0,0,0,1,0|3,0,0]=4 3020 B9R1.11 CC(C#C)[n]1cccc1 Amb24412491 [0,0,0,0,1,0|2,0,1]=4 3021 B9R1.11 CC(C#N)[n]1cccc1 Amb18641987 [0,0,0,0,1,0|2,0,1]=4 3022 B9R1.11 CC(C#N)c1ccc[nH]1 Amb18124279 [0,0,0,0,1,0|2,0,1]=4 3023 B9R1.11 CC(C=O)[n]1cccc1 Amb18642117 [0,0,0,0,1,0|1,0,0]=2 3024 B9R1.11 CC(C=O)c1c[nH]cc1 Amb24477753 [0,0,0,0,1,0|1,0,0]=2 3025 B9R1.11 CC(C=O)c1ccc[nH]1 Amb24349735 [0,0,0,0,1,0|1,0,0]=2 3026 B9R1.11 CC(C=O)c1ccco1 Amb18642174 [0,0,0,0,1,0|1,0,0]=2 3027 B9R1.11 CC(CCl)=C1C=CC=C1 Amb25705321 [0,0,0,0,1,0|1,0,2]=4 3028 B9R1.11 CC(CN)c1c[nH]cc1 Amb18062922 [0,0,0,0,1,0|2,0,1]=4 3029 B9R1.11 CC(CN)c1c[s]cc1 Amb18958489 [0,0,0,0,1,0|2,0,1]=4 3030 B9R1.11 CC(NN)c1c[nH]cc1 Amb18222164 [0,0,0,0,1,0|3,0,0]=4 3031 B9R1.11 CC(NN)c1c[s]cc1 Amb25675360 [0,0,0,0,1,0|3,0,0]=4 3032 B9R1.11 CC(NO)c1c[s]cc1 Amb24529065 [0,0,0,0,1,0|2,0,1]=4 3033 B9R1.11 CC(NO)c1cocc1 Amb24756333 [0,0,0,0,1,0|2,0,1]=4 3034 B9R1.11 CCC(C)c1ccc[nH]1 Amb24376687 [0,0,0,0,1,0|2,0,1]=4 3035 B9R1.11 CN(C=O)c1[n]cc[s]1 Amb24096785 [0,0,0,0,1,0|3,0,0]=4 3036 B9R1.11 CN(C=O)c1c[s]cc1 Amb24666083 [0,0,0,0,1,0|2,0,0]=3 3037 B9R1.11 CNC(C)c1c[nH]cc1 Amb18893263 [0,0,0,0,1,0|3,0,0]=4 3038 B9R1.11 CNC(C)c1c[s]cc1 Amb18288002 [0,0,0,0,1,0|3,0,0]=4 3039 B9R1.11 CNC(C)c1ccco1 Amb19888104 [0,0,0,0,1,0|3,0,0]=4 3040 B9R1.11 CNC(c1ccco1)C Amb1127360 [0,0,0,0,1,0|3,0,0]=4 3041 B9R1.11 CNC(c1cccs1)C Amb1799863 [0,0,0,0,1,0|3,0,0]=4 3042 B9R1.11 CNC(c1cocc1)C Amb2234942 [0,0,0,0,1,0|3,0,0]=4 3043 B9R1.11 CN[C@@H](C)c1c[s]cc1 Amb24628804 [0,0,0,0,1,0|3,0,0]=4 3044 B9R1.11 CN[C@@H](C)c1ccc[s]1 Amb24364654 [0,0,0,0,1,0|3,0,0]=4 3045 B9R1.11 CN[C@H](C)c1c[s]cc1 Amb24436085 [0,0,0,0,1,0|3,0,0]=4 3046 B9R1.11 CN[C@H](C)c1ccc[s]1 Amb24635445 [0,0,0,0,1,0|3,0,0]=4 3047 B9R1.11 CN[C@H](C)c1ccco1 Amb24434234 [0,0,0,0,1,0|3,0,0]=4 3048 B9R1.11 CN[C@H](C)c1cocc1 Amb25361831 [0,0,0,0,1,0|3,0,0]=4 3049 B9R1.11 COC(C)c1ccc[s]1 Amb25026642 [0,0,0,0,1,0|3,0,0]=4 3050 B9R1.11 COC(C)c1ccco1 Amb25220078 [0,0,0,0,1,0|3,0,0]=4 3051 B9R1.11 CSC(C)c1ccc[s]1 Amb24476743 [0,0,0,0,1,0|3,0,0]=4 3052 B9R1.11 C[C@@H](C=O)[n]1cccc1 Amb25032110 [0,0,0,0,1,0|1,0,0]=2 3053 B9R1.11 C[C@@H](C=O)c1ccc[s]1 Amb24602792 [0,0,0,0,1,0|1,0,0]=2 3054 B9R1.11 C[C@@H](C=O)c1ccco1 Amb25830685 [0,0,0,0,1,0|1,0,0]=2 3055 B9R1.11 C[C@@H](CO)[n]1cccc1 Amb24417094 [0,0,0,0,1,0|1,0,2]=4 3056 B9R1.11 C[C@@H](CO)c1c[s]cc1 Amb24734195 [0,0,0,0,1,0|1,0,2]=4 3057 B9R1.11 C[C@@H](CO)c1ccc[s]1 Amb24619184 [0,0,0,0,1,0|1,0,2]=4 3058 B9R1.11 C[C@@H](CO)c1ccco1 Amb24340224 [0,0,0,0,1,0|1,0,2]=4 3059 B9R1.11 C[C@@H](NO)c1ccc[s]1 Amb24445194 [0,0,0,0,1,0|2,0,1]=4 3060 B9R1.11 C[C@H](C=C)[n]1cccc1 Amb24417723 [0,0,0,0,1,0|2,0,0]=3 3061 B9R1.11 C[C@H](C=O)c1c[s]cc1 Amb24722851 [0,0,0,0,1,0|1,0,0]=2 3062 B9R1.11 C[C@H](C=O)c1ccco1 Amb25735791 [0,0,0,0,1,0|1,0,0]=2 3063 B9R1.11 C[C@H](CO)C1=CCC=C1 Amb25745076 [0,0,0,0,1,0|0,0,3]=4 3064 B9R1.11 C[C@H](CO)[n]1cccc1 Amb24481818 [0,0,0,0,1,0|1,0,2]=4 3065 B9R1.11 C[C@H](NO)c1ccco1 Amb25354707 [0,0,0,0,1,0|2,0,1]=4 3066 B9R1.11 C\C(=C\Br)\c1cc[s]c1 Amb25253460 [0,0,0,0,1,0|2,0,1]=4 3067 B9R1.11 C\C(=C\Cl)\c1ccc[s]1 Amb24470059 [0,0,0,0,1,0|2,0,1]=4 3068 B9R1.11 ClCC(c1cccs1)C Amb17232346 [0,0,0,0,1,0|2,0,1]=4 3069 B9R1.11 N#CC(c1cccs1)C Amb17089237 [0,0,0,0,1,0|2,0,1]=4 3070 B9R1.11 NOC(c1cccs1)C Amb17089184 [0,0,0,0,1,0|3,0,0]=4 3071 B9R1.11 N[C@H](C=O)c1c[n]c[nH]1 Amb25084959 [0,0,0,0,1,0|3,0,0]=4 3072 B9R1.11 O=C(C=O)c1c[s]cc1 Amb18124566 [0,0,0,0,1,0|2,0,1]=4 3073 B9R1.11 O=C(C=O)c1ccc[nH]1 Amb25146153 [0,0,0,0,1,0|2,0,1]=4 3074 B9R1.11 O=CC(=O)c1ccco1 Amb17593264 [0,0,0,0,1,0|2,0,1]=4 3075 B9R1.11 O=CC(=O)c1cccs1 Amb10067937 [0,0,0,0,1,0|2,0,1]=4 3076 B9R1.11 O=CC(=O)c1cccs1 Amb10607111 [0,0,0,0,1,0|2,0,1]=4 3077 B9R1.11 O=CC(F)c1c[nH]c[n]1 Amb24714535 [0,0,0,0,1,0|3,0,0]=4 3078 B9R1.11 O=CC(c1cccs1)C Amb17138391 [0,0,0,0,1,0|1,0,0]=2 3079 B9R1.11 OC(C=O)c1c[s]cc1 Amb24466343 [0,0,0,0,1,0|2,0,0]=3 3080 B9R1.11 OC(C=O)c1ccco1 Amb25769824 [0,0,0,0,1,0|2,0,0]=3 3081 B9R1.11 OC(C=O)c1cocc1 Amb25334420 [0,0,0,0,1,0|2,0,0]=3 3082 B9R1.11 OCC(c1cccs1)C Amb17231948 [0,0,0,0,1,0|1,0,2]=4 3083 B9R1.11 ONC(c1ccco1)C Amb10605011 [0,0,0,0,1,0|2,0,1]=4 3084 B9R1.11 ONC(c1cccs1)C Amb10606933 [0,0,0,0,1,0|2,0,1]=4 3085 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [0,0,0,0,0,1|2,0,1]=4 3086 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [0,0,0,0,0,1|2,0,1]=4 3087 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [0,0,0,0,0,1|1,0,1]=3 3088 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [0,0,0,0,0,1|2,0,1]=4 3089 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [0,0,0,0,0,1|2,0,1]=4 3090 B11R1.40 C#CC(O)Nc1ccccc1 Amb24561876 [0,0,0,0,0,1|2,0,1]=4 3091 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [0,0,0,0,0,1|2,0,1]=4 3092 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [0,0,0,0,0,1|1,0,2]=4 3093 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [0,0,0,0,0,1|0,0,2]=3 3094 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [0,0,0,0,0,1|0,0,2]=3 3095 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,0,1|2,0,1]=4 3096 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [0,0,0,0,0,1|2,0,1]=4 3097 B11R1.40 C=CC(Cl)Oc1ccccc1 Amb25363210 [0,0,0,0,0,1|2,0,0]=3 3098 B11R1.40 C=CC(N)Cc1cccc[n]1 Amb25077646 [0,0,0,0,0,1|3,0,0]=4 3099 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [0,0,0,0,0,1|2,0,0]=3 3100 B11R1.40 C=CC(O)Cc1c[n]ccc1 Amb25097959 [0,0,0,0,0,1|3,0,0]=4 3101 B11R1.40 C=CC(O)Cc1cccc[n]1 Amb25241001 [0,0,0,0,0,1|3,0,0]=4 3102 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [0,0,0,0,0,1|2,0,0]=3 3103 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [0,0,0,0,0,1|2,0,0]=3 3104 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [0,0,0,0,0,1|2,0,0]=3 3105 B11R1.40 C=C[C@H](O)Cc1cccc[n]1 Amb25806691 [0,0,0,0,0,1|3,0,0]=4 3106 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [0,0,0,0,0,1|2,0,1]=4 3107 B11R1.40 CC(C#N)Nc1c[n]ccc1 Amb24100579 [0,0,0,0,0,1|2,0,1]=4 3108 B11R1.40 CC(C#N)Nc1cccc[n]1 Amb18644336 [0,0,0,0,0,1|2,0,1]=4 3109 B11R1.40 CC(C#N)Sc1cccc[n]1 Amb18183514 [0,0,0,0,0,1|2,0,1]=4 3110 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [0,0,0,0,0,1|1,0,1]=3 3111 B11R1.40 CC(C=C)Nc1[n]ccc[n]1 Amb24463444 [0,0,0,0,0,1|3,0,0]=4 3112 B11R1.40 CC(C=C)Nc1cc[n]cc1 Amb24360653 [0,0,0,0,0,1|2,0,0]=3 3113 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [0,0,0,0,0,1|1,0,0]=2 3114 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [0,0,0,0,0,1|1,0,0]=2 3115 B11R1.40 CC(C=C)Sc1[n]ccc[n]1 Amb25163100 [0,0,0,0,0,1|3,0,0]=4 3116 B11R1.40 CC(C=C)Sc1c[n]cc[n]1 Amb25032971 [0,0,0,0,0,1|3,0,0]=4 3117 B11R1.40 CC(C=C)Sc1ccc[n][n]1 Amb24556813 [0,0,0,0,0,1|3,0,0]=4 3118 B11R1.40 CC(C=C)Sc1cccc[n]1 Amb24404468 [0,0,0,0,0,1|2,0,0]=3 3119 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [0,0,0,0,0,1|1,0,0]=2 3120 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [0,0,0,0,0,1|0,0,0]=1 3121 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [0,0,0,0,0,1|0,0,0]=1 3122 B11R1.40 CC(CBr)Cc1c[n]ccc1 Amb25345425 [0,0,0,0,0,1|2,0,1]=4 3123 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [0,0,0,0,0,1|1,0,1]=3 3124 B11R1.40 CC(CCl)Nc1cc[n]cc1 Amb24420964 [0,0,0,0,0,1|2,0,1]=4 3125 B11R1.40 CC(CCl)Sc1cccc[n]1 Amb25122218 [0,0,0,0,0,1|2,0,1]=4 3126 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [0,0,0,0,0,1|1,0,1]=3 3127 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [0,0,0,0,0,1|1,0,1]=3 3128 B11R1.40 CC(CN)Nc1cc[n]cc1 Amb18908422 [0,0,0,0,0,1|2,0,1]=4 3129 B11R1.40 CC(CN)Nc1cccc[n]1 Amb24477483 [0,0,0,0,0,1|2,0,1]=4 3130 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [0,0,0,0,0,1|1,0,1]=3 3131 B11R1.40 CC(CN)Oc1cccc[n]1 Amb22522747 [0,0,0,0,0,1|2,0,1]=4 3132 B11R1.40 CC(CN)Sc1cc[n]cc1 Amb18252034 [0,0,0,0,0,1|2,0,1]=4 3133 B11R1.40 CC(CN)Sc1cccc[n]1 Amb18992825 [0,0,0,0,0,1|2,0,1]=4 3134 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [0,0,0,0,0,1|1,0,2]=4 3135 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [0,0,0,0,0,1|0,0,2]=3 3136 B11R1.40 CC(CO)Sc1cccc[n]1 Amb24486922 [0,0,0,0,0,1|1,0,2]=4 3137 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [0,0,0,0,0,1|0,0,2]=3 3138 B11R1.40 CC(Cc1c[n]c[n]c1)C=O Amb25056320 [0,0,0,0,0,1|2,0,0]=3 3139 B11R1.40 CC(Cc1c[n]cc[n]1)C=O Amb25806959 [0,0,0,0,0,1|2,0,0]=3 3140 B11R1.40 CC(Cc1c[n]ccc1)NN Amb25341062 [0,0,0,0,0,1|3,0,0]=4 3141 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [0,0,0,0,0,1|2,0,1]=4 3142 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [0,0,0,0,0,1|1,0,1]=3 3143 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [0,0,0,0,0,1|1,0,0]=2 3144 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [0,0,0,0,0,1|2,0,0]=3 3145 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [0,0,0,0,0,1|2,0,0]=3 3146 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [0,0,0,0,0,1|2,0,0]=3 3147 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [0,0,0,0,0,1|1,0,1]=3 3148 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [0,0,0,0,0,1|2,0,1]=4 3149 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [0,0,0,0,0,1|2,0,1]=4 3150 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [0,0,0,0,0,1|2,0,1]=4 3151 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [0,0,0,0,0,1|1,0,1]=3 3152 B11R1.40 CCC(C)Sc1cccc[n]1 Amb25822094 [0,0,0,0,0,1|2,0,1]=4 3153 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [0,0,0,0,0,1|1,0,1]=3 3154 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [0,0,0,0,0,1|2,0,1]=4 3155 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [0,0,0,0,0,1|2,0,1]=4 3156 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [0,0,0,0,0,1|2,0,1]=4 3157 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [0,0,0,0,0,1|2,0,1]=4 3158 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [0,0,0,0,0,1|2,0,1]=4 3159 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [0,0,0,0,0,1|2,0,1]=4 3160 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [0,0,0,0,0,1|2,0,1]=4 3161 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [0,0,0,0,0,1|2,0,1]=4 3162 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [0,0,0,0,0,1|2,0,1]=4 3163 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [0,0,0,0,0,1|2,0,1]=4 3164 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [0,0,0,0,0,1|1,0,2]=4 3165 B11R1.40 CN(Cc1c[n]ccc1)C=O Amb24096746 [0,0,0,0,0,1|2,0,0]=3 3166 B11R1.40 CN(Cc1cc[n]c[n]1)C=O Amb25264949 [0,0,0,0,0,1|3,0,0]=4 3167 B11R1.40 CN(Cc1cccc[n]1)C=O Amb25189288 [0,0,0,0,0,1|2,0,0]=3 3168 B11R1.40 CN(Cc1cccc[n]1)N=O Amb24636522 [0,0,0,0,0,1|3,0,0]=4 3169 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [0,0,0,0,0,1|2,0,1]=4 3170 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [0,0,0,0,0,1|1,1,0]=3 3171 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [0,0,0,0,0,1|2,0,0]=3 3172 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [0,0,0,0,0,1|2,0,0]=3 3173 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [0,0,0,0,0,1|3,0,0]=4 3174 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [0,0,0,0,0,1|2,0,0]=3 3175 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [0,0,0,0,0,1|3,0,0]=4 3176 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,0,0,0,0,1|3,0,0]=4 3177 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,0,0,0,0,1|3,0,0]=4 3178 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,0,0,0,0,1|2,1,0]=4 3179 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [0,0,0,0,0,1|0,0,0]=1 3180 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [0,0,0,0,0,1|0,0,0]=1 3181 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [0,0,0,0,0,1|1,0,1]=3 3182 B11R1.40 C[C@@H](CO)Nc1cccc[n]1 Amb25205329 [0,0,0,0,0,1|1,0,2]=4 3183 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [0,0,0,0,0,1|0,0,2]=3 3184 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [0,0,0,0,0,1|1,0,0]=2 3185 B11R1.40 C[C@H](CN)Cc1cc[n]cc1 Amb24745496 [0,0,0,0,0,1|2,0,1]=4 3186 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [0,0,0,0,0,1|0,0,2]=3 3187 B11R1.40 C[C@H](CO)Nc1cccc[n]1 Amb25275075 [0,0,0,0,0,1|1,0,2]=4 3188 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [0,0,0,0,0,1|0,0,0]=1 3189 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [0,0,0,0,0,1|1,0,1]=3 3190 B11R1.40 C\C(=C/c1c[n]cc[n]1)\C=O Amb25277133 [0,0,0,0,0,1|2,0,1]=4 3191 B11R1.40 C\C(=C/c1cc[n]cc1)\C=C Amb24103157 [0,0,0,0,0,1|2,0,1]=4 3192 B11R1.40 C\C(=C/c1ccc[n]c1)\C=C Amb24085616 [0,0,0,0,0,1|2,0,1]=4 3193 B11R1.40 C\C(=C/c1cccc[n]1)\C=C Amb24101881 [0,0,0,0,0,1|2,0,1]=4 3194 B11R1.40 C\C(=C/c1ccccc1)\C#N Amb18644009 [0,0,0,0,0,1|1,0,2]=4 3195 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [0,0,0,0,0,1|2,0,1]=4 3196 B11R1.40 C\C(=C\c1c[n]cc[n]1)\C=O Amb25252285 [0,0,0,0,0,1|2,0,1]=4 3197 B11R1.40 C\C(=C\c1cc[n]c[n]1)\C=O Amb25149244 [0,0,0,0,0,1|2,0,1]=4 3198 B11R1.40 C\C(=C\c1cc[n]cc1)\C=C Amb24103181 [0,0,0,0,0,1|2,0,1]=4 3199 B11R1.40 C\C(=C\c1cc[n]cc1)\C=O Amb24366948 [0,0,0,0,0,1|1,0,1]=3 3200 B11R1.40 C\C(=C\c1ccc[n]c1)\C=C Amb24085626 [0,0,0,0,0,1|2,0,1]=4 3201 B11R1.40 C\C(=C\c1cccc[n]1)\C=C Amb24101910 [0,0,0,0,0,1|2,0,1]=4 3202 B11R1.40 C\C(=C\c1cccc[n]1)\C=O Amb25149235 [0,0,0,0,0,1|1,0,1]=3 3203 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [0,0,0,0,0,1|0,0,1]=2 3204 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [0,0,0,0,0,1|1,0,1]=3 3205 B11R1.40 C\C(\CBr)=C/c1ccccc1 Amb24605004 [0,0,0,0,0,1|1,0,2]=4 3206 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [0,0,0,0,0,1|1,0,2]=4 3207 B11R1.40 C\C(\CN)=C/c1ccccc1 Amb25076849 [0,0,0,0,0,1|1,0,2]=4 3208 B11R1.40 C\C(\CN)=C\c1ccccc1 Amb24634730 [0,0,0,0,0,1|1,0,2]=4 3209 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [0,0,0,0,0,1|1,0,1]=3 3210 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [0,0,0,0,0,1|2,0,1]=4 3211 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [0,0,0,0,0,1|2,0,1]=4 3212 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [0,0,0,0,0,1|1,0,1]=3 3213 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [0,0,0,0,0,1|2,0,1]=4 3214 B11R1.40 ClCC(Cl)Oc1ccccc1 Amb24358073 [0,0,0,0,0,1|2,0,1]=4 3215 B11R1.40 ClCC(Cl)Sc1ccccc1 Amb24653564 [0,0,0,0,0,1|2,0,1]=4 3216 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [0,0,0,0,0,1|1,0,1]=3 3217 B11R1.40 FC(CCl)Sc1ccccc1 Amb24390863 [0,0,0,0,0,1|2,0,1]=4 3218 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [0,0,0,0,0,1|2,0,1]=4 3219 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [0,0,0,0,0,1|2,0,1]=4 3220 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [0,0,0,0,0,1|2,0,1]=4 3221 B11R1.40 N#CC(F)Sc1ccccc1 Amb24323242 [0,0,0,0,0,1|2,0,1]=4 3222 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [0,0,0,0,0,1|2,0,1]=4 3223 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [0,0,0,0,0,1|2,0,1]=4 3224 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [0,0,0,0,0,1|2,0,1]=4 3225 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [0,0,0,0,0,1|2,0,1]=4 3226 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [0,0,0,0,0,1|2,0,1]=4 3227 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [0,0,0,0,0,1|2,0,1]=4 3228 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [0,0,0,0,0,1|2,0,1]=4 3229 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [0,0,0,0,0,1|2,0,1]=4 3230 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [0,0,0,0,0,1|2,0,1]=4 3231 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [0,0,0,0,0,1|1,0,1]=3 3232 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [0,0,0,0,0,1|2,0,1]=4 3233 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [0,0,0,0,0,1|2,0,1]=4 3234 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [0,0,0,0,0,1|2,0,1]=4 3235 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [0,0,0,0,0,1|2,0,1]=4 3236 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [0,0,0,0,0,1|2,0,1]=4 3237 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [0,0,0,0,0,1|2,0,1]=4 3238 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [0,0,0,0,0,1|2,0,1]=4 3239 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [0,0,0,0,0,1|1,0,2]=4 3240 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [0,0,0,0,0,1|1,1,1]=4 3241 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [0,0,0,0,0,1|2,0,1]=4 3242 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [0,0,0,0,0,1|2,0,1]=4 3243 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [0,0,0,0,0,1|2,0,1]=4 3244 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [0,0,0,0,0,1|1,1,1]=4 3245 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [0,0,0,0,0,1|1,0,0]=2 3246 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [0,0,0,0,0,1|1,0,2]=4 3247 B11R1.40 O=C(C=O)Nc1cc[n]cc1 Amb24360354 [0,0,0,0,0,1|2,0,1]=4 3248 B11R1.40 O=C(C=O)Oc1c[n]ccc1 Amb24484745 [0,0,0,0,0,1|2,0,1]=4 3249 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [0,0,0,0,0,1|1,0,1]=3 3250 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,0,1|1,0,1]=3 3251 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [0,0,0,0,0,1|2,0,0]=3 3252 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [0,0,0,0,0,1|1,0,0]=2 3253 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [0,0,0,0,0,1|1,0,0]=2 3254 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [0,0,0,0,0,1|2,0,0]=3 3255 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [0,0,0,0,0,1|1,0,0]=2 3256 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [0,0,0,0,0,1|1,0,0]=2 3257 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [0,0,0,0,0,1|1,0,0]=2 3258 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [0,0,0,0,0,1|1,0,0]=2 3259 B11R1.40 O=C\C(=C\c1ccccn1)\C Amb1014105 [0,0,0,0,0,1|1,0,1]=3 3260 B11R1.40 O=C\C(=C\c1cccnc1)\C Amb17334266 [0,0,0,0,0,1|1,0,1]=3 3261 B11R1.40 O=C\C(=C\c1ccncc1)\C Amb17334268 [0,0,0,0,0,1|1,0,1]=3 3262 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [0,0,0,0,0,1|1,0,1]=3 3263 B11R1.40 O=C\C(\Cl)=C/c1ccc[n]c1 Amb24357125 [0,0,0,0,0,1|2,0,1]=4 3264 B11R1.40 O=C\C(\Cl)=C\c1cccc[n]1 Amb18126489 [0,0,0,0,0,1|2,0,1]=4 3265 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [0,0,0,0,0,1|1,0,1]=3 3266 B11R1.40 O=C\C(\F)=C\c1cccc[n]1 Amb24689556 [0,0,0,0,0,1|2,0,1]=4 3267 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [0,0,0,0,0,1|1,0,1]=3 3268 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [0,0,0,0,0,1|2,0,0]=3 3269 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [0,0,0,0,0,1|2,0,1]=4 3270 B11R1.40 OC(CBr)Oc1ccccc1 Amb24724811 [0,0,0,0,0,1|2,0,1]=4 3271 B11R1.40 OC(CBr)Sc1ccccc1 Amb24065441 [0,0,0,0,0,1|2,0,1]=4 3272 B11R1.40 OC(CCl)Oc1ccccc1 Amb24635839 [0,0,0,0,0,1|2,0,1]=4 3273 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [0,0,0,0,0,1|2,0,1]=4 3274 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [0,0,0,0,0,1|1,1,1]=4 3275 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [0,0,0,0,0,1|2,0,0]=3 3276 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [0,0,0,0,0,1|2,0,0]=3 3277 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [0,0,0,0,0,1|1,0,0]=2 3278 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [0,0,0,0,0,1|0,0,2]=3 3279 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [0,0,0,0,0,1|1,0,2]=4 3280 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [0,0,0,0,0,1|1,0,2]=4 3281 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [0,0,0,0,0,1|1,0,2]=4 3282 B11R1.40 OCC(O)Nc1ccccc1 Amb25369775 [0,0,0,0,0,1|1,0,2]=4 3283 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [0,0,0,0,0,1|0,0,2]=3 3284 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [0,0,0,0,0,1|1,0,2]=4 3285 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [0,0,0,0,0,1|1,0,2]=4 3286 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [0,0,0,0,0,1|1,0,2]=4 3287 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [0,0,0,0,0,1|2,0,1]=4 3288 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [0,0,0,0,0,1|2,0,1]=4 3289 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [0,0,0,0,0,1|2,0,1]=4 3290 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [0,0,0,0,0,1|1,0,0]=2 3291 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [0,0,0,0,0,1|1,0,1]=3 3292 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [0,0,0,0,0,1|1,0,1]=3 3293 B11R1.852 C=CC(O)C1C=CC=CC=C1 Amb25676763 [0,0,0,0,0,1|2,0,1]=4 3294 B11R1.852 CC(C=O)C1C=CC=CC=C1 Amb24594590 [0,0,0,0,0,1|0,0,1]=2 3295 B11R1.852 CC(C=O)C=1CC=CC=CC1 Amb24484730 [0,0,0,0,0,1|0,0,0]=1 3296 B11R1.852 CC(CO)C1C=CC=CC=C1 Amb25763818 [0,0,0,0,0,1|0,0,3]=4 3297 B11R1.852 C[C@@H](C=O)C1C=CC=CC=C1 Amb25767698 [0,0,0,0,0,1|0,0,1]=2 3298 B8R0.1 CC(CC=O)=C\C=C\Br Amb24480026 [1,0,1,0,0,0|1,0,1]=4 3299 B8R0.1 CC(CC=O)\C=C/C=C Amb25074501 [1,0,1,0,0,0|0,0,2]=4 3300 B8R0.1 CC(CC=O)\C=C\C=C Amb24656025 [1,0,1,0,0,0|0,0,2]=4 3301 B8R0.1 C\C(=C/C=O)\C=C\C=C Amb24677104 [1,0,1,0,0,0|0,0,2]=4 3302 B8R0.1 C\C(\CC=O)=C\C=CBr Amb24595758 [1,0,1,0,0,0|1,0,1]=4 3303 B8R0.6 C\C(=C/C=C\C=O)\C=O Amb25773349 [1,0,1,0,0,0|1,0,1]=4 3304 B8R0.6 C\C(=C\C=C/C=O)\C=O Amb18642173 [1,0,1,0,0,0|1,0,1]=4 3305 B8R0.8 CC(C)C(=O)\C=C\C=C Amb25026498 [1,0,1,0,0,0|1,0,1]=4 3306 B8R0.22 CC=C(CC=O)\C=C\C Amb25179849 [1,0,1,0,0,0|0,0,2]=4 3307 B8R0.22 C\C=C(\CC=O)/C=C/C Amb25785625 [1,0,1,0,0,0|0,0,2]=4 3308 B8R0.22 C\C=C/C(CC=O)=C=C Amb25053038 [1,0,1,0,0,0|0,0,2]=4 3309 B8R0.4 C=C=C\C=C\CCC=O Amb25725906 [1,0,1,0,0,0|0,0,2]=4 3310 B8R0.4 C=CC\C=C\C=C/C=O Amb18642058 [1,0,1,0,0,0|0,0,2]=4 3311 B8R0.4 C=CC\C=C\C=CC=O Amb25259279 [1,0,1,0,0,0|0,0,2]=4 3312 B8R0.4 C=CC\C=C\C=C\C=O Amb25772895 [1,0,1,0,0,0|0,0,2]=4 3313 B8R0.4 C=CC\C=C\CCC=O Amb18642218 [1,0,1,0,0,0|0,0,2]=4 3314 B8R0.4 C=C\C=C\CCCC=O Amb18642211 [1,0,1,0,0,0|0,0,2]=4 3315 B8R0.4 CC=CC=CC=CC=O Amb24632185 [1,0,1,0,0,0|0,0,2]=4 3316 B8R0.4 CCC\C=C\C=C\C=C Amb22641675 [1,0,1,0,0,0|1,0,1]=4 3317 B8R0.4 C\C=C/C=C/CCC=O Amb25770156 [1,0,1,0,0,0|0,0,2]=4 3318 B8R0.4 C\C=C\C=C\C=C\C=O Amb17593248 [1,0,1,0,0,0|0,0,2]=4 3319 B8R0.4 C\C=C\C=C\CCC=O Amb25363492 [1,0,1,0,0,0|0,0,2]=4 3320 B8R0.4 NC=CC=CC=CC=O Amb24477820 [1,0,1,0,0,0|1,0,1]=4 3321 B8R0.4 O=CC=CC=CC=CBr Amb25237493 [1,0,1,0,0,0|1,0,1]=4 3322 B8R0.4 O=CCCC=C\C=C\Cl Amb25173006 [1,0,1,0,0,0|1,0,1]=4 3323 B8R0.4 O=CCC\C=C/C=C/Cl Amb24480011 [1,0,1,0,0,0|1,0,1]=4 3324 B8R0.4 O=C\C=C/C=C\CC=O Amb24496324 [1,0,1,0,0,0|1,0,0]=3 3325 B8R0.4 O=C\C=C\C=C\C=C\Cl Amb25706814 [1,0,1,0,0,0|1,0,1]=4 3326 B8R0.4 [O-]\C=C\C=C\C=C\C=O Amb24639146 [1,0,1,0,0,0|1,0,1]=4 3327 B8R0.7 C=C\C=C\C=C\C(O)=O Amb25785031 [1,0,1,0,0,0|1,0,1]=4 3328 B8R0.7 CC(=O)\C=C/C=C\C=O Amb25239361 [1,0,1,0,0,0|1,0,1]=4 3329 B8R0.7 CC(=O)\C=C\C=C/C=C Amb25723853 [1,0,1,0,0,0|0,0,1]=3 3330 B8R0.7 CC(=O)\C=C\C=CC=C Amb24634570 [1,0,1,0,0,0|0,0,1]=3 3331 B8R0.7 CC(=O)\C=C\C=C\C=C Amb25707424 [1,0,1,0,0,0|0,0,1]=3 3332 B8R0.7 CC(=O)\C=C\C=C\C=O Amb18642168 [1,0,1,0,0,0|1,0,1]=4 3333 B8R0.7 CC(C)\C=C\C=C\C=O Amb18642247 [1,0,1,0,0,0|1,0,1]=4 3334 B8R1.2 BrC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367404 [2,0,0,0,0,0|1,0,0]=3 3335 B8R1.2 BrC[13c]1ccccc1 Amb22367396 [2,0,0,0,0,0|1,0,0]=3 3336 B8R1.2 BrCc1cc[n]cc1 Amb22753071 [2,0,0,0,0,0|2,0,0]=4 3337 B8R1.2 BrCc1cccc[n]1 Amb22751621 [2,0,0,0,0,0|2,0,0]=4 3338 B8R1.2 Br[13CH2]c1ccccc1 Amb22366910 [2,0,0,0,0,0|1,0,0]=3 3339 B8R1.2 Br[Hg]c1ccccc1 Amb22369231 [2,0,0,0,0,0|2,0,0]=4 3340 B8R1.2 C#[13C]c1ccccc1 Amb22367126 [2,0,0,0,0,0|0,0,2]=4 3341 B8R1.2 C=C[n+]1ccccc1 Amb10552726 [2,0,0,0,0,0|1,0,1]=4 3342 B8R1.2 C=C[n+]1ccccc1 Amb10552768 [2,0,0,0,0,0|1,0,1]=4 3343 B8R1.2 C=C[n+]1ccccc1 Amb10552769 [2,0,0,0,0,0|1,0,1]=4 3344 B8R1.2 C=C[n+]1ccccc1 Amb10552775 [2,0,0,0,0,0|1,0,1]=4 3345 B8R1.2 C=Cc1ccccc1 Amb22337033 [2,0,0,0,0,0|0,0,1]=3 3346 B8R1.2 C=Cc1ccccc1 Amb22337871 [2,0,0,0,0,0|0,0,1]=3 3347 B8R1.2 C=Cc1ccccc1 Amb22337937 [2,0,0,0,0,0|0,0,1]=3 3348 B8R1.2 C=Cc1ccccc1 Amb22338204 [2,0,0,0,0,0|0,0,1]=3 3349 B8R1.2 C=Cc1ccccc1 Amb22338475 [2,0,0,0,0,0|0,0,1]=3 3350 B8R1.2 C=Cc1ccccc1 Amb22351316 [2,0,0,0,0,0|0,0,1]=3 3351 B8R1.2 C=Cc1ccccc1 Amb22731028 [2,0,0,0,0,0|0,0,1]=3 3352 B8R1.2 C=Cc1ccccc1 Amb22733123 [2,0,0,0,0,0|0,0,1]=3 3353 B8R1.2 C=Cc1cccnc1 Amb10071930 [2,0,0,0,0,0|1,0,1]=4 3354 B8R1.2 C=Nc1ccccc1 Amb24605672 [2,0,0,0,0,0|1,0,0]=3 3355 B8R1.2 CCC1=CCC=CN1 Amb24524490 [2,0,0,0,0,0|1,0,1]=4 3356 B8R1.2 CCC=1CC=CCC1 Amb22227940 [2,0,0,0,0,0|0,0,2]=4 3357 B8R1.2 CC[n+]1ccccc1 Amb22739693 [2,0,0,0,0,0|1,0,0]=3 3358 B8R1.2 CCc1[n]ccc[n]1 Amb24095641 [2,0,0,0,0,0|2,0,0]=4 3359 B8R1.2 CCc1c[n]c[n]c1 Amb24097063 [2,0,0,0,0,0|2,0,0]=4 3360 B8R1.2 CCc1c[n]cc[n]1 Amb20620291 [2,0,0,0,0,0|2,0,0]=4 3361 B8R1.2 CCc1cc[n]c[n]1 Amb20242304 [2,0,0,0,0,0|2,0,0]=4 3362 B8R1.2 CCc1ccccc1 Amb22336270 [2,0,0,0,0,0|0,0,0]=2 3363 B8R1.2 CCc1ccccc1 Amb22366965 [2,0,0,0,0,0|0,0,0]=2 3364 B8R1.2 CCc1ccccc1 Amb2447474 [2,0,0,0,0,0|0,0,0]=2 3365 B8R1.2 CO[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17608460 [2,0,0,0,0,0|1,0,0]=3 3366 B8R1.2 CO[13c]1ccccc1 Amb22362658 [2,0,0,0,0,0|1,0,0]=3 3367 B8R1.2 CO[n+]1ccccc1 Amb10552605 [2,0,0,0,0,0|2,0,0]=4 3368 B8R1.2 COc1cc[n]cc1 Amb24079672 [2,0,0,0,0,0|2,0,0]=4 3369 B8R1.2 COc1cccnc1 Amb10573360 [2,0,0,0,0,0|2,0,0]=4 3370 B8R1.2 CPc1ccccc1 Amb25341327 [2,0,0,0,0,0|1,0,0]=3 3371 B8R1.2 CSc1c[n]ccc1 Amb24087396 [2,0,0,0,0,0|2,0,0]=4 3372 B8R1.2 CSc1cc[n]cc1 Amb24103013 [2,0,0,0,0,0|2,0,0]=4 3373 B8R1.2 CSc1cccc[n]1 Amb24081200 [2,0,0,0,0,0|2,0,0]=4 3374 B8R1.2 C[13CH2]c1ccccc1 Amb22362696 [2,0,0,0,0,0|0,0,0]=2 3375 B8R1.2 C[SiH2]c1ccccc1 Amb19893954 [2,0,0,0,0,0|0,1,0]=3 3376 B8R1.2 ClC=C1C=COC=C1 Amb24470181 [2,0,0,0,0,0|2,0,0]=4 3377 B8R1.2 ClC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367253 [2,0,0,0,0,0|1,0,0]=3 3378 B8R1.2 ClCc1cccc[n]1 Amb22489454 [2,0,0,0,0,0|2,0,0]=4 3379 B8R1.2 ClCc1ccccc1 Amb22363332 [2,0,0,0,0,0|1,0,0]=3 3380 B8R1.2 ClCc1ccncc1 Amb1933717 [2,0,0,0,0,0|2,0,0]=4 3381 B8R1.2 ClSc1ccccc1 Amb10575597 [2,0,0,0,0,0|2,0,0]=4 3382 B8R1.2 Cl[13CH2]c1ccccc1 Amb22351323 [2,0,0,0,0,0|1,0,0]=3 3383 B8R1.2 Cl[SiH2]c1ccccc1 Amb22351128 [2,0,0,0,0,0|1,1,0]=4 3384 B8R1.2 FCc1c[n]ccc1 Amb25259171 [2,0,0,0,0,0|2,0,0]=4 3385 B8R1.2 FCc1cc[n]cc1 Amb22372287 [2,0,0,0,0,0|2,0,0]=4 3386 B8R1.2 FCc1cccc[n]1 Amb24093657 [2,0,0,0,0,0|2,0,0]=4 3387 B8R1.2 FCc1ccccc1 Amb10838335 [2,0,0,0,0,0|1,0,0]=3 3388 B8R1.2 FSc1ccccc1 Amb25198589 [2,0,0,0,0,0|2,0,0]=4 3389 B8R1.2 ICc1cc[n]cc1 Amb22489735 [2,0,0,0,0,0|2,0,0]=4 3390 B8R1.2 ICc1cc[n]cc1 Amb22748952 [2,0,0,0,0,0|2,0,0]=4 3391 B8R1.2 ICc1cccnc1 Amb10602162 [2,0,0,0,0,0|2,0,0]=4 3392 B8R1.2 I[Hg]c1ccccc1 Amb22347346 [2,0,0,0,0,0|2,0,0]=4 3393 B8R1.2 I[Mg]c1ccccc1 Amb22730124 [2,0,0,0,0,0|2,0,0]=4 3394 B8R1.2 I[Se]c1ccccc1 Amb10601593 [2,0,0,0,0,0|2,0,0]=4 3395 B8R1.2 N#Cc1ccccc1 Amb21864642 [2,0,0,0,0,0|1,0,1]=4 3396 B8R1.2 N#Cc1ccccc1 Amb22167299 [2,0,0,0,0,0|1,0,1]=4 3397 B8R1.2 N#[N+]c1ccccc1 Amb10564805 [2,0,0,0,0,0|2,0,0]=4 3398 B8R1.2 N=Cc1c[n]ccc1 Amb24062509 [2,0,0,0,0,0|2,0,0]=4 3399 B8R1.2 N=Cc1cccc[n]1 Amb24081259 [2,0,0,0,0,0|2,0,0]=4 3400 B8R1.2 NC[n+]1ccccc1 Amb24716810 [2,0,0,0,0,0|2,0,0]=4 3401 B8R1.2 NCc1cc[n]cc1 Amb20620293 [2,0,0,0,0,0|2,0,0]=4 3402 B8R1.2 NCc1cc[n]cc1 Amb20622010 [2,0,0,0,0,0|2,0,0]=4 3403 B8R1.2 NCc1cccc[n]1 Amb20620292 [2,0,0,0,0,0|2,0,0]=4 3404 B8R1.2 NCc1cccc[n]1 Amb22274458 [2,0,0,0,0,0|2,0,0]=4 3405 B8R1.2 NCc1ccccc1 Amb19958612 [2,0,0,0,0,0|1,0,0]=3 3406 B8R1.2 NCc1ccccc1 Amb22052549 [2,0,0,0,0,0|1,0,0]=3 3407 B8R1.2 NCc1ccccc1 Amb23459863 [2,0,0,0,0,0|1,0,0]=3 3408 B8R1.2 NCc1ccccc1 Amb24325406 [2,0,0,0,0,0|1,0,0]=3 3409 B8R1.2 NCc1cccnc1 Amb1481403 [2,0,0,0,0,0|2,0,0]=4 3410 B8R1.2 NCc1cccnc1 Amb2189172 [2,0,0,0,0,0|2,0,0]=4 3411 B8R1.2 NCc1ccncc1 Amb1156526 [2,0,0,0,0,0|2,0,0]=4 3412 B8R1.2 NNc1ccccc1 Amb22002446 [2,0,0,0,0,0|2,0,0]=4 3413 B8R1.2 NNc1ccccc1 Amb22166856 [2,0,0,0,0,0|2,0,0]=4 3414 B8R1.2 NNc1ccccc1 Amb22731573 [2,0,0,0,0,0|2,0,0]=4 3415 B8R1.2 NOc1ccccc1 Amb18123833 [2,0,0,0,0,0|2,0,0]=4 3416 B8R1.2 NOc1ccccc1 Amb22231364 [2,0,0,0,0,0|2,0,0]=4 3417 B8R1.2 O=Bc1ccccc1 Amb25221658 [2,0,0,0,0,0|1,0,0]=3 3418 B8R1.2 O=CC1=CCNC=C1 Amb24598254 [2,0,0,0,0,0|1,0,1]=4 3419 B8R1.2 O=CC1C=CC=CO1 Amb25053141 [2,0,0,0,0,0|1,0,1]=4 3420 B8R1.2 O=CC1C=COC=C1 Amb18641607 [2,0,0,0,0,0|1,0,1]=4 3421 B8R1.2 O=C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367549 [2,0,0,0,0,0|0,0,0]=2 3422 B8R1.2 O=Cc1cc[n]cc1 Amb20672039 [2,0,0,0,0,0|1,0,0]=3 3423 B8R1.2 O=Cc1cncnc1 Amb2235993 [2,0,0,0,0,0|2,0,0]=4 3424 B8R1.2 O=S=C1C=CC=CN1 Amb25679690 [2,0,0,0,0,0|2,0,0]=4 3425 B8R1.2 O=S=C1C=CNC=C1 Amb24606190 [2,0,0,0,0,0|2,0,0]=4 3426 B8R1.2 O=[13CH]c1ccccc1 Amb22349200 [2,0,0,0,0,0|0,0,0]=2 3427 B8R1.2 O=[I]c1ccccc1 Amb15692855 [2,0,0,0,0,0|1,0,0]=3 3428 B8R1.2 OC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367395 [2,0,0,0,0,0|0,0,1]=3 3429 B8R1.2 OCc1c[n]ccc1 Amb20622013 [2,0,0,0,0,0|1,0,1]=4 3430 B8R1.2 OCc1c[n]ccc1 Amb22434305 [2,0,0,0,0,0|1,0,1]=4 3431 B8R1.2 OCc1cc[n]cc1 Amb24183964 [2,0,0,0,0,0|1,0,1]=4 3432 B8R1.2 OCc1ccccn1 Amb16231923 [2,0,0,0,0,0|1,0,1]=4 3433 B8R1.2 OCc1ccncc1 Amb16231990 [2,0,0,0,0,0|1,0,1]=4 3434 B8R1.2 ONc1ccccc1 Amb17672282 [2,0,0,0,0,0|1,0,1]=4 3435 B8R1.2 ONc1ccccc1 Amb22445293 [2,0,0,0,0,0|1,0,1]=4 3436 B8R1.2 OSc1ccccc1 Amb25200260 [2,0,0,0,0,0|1,0,1]=4 3437 B8R1.2 O[13CH2]c1ccccc1 Amb22363258 [2,0,0,0,0,0|0,0,1]=3 3438 B8R1.2 O[14CH2]c1ccccc1 Amb22733558 [2,0,0,0,0,0|0,0,1]=3 3439 B8R1.2 O[Hg]c1ccccc1 Amb17940723 [2,0,0,0,0,0|1,0,1]=4 3440 B8R1.2 SCc1c[n]ccc1 Amb21984718 [2,0,0,0,0,0|1,1,0]=4 3441 B8R1.2 SCc1cc[n]cc1 Amb22008603 [2,0,0,0,0,0|1,1,0]=4 3442 B8R1.2 SCc1cccc[n]1 Amb20622005 [2,0,0,0,0,0|1,1,0]=4 3443 B8R1.2 [13CH3]Cc1ccccc1 Amb22353602 [2,0,0,0,0,0|0,0,0]=2 3444 B8R1.2 [15NH2]Cc1ccccc1 Amb22351500 [2,0,0,0,0,0|1,0,0]=3 3445 B8R1.2 [C-]#Cc1ccccc1 Amb22731283 [2,0,0,0,0,0|0,0,2]=4 3446 B8R1.2 [C-]#Cc1ccccc1 Amb22731714 [2,0,0,0,0,0|0,0,2]=4 3447 B8R1.2 [C-]#Cc1ccccc1 Amb22733589 [2,0,0,0,0,0|0,0,2]=4 3448 B8R1.2 [C-]#[N+]c1ccccc1 Amb1107613 [2,0,0,0,0,0|1,0,1]=4 3449 B8R1.2 [Li]Sc1ccccc1 Amb17939763 [2,0,0,0,0,0|2,0,0]=4 3450 B8R1.2 [Mg+]Cc1ccccc1 Amb22043988 [2,0,0,0,0,0|1,0,0]=3 3451 B8R1.2 [NH3+]Cc1ccccc1 Amb10555897 [2,0,0,0,0,0|1,0,0]=3 3452 B8R1.2 [NH3+]Oc1ccccc1 Amb10552602 [2,0,0,0,0,0|2,0,0]=4 3453 B8R1.2 [Na]Sc1ccccc1 Amb22353443 [2,0,0,0,0,0|2,0,0]=4 3454 B8R1.2 [O-]Cc1ccccc1 Amb22367041 [2,0,0,0,0,0|0,0,1]=3 3455 B8R1.2 [SiH3]Cc1ccccc1 Amb22347052 [2,0,0,0,0,0|0,1,0]=3 3456 B8R1.2 [Tl]Sc1ccccc1 Amb22366489 [2,0,0,0,0,0|2,0,0]=4 3457 B10R0.40 CC(C)(C=C)C(=O)\C=C\C=C Amb24765019 [0,1,1,0,0,0|2,0,0]=4 3458 B10R0.68 CC(C)(C=C)\C(\C=O)=C\C=C Amb25385802 [0,1,1,0,0,0|2,0,0]=4 3459 B10R0.41 C\C=C\C=C\C=C(\CC)/C=O Amb25385823 [0,1,1,0,0,0|0,0,2]=4 3460 B10R0.55 CC(C)\C=C\C=CC(C)C=O Amb25383618 [0,1,1,0,0,0|0,0,2]=4 3461 B10R0.55 CC(C)\C=C\C=C\[C@H](C)C=O Amb25385960 [0,1,1,0,0,0|0,0,2]=4 3462 B10R0.59 C\C(\C=O)=C/C\C=C(/C)\C=C Amb25385873 [0,1,1,0,0,0|0,0,2]=4 3463 B10R0.59 C\C=C(\C)/C=C/C=C(\C)/C=O Amb25103645 [0,1,1,0,0,0|0,0,2]=4 3464 B10R0.59 C\C=C(\C)/C=CC=C(C)C=O Amb24670403 [0,1,1,0,0,0|0,0,2]=4 3465 B10R0.74 C\C(=C/C=C/C=C/C=O)\C=O Amb24765099 [0,1,1,0,0,0|0,0,1]=3 3466 B10R0.74 C\C(=C/C=C\C=C\C=O)\C=O Amb24765108 [0,1,1,0,0,0|0,0,1]=3 3467 B10R0.75 CC=CC=CC=C(C)C(C)=O Amb24706923 [0,1,1,0,0,0|0,0,2]=4 3468 B10R0.75 C\C(=C/C=C/C=C/C)\C(O)=O Amb24373133 [0,1,1,0,0,0|0,0,2]=4 3469 B10R1.13 BrC(Br)c1ccc(Br)cc1 Amb17672294 [1,1,0,0,0,0|2,0,0]=4 3470 B10R1.13 BrC(c1ccc(cc1)C)Br Amb16234185 [1,1,0,0,0,0|2,0,0]=4 3471 B10R1.13 Brc1ccc(cc1)P(=O)O Amb10571105 [1,1,0,0,0,0|2,0,0]=4 3472 B10R1.13 Brc1ccc(cc1)[N+](=O)[O-] Amb1929309 [1,1,0,0,0,0|2,0,0]=4 3473 B10R1.13 Brc1ccc(cn1)C(C)C Amb10600533 [1,1,0,0,0,0|1,0,1]=4 3474 B10R1.13 Brc1ccc(nc1)C(=O)C Amb10601919 [1,1,0,0,0,0|1,0,1]=4 3475 B10R1.13 Brc1ccc(nc1)C(C)C Amb10600809 [1,1,0,0,0,0|1,0,1]=4 3476 B10R1.13 C=C(Br)c1ccc(Cl)cc1 Amb22336832 [1,1,0,0,0,0|1,0,1]=4 3477 B10R1.13 C=C(F)c1ccc(Br)cc1 Amb25169370 [1,1,0,0,0,0|1,0,1]=4 3478 B10R1.13 C=C(F)c1ccc(Cl)cc1 Amb22008097 [1,1,0,0,0,0|1,0,1]=4 3479 B10R1.13 C=C(F)c1ccc(F)cc1 Amb24053856 [1,1,0,0,0,0|1,0,1]=4 3480 B10R1.13 CC(=C)c1ccc(Br)c[n]1 Amb20617316 [1,1,0,0,0,0|1,0,1]=4 3481 B10R1.13 CC(=C)c1ccc(Cl)[n]c1 Amb20620746 [1,1,0,0,0,0|1,0,1]=4 3482 B10R1.13 CC(=C)c1ccc(F)[n]c1 Amb24655160 [1,1,0,0,0,0|1,0,1]=4 3483 B10R1.13 CC(=C)c1ccc(N)[n]c1 Amb25077205 [1,1,0,0,0,0|1,0,1]=4 3484 B10R1.13 CC(=C)c1ccc(N)c[n]1 Amb20617317 [1,1,0,0,0,0|1,0,1]=4 3485 B10R1.13 CC(=C)c1ccc(cc1)N Amb17107085 [1,1,0,0,0,0|0,0,1]=3 3486 B10R1.13 CC(=C)c1ccc(cc1)O Amb13883631 [1,1,0,0,0,0|0,0,1]=3 3487 B10R1.13 CC(=N)c1ccc(cc1)O Amb10576568 [1,1,0,0,0,0|1,0,1]=4 3488 B10R1.13 CC(=O)C=1C=CC(=C)CC1 Amb24758694 [1,1,0,0,0,0|0,0,2]=4 3489 B10R1.13 CC(=O)C=1C=CC(=O)NC1 Amb22744839 [1,1,0,0,0,0|1,0,1]=4 3490 B10R1.13 CC(=O)N1C=CC(=O)C=C1 Amb25320190 [1,1,0,0,0,0|1,0,1]=4 3491 B10R1.13 CC(=O)N1C=CC(=S)C=C1 Amb24062617 [1,1,0,0,0,0|1,0,1]=4 3492 B10R1.13 CC(=O)[n+]1ccc(N)cc1 Amb24661347 [1,1,0,0,0,0|1,0,1]=4 3493 B10R1.13 CC(=O)c1c[n]c(O)cc1 Amb22490878 [1,1,0,0,0,0|1,0,1]=4 3494 B10R1.13 CC(=O)c1cc[n+](C)cc1 Amb22481987 [1,1,0,0,0,0|1,0,1]=4 3495 B10R1.13 CC(=O)c1cc[n+](cc1)[O-] Amb10552750 [1,1,0,0,0,0|1,0,1]=4 3496 B10R1.13 CC(=O)c1ccc(F)c[n]1 Amb21864749 [1,1,0,0,0,0|1,0,1]=4 3497 B10R1.13 CC(=O)c1ccc(I)[n]c1 Amb25217952 [1,1,0,0,0,0|1,0,1]=4 3498 B10R1.13 CC(=O)c1ccc(N)c[n]1 Amb20247966 [1,1,0,0,0,0|1,0,1]=4 3499 B10R1.13 CC(=O)c1ccc(N)cc1 Amb22734863 [1,1,0,0,0,0|0,0,1]=3 3500 B10R1.13 CC(=O)c1ccc(O)[n]c1 Amb19958095 [1,1,0,0,0,0|1,0,1]=4 3501 B10R1.13 CC(=O)c1ccc(S)[n]c1 Amb24505216 [1,1,0,0,0,0|1,0,1]=4 3502 B10R1.13 CC(=O)c1ccc(cc1)Br Amb1221363 [1,1,0,0,0,0|0,0,1]=3 3503 B10R1.13 CC(=O)c1ccc(cc1)I Amb1233200 [1,1,0,0,0,0|0,0,1]=3 3504 B10R1.13 CC(=O)c1ccc(cc1)O Amb1212250 [1,1,0,0,0,0|0,0,1]=3 3505 B10R1.13 CC(=O)c1ccc(cc1)S Amb17593795 [1,1,0,0,0,0|0,0,1]=3 3506 B10R1.13 CC(Br)c1ccc(Br)c[n]1 Amb22751426 [1,1,0,0,0,0|2,0,0]=4 3507 B10R1.13 CC(Br)c1ccc(Cl)[n]c1 Amb24715311 [1,1,0,0,0,0|2,0,0]=4 3508 B10R1.13 CC(Br)c1ccc(Cl)c[n]1 Amb25078302 [1,1,0,0,0,0|2,0,0]=4 3509 B10R1.13 CC(Br)c1ccc(F)c[n]1 Amb23450336 [1,1,0,0,0,0|2,0,0]=4 3510 B10R1.13 CC(Br)c1ccc(O)cc1 Amb24759115 [1,1,0,0,0,0|1,0,0]=3 3511 B10R1.13 CC(C)=C1C=CC(=O)C=C1 Amb24690878 [1,1,0,0,0,0|0,0,2]=4 3512 B10R1.13 CC(C)N1C=CC(=S)C=C1 Amb24062616 [1,1,0,0,0,0|1,0,1]=4 3513 B10R1.13 CC(C)c1ccc(Cl)[n]c1 Amb25083723 [1,1,0,0,0,0|1,0,1]=4 3514 B10R1.13 CC(C)c1ccc(Cl)cc1 Amb22059617 [1,1,0,0,0,0|0,0,1]=3 3515 B10R1.13 CC(Cl)c1cc[n+]([O-])cc1 Amb24379935 [1,1,0,0,0,0|2,0,0]=4 3516 B10R1.13 CC(Cl)c1ccc(Br)c[n]1 Amb22751427 [1,1,0,0,0,0|2,0,0]=4 3517 B10R1.13 CC(Cl)c1ccc(I)cc1 Amb24479297 [1,1,0,0,0,0|1,0,0]=3 3518 B10R1.13 CC(F)c1ccc(Br)cc1 Amb22896470 [1,1,0,0,0,0|1,0,0]=3 3519 B10R1.13 CC(F)c1ccc(F)cc1 Amb22008083 [1,1,0,0,0,0|1,0,0]=3 3520 B10R1.13 CC(F)c1ccc(N)c[n]1 Amb24564755 [1,1,0,0,0,0|2,0,0]=4 3521 B10R1.13 CC(F)c1ccc(O)cc1 Amb25084251 [1,1,0,0,0,0|1,0,0]=3 3522 B10R1.13 CC(N)c1ccc(Br)[n]c1 Amb22011636 [1,1,0,0,0,0|2,0,0]=4 3523 B10R1.13 CC(N)c1ccc(Br)c[n]1 Amb21964136 [1,1,0,0,0,0|2,0,0]=4 3524 B10R1.13 CC(N)c1ccc(Br)c[n]1 Amb23440520 [1,1,0,0,0,0|2,0,0]=4 3525 B10R1.13 CC(N)c1ccc(Cl)[n]c1 Amb23446917 [1,1,0,0,0,0|2,0,0]=4 3526 B10R1.13 CC(N)c1ccc(Cl)c[n]1 Amb18830679 [1,1,0,0,0,0|2,0,0]=4 3527 B10R1.13 CC(N)c1ccc(F)[n]c1 Amb18202880 [1,1,0,0,0,0|2,0,0]=4 3528 B10R1.13 CC(N)c1ccc(F)c[n]1 Amb21864846 [1,1,0,0,0,0|2,0,0]=4 3529 B10R1.13 CC(N)c1ccc(F)c[n]1 Amb23440361 [1,1,0,0,0,0|2,0,0]=4 3530 B10R1.13 CC(N)c1ccc(F)cc1 Amb19373284 [1,1,0,0,0,0|1,0,0]=3 3531 B10R1.13 CC(N)c1ccc(I)[n]c1 Amb23446982 [1,1,0,0,0,0|2,0,0]=4 3532 B10R1.13 CC(N)c1ccc(N)[n]c1 Amb18832283 [1,1,0,0,0,0|2,0,0]=4 3533 B10R1.13 CC(N)c1ccc(O)[n]c1 Amb23446713 [1,1,0,0,0,0|2,0,0]=4 3534 B10R1.13 CC(N)c1ccc(O)c[n]1 Amb25097193 [1,1,0,0,0,0|2,0,0]=4 3535 B10R1.13 CC(N)c1ccc(O)cc1 Amb19888161 [1,1,0,0,0,0|1,0,0]=3 3536 B10R1.13 CC(N)c1ccc(S)[n]c1 Amb23446726 [1,1,0,0,0,0|2,0,0]=4 3537 B10R1.13 CC(N)c1ccc(S)cc1 Amb25233878 [1,1,0,0,0,0|1,0,0]=3 3538 B10R1.13 CC(O)=C1C=CC(=O)C=C1 Amb24480664 [1,1,0,0,0,0|0,0,2]=4 3539 B10R1.13 CC(O)[n+]1ccc(C)cc1 Amb25206607 [1,1,0,0,0,0|1,0,1]=4 3540 B10R1.13 CC(O)c1cc[n+]([O-])cc1 Amb25139654 [1,1,0,0,0,0|1,0,1]=4 3541 B10R1.13 CC(O)c1ccc(Br)[n]c1 Amb23446253 [1,1,0,0,0,0|1,0,1]=4 3542 B10R1.13 CC(O)c1ccc(Cl)[n]c1 Amb19944632 [1,1,0,0,0,0|1,0,1]=4 3543 B10R1.13 CC(O)c1ccc(Cl)c[n]1 Amb24594875 [1,1,0,0,0,0|1,0,1]=4 3544 B10R1.13 CC(O)c1ccc(F)[n]c1 Amb23412440 [1,1,0,0,0,0|1,0,1]=4 3545 B10R1.13 CC(O)c1ccc(F)c[n]1 Amb23412445 [1,1,0,0,0,0|1,0,1]=4 3546 B10R1.13 CC(O)c1ccc(I)[n]c1 Amb23446979 [1,1,0,0,0,0|1,0,1]=4 3547 B10R1.13 CC(O)c1ccc(N)[n]c1 Amb23446325 [1,1,0,0,0,0|1,0,1]=4 3548 B10R1.13 CC(O)c1ccc(O)[n]c1 Amb23446710 [1,1,0,0,0,0|1,0,1]=4 3549 B10R1.13 CC(O)c1ccc(S)[n]c1 Amb23446723 [1,1,0,0,0,0|1,0,1]=4 3550 B10R1.13 CC(S)c1ccc(F)c[n]1 Amb24379137 [1,1,0,0,0,0|1,1,0]=4 3551 B10R1.13 CC(S)c1ccc(I)cc1 Amb24480962 [1,1,0,0,0,0|0,1,0]=3 3552 B10R1.13 CC(S)c1ccc(N)cc1 Amb25764450 [1,1,0,0,0,0|0,1,0]=3 3553 B10R1.13 CC(c1ccc(cc1)Br)N Amb1211897 [1,1,0,0,0,0|1,0,0]=3 3554 B10R1.13 CC(c1ccc(cc1)Br)N Amb2137046 [1,1,0,0,0,0|1,0,0]=3 3555 B10R1.13 CC(c1ccc(cc1)Cl)N Amb10782077 [1,1,0,0,0,0|1,0,0]=3 3556 B10R1.13 CC(c1ccc(cc1)F)N Amb2568493 [1,1,0,0,0,0|1,0,0]=3 3557 B10R1.13 CC(c1ccc(cc1)F)O Amb1211893 [1,1,0,0,0,0|0,0,1]=3 3558 B10R1.13 CC(c1ccc(cc1)I)O Amb1110523 [1,1,0,0,0,0|0,0,1]=3 3559 B10R1.13 CC(c1ccc(cc1)N)C Amb1239129 [1,1,0,0,0,0|0,0,1]=3 3560 B10R1.13 CC(c1ccc(cc1)O)C Amb1211898 [1,1,0,0,0,0|0,0,1]=3 3561 B10R1.13 CC(c1ccc(cc1)S)O Amb17593857 [1,1,0,0,0,0|0,0,1]=3 3562 B10R1.13 CN(C)c1ccc(I)cc1 Amb17940199 [1,1,0,0,0,0|1,0,1]=4 3563 B10R1.13 CN(C)c1ccc(N)cc1 Amb22167797 [1,1,0,0,0,0|1,0,1]=4 3564 B10R1.13 CN(C)c1ccc(N)cc1 Amb22388752 [1,1,0,0,0,0|1,0,1]=4 3565 B10R1.13 CN(C)c1ccc(N)cc1 Amb22732453 [1,1,0,0,0,0|1,0,1]=4 3566 B10R1.13 CN(C)c1ccc(O)cc1 Amb21864855 [1,1,0,0,0,0|1,0,1]=4 3567 B10R1.13 CN(c1ccc(cc1)Br)N Amb17237219 [1,1,0,0,0,0|2,0,0]=4 3568 B10R1.13 CN(c1ccc(cc1)Cl)N Amb16202770 [1,1,0,0,0,0|2,0,0]=4 3569 B10R1.13 CN(c1ccc(cc1)Cl)N Amb17232198 [1,1,0,0,0,0|2,0,0]=4 3570 B10R1.13 CN(c1ccc(cc1)F)N Amb17231916 [1,1,0,0,0,0|2,0,0]=4 3571 B10R1.13 CN(c1ccc(cc1)N)C Amb1153912 [1,1,0,0,0,0|1,0,1]=4 3572 B10R1.13 CS(=O)C=1C=CC(=O)NC1 Amb25248845 [1,1,0,0,0,0|2,0,0]=4 3573 B10R1.13 CS(=O)c1ccc(Br)[n]c1 Amb22899805 [1,1,0,0,0,0|2,0,0]=4 3574 B10R1.13 CS(=O)c1ccc(Cl)cc1 Amb19892199 [1,1,0,0,0,0|1,0,0]=3 3575 B10R1.13 CS(=O)c1ccc(F)cc1 Amb19892152 [1,1,0,0,0,0|1,0,0]=3 3576 B10R1.13 CS(=O)c1ccc(N)c[n]1 Amb24529303 [1,1,0,0,0,0|2,0,0]=4 3577 B10R1.13 CS(=O)c1ccc(N)cc1 Amb18945202 [1,1,0,0,0,0|1,0,0]=3 3578 B10R1.13 CS(=O)c1ccc(O)cc1 Amb17873067 [1,1,0,0,0,0|1,0,0]=3 3579 B10R1.13 C[13C](=O)c1ccc(cc1)N Amb17607866 [1,1,0,0,0,0|0,0,1]=3 3580 B10R1.13 C[As](C)c1ccc(Br)cc1 Amb22347193 [1,1,0,0,0,0|1,0,1]=4 3581 B10R1.13 C[As](C)c1ccc(O)cc1 Amb22347181 [1,1,0,0,0,0|1,0,1]=4 3582 B10R1.13 C[C@@H](Cl)c1ccc(Cl)[n]c1 Amb25100852 [1,1,0,0,0,0|2,0,0]=4 3583 B10R1.13 C[C@@H](Cl)c1ccc(F)c[n]1 Amb24419095 [1,1,0,0,0,0|2,0,0]=4 3584 B10R1.13 C[C@@H](N)c1ccc(Br)[n]c1 Amb19929560 [1,1,0,0,0,0|2,0,0]=4 3585 B10R1.13 C[C@@H](N)c1ccc(Br)[n]c1 Amb25055663 [1,1,0,0,0,0|2,0,0]=4 3586 B10R1.13 C[C@@H](N)c1ccc(Br)c[n]1 Amb19929894 [1,1,0,0,0,0|2,0,0]=4 3587 B10R1.13 C[C@@H](N)c1ccc(Br)c[n]1 Amb23440518 [1,1,0,0,0,0|2,0,0]=4 3588 B10R1.13 C[C@@H](N)c1ccc(Br)c[n]1 Amb23440519 [1,1,0,0,0,0|2,0,0]=4 3589 B10R1.13 C[C@@H](N)c1ccc(Cl)c[n]1 Amb25146319 [1,1,0,0,0,0|2,0,0]=4 3590 B10R1.13 C[C@@H](N)c1ccc(Cl)cc1 Amb22288609 [1,1,0,0,0,0|1,0,0]=3 3591 B10R1.13 C[C@@H](N)c1ccc(F)c[n]1 Amb22744794 [1,1,0,0,0,0|2,0,0]=4 3592 B10R1.13 C[C@@H](N)c1ccc(F)c[n]1 Amb23440360 [1,1,0,0,0,0|2,0,0]=4 3593 B10R1.13 C[C@@H](N)c1ccc(I)[n]c1 Amb25786237 [1,1,0,0,0,0|2,0,0]=4 3594 B10R1.13 C[C@@H](N)c1ccc(N)[n]c1 Amb25324358 [1,1,0,0,0,0|2,0,0]=4 3595 B10R1.13 C[C@@H](N)c1ccc(N)c[n]1 Amb25063033 [1,1,0,0,0,0|2,0,0]=4 3596 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22406362 [1,1,0,0,0,0|1,0,0]=3 3597 B10R1.13 C[C@@H](N)c1ccc(N)cc1 Amb22504246 [1,1,0,0,0,0|1,0,0]=3 3598 B10R1.13 C[C@@H](N)c1ccc(O)c[n]1 Amb25062520 [1,1,0,0,0,0|2,0,0]=4 3599 B10R1.13 C[C@@H](N)c1ccc(S)[n]c1 Amb24417180 [1,1,0,0,0,0|2,0,0]=4 3600 B10R1.13 C[C@@H](O)c1ccc(Br)[n]c1 Amb25377395 [1,1,0,0,0,0|1,0,1]=4 3601 B10R1.13 C[C@@H](O)c1ccc(Br)c[n]1 Amb24732317 [1,1,0,0,0,0|1,0,1]=4 3602 B10R1.13 C[C@@H](O)c1ccc(Cl)cc1 Amb20241103 [1,1,0,0,0,0|0,0,1]=3 3603 B10R1.13 C[C@@H](O)c1ccc(F)c[n]1 Amb25377570 [1,1,0,0,0,0|1,0,1]=4 3604 B10R1.13 C[C@@H](O)c1ccc(N)cc1 Amb25228343 [1,1,0,0,0,0|0,0,1]=3 3605 B10R1.13 C[C@@H](O)c1ccc(O)cc1 Amb25273162 [1,1,0,0,0,0|0,0,1]=3 3606 B10R1.13 C[C@@H](c1ccc(cc1)F)N Amb10838303 [1,1,0,0,0,0|1,0,0]=3 3607 B10R1.13 C[C@@H](c1ccc(cc1)F)O Amb16185872 [1,1,0,0,0,0|0,0,1]=3 3608 B10R1.13 C[C@H](F)c1ccc(Br)cc1 Amb22008088 [1,1,0,0,0,0|1,0,0]=3 3609 B10R1.13 C[C@H](N)c1ccc(Br)[n]c1 Amb19929562 [1,1,0,0,0,0|2,0,0]=4 3610 B10R1.13 C[C@H](N)c1ccc(Br)c[n]1 Amb19929895 [1,1,0,0,0,0|2,0,0]=4 3611 B10R1.13 C[C@H](N)c1ccc(Br)cc1 Amb22274557 [1,1,0,0,0,0|1,0,0]=3 3612 B10R1.13 C[C@H](N)c1ccc(Cl)[n]c1 Amb24058236 [1,1,0,0,0,0|2,0,0]=4 3613 B10R1.13 C[C@H](N)c1ccc(Cl)cc1 Amb22288669 [1,1,0,0,0,0|1,0,0]=3 3614 B10R1.13 C[C@H](N)c1ccc(F)c[n]1 Amb25843222 [1,1,0,0,0,0|2,0,0]=4 3615 B10R1.13 C[C@H](N)c1ccc(F)cc1 Amb22406364 [1,1,0,0,0,0|1,0,0]=3 3616 B10R1.13 C[C@H](N)c1ccc(I)c[n]1 Amb24468660 [1,1,0,0,0,0|2,0,0]=4 3617 B10R1.13 C[C@H](N)c1ccc(N)[n]c1 Amb25069386 [1,1,0,0,0,0|2,0,0]=4 3618 B10R1.13 C[C@H](N)c1ccc(N)cc1 Amb24106647 [1,1,0,0,0,0|1,0,0]=3 3619 B10R1.13 C[C@H](N)c1ccc(O)[n]c1 Amb24562815 [1,1,0,0,0,0|2,0,0]=4 3620 B10R1.13 C[C@H](N)c1ccc(O)c[n]1 Amb24700259 [1,1,0,0,0,0|2,0,0]=4 3621 B10R1.13 C[C@H](O)c1ccc(Br)c[n]1 Amb25147811 [1,1,0,0,0,0|1,0,1]=4 3622 B10R1.13 C[C@H](O)c1ccc(Cl)[n]c1 Amb24415131 [1,1,0,0,0,0|1,0,1]=4 3623 B10R1.13 C[C@H](O)c1ccc(Cl)c[n]1 Amb24724836 [1,1,0,0,0,0|1,0,1]=4 3624 B10R1.13 C[C@H](O)c1ccc(Cl)cc1 Amb20241104 [1,1,0,0,0,0|0,0,1]=3 3625 B10R1.13 C[C@H](O)c1ccc(F)c[n]1 Amb25785567 [1,1,0,0,0,0|1,0,1]=4 3626 B10R1.13 C[C@H](O)c1ccc(N)cc1 Amb24384238 [1,1,0,0,0,0|0,0,1]=3 3627 B10R1.13 C[C@H](O)c1ccc(O)cc1 Amb24644699 [1,1,0,0,0,0|0,0,1]=3 3628 B10R1.13 C[C@H](O)c1ccc(S)cc1 Amb25823717 [1,1,0,0,0,0|0,0,1]=3 3629 B10R1.13 C[C@H](c1ccc(cc1)F)N Amb10839828 [1,1,0,0,0,0|1,0,0]=3 3630 B10R1.13 C[C@H](c1ccc(cc1)F)N Amb16233880 [1,1,0,0,0,0|1,0,0]=3 3631 B10R1.13 C[C@H](c1ccc(cc1)I)N Amb15690597 [1,1,0,0,0,0|1,0,0]=3 3632 B10R1.13 C[N+](C)=C1C=CC(=O)C=C1 Amb25730270 [1,1,0,0,0,0|1,0,1]=4 3633 B10R1.13 C[NH+](C)c1ccc(N)cc1 Amb25289220 [1,1,0,0,0,0|1,0,1]=4 3634 B10R1.13 C[NH+](C)c1ccc([NH3+])cc1 Amb20246441 [1,1,0,0,0,0|1,0,1]=4 3635 B10R1.13 C[S+](C)c1ccc(O)cc1 Amb24066115 [1,1,0,0,0,0|1,0,1]=4 3636 B10R1.13 C[S+](C)c1ccc(O)cc1 Amb25093771 [1,1,0,0,0,0|1,0,1]=4 3637 B10R1.13 C[SiH](C)c1ccc(O)cc1 Amb24676783 [1,1,0,0,0,0|0,1,1]=4 3638 B10R1.13 C[n+]1ccc(cc1)C(C)C Amb10573358 [1,1,0,0,0,0|1,0,1]=4 3639 B10R1.13 Cc1ccc([n]c1)C(C)=C Amb24084447 [1,1,0,0,0,0|1,0,1]=4 3640 B10R1.13 Cc1ccc([n]c1)C(C)=O Amb22587200 [1,1,0,0,0,0|1,0,1]=4 3641 B10R1.13 Cc1ccc([n]c1)C(C)Cl Amb22753450 [1,1,0,0,0,0|2,0,0]=4 3642 B10R1.13 Cc1ccc([n]c1)C(C)N Amb22756401 [1,1,0,0,0,0|2,0,0]=4 3643 B10R1.13 Cc1ccc([n]c1)S(C)=O Amb25837594 [1,1,0,0,0,0|2,0,0]=4 3644 B10R1.13 Cc1ccc([n]c1)[C@@H](C)N Amb25146463 [1,1,0,0,0,0|2,0,0]=4 3645 B10R1.13 Cc1ccc([n]c1)[C@@H](C)O Amb24549031 [1,1,0,0,0,0|1,0,1]=4 3646 B10R1.13 Cc1ccc(c[n]1)C(C)C Amb25268487 [1,1,0,0,0,0|1,0,1]=4 3647 B10R1.13 Cc1ccc(cc1)B(C)O Amb25120944 [1,1,0,0,0,0|1,0,1]=4 3648 B10R1.13 Cc1ccc(cc1)C(=C)F Amb25354650 [1,1,0,0,0,0|1,0,1]=4 3649 B10R1.13 Cc1ccc(cc1)C(=O)C Amb2447132 [1,1,0,0,0,0|0,0,1]=3 3650 B10R1.13 Cc1ccc(cc1)C(=S)C Amb10602373 [1,1,0,0,0,0|0,1,1]=4 3651 B10R1.13 Cc1ccc(cc1)C(C)C Amb19929657 [1,1,0,0,0,0|0,0,1]=3 3652 B10R1.13 Cc1ccc(cc1)C(C)F Amb25292877 [1,1,0,0,0,0|1,0,0]=3 3653 B10R1.13 Cc1ccc(cc1)C(N)C Amb1108137 [1,1,0,0,0,0|1,0,0]=3 3654 B10R1.13 Cc1ccc(cc1)C([O-])=O Amb21962678 [1,1,0,0,0,0|1,0,1]=4 3655 B10R1.13 Cc1ccc(cc1)N(N)C Amb17231897 [1,1,0,0,0,0|2,0,0]=4 3656 B10R1.13 Cc1ccc(cc1)P(=O)O Amb10571101 [1,1,0,0,0,0|2,0,0]=4 3657 B10R1.13 Cc1ccc(cc1)S(=O)O Amb10601729 [1,1,0,0,0,0|2,0,0]=4 3658 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb10790480 [1,1,0,0,0,0|2,0,0]=4 3659 B10R1.13 Cc1ccc(cc1)S(=O)[O-] Amb16185755 [1,1,0,0,0,0|2,0,0]=4 3660 B10R1.13 Cc1ccc(cc1)S(Cl)=O Amb17939004 [1,1,0,0,0,0|2,0,0]=4 3661 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22436806 [1,1,0,0,0,0|2,0,0]=4 3662 B10R1.13 Cc1ccc(cc1)S(O)=O Amb22730230 [1,1,0,0,0,0|2,0,0]=4 3663 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22360764 [1,1,0,0,0,0|2,0,0]=4 3664 B10R1.13 Cc1ccc(cc1)S([O-])=O Amb22411411 [1,1,0,0,0,0|2,0,0]=4 3665 B10R1.13 Cc1ccc(cc1)[C@@H](C)N Amb20242449 [1,1,0,0,0,0|1,0,0]=3 3666 B10R1.13 Cc1ccc(cc1)[C@@H](C)N Amb22288639 [1,1,0,0,0,0|1,0,0]=3 3667 B10R1.13 Cc1ccc(cc1)[C@@H](C)O Amb25859279 [1,1,0,0,0,0|0,0,1]=3 3668 B10R1.13 Cc1ccc(cc1)[C@H](C)N Amb22288674 [1,1,0,0,0,0|1,0,0]=3 3669 B10R1.13 Cc1ccc(cc1)[C@H](C)O Amb20241494 [1,1,0,0,0,0|0,0,1]=3 3670 B10R1.13 Cc1ccc(cc1)[C@H](O)Cl Amb25065327 [1,1,0,0,0,0|1,0,1]=4 3671 B10R1.13 Cc1ccc(cc1)[S@](=O)N Amb16233804 [1,1,0,0,0,0|2,0,0]=4 3672 B10R1.13 Cc1ccc(cc1)[S@](C)=O Amb22226741 [1,1,0,0,0,0|1,0,0]=3 3673 B10R1.13 Cc1ccc(cc1)[S@](N)=O Amb19889838 [1,1,0,0,0,0|2,0,0]=4 3674 B10R1.13 Cc1ccc(nc1)C(=O)C Amb10608263 [1,1,0,0,0,0|1,0,1]=4 3675 B10R1.13 Cc1ccc(nc1)C(N)C Amb10608253 [1,1,0,0,0,0|2,0,0]=4 3676 B10R1.13 ClC(=C)c1ccc(cc1)F Amb17610890 [1,1,0,0,0,0|1,0,1]=4 3677 B10R1.13 Clc1ccc(cc1)C(Cl)Cl Amb16234135 [1,1,0,0,0,0|2,0,0]=4 3678 B10R1.13 Clc1ccc(cc1)S(=O)[O-] Amb10790466 [1,1,0,0,0,0|2,0,0]=4 3679 B10R1.13 Clc1ccc(cc1)[I](=O)=O Amb10553247 [1,1,0,0,0,0|2,0,0]=4 3680 B10R1.13 Clc1ccc(nc1)C(=O)C Amb16191910 [1,1,0,0,0,0|1,0,1]=4 3681 B10R1.13 FC(F)c1ccc(Cl)cc1 Amb19889908 [1,1,0,0,0,0|2,0,0]=4 3682 B10R1.13 Fc1ccc(cc1)C(I)=O Amb17942820 [1,1,0,0,0,0|1,0,1]=4 3683 B10R1.13 Fc1ccc(cc1)S(=O)Cl Amb13881361 [1,1,0,0,0,0|2,0,0]=4 3684 B10R1.13 Fc1ccc(cn1)C(=O)C Amb10603339 [1,1,0,0,0,0|1,0,1]=4 3685 B10R1.13 Ic1ccc(cc1)[N+](=O)[O-] Amb1151924 [1,1,0,0,0,0|2,0,0]=4 3686 B10R1.13 NC(=O)c1ccc(cc1)Br Amb1232839 [1,1,0,0,0,0|1,0,1]=4 3687 B10R1.13 NC(=O)c1ccc(cc1)F Amb1230540 [1,1,0,0,0,0|1,0,1]=4 3688 B10R1.13 NC(=O)c1ccc(cc1)I Amb2227687 [1,1,0,0,0,0|1,0,1]=4 3689 B10R1.13 NC(=O)c1ccc(cc1)O Amb1240570 [1,1,0,0,0,0|1,0,1]=4 3690 B10R1.13 NC(=O)c1ccc(cc1)O Amb13951374 [1,1,0,0,0,0|1,0,1]=4 3691 B10R1.13 Nc1ccc(cc1)C(=O)F Amb24548959 [1,1,0,0,0,0|1,0,1]=4 3692 B10R1.13 Nc1ccc(cc1)C(F)F Amb20242301 [1,1,0,0,0,0|2,0,0]=4 3693 B10R1.13 Nc1ccc(cc1)C(F)F Amb23399562 [1,1,0,0,0,0|2,0,0]=4 3694 B10R1.13 Nc1ccc(cc1)C(N)C Amb10070180 [1,1,0,0,0,0|1,0,0]=3 3695 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22349631 [1,1,0,0,0,0|1,0,1]=4 3696 B10R1.13 Nc1ccc(cc1)C(O)=O Amb22363131 [1,1,0,0,0,0|1,0,1]=4 3697 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24066899 [1,1,0,0,0,0|1,0,1]=4 3698 B10R1.13 Nc1ccc(cc1)C(O)=O Amb24091246 [1,1,0,0,0,0|1,0,1]=4 3699 B10R1.13 Nc1ccc(cc1)P(O)=O Amb24482412 [1,1,0,0,0,0|2,0,0]=4 3700 B10R1.13 Nc1ccc(cc1)S(=O)=O Amb25065185 [1,1,0,0,0,0|2,0,0]=4 3701 B10R1.13 Nc1ccc(cc1)S(N)=O Amb24446357 [1,1,0,0,0,0|2,0,0]=4 3702 B10R1.13 Nc1ccc(cc1)[C@@H](N)C Amb16233993 [1,1,0,0,0,0|1,0,0]=3 3703 B10R1.13 Nc1ccc(cc1)[N+](=O)[O-] Amb1935140 [1,1,0,0,0,0|2,0,0]=4 3704 B10R1.13 Nc1ccc(cn1)C(=O)C Amb10608783 [1,1,0,0,0,0|1,0,1]=4 3705 B10R1.13 Nc1ccc(cn1)C(C)C Amb13884058 [1,1,0,0,0,0|1,0,1]=4 3706 B10R1.13 Nc1ccc(nc1)C(C)C Amb10600811 [1,1,0,0,0,0|1,0,1]=4 3707 B10R1.13 O=C(Br)c1ccc(Br)cc1 Amb24079095 [1,1,0,0,0,0|1,0,1]=4 3708 B10R1.13 O=C(Br)c1ccc(Cl)cc1 Amb25843658 [1,1,0,0,0,0|1,0,1]=4 3709 B10R1.13 O=C(Br)c1ccc(F)cc1 Amb24070269 [1,1,0,0,0,0|1,0,1]=4 3710 B10R1.13 O=C(Cl)c1ccc(S)cc1 Amb24070681 [1,1,0,0,0,0|1,0,1]=4 3711 B10R1.13 O=C(Cl)c1ccc(cc1)[*] Amb22045243 [1,1,0,0,0,0|1,0,1]=4 3712 B10R1.13 O=N(=O)c1ccc(Cl)cc1 Amb20621796 [1,1,0,0,0,0|2,0,0]=4 3713 B10R1.13 O=N(=O)c1ccc(F)cc1 Amb20621319 [1,1,0,0,0,0|2,0,0]=4 3714 B10R1.13 O=N(=O)c1ccc(I)cc1 Amb20621832 [1,1,0,0,0,0|2,0,0]=4 3715 B10R1.13 O=S(Cl)c1ccc(Br)cc1 Amb18071349 [1,1,0,0,0,0|2,0,0]=4 3716 B10R1.13 O=S(Cl)c1ccc(Cl)cc1 Amb18565622 [1,1,0,0,0,0|2,0,0]=4 3717 B10R1.13 O=[13C](Cl)c1ccc(Cl)cc1 Amb22367579 [1,1,0,0,0,0|1,0,1]=4 3718 B10R1.13 O=[13C](Cl)c1ccc(F)cc1 Amb22351347 [1,1,0,0,0,0|1,0,1]=4 3719 B10R1.13 O=[S-](=O)c1ccc(cc1)F Amb13881372 [1,1,0,0,0,0|2,0,0]=4 3720 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22336507 [1,1,0,0,0,0|1,0,1]=4 3721 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c](Cl)[13cH][13cH]1 Amb22336969 [1,1,0,0,0,0|1,0,1]=4 3722 B10R1.13 OC(=O)[13c]1[13cH][13cH][13c]([13cH][13cH]1)N Amb17607883 [1,1,0,0,0,0|1,0,1]=4 3723 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22432829 [1,1,0,0,0,0|1,0,1]=4 3724 B10R1.13 OC(=O)c1ccc(Cl)cc1 Amb22445441 [1,1,0,0,0,0|1,0,1]=4 3725 B10R1.13 OC(=O)c1ccc(O)cc1 Amb22338464 [1,1,0,0,0,0|1,0,1]=4 3726 B10R1.13 OC(=O)c1ccc(cc1)Br Amb1935068 [1,1,0,0,0,0|1,0,1]=4 3727 B10R1.13 OC(=O)c1ccc(cc1)S Amb2371749 [1,1,0,0,0,0|1,0,1]=4 3728 B10R1.13 OC(=O)c1ccc(cc1)[Hg+] Amb17610950 [1,1,0,0,0,0|1,0,1]=4 3729 B10R1.13 OP(=O)c1ccc(Br)cc1 Amb21963574 [1,1,0,0,0,0|2,0,0]=4 3730 B10R1.13 OS(=O)c1ccc(Br)cc1 Amb18570792 [1,1,0,0,0,0|2,0,0]=4 3731 B10R1.13 OS(=O)c1ccc(Cl)cc1 Amb18564047 [1,1,0,0,0,0|2,0,0]=4 3732 B10R1.13 OS(=O)c1ccc(F)cc1 Amb18065461 [1,1,0,0,0,0|2,0,0]=4 3733 B10R1.13 O[13C](=O)c1ccc(Cl)cc1 Amb22367343 [1,1,0,0,0,0|1,0,1]=4 3734 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)C(O)=O Amb22367403 [1,1,0,0,0,0|1,0,1]=4 3735 B10R1.13 O[13c]1[13cH][13cH][13c]([13cH][13cH]1)[13C](O)=O Amb22367323 [1,1,0,0,0,0|1,0,1]=4 3736 B10R1.13 Oc1ccc(cc1)C(=O)Br Amb24070379 [1,1,0,0,0,0|1,0,1]=4 3737 B10R1.13 Oc1ccc(cc1)C(=O)F Amb25736983 [1,1,0,0,0,0|1,0,1]=4 3738 B10R1.13 Oc1ccc(cc1)C(=O)O Amb2569657 [1,1,0,0,0,0|1,0,1]=4 3739 B10R1.13 Oc1ccc(cc1)C(F)F Amb20241070 [1,1,0,0,0,0|2,0,0]=4 3740 B10R1.13 Oc1ccc(cc1)C(O)O Amb24478338 [1,1,0,0,0,0|1,0,1]=4 3741 B10R1.13 Oc1ccc(cc1)N(=O)=O Amb20621866 [1,1,0,0,0,0|2,0,0]=4 3742 B10R1.13 Oc1ccc(cc1)S(=O)=O Amb25321036 [1,1,0,0,0,0|2,0,0]=4 3743 B10R1.13 Oc1ccc(cc1)[13C](O)=O Amb22353368 [1,1,0,0,0,0|1,0,1]=4 3744 B10R1.13 Oc1ccc(cc1)[15N+](=O)[O-] Amb17618438 [1,1,0,0,0,0|2,0,0]=4 3745 B10R1.13 Oc1ccc(cc1)[N+]([O-])=O Amb17679040 [1,1,0,0,0,0|2,0,0]=4 3746 B10R1.13 Oc1ccc(cn1)C(C)C Amb10600535 [1,1,0,0,0,0|1,0,1]=4 3747 B10R1.13 Oc1ccc(nc1)C(=O)C Amb16231971 [1,1,0,0,0,0|1,0,1]=4 3748 B10R1.13 Oc1ccc(nc1)C(C)C Amb10600812 [1,1,0,0,0,0|1,0,1]=4 3749 B10R1.13 [15NH2]c1ccc(cc1)[15N+]([O-])=O Amb22338600 [1,1,0,0,0,0|2,0,0]=4 3750 B10R1.13 [2H]C(=O)c1ccc(O)cc1 Amb22367155 [1,1,0,0,0,0|1,0,1]=4 3751 B10R1.13 [2H]c1ccc(cc1)C(O)=O Amb22345875 [1,1,0,0,0,0|1,0,1]=4 3752 B10R1.13 [O-]C(=O)c1ccc(I)cc1 Amb22347262 [1,1,0,0,0,0|1,0,1]=4 3753 B10R1.13 [O-]S(=O)c1ccc(Br)cc1 Amb17871926 [1,1,0,0,0,0|2,0,0]=4 3754 B10R1.13 [O-]S(=O)c1ccc(Cl)cc1 Amb22167650 [1,1,0,0,0,0|2,0,0]=4 3755 B10R1.13 [O-]S(=O)c1ccc(F)cc1 Amb22899783 [1,1,0,0,0,0|2,0,0]=4 3756 B10R1.13 [O-]S(=O)c1ccc(I)cc1 Amb24589703 [1,1,0,0,0,0|2,0,0]=4 3757 B10R1.13 [O-][N+](=O)[13c]1[13cH][13cH][13c](Br)[13cH][13cH]1 Amb22338850 [1,1,0,0,0,0|2,0,0]=4 3758 B10R1.13 [O-][N+](=O)c1c[13cH][13c](O)[13cH]c1 Amb22055938 [1,1,0,0,0,0|2,0,0]=4 3759 B10R1.13 [O-]c1ccc(cc1)[N+]([O-])=O Amb24308951 [1,1,0,0,0,0|2,0,0]=4 3760 B10R1.28 CC(C)(O)c1cccc[n]1 Amb24081255 [1,1,0,0,0,0|1,0,1]=4 3761 B10R1.28 CC(F)(F)c1ccccc1 Amb19944228 [1,1,0,0,0,0|1,0,0]=3 3762 B10R1.28 CC([n+]1ccccc1)(C)C Amb10553757 [1,1,0,0,0,0|1,0,1]=4 3763 B10R1.28 CC(c1ccccn1)(F)F Amb10607184 [1,1,0,0,0,0|2,0,0]=4 3764 B10R1.28 CC(c1cccnc1)(F)F Amb10607183 [1,1,0,0,0,0|2,0,0]=4 3765 B10R1.28 CC(c1cccnc1)(N)C Amb16191921 [1,1,0,0,0,0|1,0,1]=4 3766 B10R1.28 CC(c1ccncc1)(F)F Amb10607182 [1,1,0,0,0,0|2,0,0]=4 3767 B10R1.28 CC(c1ccncc1)(N)C Amb16192041 [1,1,0,0,0,0|1,0,1]=4 3768 B10R1.28 CP(C)(=O)c1ccccc1 Amb19925666 [1,1,0,0,0,0|1,0,0]=3 3769 B10R1.28 CP(C)(=S)c1ccccc1 Amb24540921 [1,1,0,0,0,0|1,0,1]=4 3770 B10R1.28 CP(O)(=O)c1ccccc1 Amb22052646 [1,1,0,0,0,0|1,0,0]=3 3771 B10R1.28 CS(=N)(=O)c1cccc[n]1 Amb25293043 [1,1,0,0,0,0|2,0,0]=4 3772 B10R1.28 CS(=N)(=O)c1ccccc1 Amb17768294 [1,1,0,0,0,0|1,0,0]=3 3773 B10R1.28 CS(=O)(=O)c1cc[n]cc1 Amb22233630 [1,1,0,0,0,0|2,0,0]=4 3774 B10R1.28 CS(=O)(=O)c1ccccc1 Amb2419479 [1,1,0,0,0,0|1,0,0]=3 3775 B10R1.28 CS(N)(=O)c1ccccc1 Amb17774672 [1,1,0,0,0,0|1,0,0]=3 3776 B10R1.28 C[Ge](C)(C)c1ccccc1 Amb19930279 [1,1,0,0,0,0|0,1,1]=4 3777 B10R1.28 C[Ge](C)(Cl)c1ccccc1 Amb19930277 [1,1,0,0,0,0|0,1,1]=4 3778 B10R1.28 C[N+](C)(C)c1ccccc1 Amb22043253 [1,1,0,0,0,0|1,0,1]=4 3779 B10R1.28 C[N+](C)(C)c1ccccc1 Amb22345936 [1,1,0,0,0,0|1,0,1]=4 3780 B10R1.28 C[N+](C)(C)c1ccccc1 Amb22436823 [1,1,0,0,0,0|1,0,1]=4 3781 B10R1.28 C[N+](C)([O-])c1ccccc1 Amb17672894 [1,1,0,0,0,0|1,0,1]=4 3782 B10R1.28 C[S@@](=O)(=N)c1ccccc1 Amb17617583 [1,1,0,0,0,0|1,0,0]=3 3783 B10R1.28 C[Si](C)([O-])c1ccccc1 Amb22047410 [1,1,0,0,0,0|0,1,1]=4 3784 B10R1.28 C[Si](C)([O-])c1ccccc1 Amb22336936 [1,1,0,0,0,0|0,1,1]=4 3785 B10R1.28 C[Sn](C)(C)c1ccccc1 Amb22369719 [1,1,0,0,0,0|1,0,1]=4 3786 B10R1.28 C[Te](Br)(Br)c1ccccc1 Amb22358701 [1,1,0,0,0,0|2,0,0]=4 3787 B10R1.28 FC(c1ccccc1)(Cl)Cl Amb10838341 [1,1,0,0,0,0|2,0,0]=4 3788 B10R1.28 FC(c1ccccc1)(Cl)F Amb10606273 [1,1,0,0,0,0|2,0,0]=4 3789 B10R1.28 NC(F)(F)c1ccccc1 Amb24761365 [1,1,0,0,0,0|2,0,0]=4 3790 B10R1.28 NS(=O)(=O)c1ccccc1 Amb1134014 [1,1,0,0,0,0|2,0,0]=4 3791 B10R1.28 O=S(=O)(Cl)c1ccccc1 Amb22169434 [1,1,0,0,0,0|2,0,0]=4 3792 B10R1.28 O=S(=O)([S-])c1ccccc1 Amb22730319 [1,1,0,0,0,0|2,0,0]=4 3793 B10R1.28 OS(=O)(=O)c1ccccc1 Amb16233878 [1,1,0,0,0,0|2,0,0]=4 3794 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22347475 [1,1,0,0,0,0|2,0,0]=4 3795 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22350405 [1,1,0,0,0,0|2,0,0]=4 3796 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22406404 [1,1,0,0,0,0|2,0,0]=4 3797 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22490259 [1,1,0,0,0,0|2,0,0]=4 3798 B10R1.28 OS(=O)(=O)c1ccccc1 Amb22491846 [1,1,0,0,0,0|2,0,0]=4 3799 B10R1.28 [13CH3]S(=O)(=O)c1ccccc1 Amb22055823 [1,1,0,0,0,0|1,0,0]=3 3800 B10R1.28 [2H]C([2H])(Br)c1ccccc1 Amb22336366 [1,1,0,0,0,0|2,0,0]=4 3801 B10R1.28 [2H]C([2H])(C)c1ccccc1 Amb22733791 [1,1,0,0,0,0|1,0,0]=3 3802 B10R1.28 [2H]C([2H])(Cl)c1ccccc1 Amb22367143 [1,1,0,0,0,0|2,0,0]=4 3803 B10R1.28 [2H]C([2H])(N)c1ccccc1 Amb22365955 [1,1,0,0,0,0|2,0,0]=4 3804 B10R1.28 [2H]C([2H])(O)c1ccccc1 Amb22336509 [1,1,0,0,0,0|1,0,1]=4 3805 B10R1.28 [2H]C([2H])([2H])c1ccccc1 Amb22336370 [1,1,0,0,0,0|2,0,0]=4 3806 B10R1.28 [2H][13C]([2H])(O)c1ccccc1 Amb22353418 [1,1,0,0,0,0|1,0,1]=4 3807 B10R1.28 [O-]P([O-])(=O)c1ccccc1 Amb22366491 [1,1,0,0,0,0|2,0,0]=4 3808 B10R1.28 [O-]P([O-])(=O)c1ccccc1 Amb22730862 [1,1,0,0,0,0|2,0,0]=4 3809 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb1953809 [1,1,0,0,0,0|2,0,0]=4 3810 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb19957999 [1,1,0,0,0,0|2,0,0]=4 3811 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22231402 [1,1,0,0,0,0|2,0,0]=4 3812 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22366488 [1,1,0,0,0,0|2,0,0]=4 3813 B10R1.28 [O-]S(=O)(=O)c1ccccc1 Amb22734771 [1,1,0,0,0,0|2,0,0]=4 3814 B10R1.28 [O-]S(=O)(=S)c1ccccc1 Amb22168151 [1,1,0,0,0,0|2,0,0]=4 3815 B10R1.28 [S-]S(=O)(=O)c1ccccc1 Amb17190275 [1,1,0,0,0,0|2,0,0]=4 3816 B10R1.61 BrC(c1ccccc1F)Br Amb10839627 [1,1,0,0,0,0|2,0,0]=4 3817 B10R1.61 CC(=C)c1[n]cccc1N Amb25223722 [1,1,0,0,0,0|1,0,1]=4 3818 B10R1.61 CC(=C)c1ccccc1Br Amb25797043 [1,1,0,0,0,0|0,0,1]=3 3819 B10R1.61 CC(=C)c1ccccc1Cl Amb24720539 [1,1,0,0,0,0|0,0,1]=3 3820 B10R1.61 CC(=C)c1ccccc1O Amb18124426 [1,1,0,0,0,0|0,0,1]=3 3821 B10R1.61 CC(=N)c1ccccc1O Amb24505228 [1,1,0,0,0,0|1,0,1]=4 3822 B10R1.61 CC(=O)C1=CC=CNC1=O Amb18263217 [1,1,0,0,0,0|1,0,1]=4 3823 B10R1.61 CC(=O)C1=CNC=CC1=O Amb22522167 [1,1,0,0,0,0|1,0,1]=4 3824 B10R1.61 CC(=O)C1C=CC=CC1=C Amb24408031 [1,1,0,0,0,0|0,0,2]=4 3825 B10R1.61 CC(=O)c1[n]cccc1Br Amb19959407 [1,1,0,0,0,0|1,0,1]=4 3826 B10R1.61 CC(=O)c1[n]cccc1Cl Amb22233858 [1,1,0,0,0,0|1,0,1]=4 3827 B10R1.61 CC(=O)c1[n]cccc1I Amb23402738 [1,1,0,0,0,0|1,0,1]=4 3828 B10R1.61 CC(=O)c1c[n]ccc1F Amb22233738 [1,1,0,0,0,0|1,0,1]=4 3829 B10R1.61 CC(=O)c1c[n]ccc1N Amb23401918 [1,1,0,0,0,0|1,0,1]=4 3830 B10R1.61 CC(=O)c1cc[n]cc1Br Amb21858252 [1,1,0,0,0,0|1,0,1]=4 3831 B10R1.61 CC(=O)c1cc[n]cc1Cl Amb22494032 [1,1,0,0,0,0|1,0,1]=4 3832 B10R1.61 CC(=O)c1cc[n]cc1I Amb24638217 [1,1,0,0,0,0|1,0,1]=4 3833 B10R1.61 CC(=O)c1cc[n]cc1O Amb18643112 [1,1,0,0,0,0|1,0,1]=4 3834 B10R1.61 CC(=O)c1ccc[n]c1O Amb18832396 [1,1,0,0,0,0|1,0,1]=4 3835 B10R1.61 CC(=O)c1cccc[n+]1C Amb10573498 [1,1,0,0,0,0|1,0,1]=4 3836 B10R1.61 CC(=O)c1ccccc1Br Amb1232838 [1,1,0,0,0,0|0,0,1]=3 3837 B10R1.61 CC(=O)c1ccccc1S Amb22396354 [1,1,0,0,0,0|0,0,1]=3 3838 B10R1.61 CC(=O)c1cccnc1Br Amb10602206 [1,1,0,0,0,0|1,0,1]=4 3839 B10R1.61 CC(=O)c1cccnc1F Amb2447597 [1,1,0,0,0,0|1,0,1]=4 3840 B10R1.61 CC(=O)c1ccncc1F Amb10603317 [1,1,0,0,0,0|1,0,1]=4 3841 B10R1.61 CC(=O)c1ncccc1C Amb10067752 [1,1,0,0,0,0|1,0,1]=4 3842 B10R1.61 CC(=O)c1ncccc1O Amb16233269 [1,1,0,0,0,0|1,0,1]=4 3843 B10R1.61 CC(=S)c1ccccc1F Amb25114147 [1,1,0,0,0,0|0,1,1]=4 3844 B10R1.61 CC(=S)c1ccccc1O Amb25116058 [1,1,0,0,0,0|0,1,1]=4 3845 B10R1.61 CC(Br)c1[n]cccc1F Amb23412454 [1,1,0,0,0,0|2,0,0]=4 3846 B10R1.61 CC(Br)c1c[n]ccc1Br Amb24666814 [1,1,0,0,0,0|2,0,0]=4 3847 B10R1.61 CC(Br)c1ccc[n]c1Br Amb25236461 [1,1,0,0,0,0|2,0,0]=4 3848 B10R1.61 CC(Br)c1ccc[n]c1Cl Amb23556785 [1,1,0,0,0,0|2,0,0]=4 3849 B10R1.61 CC(Br)c1ccccc1O Amb25733525 [1,1,0,0,0,0|1,0,0]=3 3850 B10R1.61 CC(C)N1C=CC=CC1=S Amb24372900 [1,1,0,0,0,0|1,0,1]=4 3851 B10R1.61 CC(C)c1[n]cccc1Br Amb24320671 [1,1,0,0,0,0|1,0,1]=4 3852 B10R1.61 CC(C)c1[n]cccc1F Amb25699287 [1,1,0,0,0,0|1,0,1]=4 3853 B10R1.61 CC(C)c1[n]cccc1N Amb18203086 [1,1,0,0,0,0|1,0,1]=4 3854 B10R1.61 CC(C)c1[n]cccc1O Amb22886919 [1,1,0,0,0,0|1,0,1]=4 3855 B10R1.61 CC(C)c1c[n]ccc1Br Amb20617490 [1,1,0,0,0,0|1,0,1]=4 3856 B10R1.61 CC(C)c1c[n]ccc1N Amb24319529 [1,1,0,0,0,0|1,0,1]=4 3857 B10R1.61 CC(C)c1cc[n]cc1Br Amb24320560 [1,1,0,0,0,0|1,0,1]=4 3858 B10R1.61 CC(C)c1cc[n]cc1Cl Amb20242818 [1,1,0,0,0,0|1,0,1]=4 3859 B10R1.61 CC(C)c1cc[n]cc1N Amb18203089 [1,1,0,0,0,0|1,0,1]=4 3860 B10R1.61 CC(C)c1cc[n]cc1O Amb18643153 [1,1,0,0,0,0|1,0,1]=4 3861 B10R1.61 CC(C)c1ccc[n]c1Br Amb24319274 [1,1,0,0,0,0|1,0,1]=4 3862 B10R1.61 CC(C)c1ccc[n]c1Cl Amb20242809 [1,1,0,0,0,0|1,0,1]=4 3863 B10R1.61 CC(C)c1ccc[n]c1N Amb18203087 [1,1,0,0,0,0|1,0,1]=4 3864 B10R1.61 CC(C)c1ccc[n]c1O Amb24319275 [1,1,0,0,0,0|1,0,1]=4 3865 B10R1.61 CC(C)c1cccc[n+]1[O-] Amb24396261 [1,1,0,0,0,0|1,0,1]=4 3866 B10R1.61 CC(C)c1ccccc1F Amb17940016 [1,1,0,0,0,0|0,0,1]=3 3867 B10R1.61 CC(Cl)c1[n]cccc1F Amb23402726 [1,1,0,0,0,0|2,0,0]=4 3868 B10R1.61 CC(Cl)c1c[n]ccc1N Amb25337933 [1,1,0,0,0,0|2,0,0]=4 3869 B10R1.61 CC(Cl)c1cc[n]cc1F Amb22886718 [1,1,0,0,0,0|2,0,0]=4 3870 B10R1.61 CC(Cl)c1ccc[n]c1Cl Amb25245963 [1,1,0,0,0,0|2,0,0]=4 3871 B10R1.61 CC(Cl)c1ccc[n]c1F Amb24739818 [1,1,0,0,0,0|2,0,0]=4 3872 B10R1.61 CC(Cl)c1ccc[n]c1N Amb24482586 [1,1,0,0,0,0|2,0,0]=4 3873 B10R1.61 CC(F)c1ccccc1Br Amb19929256 [1,1,0,0,0,0|1,0,0]=3 3874 B10R1.61 CC(F)c1ccccc1I Amb19929254 [1,1,0,0,0,0|1,0,0]=3 3875 B10R1.61 CC(N)C1=CC=CNC1=O Amb18263550 [1,1,0,0,0,0|2,0,0]=4 3876 B10R1.61 CC(N)c1[n]cccc1F Amb23412446 [1,1,0,0,0,0|2,0,0]=4 3877 B10R1.61 CC(N)c1[n]cccc1N Amb25185118 [1,1,0,0,0,0|2,0,0]=4 3878 B10R1.61 CC(N)c1c[n]ccc1N Amb24723678 [1,1,0,0,0,0|2,0,0]=4 3879 B10R1.61 CC(N)c1cc[n]cc1F Amb25146247 [1,1,0,0,0,0|2,0,0]=4 3880 B10R1.61 CC(N)c1cc[n]cc1N Amb23400503 [1,1,0,0,0,0|2,0,0]=4 3881 B10R1.61 CC(N)c1ccc[n]c1Br Amb24056177 [1,1,0,0,0,0|2,0,0]=4 3882 B10R1.61 CC(N)c1ccc[n]c1Cl Amb23556949 [1,1,0,0,0,0|2,0,0]=4 3883 B10R1.61 CC(N)c1ccc[n]c1F Amb25694441 [1,1,0,0,0,0|2,0,0]=4 3884 B10R1.61 CC(N)c1ccccc1C Amb17935796 [1,1,0,0,0,0|1,0,0]=3 3885 B10R1.61 CC(N)c1ccccc1I Amb24403956 [1,1,0,0,0,0|1,0,0]=3 3886 B10R1.61 CC(O)C1=CC=CNC1=O Amb24479024 [1,1,0,0,0,0|1,0,1]=4 3887 B10R1.61 CC(O)c1[n]cccc1Br Amb24359972 [1,1,0,0,0,0|1,0,1]=4 3888 B10R1.61 CC(O)c1[n]cccc1Cl Amb25675491 [1,1,0,0,0,0|1,0,1]=4 3889 B10R1.61 CC(O)c1[n]cccc1F Amb22167761 [1,1,0,0,0,0|1,0,1]=4 3890 B10R1.61 CC(O)c1[n]cccc1N Amb25142455 [1,1,0,0,0,0|1,0,1]=4 3891 B10R1.61 CC(O)c1[n]cccc1O Amb18643365 [1,1,0,0,0,0|1,0,1]=4 3892 B10R1.61 CC(O)c1c[n]ccc1Br Amb25309004 [1,1,0,0,0,0|1,0,1]=4 3893 B10R1.61 CC(O)c1c[n]ccc1Cl Amb24064396 [1,1,0,0,0,0|1,0,1]=4 3894 B10R1.61 CC(O)c1c[n]ccc1N Amb24062523 [1,1,0,0,0,0|1,0,1]=4 3895 B10R1.61 CC(O)c1cc[n]cc1F Amb22546372 [1,1,0,0,0,0|1,0,1]=4 3896 B10R1.61 CC(O)c1cc[n]cc1N Amb23401920 [1,1,0,0,0,0|1,0,1]=4 3897 B10R1.61 CC(O)c1ccc[n]c1Br Amb24056176 [1,1,0,0,0,0|1,0,1]=4 3898 B10R1.61 CC(O)c1ccc[n]c1Cl Amb21961212 [1,1,0,0,0,0|1,0,1]=4 3899 B10R1.61 CC(O)c1ccccc1I Amb24644378 [1,1,0,0,0,0|0,0,1]=3 3900 B10R1.61 CC(c1ccccc1Cl)N Amb1995323 [1,1,0,0,0,0|1,0,0]=3 3901 B10R1.61 CC(c1ccccc1F)N Amb1215251 [1,1,0,0,0,0|1,0,0]=3 3902 B10R1.61 CC(c1ccccc1N)O Amb10609794 [1,1,0,0,0,0|0,0,1]=3 3903 B10R1.61 CC(c1ccccc1O)N Amb1120555 [1,1,0,0,0,0|1,0,0]=3 3904 B10R1.61 CC(c1ncccc1C)N Amb10608068 [1,1,0,0,0,0|2,0,0]=4 3905 B10R1.61 CC(n1ccccc1=O)C Amb10553036 [1,1,0,0,0,0|1,0,1]=4 3906 B10R1.61 CN(C)c1ccccc1I Amb20668324 [1,1,0,0,0,0|1,0,1]=4 3907 B10R1.61 CN(N)c1ccccc1N Amb24411488 [1,1,0,0,0,0|2,0,0]=4 3908 B10R1.61 CN(c1ccccc1Br)N Amb17237220 [1,1,0,0,0,0|2,0,0]=4 3909 B10R1.61 CN(c1ccccc1C)N Amb17231896 [1,1,0,0,0,0|2,0,0]=4 3910 B10R1.61 CN(c1ccccc1Cl)N Amb17232197 [1,1,0,0,0,0|2,0,0]=4 3911 B10R1.61 CN(c1ccccc1F)C Amb10840219 [1,1,0,0,0,0|1,0,1]=4 3912 B10R1.61 CN(c1ccccc1F)N Amb17231915 [1,1,0,0,0,0|2,0,0]=4 3913 B10R1.61 CN(c1ccccc1N)C Amb1141580 [1,1,0,0,0,0|1,0,1]=4 3914 B10R1.61 CS(=O)c1[n]cccc1N Amb18278664 [1,1,0,0,0,0|2,0,0]=4 3915 B10R1.61 CS(=O)c1cc[n]cc1N Amb18946714 [1,1,0,0,0,0|2,0,0]=4 3916 B10R1.61 CS(=O)c1ccc[n]c1Cl Amb24566478 [1,1,0,0,0,0|2,0,0]=4 3917 B10R1.61 CS(=O)c1ccccc1Br Amb19891620 [1,1,0,0,0,0|1,0,0]=3 3918 B10R1.61 CS(=O)c1ccccc1F Amb10839323 [1,1,0,0,0,0|1,0,0]=3 3919 B10R1.61 CS(=O)c1ccccc1I Amb19930098 [1,1,0,0,0,0|1,0,0]=3 3920 B10R1.61 CS(=O)c1ccccc1N Amb18945203 [1,1,0,0,0,0|1,0,0]=3 3921 B10R1.61 CS(=O)c1ccccc1O Amb2420338 [1,1,0,0,0,0|1,0,0]=3 3922 B10R1.61 C[C@@H](Cl)c1[n]cccc1F Amb25063296 [1,1,0,0,0,0|2,0,0]=4 3923 B10R1.61 C[C@@H](Cl)c1cc[n]cc1Cl Amb25114659 [1,1,0,0,0,0|2,0,0]=4 3924 B10R1.61 C[C@@H](Cl)c1ccccc1F Amb25803419 [1,1,0,0,0,0|1,0,0]=3 3925 B10R1.61 C[C@@H](N)c1[n]cccc1Br Amb24413548 [1,1,0,0,0,0|2,0,0]=4 3926 B10R1.61 C[C@@H](N)c1[n]cccc1Cl Amb24570889 [1,1,0,0,0,0|2,0,0]=4 3927 B10R1.61 C[C@@H](N)c1[n]cccc1F Amb24654773 [1,1,0,0,0,0|2,0,0]=4 3928 B10R1.61 C[C@@H](N)c1[n]cccc1O Amb25849314 [1,1,0,0,0,0|2,0,0]=4 3929 B10R1.61 C[C@@H](N)c1c[n]ccc1Br Amb24505025 [1,1,0,0,0,0|2,0,0]=4 3930 B10R1.61 C[C@@H](N)c1c[n]ccc1Cl Amb25119375 [1,1,0,0,0,0|2,0,0]=4 3931 B10R1.61 C[C@@H](N)c1cc[n]cc1N Amb24761369 [1,1,0,0,0,0|2,0,0]=4 3932 B10R1.61 C[C@@H](N)c1ccc[n]c1F Amb25805548 [1,1,0,0,0,0|2,0,0]=4 3933 B10R1.61 C[C@@H](N)c1ccc[n]c1N Amb25254871 [1,1,0,0,0,0|2,0,0]=4 3934 B10R1.61 C[C@@H](N)c1ccccc1Br Amb22754718 [1,1,0,0,0,0|1,0,0]=3 3935 B10R1.61 C[C@@H](N)c1ccccc1F Amb22288619 [1,1,0,0,0,0|1,0,0]=3 3936 B10R1.61 C[C@@H](N)c1ccccc1N Amb25714645 [1,1,0,0,0,0|1,0,0]=3 3937 B10R1.61 C[C@@H](N)c1ccccc1O Amb22748922 [1,1,0,0,0,0|1,0,0]=3 3938 B10R1.61 C[C@@H](N)c1ccccc1S Amb24738549 [1,1,0,0,0,0|1,0,0]=3 3939 B10R1.61 C[C@@H](O)c1[n]cccc1Br Amb24717023 [1,1,0,0,0,0|1,0,1]=4 3940 B10R1.61 C[C@@H](O)c1[n]cccc1Cl Amb25074994 [1,1,0,0,0,0|1,0,1]=4 3941 B10R1.61 C[C@@H](O)c1[n]cccc1F Amb24707664 [1,1,0,0,0,0|1,0,1]=4 3942 B10R1.61 C[C@@H](O)c1cc[n]cc1Cl Amb25058281 [1,1,0,0,0,0|1,0,1]=4 3943 B10R1.61 C[C@@H](O)c1cc[n]cc1F Amb24622602 [1,1,0,0,0,0|1,0,1]=4 3944 B10R1.61 C[C@@H](O)c1ccc[n]c1N Amb22745879 [1,1,0,0,0,0|1,0,1]=4 3945 B10R1.61 C[C@@H](c1ccccc1C)N Amb16233865 [1,1,0,0,0,0|1,0,0]=3 3946 B10R1.61 C[C@@H](c1ccccc1F)N Amb10607169 [1,1,0,0,0,0|1,0,0]=3 3947 B10R1.61 C[C@@H](c1ccccc1F)O Amb10838300 [1,1,0,0,0,0|0,0,1]=3 3948 B10R1.61 C[C@H](N)c1[n]cccc1N Amb24373052 [1,1,0,0,0,0|2,0,0]=4 3949 B10R1.61 C[C@H](N)c1cc[n]cc1Cl Amb25742943 [1,1,0,0,0,0|2,0,0]=4 3950 B10R1.61 C[C@H](N)c1cc[n]cc1F Amb25289879 [1,1,0,0,0,0|2,0,0]=4 3951 B10R1.61 C[C@H](N)c1ccccc1Cl Amb22284328 [1,1,0,0,0,0|1,0,0]=3 3952 B10R1.61 C[C@H](N)c1ccccc1F Amb22406363 [1,1,0,0,0,0|1,0,0]=3 3953 B10R1.61 C[C@H](N)c1ccccc1S Amb24409242 [1,1,0,0,0,0|1,0,0]=3 3954 B10R1.61 C[C@H](O)c1[n]cccc1F Amb25279268 [1,1,0,0,0,0|1,0,1]=4 3955 B10R1.61 C[C@H](O)c1c[n]ccc1Cl Amb24649604 [1,1,0,0,0,0|1,0,1]=4 3956 B10R1.61 C[C@H](O)c1cc[n]cc1Br Amb24708454 [1,1,0,0,0,0|1,0,1]=4 3957 B10R1.61 C[C@H](O)c1cc[n]cc1Cl Amb24433046 [1,1,0,0,0,0|1,0,1]=4 3958 B10R1.61 C[C@H](O)c1cc[n]cc1F Amb24447395 [1,1,0,0,0,0|1,0,1]=4 3959 B10R1.61 C[C@H](O)c1ccc[n]c1N Amb25771199 [1,1,0,0,0,0|1,0,1]=4 3960 B10R1.61 C[C@H](O)c1ccccc1O Amb24476869 [1,1,0,0,0,0|0,0,1]=3 3961 B10R1.61 C[C@H](c1ccccc1Cl)N Amb16233926 [1,1,0,0,0,0|1,0,0]=3 3962 B10R1.61 C[C@H](c1ccccc1F)N Amb10838302 [1,1,0,0,0,0|1,0,0]=3 3963 B10R1.61 C[C@H](c1ccccc1F)O Amb10838298 [1,1,0,0,0,0|0,0,1]=3 3964 B10R1.61 C[SiH](C)c1ccccc1O Amb24478319 [1,1,0,0,0,0|0,1,1]=4 3965 B10R1.61 C\C(\N)=C/1\C=CC=CC1=O Amb25147320 [1,1,0,0,0,0|1,0,1]=4 3966 B10R1.61 C\C(\N)=C\1/C=CC=CC1=O Amb24583511 [1,1,0,0,0,0|1,0,1]=4 3967 B10R1.61 C\C(\O)=C/1\C=CC=CC1=C Amb25269599 [1,1,0,0,0,0|0,0,2]=4 3968 B10R1.61 Cc1[n]cccc1C(C)=O Amb18832502 [1,1,0,0,0,0|1,0,1]=4 3969 B10R1.61 Cc1[n]cccc1C(C)N Amb18853388 [1,1,0,0,0,0|2,0,0]=4 3970 B10R1.61 Cc1[n]cccc1[C@H](C)N Amb24401138 [1,1,0,0,0,0|2,0,0]=4 3971 B10R1.61 Cc1c[n]ccc1C(C)=O Amb25757892 [1,1,0,0,0,0|1,0,1]=4 3972 B10R1.61 Cc1c[n]ccc1[C@@H](C)O Amb25713575 [1,1,0,0,0,0|1,0,1]=4 3973 B10R1.61 Cc1c[n]ccc1[C@H](C)O Amb24706964 [1,1,0,0,0,0|1,0,1]=4 3974 B10R1.61 Cc1cc[n]cc1C(C)=O Amb21964244 [1,1,0,0,0,0|1,0,1]=4 3975 B10R1.61 Cc1cc[n]cc1C(C)C Amb24103876 [1,1,0,0,0,0|1,0,1]=4 3976 B10R1.61 Cc1cc[n]cc1C(C)N Amb18832439 [1,1,0,0,0,0|2,0,0]=4 3977 B10R1.61 Cc1cc[n]cc1C(C)O Amb22059811 [1,1,0,0,0,0|1,0,1]=4 3978 B10R1.61 Cc1cc[n]cc1[C@@H](C)N Amb25147239 [1,1,0,0,0,0|2,0,0]=4 3979 B10R1.61 Cc1cc[n]cc1[C@H](C)N Amb24641376 [1,1,0,0,0,0|2,0,0]=4 3980 B10R1.61 Cc1ccc[n]c1C(C)Br Amb24749585 [1,1,0,0,0,0|2,0,0]=4 3981 B10R1.61 Cc1ccc[n]c1[C@@H](C)O Amb24406429 [1,1,0,0,0,0|1,0,1]=4 3982 B10R1.61 Cc1ccc[n]c1[C@H](C)N Amb25791601 [1,1,0,0,0,0|2,0,0]=4 3983 B10R1.61 Cc1ccc[n]c1[C@H](C)O Amb25305108 [1,1,0,0,0,0|1,0,1]=4 3984 B10R1.61 Cc1ccccc1C(=C)I Amb25289651 [1,1,0,0,0,0|1,0,1]=4 3985 B10R1.61 Cc1ccccc1C(Br)=O Amb17844075 [1,1,0,0,0,0|1,0,1]=4 3986 B10R1.61 Cc1ccccc1C(C)=C Amb22043466 [1,1,0,0,0,0|0,0,1]=3 3987 B10R1.61 Cc1ccccc1C(C)C Amb22347915 [1,1,0,0,0,0|0,0,1]=3 3988 B10R1.61 Cc1ccccc1S(=O)Cl Amb25179881 [1,1,0,0,0,0|2,0,0]=4 3989 B10R1.61 Cc1ccccc1S(C)=O Amb25092647 [1,1,0,0,0,0|1,0,0]=3 3990 B10R1.61 Cc1ccccc1S(O)=O Amb24093011 [1,1,0,0,0,0|2,0,0]=4 3991 B10R1.61 Cc1ccccc1S([O-])=O Amb19944452 [1,1,0,0,0,0|2,0,0]=4 3992 B10R1.61 Cc1ccccc1[C@@H](C)Br Amb24334736 [1,1,0,0,0,0|1,0,0]=3 3993 B10R1.61 Cc1ccccc1[C@@H](C)N Amb22288649 [1,1,0,0,0,0|1,0,0]=3 3994 B10R1.61 Cc1ccccc1[C@H](C)Br Amb24634275 [1,1,0,0,0,0|1,0,0]=3 3995 B10R1.61 ClC(Cl)c1ccccc1Cl Amb17940881 [1,1,0,0,0,0|2,0,0]=4 3996 B10R1.61 N=S(=O)c1ccccc1F Amb25760993 [1,1,0,0,0,0|2,0,0]=4 3997 B10R1.61 NC(=O)c1ccccc1F Amb1221270 [1,1,0,0,0,0|1,0,1]=4 3998 B10R1.61 NC(=O)c1ccccc1I Amb2384520 [1,1,0,0,0,0|1,0,1]=4 3999 B10R1.61 NC(=O)c1ccccc1N Amb1212111 [1,1,0,0,0,0|1,0,1]=4 4000 B10R1.61 NC(=O)c1ccccc1O Amb1935248 [1,1,0,0,0,0|1,0,1]=4 4001 B10R1.61 NC(N)c1ccccc1Br Amb20621748 [1,1,0,0,0,0|2,0,0]=4 4002 B10R1.61 Nc1ccccc1C(=O)Cl Amb20620197 [1,1,0,0,0,0|1,0,1]=4 4003 B10R1.61 Nc1ccccc1C(=O)S Amb24563424 [1,1,0,0,0,0|1,0,1]=4 4004 B10R1.61 Nc1ccccc1C(F)F Amb20075852 [1,1,0,0,0,0|2,0,0]=4 4005 B10R1.61 Nc1ccccc1C(F)F Amb22388456 [1,1,0,0,0,0|2,0,0]=4 4006 B10R1.61 Nc1ccccc1N(=O)=O Amb20621758 [1,1,0,0,0,0|2,0,0]=4 4007 B10R1.61 Nc1ccccc1S(O)=O Amb25351788 [1,1,0,0,0,0|2,0,0]=4 4008 B10R1.61 Nc1ccccc1[N+]([O-])=O Amb22277145 [1,1,0,0,0,0|2,0,0]=4 4009 B10R1.61 O=C(Cl)c1ccccc1S Amb25770152 [1,1,0,0,0,0|1,0,1]=4 4010 B10R1.61 O=N(=O)c1ccccc1Cl Amb20621781 [1,1,0,0,0,0|2,0,0]=4 4011 B10R1.61 O=N(=O)c1ccccc1F Amb20621321 [1,1,0,0,0,0|2,0,0]=4 4012 B10R1.61 O=N(=O)c1ccccc1I Amb20621837 [1,1,0,0,0,0|2,0,0]=4 4013 B10R1.61 O=S(Cl)c1ccccc1Cl Amb25286319 [1,1,0,0,0,0|2,0,0]=4 4014 B10R1.61 O=S(Cl)c1ccccc1F Amb25371664 [1,1,0,0,0,0|2,0,0]=4 4015 B10R1.61 OC(=O)[13c]1[13cH][13cH][13cH][13cH][13c]1O Amb17620019 [1,1,0,0,0,0|1,0,1]=4 4016 B10R1.61 OC(=O)c1ccccc1Cl Amb1935156 [1,1,0,0,0,0|1,0,1]=4 4017 B10R1.61 OC(=O)c1ccccc1Cl Amb22469215 [1,1,0,0,0,0|1,0,1]=4 4018 B10R1.61 OC(=O)c1ccccc1N Amb1933714 [1,1,0,0,0,0|1,0,1]=4 4019 B10R1.61 OC(=O)c1ccccc1O Amb11012607 [1,1,0,0,0,0|1,0,1]=4 4020 B10R1.61 OC(=O)c1ccccc1O Amb1912504 [1,1,0,0,0,0|1,0,1]=4 4021 B10R1.61 OC(=O)c1ccccc1O Amb22730296 [1,1,0,0,0,0|1,0,1]=4 4022 B10R1.61 OS(=O)c1ccccc1Br Amb24707545 [1,1,0,0,0,0|2,0,0]=4 4023 B10R1.61 OS(=O)c1ccccc1Cl Amb25174713 [1,1,0,0,0,0|2,0,0]=4 4024 B10R1.61 Oc1ccccc1C(=O)Br Amb24084360 [1,1,0,0,0,0|1,0,1]=4 4025 B10R1.61 Oc1ccccc1C(Cl)Cl Amb25216931 [1,1,0,0,0,0|2,0,0]=4 4026 B10R1.61 Oc1ccccc1C(F)F Amb22896722 [1,1,0,0,0,0|2,0,0]=4 4027 B10R1.61 Oc1ccccc1C(O)=O Amb22395961 [1,1,0,0,0,0|1,0,1]=4 4028 B10R1.61 Oc1ccccc1C(O)=O Amb22552528 [1,1,0,0,0,0|1,0,1]=4 4029 B10R1.61 Oc1ccccc1C(O)=O Amb22731482 [1,1,0,0,0,0|1,0,1]=4 4030 B10R1.61 Oc1ccccc1C(O)=O Amb22731708 [1,1,0,0,0,0|1,0,1]=4 4031 B10R1.61 Oc1ccccc1S(O)=O Amb25044336 [1,1,0,0,0,0|2,0,0]=4 4032 B10R1.61 Oc1ccccc1[13C](O)=O Amb22367300 [1,1,0,0,0,0|1,0,1]=4 4033 B10R1.61 Oc1ccccc1[14C](O)=O Amb22349940 [1,1,0,0,0,0|1,0,1]=4 4034 B10R1.61 [13CH3]c1ccccc1[13C](O)=O Amb22056255 [1,1,0,0,0,0|1,0,1]=4 4035 B10R1.61 [O-]C(=O)c1ccccc1Br Amb2227647 [1,1,0,0,0,0|1,0,1]=4 4036 B10R1.61 [O-]C(=O)c1ccccc1Cl Amb10071066 [1,1,0,0,0,0|1,0,1]=4 4037 B10R1.61 [O-]C(=O)c1ccccc1O Amb10807392 [1,1,0,0,0,0|1,0,1]=4 4038 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246478 [1,1,0,0,0,0|1,0,1]=4 4039 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246479 [1,1,0,0,0,0|1,0,1]=4 4040 B10R1.61 [O-]C(=O)c1ccccc1O Amb20246572 [1,1,0,0,0,0|1,0,1]=4 4041 B10R1.61 [O-]C(=O)c1ccccc1O Amb22051701 [1,1,0,0,0,0|1,0,1]=4 4042 B10R1.61 [O-]C(=O)c1ccccc1O Amb22166780 [1,1,0,0,0,0|1,0,1]=4 4043 B10R1.61 [O-]C(=O)c1ccccc1O Amb22338523 [1,1,0,0,0,0|1,0,1]=4 4044 B10R1.61 [O-]C(=O)c1ccccc1O Amb22351945 [1,1,0,0,0,0|1,0,1]=4 4045 B10R1.61 [O-]C(=O)c1ccccc1O Amb22474113 [1,1,0,0,0,0|1,0,1]=4 4046 B10R1.61 [O-]C(=O)c1ccccc1O Amb22728988 [1,1,0,0,0,0|1,0,1]=4 4047 B10R1.61 [O-]C(=O)c1ccccc1O Amb22730611 [1,1,0,0,0,0|1,0,1]=4 4048 B10R1.61 [O-]C(=O)c1ccccc1O Amb22732058 [1,1,0,0,0,0|1,0,1]=4 4049 B10R1.61 [O-]C(=O)c1ccccc1O Amb22732059 [1,1,0,0,0,0|1,0,1]=4 4050 B10R1.61 [O-]C(=O)c1ccccc1O Amb22734697 [1,1,0,0,0,0|1,0,1]=4 4051 B10R1.61 [O-]C(=O)c1ccccc1S Amb21928585 [1,1,0,0,0,0|1,0,1]=4 4052 B10R1.61 [O-]C(=O)c1ccccc1S Amb22729716 [1,1,0,0,0,0|1,0,1]=4 4053 B10R1.61 [O-]C(=O)c1ccccc1[S-] Amb20239365 [1,1,0,0,0,0|1,0,1]=4 4054 B10R1.61 [O-]S(=O)c1ccccc1Br Amb19944407 [1,1,0,0,0,0|2,0,0]=4 4055 B10R1.61 [O-]S(=O)c1ccccc1Cl Amb19944419 [1,1,0,0,0,0|2,0,0]=4 4056 B10R1.61 [O-]S(=O)c1ccccc1F Amb19944444 [1,1,0,0,0,0|2,0,0]=4 4057 B10R1.61 [O-][N+](=O)c1ccccc1I Amb1151956 [1,1,0,0,0,0|2,0,0]=4 4058 B10R1.61 [O-][N+](=O)c1ccccc1S Amb2519390 [1,1,0,0,0,0|2,0,0]=4 4059 B10R1.61 [O-]c1ccccc1C([O-])=O Amb22045661 [1,1,0,0,0,0|1,0,1]=4 4060 B10R1.61 [O-]c1ccccc1[N+]([O-])=O Amb24309051 [1,1,0,0,0,0|2,0,0]=4 4061 B10R1.113 BrC(Br)c1cccc(I)c1 Amb24452020 [1,1,0,0,0,0|2,0,0]=4 4062 B10R1.113 Brc1cccc(c1)C(N)C Amb1129931 [1,1,0,0,0,0|1,0,0]=3 4063 B10R1.113 Brc1cccc(c1)C(O)C Amb1109861 [1,1,0,0,0,0|0,0,1]=3 4064 B10R1.113 Brc1cccc(c1)N(C)C Amb2447133 [1,1,0,0,0,0|1,0,1]=4 4065 B10R1.113 Brc1cccc(c1)N(N)C Amb17237221 [1,1,0,0,0,0|2,0,0]=4 4066 B10R1.113 Brc1cccc(n1)C(C)C Amb10599839 [1,1,0,0,0,0|1,0,1]=4 4067 B10R1.113 Brc1cccc(n1)C(O)C Amb10975592 [1,1,0,0,0,0|1,0,1]=4 4068 B10R1.113 Brc1nccc(c1)C(=O)C Amb10069912 [1,1,0,0,0,0|1,0,1]=4 4069 B10R1.113 Brc1nccc(c1)C(C)C Amb10599919 [1,1,0,0,0,0|1,0,1]=4 4070 B10R1.113 C=C(Br)c1cccc(N)c1 Amb25109648 [1,1,0,0,0,0|1,0,1]=4 4071 B10R1.113 C=C(Br)c1cccc(O)c1 Amb25130635 [1,1,0,0,0,0|1,0,1]=4 4072 B10R1.113 CC(=C)c1c[n]cc(Br)c1 Amb19957922 [1,1,0,0,0,0|1,0,1]=4 4073 B10R1.113 CC(=C)c1c[n]cc(F)c1 Amb24414179 [1,1,0,0,0,0|1,0,1]=4 4074 B10R1.113 CC(=C)c1c[n]cc(N)c1 Amb24320799 [1,1,0,0,0,0|1,0,1]=4 4075 B10R1.113 CC(=C)c1cc(Br)cc[n]1 Amb20617320 [1,1,0,0,0,0|1,0,1]=4 4076 B10R1.113 CC(=C)c1cc(N)cc[n]1 Amb20617321 [1,1,0,0,0,0|1,0,1]=4 4077 B10R1.113 CC(=C)c1cc[n]c(Br)c1 Amb20617322 [1,1,0,0,0,0|1,0,1]=4 4078 B10R1.113 CC(=C)c1cc[n]c(N)c1 Amb20617323 [1,1,0,0,0,0|1,0,1]=4 4079 B10R1.113 CC(=C)c1cccc(Br)[n]1 Amb20617318 [1,1,0,0,0,0|1,0,1]=4 4080 B10R1.113 CC(=C)c1cccc(Br)c1 Amb24448711 [1,1,0,0,0,0|0,0,1]=3 4081 B10R1.113 CC(=C)c1cccc(Cl)c1 Amb24088166 [1,1,0,0,0,0|0,0,1]=3 4082 B10R1.113 CC(=C)c1cccc(F)c1 Amb25133875 [1,1,0,0,0,0|0,0,1]=3 4083 B10R1.113 CC(=C)c1cccc(N)[n]1 Amb20617319 [1,1,0,0,0,0|1,0,1]=4 4084 B10R1.113 CC(=C)c1cccc(O)c1 Amb18124424 [1,1,0,0,0,0|0,0,1]=3 4085 B10R1.113 CC(=O)C1=CC=CC(=O)N1 Amb22372289 [1,1,0,0,0,0|1,0,1]=4 4086 B10R1.113 CC(=O)C1=CC=CC(=S)N1 Amb24518912 [1,1,0,0,0,0|1,0,1]=4 4087 B10R1.113 CC(=O)c1c[n]cc(F)c1 Amb19374623 [1,1,0,0,0,0|1,0,1]=4 4088 B10R1.113 CC(=O)c1c[n]cc(F)c1 Amb22275941 [1,1,0,0,0,0|1,0,1]=4 4089 B10R1.113 CC(=O)c1c[n]cc(O)c1 Amb23399982 [1,1,0,0,0,0|1,0,1]=4 4090 B10R1.113 CC(=O)c1cc(Br)cc[n]1 Amb21858737 [1,1,0,0,0,0|1,0,1]=4 4091 B10R1.113 CC(=O)c1cc(Cl)ccn1 Amb10603326 [1,1,0,0,0,0|1,0,1]=4 4092 B10R1.113 CC(=O)c1cc(F)cc[n]1 Amb25689744 [1,1,0,0,0,0|1,0,1]=4 4093 B10R1.113 CC(=O)c1cc(N)cc[n]1 Amb23401922 [1,1,0,0,0,0|1,0,1]=4 4094 B10R1.113 CC(=O)c1cc(O)cc[n]1 Amb23399916 [1,1,0,0,0,0|1,0,1]=4 4095 B10R1.113 CC(=O)c1cc[n]c(Br)c1 Amb21964445 [1,1,0,0,0,0|1,0,1]=4 4096 B10R1.113 CC(=O)c1cc[n]c(N)c1 Amb18643066 [1,1,0,0,0,0|1,0,1]=4 4097 B10R1.113 CC(=O)c1cccc(F)[n]1 Amb21857925 [1,1,0,0,0,0|1,0,1]=4 4098 B10R1.113 CC(=O)c1cccc(N)[n]1 Amb23401921 [1,1,0,0,0,0|1,0,1]=4 4099 B10R1.113 CC(=O)c1cccc(S)c1 Amb19374493 [1,1,0,0,0,0|0,0,1]=3 4100 B10R1.113 CC(Br)c1c[n]cc(F)c1 Amb23510007 [1,1,0,0,0,0|2,0,0]=4 4101 B10R1.113 CC(Br)c1cc(Br)c[n]c1 Amb23509149 [1,1,0,0,0,0|2,0,0]=4 4102 B10R1.113 CC(Br)c1cc[n]c(Cl)c1 Amb25043830 [1,1,0,0,0,0|2,0,0]=4 4103 B10R1.113 CC(Br)c1cc[n]c(N)c1 Amb24382114 [1,1,0,0,0,0|2,0,0]=4 4104 B10R1.113 CC(Br)c1cccc(F)[n]1 Amb25041092 [1,1,0,0,0,0|2,0,0]=4 4105 B10R1.113 CC(C)C1=CC(=O)C=CO1 Amb24352130 [1,1,0,0,0,0|1,0,1]=4 4106 B10R1.113 CC(C)C1=CC(=O)C=CS1 Amb25830602 [1,1,0,0,0,0|1,0,1]=4 4107 B10R1.113 CC(C)C1=CC(=S)C=CN1 Amb24556344 [1,1,0,0,0,0|1,0,1]=4 4108 B10R1.113 CC(C)C1=CC=CC(=O)N1 Amb22372290 [1,1,0,0,0,0|1,0,1]=4 4109 B10R1.113 CC(C)C1=CC=CC(=S)N1 Amb25693727 [1,1,0,0,0,0|1,0,1]=4 4110 B10R1.113 CC(C)c1c[n]cc(Br)c1 Amb20617710 [1,1,0,0,0,0|1,0,1]=4 4111 B10R1.113 CC(C)c1c[n]cc(N)c1 Amb18832433 [1,1,0,0,0,0|1,0,1]=4 4112 B10R1.113 CC(C)c1c[n]cc(O)c1 Amb20617711 [1,1,0,0,0,0|1,0,1]=4 4113 B10R1.113 CC(C)c1cc(F)cc[n]1 Amb24319237 [1,1,0,0,0,0|1,0,1]=4 4114 B10R1.113 CC(C)c1cc[n]c(Cl)c1 Amb20617633 [1,1,0,0,0,0|1,0,1]=4 4115 B10R1.113 CC(C)c1cc[n]c(F)c1 Amb24084194 [1,1,0,0,0,0|1,0,1]=4 4116 B10R1.113 CC(C)c1cccc(F)[n]1 Amb24319185 [1,1,0,0,0,0|1,0,1]=4 4117 B10R1.113 CC(C)c1cccc(F)c1 Amb25214297 [1,1,0,0,0,0|0,0,1]=3 4118 B10R1.113 CC(C)c1cccc(I)[n]1 Amb25169353 [1,1,0,0,0,0|1,0,1]=4 4119 B10R1.113 CC(C)c1cccc(S)c1 Amb24102307 [1,1,0,0,0,0|0,0,1]=3 4120 B10R1.113 CC(Cl)c1cc(Br)cc[n]1 Amb24371346 [1,1,0,0,0,0|2,0,0]=4 4121 B10R1.113 CC(F)c1cc[n]c(Cl)c1 Amb25286802 [1,1,0,0,0,0|2,0,0]=4 4122 B10R1.113 CC(F)c1cccc(Br)c1 Amb22896506 [1,1,0,0,0,0|1,0,0]=3 4123 B10R1.113 CC(F)c1cccc(Cl)c1 Amb25178277 [1,1,0,0,0,0|1,0,0]=3 4124 B10R1.113 CC(F)c1cccc(O)c1 Amb24529130 [1,1,0,0,0,0|1,0,0]=3 4125 B10R1.113 CC(N)C=1C=CNC(=O)C1 Amb24529181 [1,1,0,0,0,0|2,0,0]=4 4126 B10R1.113 CC(N)c1c[n]cc(F)c1 Amb18279087 [1,1,0,0,0,0|2,0,0]=4 4127 B10R1.113 CC(N)c1cc(Cl)cc[n]1 Amb18830678 [1,1,0,0,0,0|2,0,0]=4 4128 B10R1.113 CC(N)c1cc(I)cc[n]1 Amb24667735 [1,1,0,0,0,0|2,0,0]=4 4129 B10R1.113 CC(N)c1cc(N)cc[n]1 Amb25095016 [1,1,0,0,0,0|2,0,0]=4 4130 B10R1.113 CC(N)c1cc[n]c(Cl)c1 Amb24056180 [1,1,0,0,0,0|2,0,0]=4 4131 B10R1.113 CC(N)c1cccc(N)[n]1 Amb24411433 [1,1,0,0,0,0|2,0,0]=4 4132 B10R1.113 CC(N)c1cccc(O)[n]1 Amb24349731 [1,1,0,0,0,0|2,0,0]=4 4133 B10R1.113 CC(O)c1c[n]cc(F)c1 Amb25300087 [1,1,0,0,0,0|1,0,1]=4 4134 B10R1.113 CC(O)c1cc(Cl)cc[n]1 Amb24480513 [1,1,0,0,0,0|1,0,1]=4 4135 B10R1.113 CC(O)c1cc[n]c(Br)c1 Amb25789039 [1,1,0,0,0,0|1,0,1]=4 4136 B10R1.113 CC(O)c1cc[n]c(Cl)c1 Amb22496405 [1,1,0,0,0,0|1,0,1]=4 4137 B10R1.113 CC(O)c1cc[n]c(F)c1 Amb20248121 [1,1,0,0,0,0|1,0,1]=4 4138 B10R1.113 CC(O)c1cc[n]c(N)c1 Amb22001626 [1,1,0,0,0,0|1,0,1]=4 4139 B10R1.113 CC(O)c1cc[n]c(N)c1 Amb22896375 [1,1,0,0,0,0|1,0,1]=4 4140 B10R1.113 CC(O)c1cccc(Cl)[n]1 Amb25357229 [1,1,0,0,0,0|1,0,1]=4 4141 B10R1.113 CC(O)c1cccc(F)[n]1 Amb24601796 [1,1,0,0,0,0|1,0,1]=4 4142 B10R1.113 CC(O)c1cccc(N)[n]1 Amb25147502 [1,1,0,0,0,0|1,0,1]=4 4143 B10R1.113 CC(S)c1c[n]cc(F)c1 Amb25802187 [1,1,0,0,0,0|1,1,0]=4 4144 B10R1.113 CC(c1cc(Br)cnc1)O Amb17595353 [1,1,0,0,0,0|1,0,1]=4 4145 B10R1.113 CC(c1nccc(c1)Br)C Amb10599879 [1,1,0,0,0,0|1,0,1]=4 4146 B10R1.113 CC(c1nccc(c1)Cl)C Amb10599890 [1,1,0,0,0,0|1,0,1]=4 4147 B10R1.113 CC(c1nccc(c1)N)C Amb10599893 [1,1,0,0,0,0|1,0,1]=4 4148 B10R1.113 CC(c1nccc(c1)O)C Amb10599894 [1,1,0,0,0,0|1,0,1]=4 4149 B10R1.113 CS(=O)c1c[n]cc(Br)c1 Amb25376177 [1,1,0,0,0,0|2,0,0]=4 4150 B10R1.113 CS(=O)c1cc(I)cc[n]1 Amb24565079 [1,1,0,0,0,0|2,0,0]=4 4151 B10R1.113 CS(=O)c1cc[n]c(Br)c1 Amb24517195 [1,1,0,0,0,0|2,0,0]=4 4152 B10R1.113 CS(=O)c1cc[n]c(N)c1 Amb24667745 [1,1,0,0,0,0|2,0,0]=4 4153 B10R1.113 CS(=O)c1cc[n]c(O)c1 Amb25313323 [1,1,0,0,0,0|2,0,0]=4 4154 B10R1.113 CS(=O)c1cccc(Br)[n]1 Amb25270281 [1,1,0,0,0,0|2,0,0]=4 4155 B10R1.113 CS(=O)c1cccc(Br)c1 Amb19891299 [1,1,0,0,0,0|1,0,0]=3 4156 B10R1.113 CS(=O)c1cccc(Cl)c1 Amb19892202 [1,1,0,0,0,0|1,0,0]=3 4157 B10R1.113 CS(=O)c1cccc(F)c1 Amb19892020 [1,1,0,0,0,0|1,0,0]=3 4158 B10R1.113 C[As](C)c1cccc(O)c1 Amb22347180 [1,1,0,0,0,0|1,0,1]=4 4159 B10R1.113 C[C@@H](N)c1c[n]cc(Br)c1 Amb23440402 [1,1,0,0,0,0|2,0,0]=4 4160 B10R1.113 C[C@@H](N)c1c[n]cc(Br)c1 Amb24401330 [1,1,0,0,0,0|2,0,0]=4 4161 B10R1.113 C[C@@H](N)c1c[n]cc(Cl)c1 Amb23440380 [1,1,0,0,0,0|2,0,0]=4 4162 B10R1.113 C[C@@H](N)c1c[n]cc(Cl)c1 Amb24657255 [1,1,0,0,0,0|2,0,0]=4 4163 B10R1.113 C[C@@H](N)c1c[n]cc(O)c1 Amb24386111 [1,1,0,0,0,0|2,0,0]=4 4164 B10R1.113 C[C@@H](N)c1cc(F)cc[n]1 Amb25377892 [1,1,0,0,0,0|2,0,0]=4 4165 B10R1.113 C[C@@H](N)c1cc(I)cc[n]1 Amb25117389 [1,1,0,0,0,0|2,0,0]=4 4166 B10R1.113 C[C@@H](N)c1cc(N)[n]cc1 Amb24623676 [1,1,0,0,0,0|2,0,0]=4 4167 B10R1.113 C[C@@H](N)c1cc(N)c[n]c1 Amb25133526 [1,1,0,0,0,0|2,0,0]=4 4168 B10R1.113 C[C@@H](N)c1cc(N)ccc1 Amb22288659 [1,1,0,0,0,0|1,0,0]=3 4169 B10R1.113 C[C@@H](N)c1cc(O)cc[n]1 Amb25348491 [1,1,0,0,0,0|2,0,0]=4 4170 B10R1.113 C[C@@H](N)c1cc[n]c(Br)c1 Amb19929850 [1,1,0,0,0,0|2,0,0]=4 4171 B10R1.113 C[C@@H](N)c1cc[n]c(Br)c1 Amb24727273 [1,1,0,0,0,0|2,0,0]=4 4172 B10R1.113 C[C@@H](N)c1cc[n]c(Cl)c1 Amb19889553 [1,1,0,0,0,0|2,0,0]=4 4173 B10R1.113 C[C@@H](N)c1cc[n]c(Cl)c1 Amb25146374 [1,1,0,0,0,0|2,0,0]=4 4174 B10R1.113 C[C@@H](N)c1cccc(Cl)c1 Amb22288623 [1,1,0,0,0,0|1,0,0]=3 4175 B10R1.113 C[C@@H](N)c1cccc(F)c1 Amb22274554 [1,1,0,0,0,0|1,0,0]=3 4176 B10R1.113 C[C@@H](N)c1cccc(I)c1 Amb25804787 [1,1,0,0,0,0|1,0,0]=3 4177 B10R1.113 C[C@@H](N)c1cccc(O)c1 Amb22748255 [1,1,0,0,0,0|1,0,0]=3 4178 B10R1.113 C[C@@H](O)c1cc[n]c(Br)c1 Amb25216395 [1,1,0,0,0,0|1,0,1]=4 4179 B10R1.113 C[C@@H](O)c1cc[n]c(Cl)c1 Amb25059848 [1,1,0,0,0,0|1,0,1]=4 4180 B10R1.113 C[C@@H](O)c1cccc(Br)[n]1 Amb25341088 [1,1,0,0,0,0|1,0,1]=4 4181 B10R1.113 C[C@@H](O)c1cccc(I)c1 Amb25187293 [1,1,0,0,0,0|0,0,1]=3 4182 B10R1.113 C[C@H](N)c1c[n]cc(Br)c1 Amb25137770 [1,1,0,0,0,0|2,0,0]=4 4183 B10R1.113 C[C@H](N)c1c[n]cc(F)c1 Amb24586948 [1,1,0,0,0,0|2,0,0]=4 4184 B10R1.113 C[C@H](N)c1cc(Cl)cc[n]1 Amb24624662 [1,1,0,0,0,0|2,0,0]=4 4185 B10R1.113 C[C@H](N)c1cc(I)cc[n]1 Amb24382688 [1,1,0,0,0,0|2,0,0]=4 4186 B10R1.113 C[C@H](N)c1cc(N)ccc1 Amb22169653 [1,1,0,0,0,0|1,0,0]=3 4187 B10R1.113 C[C@H](N)c1cc(N)ccc1 Amb22288703 [1,1,0,0,0,0|1,0,0]=3 4188 B10R1.113 C[C@H](N)c1cc[n]c(Br)c1 Amb19929849 [1,1,0,0,0,0|2,0,0]=4 4189 B10R1.113 C[C@H](N)c1cc[n]c(Br)c1 Amb25758471 [1,1,0,0,0,0|2,0,0]=4 4190 B10R1.113 C[C@H](N)c1cc[n]c(Cl)c1 Amb19889552 [1,1,0,0,0,0|2,0,0]=4 4191 B10R1.113 C[C@H](N)c1cccc(Cl)c1 Amb22406373 [1,1,0,0,0,0|1,0,0]=3 4192 B10R1.113 C[C@H](N)c1cccc(I)[n]1 Amb24333272 [1,1,0,0,0,0|2,0,0]=4 4193 B10R1.113 C[C@H](N)c1cccc(I)c1 Amb24464976 [1,1,0,0,0,0|1,0,0]=3 4194 B10R1.113 C[C@H](N)c1cccc(N)[n]1 Amb25292190 [1,1,0,0,0,0|2,0,0]=4 4195 B10R1.113 C[C@H](O)c1c[n]cc(Br)c1 Amb24461161 [1,1,0,0,0,0|1,0,1]=4 4196 B10R1.113 C[C@H](O)c1cc(Cl)cc[n]1 Amb24532091 [1,1,0,0,0,0|1,0,1]=4 4197 B10R1.113 C[SiH](C)c1cccc(N)c1 Amb25095368 [1,1,0,0,0,0|0,1,1]=4 4198 B10R1.113 C[n+]1cccc(c1)C(=O)C Amb10573212 [1,1,0,0,0,0|1,0,1]=4 4199 B10R1.113 C[n+]1cccc(c1)C(=O)C Amb10573246 [1,1,0,0,0,0|1,0,1]=4 4200 B10R1.113 Cc1c[n]cc(c1)C(C)=O Amb21964245 [1,1,0,0,0,0|1,0,1]=4 4201 B10R1.113 Cc1c[n]cc(c1)C(C)Br Amb24715358 [1,1,0,0,0,0|2,0,0]=4 4202 B10R1.113 Cc1c[n]cc(c1)C(C)C Amb25761309 [1,1,0,0,0,0|1,0,1]=4 4203 B10R1.113 Cc1cc(cc[n]1)C(C)=O Amb19957654 [1,1,0,0,0,0|1,0,1]=4 4204 B10R1.113 Cc1cc(cc[n]1)C(C)Br Amb24482512 [1,1,0,0,0,0|2,0,0]=4 4205 B10R1.113 Cc1cc(cc[n]1)C(C)N Amb18832438 [1,1,0,0,0,0|2,0,0]=4 4206 B10R1.113 Cc1cc(cc[n]1)C(C)O Amb24410724 [1,1,0,0,0,0|1,0,1]=4 4207 B10R1.113 Cc1cc(ccc1)C(O)O Amb24581716 [1,1,0,0,0,0|1,0,1]=4 4208 B10R1.113 Cc1cc(ccc1)S(=O)Cl Amb18065521 [1,1,0,0,0,0|2,0,0]=4 4209 B10R1.113 Cc1cc(ccc1)S(O)=O Amb18563469 [1,1,0,0,0,0|2,0,0]=4 4210 B10R1.113 Cc1cc(ccc1)S([O-])=O Amb19944453 [1,1,0,0,0,0|2,0,0]=4 4211 B10R1.113 Cc1cc[n]c(c1)C(C)=C Amb24397302 [1,1,0,0,0,0|1,0,1]=4 4212 B10R1.113 Cc1cc[n]c(c1)C(C)N Amb21959650 [1,1,0,0,0,0|2,0,0]=4 4213 B10R1.113 Cc1cc[n]c(c1)[C@@H](C)N Amb24428657 [1,1,0,0,0,0|2,0,0]=4 4214 B10R1.113 Cc1cccc([n]1)C(C)=C Amb24084454 [1,1,0,0,0,0|1,0,1]=4 4215 B10R1.113 Cc1cccc([n]1)C(C)Cl Amb25829792 [1,1,0,0,0,0|2,0,0]=4 4216 B10R1.113 Cc1cccc([n]1)C(C)O Amb24529239 [1,1,0,0,0,0|1,0,1]=4 4217 B10R1.113 Cc1cccc([n]1)[C@@H](C)N Amb24377656 [1,1,0,0,0,0|2,0,0]=4 4218 B10R1.113 Cc1cccc([n]1)[C@@H](C)O Amb24684857 [1,1,0,0,0,0|1,0,1]=4 4219 B10R1.113 Cc1cccc([n]1)[C@H](C)O Amb24105803 [1,1,0,0,0,0|1,0,1]=4 4220 B10R1.113 Cc1cccc(c1)B(C)C Amb25251093 [1,1,0,0,0,0|1,0,1]=4 4221 B10R1.113 Cc1cccc(c1)C(=C)C Amb10844683 [1,1,0,0,0,0|0,0,1]=3 4222 B10R1.113 Cc1cccc(c1)C(C)Br Amb18311397 [1,1,0,0,0,0|1,0,0]=3 4223 B10R1.113 Cc1cccc(c1)C(C)Cl Amb18787553 [1,1,0,0,0,0|1,0,0]=3 4224 B10R1.113 Cc1cccc(c1)C(C)N Amb20671145 [1,1,0,0,0,0|1,0,0]=3 4225 B10R1.113 Cc1cccc(c1)C(C)S Amb18787459 [1,1,0,0,0,0|0,1,0]=3 4226 B10R1.113 Cc1cccc(c1)C(N)C Amb2213633 [1,1,0,0,0,0|1,0,0]=3 4227 B10R1.113 Cc1cccc(c1)S(C)=O Amb19892225 [1,1,0,0,0,0|1,0,0]=3 4228 B10R1.113 Cc1cccc(c1)[C@@H](C)N Amb22288648 [1,1,0,0,0,0|1,0,0]=3 4229 B10R1.113 Cc1cccc(c1)[C@@H](C)N Amb22744913 [1,1,0,0,0,0|1,0,0]=3 4230 B10R1.113 Cc1cccc(c1)[C@@H](C)O Amb24476868 [1,1,0,0,0,0|0,0,1]=3 4231 B10R1.113 Cc1cccc(c1)[C@@H](N)C Amb16233866 [1,1,0,0,0,0|1,0,0]=3 4232 B10R1.113 Cc1cccc(c1)[C@H](C)Br Amb25053913 [1,1,0,0,0,0|1,0,0]=3 4233 B10R1.113 Cc1cccc(c1)[C@H](C)N Amb22504241 [1,1,0,0,0,0|1,0,0]=3 4234 B10R1.113 Cc1cccc(c1)[C@H](C)O Amb25335556 [1,1,0,0,0,0|0,0,1]=3 4235 B10R1.113 Cc1cccc(n1)C(=O)C Amb10069245 [1,1,0,0,0,0|1,0,1]=4 4236 B10R1.113 Cc1cccc(n1)C(N)C Amb10608358 [1,1,0,0,0,0|2,0,0]=4 4237 B10R1.113 Cc1ccnc(c1)C(N)C Amb10608299 [1,1,0,0,0,0|2,0,0]=4 4238 B10R1.113 Clc1cccc(c1)C(=O)N Amb1218066 [1,1,0,0,0,0|1,0,1]=4 4239 B10R1.113 Clc1cccc(c1)C(=O)O Amb2223069 [1,1,0,0,0,0|1,0,1]=4 4240 B10R1.113 Clc1cccc(c1)C(=O)[O-] Amb10069116 [1,1,0,0,0,0|1,0,1]=4 4241 B10R1.113 Clc1cccc(c1)C(N)C Amb1105977 [1,1,0,0,0,0|1,0,0]=3 4242 B10R1.113 Clc1cccc(n1)C(=O)C Amb10603338 [1,1,0,0,0,0|1,0,1]=4 4243 B10R1.113 FC(Cl)c1cc(Cl)ccc1 Amb25098955 [1,1,0,0,0,0|2,0,0]=4 4244 B10R1.113 FC(F)c1cccc(Cl)c1 Amb24663599 [1,1,0,0,0,0|2,0,0]=4 4245 B10R1.113 FC(F)c1cccc(I)c1 Amb22174146 [1,1,0,0,0,0|2,0,0]=4 4246 B10R1.113 Fc1cccc(c1)C(Cl)Cl Amb10839619 [1,1,0,0,0,0|2,0,0]=4 4247 B10R1.113 Fc1cccc(c1)C(F)Cl Amb24482475 [1,1,0,0,0,0|2,0,0]=4 4248 B10R1.113 Fc1cccc(c1)C(N)C Amb1657244 [1,1,0,0,0,0|1,0,0]=3 4249 B10R1.113 Fc1cccc(c1)N(C)C Amb10841394 [1,1,0,0,0,0|1,0,1]=4 4250 B10R1.113 Fc1cccc(c1)N(N)C Amb17231917 [1,1,0,0,0,0|2,0,0]=4 4251 B10R1.113 Fc1cccc(c1)[C@@H](N)C Amb16233879 [1,1,0,0,0,0|1,0,0]=3 4252 B10R1.113 Fc1nccc(c1)C(=O)C Amb10066942 [1,1,0,0,0,0|1,0,1]=4 4253 B10R1.113 NC(=O)c1cccc(S)c1 Amb24059371 [1,1,0,0,0,0|1,0,1]=4 4254 B10R1.113 Nc1cc(ccc1)C(=O)Cl Amb24085841 [1,1,0,0,0,0|1,0,1]=4 4255 B10R1.113 Nc1cc(ccc1)C(=O)F Amb25698257 [1,1,0,0,0,0|1,0,1]=4 4256 B10R1.113 Nc1cc(ccc1)C(F)F Amb19894459 [1,1,0,0,0,0|2,0,0]=4 4257 B10R1.113 Nc1cc(ccc1)C([O-])=O Amb22730283 [1,1,0,0,0,0|1,0,1]=4 4258 B10R1.113 Nc1cccc(c1)C(=C)C Amb17107084 [1,1,0,0,0,0|0,0,1]=3 4259 B10R1.113 Nc1cccc(c1)C(=O)N Amb1106189 [1,1,0,0,0,0|1,0,1]=4 4260 B10R1.113 Nc1cccc(c1)C(=O)O Amb1935166 [1,1,0,0,0,0|1,0,1]=4 4261 B10R1.113 Nc1cccc(c1)C(F)F Amb13952375 [1,1,0,0,0,0|2,0,0]=4 4262 B10R1.113 Nc1cccc(c1)C(O)C Amb2092782 [1,1,0,0,0,0|0,0,1]=3 4263 B10R1.113 Nc1cccc(n1)C(C)C Amb10599850 [1,1,0,0,0,0|1,0,1]=4 4264 B10R1.113 Nc1nccc(c1)C(C)C Amb10599924 [1,1,0,0,0,0|1,0,1]=4 4265 B10R1.113 O=C(Cl)c1cccc(S)c1 Amb21961741 [1,1,0,0,0,0|1,0,1]=4 4266 B10R1.113 O=N(=O)c1cccc(Cl)c1 Amb20621790 [1,1,0,0,0,0|2,0,0]=4 4267 B10R1.113 O=N(=O)c1cccc(F)c1 Amb20621320 [1,1,0,0,0,0|2,0,0]=4 4268 B10R1.113 O=S(Cl)c1cc(Cl)ccc1 Amb18565623 [1,1,0,0,0,0|2,0,0]=4 4269 B10R1.113 OS(=O)c1cccc(Br)c1 Amb24626118 [1,1,0,0,0,0|2,0,0]=4 4270 B10R1.113 OS(=O)c1cccc(Cl)c1 Amb18564048 [1,1,0,0,0,0|2,0,0]=4 4271 B10R1.113 OS(=O)c1cccc(F)c1 Amb25263422 [1,1,0,0,0,0|2,0,0]=4 4272 B10R1.113 Oc1cc(ccc1)C(=O)Br Amb24102249 [1,1,0,0,0,0|1,0,1]=4 4273 B10R1.113 Oc1cc(ccc1)C(F)F Amb22174147 [1,1,0,0,0,0|2,0,0]=4 4274 B10R1.113 Oc1cc(ccc1)N(=O)=O Amb20621867 [1,1,0,0,0,0|2,0,0]=4 4275 B10R1.113 Oc1cccc(c1)C(=O)O Amb1208301 [1,1,0,0,0,0|1,0,1]=4 4276 B10R1.113 Oc1cccc(c1)C(N)C Amb10201554 [1,1,0,0,0,0|1,0,0]=3 4277 B10R1.113 Oc1cccc(c1)C(N)C Amb1116261 [1,1,0,0,0,0|1,0,0]=3 4278 B10R1.113 Oc1cccc(c1)P(O)=O Amb25318918 [1,1,0,0,0,0|2,0,0]=4 4279 B10R1.113 Oc1cccc(c1)[C@@H](O)C Amb13952963 [1,1,0,0,0,0|0,0,1]=3 4280 B10R1.113 Oc1cccc(c1)[C@H](O)C Amb13952964 [1,1,0,0,0,0|0,0,1]=3 4281 B10R1.113 Oc1cccc(c1)[N+](=O)[O-] Amb1929299 [1,1,0,0,0,0|2,0,0]=4 4282 B10R1.113 Oc1cccc(n1)C(C)C Amb10599851 [1,1,0,0,0,0|1,0,1]=4 4283 B10R1.113 Oc1nccc(c1)C(C)C Amb10599925 [1,1,0,0,0,0|1,0,1]=4 4284 B10R1.113 Sc1cccc(c1)[N+](=O)[O-] Amb15694852 [1,1,0,0,0,0|2,0,0]=4 4285 B10R1.113 [O-]C(=O)c1cccc(O)c1 Amb22277134 [1,1,0,0,0,0|1,0,1]=4 4286 B10R1.113 [O-]S(=O)c1cccc(Br)c1 Amb19944408 [1,1,0,0,0,0|2,0,0]=4 4287 B10R1.113 [O-]S(=O)c1cccc(Cl)c1 Amb19944420 [1,1,0,0,0,0|2,0,0]=4 4288 B10R1.113 [O-]S(=O)c1cccc(F)c1 Amb19944445 [1,1,0,0,0,0|2,0,0]=4 4289 B10R1.1 BrC=Cc1ccc(cc1)Cl Amb17609952 [1,1,0,0,0,0|1,0,1]=4 4290 B10R1.1 BrCCc1ccc(I)cc1 Amb25266376 [1,1,0,0,0,0|1,0,1]=4 4291 B10R1.1 BrCCc1ccc(cc1)N Amb17595296 [1,1,0,0,0,0|1,0,1]=4 4292 B10R1.1 Br[Zn]Cc1ccc(I)cc1 Amb22000470 [1,1,0,0,0,0|2,0,0]=4 4293 B10R1.1 Br\C=C\c1ccc(cc1)Br Amb17609929 [1,1,0,0,0,0|1,0,1]=4 4294 B10R1.1 Brc1ccc(CCI)cc1 Amb22002540 [1,1,0,0,0,0|1,0,1]=4 4295 B10R1.1 Brc1ccc(C[Mg]Br)cc1 Amb22000536 [1,1,0,0,0,0|2,0,0]=4 4296 B10R1.1 Brc1ccc(C[Zn]Br)cc1 Amb22000432 [1,1,0,0,0,0|2,0,0]=4 4297 B10R1.1 C#CCc1ccc(F)cc1 Amb25679386 [1,1,0,0,0,0|1,0,1]=4 4298 B10R1.1 C=CCC1C=CC(=O)C=C1 Amb25718380 [1,1,0,0,0,0|1,0,1]=4 4299 B10R1.1 C=CC[n+]1ccc(N)cc1 Amb24486611 [1,1,0,0,0,0|2,0,0]=4 4300 B10R1.1 C=CCc1ccc(O)cc1 Amb18124422 [1,1,0,0,0,0|1,0,0]=3 4301 B10R1.1 C=COc1ccc(Br)cc1 Amb24366552 [1,1,0,0,0,0|2,0,0]=4 4302 B10R1.1 C=COc1ccc(I)cc1 Amb24753381 [1,1,0,0,0,0|2,0,0]=4 4303 B10R1.1 C=COc1ccc(O)cc1 Amb25134046 [1,1,0,0,0,0|2,0,0]=4 4304 B10R1.1 C=CSc1ccc(N)cc1 Amb18125327 [1,1,0,0,0,0|2,0,0]=4 4305 B10R1.1 CCCc1ccc(cc1)F Amb10845722 [1,1,0,0,0,0|1,0,1]=4 4306 B10R1.1 CN1C=CC(=CC=O)C=C1 Amb25075626 [1,1,0,0,0,0|1,0,1]=4 4307 B10R1.1 CNCc1ccc(Br)cc1 Amb17739893 [1,1,0,0,0,0|2,0,0]=4 4308 B10R1.1 CNCc1ccc(Cl)cc1 Amb17935917 [1,1,0,0,0,0|2,0,0]=4 4309 B10R1.1 CNCc1ccc(I)cc1 Amb23569028 [1,1,0,0,0,0|2,0,0]=4 4310 B10R1.1 CNCc1ccc(cc1)Br Amb1209641 [1,1,0,0,0,0|2,0,0]=4 4311 B10R1.1 CNCc1ccc(cc1)C Amb1241142 [1,1,0,0,0,0|2,0,0]=4 4312 B10R1.1 CNCc1ccc(cc1)Cl Amb1648458 [1,1,0,0,0,0|2,0,0]=4 4313 B10R1.1 CNCc1ccc(cc1)F Amb1105922 [1,1,0,0,0,0|2,0,0]=4 4314 B10R1.1 CNCc1ccc(cc1)O Amb1116278 [1,1,0,0,0,0|2,0,0]=4 4315 B10R1.1 COCc1ccc(Br)cc1 Amb18320178 [1,1,0,0,0,0|2,0,0]=4 4316 B10R1.1 COCc1ccc(Cl)cc1 Amb22497336 [1,1,0,0,0,0|2,0,0]=4 4317 B10R1.1 COCc1ccc(F)cc1 Amb24064703 [1,1,0,0,0,0|2,0,0]=4 4318 B10R1.1 COCc1ccc(I)cc1 Amb22234050 [1,1,0,0,0,0|2,0,0]=4 4319 B10R1.1 COCc1ccc(S)cc1 Amb19149369 [1,1,0,0,0,0|2,0,0]=4 4320 B10R1.1 COCc1ccc(cc1)N Amb1137167 [1,1,0,0,0,0|2,0,0]=4 4321 B10R1.1 CSCc1ccc(Br)cc1 Amb19373540 [1,1,0,0,0,0|2,0,0]=4 4322 B10R1.1 CSCc1ccc(I)cc1 Amb25799869 [1,1,0,0,0,0|2,0,0]=4 4323 B10R1.1 CSCc1ccc(N)cc1 Amb18544980 [1,1,0,0,0,0|2,0,0]=4 4324 B10R1.1 CSCc1ccc(O)cc1 Amb18644673 [1,1,0,0,0,0|2,0,0]=4 4325 B10R1.1 CSCc1ccc(cc1)C Amb16185125 [1,1,0,0,0,0|2,0,0]=4 4326 B10R1.1 C\C=C\c1ccc(Br)cc1 Amb25698766 [1,1,0,0,0,0|1,0,1]=4 4327 B10R1.1 C\C=C\c1ccc(O)cc1 Amb18124423 [1,1,0,0,0,0|1,0,1]=4 4328 B10R1.1 Cc1ccc(C=C=O)cc1 Amb24100707 [1,1,0,0,0,0|0,0,2]=4 4329 B10R1.1 Cc1ccc(CCC)cc1 Amb22227992 [1,1,0,0,0,0|1,0,1]=4 4330 B10R1.1 Cc1ccc(CCF)cc1 Amb24659769 [1,1,0,0,0,0|1,0,1]=4 4331 B10R1.1 Cc1ccc(CCI)cc1 Amb25096362 [1,1,0,0,0,0|1,0,1]=4 4332 B10R1.1 Cc1ccc(CCN)cc1 Amb19261118 [1,1,0,0,0,0|1,0,1]=4 4333 B10R1.1 Cc1ccc(CNN)cc1 Amb19890079 [1,1,0,0,0,0|2,0,0]=4 4334 B10R1.1 Cc1ccc(CNN)cc1 Amb21954052 [1,1,0,0,0,0|2,0,0]=4 4335 B10R1.1 Cc1ccc(CNO)cc1 Amb25798742 [1,1,0,0,0,0|1,0,1]=4 4336 B10R1.1 Cc1ccc(CON)cc1 Amb21929103 [1,1,0,0,0,0|2,0,0]=4 4337 B10R1.1 Cc1ccc(C[Mg]Cl)cc1 Amb19928780 [1,1,0,0,0,0|2,0,0]=4 4338 B10R1.1 Cc1ccc(C[Zn]Cl)cc1 Amb22000457 [1,1,0,0,0,0|2,0,0]=4 4339 B10R1.1 Cc1ccc(NC=O)[n]c1 Amb24072528 [1,1,0,0,0,0|2,0,0]=4 4340 B10R1.1 Cc1ccc(OC=C)cc1 Amb17674188 [1,1,0,0,0,0|2,0,0]=4 4341 B10R1.1 Cc1ccc(\C=C\Cl)cc1 Amb24652500 [1,1,0,0,0,0|1,0,1]=4 4342 B10R1.1 Cc1ccc(cc1)C[N+]#[C-] Amb1981066 [1,1,0,0,0,0|2,0,0]=4 4343 B10R1.1 Cc1ccc(cc1)N=S=O Amb22411290 [1,1,0,0,0,0|2,0,0]=4 4344 B10R1.1 Cc1ccc(cc1)NC=S Amb24427648 [1,1,0,0,0,0|1,1,0]=4 4345 B10R1.1 Cc1ccc(cc1)OC=O Amb25248584 [1,1,0,0,0,0|1,0,0]=3 4346 B10R1.1 Cc1ccc(cc1)SC=C Amb24375563 [1,1,0,0,0,0|2,0,0]=4 4347 B10R1.1 Cl\C=C\c1ccc(cc1)Cl Amb10573154 [1,1,0,0,0,0|1,0,1]=4 4348 B10R1.1 Clc1ccc(CCI)cc1 Amb25363991 [1,1,0,0,0,0|1,0,1]=4 4349 B10R1.1 Clc1ccc(C[Zn]Cl)cc1 Amb22000429 [1,1,0,0,0,0|2,0,0]=4 4350 B10R1.1 Clc1ccc(\C=C\Br)cc1 Amb25145661 [1,1,0,0,0,0|1,0,1]=4 4351 B10R1.1 Clc1ccc(cc1)C[N+]#[C-] Amb2235910 [1,1,0,0,0,0|2,0,0]=4 4352 B10R1.1 FCCc1ccc(Br)cc1 Amb25047426 [1,1,0,0,0,0|1,0,1]=4 4353 B10R1.1 Fc1ccc(C[Mg]Cl)cc1 Amb17938181 [1,1,0,0,0,0|2,0,0]=4 4354 B10R1.1 Fc1ccc(C[Zn]Cl)cc1 Amb17938179 [1,1,0,0,0,0|2,0,0]=4 4355 B10R1.1 Fc1ccc(\C=C\Br)cc1 Amb24553254 [1,1,0,0,0,0|1,0,1]=4 4356 B10R1.1 Fc1ccc(\C=C\Cl)cc1 Amb24482350 [1,1,0,0,0,0|1,0,1]=4 4357 B10R1.1 Fc1ccc(cc1)C[N+]#[C-] Amb1981065 [1,1,0,0,0,0|2,0,0]=4 4358 B10R1.1 Fc1ccc(cc1)NC=S Amb24703342 [1,1,0,0,0,0|1,1,0]=4 4359 B10R1.1 N#CCc1ccc(S)cc1 Amb24509708 [1,1,0,0,0,0|1,0,1]=4 4360 B10R1.1 N#CCc1ccc(cc1)Br Amb1130758 [1,1,0,0,0,0|1,0,1]=4 4361 B10R1.1 N#CCc1ccc(cc1)Cl Amb1883007 [1,1,0,0,0,0|1,0,1]=4 4362 B10R1.1 N#CCc1ccc(cc1)F Amb1154069 [1,1,0,0,0,0|1,0,1]=4 4363 B10R1.1 N#CCc1ccc(cc1)N Amb1215260 [1,1,0,0,0,0|1,0,1]=4 4364 B10R1.1 N#CCc1ccc(cc1)O Amb1154109 [1,1,0,0,0,0|1,0,1]=4 4365 B10R1.1 N=CNc1ccc(Cl)cc1 Amb25683127 [1,1,0,0,0,0|2,0,0]=4 4366 B10R1.1 NCCc1ccc(Cl)cc1 Amb22497649 [1,1,0,0,0,0|1,0,1]=4 4367 B10R1.1 NCCc1ccc(I)cc1 Amb19516023 [1,1,0,0,0,0|1,0,1]=4 4368 B10R1.1 NCCc1ccc(N)cc1 Amb17772211 [1,1,0,0,0,0|1,0,1]=4 4369 B10R1.1 NCCc1ccc(O)cc1 Amb17778990 [1,1,0,0,0,0|1,0,1]=4 4370 B10R1.1 NCCc1ccc(S)cc1 Amb25700837 [1,1,0,0,0,0|1,0,1]=4 4371 B10R1.1 NCCc1ccc(cc1)Br Amb10808111 [1,1,0,0,0,0|1,0,1]=4 4372 B10R1.1 NCCc1ccc(cc1)C Amb1129454 [1,1,0,0,0,0|1,0,1]=4 4373 B10R1.1 NCCc1ccc(cc1)Cl Amb1212558 [1,1,0,0,0,0|1,0,1]=4 4374 B10R1.1 NCCc1ccc(cc1)F Amb1215262 [1,1,0,0,0,0|1,0,1]=4 4375 B10R1.1 NNCc1ccc(Br)cc1 Amb19893264 [1,1,0,0,0,0|2,0,0]=4 4376 B10R1.1 NNCc1ccc(Br)cc1 Amb23439145 [1,1,0,0,0,0|2,0,0]=4 4377 B10R1.1 NNCc1ccc(Cl)cc1 Amb19890158 [1,1,0,0,0,0|2,0,0]=4 4378 B10R1.1 NNCc1ccc(Cl)cc1 Amb20668069 [1,1,0,0,0,0|2,0,0]=4 4379 B10R1.1 NNCc1ccc(Cl)cc1 Amb21954056 [1,1,0,0,0,0|2,0,0]=4 4380 B10R1.1 NNCc1ccc(F)cc1 Amb19893258 [1,1,0,0,0,0|2,0,0]=4 4381 B10R1.1 NNCc1ccc(I)cc1 Amb25794991 [1,1,0,0,0,0|2,0,0]=4 4382 B10R1.1 NNCc1ccc(cc1)Br Amb1114984 [1,1,0,0,0,0|2,0,0]=4 4383 B10R1.1 NNCc1ccc(cc1)C Amb1112560 [1,1,0,0,0,0|2,0,0]=4 4384 B10R1.1 NNCc1ccc(cc1)Cl Amb1121233 [1,1,0,0,0,0|2,0,0]=4 4385 B10R1.1 NNCc1ccc(cc1)F Amb10841872 [1,1,0,0,0,0|2,0,0]=4 4386 B10R1.1 NNCc1ccc(cc1)F Amb1112880 [1,1,0,0,0,0|2,0,0]=4 4387 B10R1.1 NOCc1ccc(Br)cc1 Amb22234858 [1,1,0,0,0,0|2,0,0]=4 4388 B10R1.1 NOCc1ccc(Cl)cc1 Amb19889791 [1,1,0,0,0,0|2,0,0]=4 4389 B10R1.1 NOCc1ccc(F)cc1 Amb19883929 [1,1,0,0,0,0|2,0,0]=4 4390 B10R1.1 NOCc1ccc(cc1)C Amb1946246 [1,1,0,0,0,0|2,0,0]=4 4391 B10R1.1 NOCc1ccc(cc1)Cl Amb10607411 [1,1,0,0,0,0|2,0,0]=4 4392 B10R1.1 NOCc1ccc(cc1)F Amb17091427 [1,1,0,0,0,0|2,0,0]=4 4393 B10R1.1 N\C=C\c1ccc(Cl)cc1 Amb24418167 [1,1,0,0,0,0|1,0,1]=4 4394 B10R1.1 Nc1ccc(CC=O)c[n]1 Amb24549097 [1,1,0,0,0,0|1,0,0]=3 4395 B10R1.1 Nc1ccc(CC=O)cc1 Amb22831156 [1,1,0,0,0,0|0,0,0]=2 4396 B10R1.1 Nc1ccc(CCBr)cc1 Amb24066884 [1,1,0,0,0,0|1,0,1]=4 4397 B10R1.1 Nc1ccc(CCCl)cc1 Amb18125908 [1,1,0,0,0,0|1,0,1]=4 4398 B10R1.1 Nc1ccc(CCF)cc1 Amb24655949 [1,1,0,0,0,0|1,0,1]=4 4399 B10R1.1 Nc1ccc(CNO)cc1 Amb25835653 [1,1,0,0,0,0|1,0,1]=4 4400 B10R1.1 Nc1ccc(C[PH2]=O)cc1 Amb25118632 [1,1,0,0,0,0|1,0,0]=3 4401 B10R1.1 Nc1ccc(cc1)N=S=O Amb25321782 [1,1,0,0,0,0|2,0,0]=4 4402 B10R1.1 Nc1ccc(cc1)ON=O Amb25147338 [1,1,0,0,0,0|2,0,0]=4 4403 B10R1.1 Nc1ccc(cc1)SC=O Amb25299329 [1,1,0,0,0,0|1,0,0]=3 4404 B10R1.1 O=C=Nc1ccc(S)cc1 Amb24477298 [1,1,0,0,0,0|1,0,1]=4 4405 B10R1.1 O=C=Nc1ccc(cc1)F Amb2092739 [1,1,0,0,0,0|1,0,1]=4 4406 B10R1.1 O=CCN1C=CC(=O)C=C1 Amb25337339 [1,1,0,0,0,0|1,0,0]=3 4407 B10R1.1 O=CCc1[n]cc(Cl)c[n]1 Amb24712674 [1,1,0,0,0,0|2,0,0]=4 4408 B10R1.1 O=CCc1ccc(Br)[n]c1 Amb24068700 [1,1,0,0,0,0|1,0,0]=3 4409 B10R1.1 O=CCc1ccc(I)cc1 Amb24079622 [1,1,0,0,0,0|0,0,0]=2 4410 B10R1.1 O=CCc1ccc(cc1)Br Amb16230450 [1,1,0,0,0,0|0,0,0]=2 4411 B10R1.1 O=CCc1ccc(cc1)Cl Amb10603161 [1,1,0,0,0,0|0,0,0]=2 4412 B10R1.1 O=CCc1ccc(cc1)F Amb16230451 [1,1,0,0,0,0|0,0,0]=2 4413 B10R1.1 O=CNc1ccc(Br)[n]c1 Amb24411713 [1,1,0,0,0,0|2,0,0]=4 4414 B10R1.1 O=CNc1ccc(Cl)[n]c1 Amb24480511 [1,1,0,0,0,0|2,0,0]=4 4415 B10R1.1 O=CNc1ccc(F)cc1 Amb20407399 [1,1,0,0,0,0|1,0,0]=3 4416 B10R1.1 O=CNc1ccc(I)c[n]1 Amb25738355 [1,1,0,0,0,0|2,0,0]=4 4417 B10R1.1 O=CNc1ccc(cc1)N Amb17334152 [1,1,0,0,0,0|1,0,0]=3 4418 B10R1.1 O=CNc1ccc(cc1)O Amb2370690 [1,1,0,0,0,0|1,0,0]=3 4419 B10R1.1 O=COc1ccc(Cl)cc1 Amb24436068 [1,1,0,0,0,0|1,0,0]=3 4420 B10R1.1 O=S=Nc1ccc(Br)cc1 Amb22411348 [1,1,0,0,0,0|2,0,0]=4 4421 B10R1.1 O=S=Nc1ccc(Cl)cc1 Amb22411317 [1,1,0,0,0,0|2,0,0]=4 4422 B10R1.1 OCCc1ccc(I)cc1 Amb19668873 [1,1,0,0,0,0|0,0,2]=4 4423 B10R1.1 OCCc1ccc(S)cc1 Amb24379931 [1,1,0,0,0,0|0,0,2]=4 4424 B10R1.1 ONCc1ccc(Br)cc1 Amb23449447 [1,1,0,0,0,0|1,0,1]=4 4425 B10R1.1 ONCc1ccc(Cl)cc1 Amb25145635 [1,1,0,0,0,0|1,0,1]=4 4426 B10R1.1 ONCc1ccc(F)cc1 Amb22157298 [1,1,0,0,0,0|1,0,1]=4 4427 B10R1.1 ONCc1ccc(I)cc1 Amb24529167 [1,1,0,0,0,0|1,0,1]=4 4428 B10R1.1 Oc1ccc(CCCl)cc1 Amb25709371 [1,1,0,0,0,0|1,0,1]=4 4429 B10R1.1 Oc1ccc(CCF)cc1 Amb25735077 [1,1,0,0,0,0|1,0,1]=4 4430 B10R1.1 Oc1ccc(CCI)cc1 Amb24094233 [1,1,0,0,0,0|1,0,1]=4 4431 B10R1.1 Oc1ccc(CCS)cc1 Amb25767004 [1,1,0,0,0,0|0,1,1]=4 4432 B10R1.1 Oc1ccc(CNO)cc1 Amb23449449 [1,1,0,0,0,0|1,0,1]=4 4433 B10R1.1 Oc1ccc(\C=C/Br)cc1 Amb25830036 [1,1,0,0,0,0|1,0,1]=4 4434 B10R1.1 Oc1ccc(cc1)N=C=O Amb18642975 [1,1,0,0,0,0|1,0,1]=4 4435 B10R1.1 Oc1ccc(cc1)N=S=O Amb24478361 [1,1,0,0,0,0|2,0,0]=4 4436 B10R1.1 Oc1ccc(cc1)OC=O Amb18643207 [1,1,0,0,0,0|1,0,0]=3 4437 B10R1.1 Oc1ccc(cc1)ON=O Amb25729156 [1,1,0,0,0,0|2,0,0]=4 4438 B10R1.1 S=CNc1ccc(Br)cc1 Amb24453374 [1,1,0,0,0,0|1,1,0]=4 4439 B10R1.1 S=CNc1ccc(Cl)cc1 Amb25040558 [1,1,0,0,0,0|1,1,0]=4 4440 B10R1.1 SCCc1ccc(cc1)Br Amb17404679 [1,1,0,0,0,0|0,1,1]=4 4441 B10R1.1 SCCc1ccc(cc1)C Amb16183304 [1,1,0,0,0,0|0,1,1]=4 4442 B10R1.1 SCCc1ccc(cc1)Cl Amb17400376 [1,1,0,0,0,0|0,1,1]=4 4443 B10R1.1 SCCc1ccc(cc1)F Amb17400005 [1,1,0,0,0,0|0,1,1]=4 4444 B10R1.1 Sc1ccc(CCBr)cc1 Amb24428628 [1,1,0,0,0,0|1,0,1]=4 4445 B10R1.1 Sc1ccc(CCCl)cc1 Amb24482361 [1,1,0,0,0,0|1,0,1]=4 4446 B10R1.1 [NH3+]OCc1ccc(cc1)Cl Amb2427236 [1,1,0,0,0,0|2,0,0]=4 4447 B10R1.1 [NH3+]OCc1ccc(cc1)F Amb2420803 [1,1,0,0,0,0|2,0,0]=4 4448 B10R1.4 Bc1ccccc1CCN Amb24629754 [1,1,0,0,0,0|1,0,1]=4 4449 B10R1.4 BrCCc1ccccc1I Amb25742518 [1,1,0,0,0,0|1,0,1]=4 4450 B10R1.4 Br\C=C\c1ccccc1Br Amb17609930 [1,1,0,0,0,0|1,0,1]=4 4451 B10R1.4 Brc1ccccc1CCBr Amb19515770 [1,1,0,0,0,0|1,0,1]=4 4452 B10R1.4 Brc1ccccc1CCI Amb25255595 [1,1,0,0,0,0|1,0,1]=4 4453 B10R1.4 Brc1ccccc1C[Mg]Br Amb22000538 [1,1,0,0,0,0|2,0,0]=4 4454 B10R1.4 Brc1ccccc1C[Zn]Br Amb22000430 [1,1,0,0,0,0|2,0,0]=4 4455 B10R1.4 C#CCc1ccccc1O Amb24478360 [1,1,0,0,0,0|1,0,1]=4 4456 B10R1.4 C=CCC1=CC=CNC1=O Amb24479088 [1,1,0,0,0,0|2,0,0]=4 4457 B10R1.4 C=CCC1=COC=CC1=O Amb22749954 [1,1,0,0,0,0|2,0,0]=4 4458 B10R1.4 C=CCN1C=CC=CC1=O Amb22364461 [1,1,0,0,0,0|2,0,0]=4 4459 B10R1.4 C=CCN1C=CC=CC1=O Amb22730630 [1,1,0,0,0,0|2,0,0]=4 4460 B10R1.4 C=CCN1C=CC=CC1=S Amb24365325 [1,1,0,0,0,0|2,0,0]=4 4461 B10R1.4 C=CC[n+]1ccccc1Br Amb25854845 [1,1,0,0,0,0|2,0,0]=4 4462 B10R1.4 C=CC[n+]1ccccc1N Amb1394989 [1,1,0,0,0,0|2,0,0]=4 4463 B10R1.4 C=CCc1[n]cccc1O Amb20248276 [1,1,0,0,0,0|2,0,0]=4 4464 B10R1.4 C=CCc1c[n]ccc1Br Amb25167378 [1,1,0,0,0,0|2,0,0]=4 4465 B10R1.4 C=CCc1cc[n]cc1F Amb24524528 [1,1,0,0,0,0|2,0,0]=4 4466 B10R1.4 C=CCc1cccc[n+]1[O-] Amb24433371 [1,1,0,0,0,0|2,0,0]=4 4467 B10R1.4 C=CCc1ccccc1N Amb18642928 [1,1,0,0,0,0|1,0,0]=3 4468 B10R1.4 C=CCc1ccccc1O Amb1971446 [1,1,0,0,0,0|1,0,0]=3 4469 B10R1.4 C=COc1ccccc1Br Amb25095432 [1,1,0,0,0,0|2,0,0]=4 4470 B10R1.4 C=COc1ccccc1N Amb18124449 [1,1,0,0,0,0|2,0,0]=4 4471 B10R1.4 C=COc1ccccc1O Amb18643057 [1,1,0,0,0,0|2,0,0]=4 4472 B10R1.4 C=c1ccccc1=C=C=O Amb24068717 [1,1,0,0,0,0|0,0,2]=4 4473 B10R1.4 CCCc1ccccc1I Amb20622716 [1,1,0,0,0,0|1,0,1]=4 4474 B10R1.4 CNCc1ccccc1Br Amb1210073 [1,1,0,0,0,0|2,0,0]=4 4475 B10R1.4 CNCc1ccccc1C Amb1648007 [1,1,0,0,0,0|2,0,0]=4 4476 B10R1.4 CNCc1ccccc1Cl Amb1694838 [1,1,0,0,0,0|2,0,0]=4 4477 B10R1.4 CNCc1ccccc1F Amb10609411 [1,1,0,0,0,0|2,0,0]=4 4478 B10R1.4 CNCc1ccccc1F Amb1675335 [1,1,0,0,0,0|2,0,0]=4 4479 B10R1.4 CNCc1ccccc1I Amb21861741 [1,1,0,0,0,0|2,0,0]=4 4480 B10R1.4 CNCc1ccccc1O Amb1113119 [1,1,0,0,0,0|2,0,0]=4 4481 B10R1.4 CNCc1ccccc1O Amb19930187 [1,1,0,0,0,0|2,0,0]=4 4482 B10R1.4 COCc1ccccc1I Amb19373361 [1,1,0,0,0,0|2,0,0]=4 4483 B10R1.4 COCc1ccccc1O Amb22751673 [1,1,0,0,0,0|2,0,0]=4 4484 B10R1.4 CSCc1ccccc1N Amb18951025 [1,1,0,0,0,0|2,0,0]=4 4485 B10R1.4 CSCc1ccccc1O Amb18125792 [1,1,0,0,0,0|2,0,0]=4 4486 B10R1.4 C[n]1ccccc1=NC=O Amb24072921 [1,1,0,0,0,0|2,0,0]=4 4487 B10R1.4 C\C=C/c1ccccc1O Amb24422361 [1,1,0,0,0,0|1,0,1]=4 4488 B10R1.4 C\C=C\c1ccccc1Cl Amb22054732 [1,1,0,0,0,0|1,0,1]=4 4489 B10R1.4 C\C=C\c1ccccc1N Amb18642929 [1,1,0,0,0,0|1,0,1]=4 4490 B10R1.4 C\C=N\c1ccccc1N Amb24715815 [1,1,0,0,0,0|2,0,0]=4 4491 B10R1.4 C\C=N\c1ccccc1O Amb25296771 [1,1,0,0,0,0|2,0,0]=4 4492 B10R1.4 Cc1[n]cccc1NC=O Amb24072042 [1,1,0,0,0,0|2,0,0]=4 4493 B10R1.4 Cc1c[n]ccc1CC=O Amb25368595 [1,1,0,0,0,0|1,0,0]=3 4494 B10R1.4 Cc1c[n]ccc1NC=O Amb24072215 [1,1,0,0,0,0|2,0,0]=4 4495 B10R1.4 Cc1ccccc1CCC Amb22227985 [1,1,0,0,0,0|1,0,1]=4 4496 B10R1.4 Cc1ccccc1CCN Amb20622598 [1,1,0,0,0,0|1,0,1]=4 4497 B10R1.4 Cc1ccccc1CNN Amb21954057 [1,1,0,0,0,0|2,0,0]=4 4498 B10R1.4 Cc1ccccc1CNO Amb25343987 [1,1,0,0,0,0|1,0,1]=4 4499 B10R1.4 Cc1ccccc1CSC Amb24370548 [1,1,0,0,0,0|2,0,0]=4 4500 B10R1.4 Cc1ccccc1C[Mg]Cl Amb22000539 [1,1,0,0,0,0|2,0,0]=4 4501 B10R1.4 Cc1ccccc1C[Zn]Cl Amb22000455 [1,1,0,0,0,0|2,0,0]=4 4502 B10R1.4 Cc1ccccc1N=S=O Amb22411326 [1,1,0,0,0,0|2,0,0]=4 4503 B10R1.4 Cc1ccccc1OC=C Amb17674186 [1,1,0,0,0,0|2,0,0]=4 4504 B10R1.4 ClCCc1ccccc1Br Amb24644893 [1,1,0,0,0,0|1,0,1]=4 4505 B10R1.4 ClCCc1ccccc1I Amb24742826 [1,1,0,0,0,0|1,0,1]=4 4506 B10R1.4 Cl\C=C\c1ccccc1Cl Amb10572874 [1,1,0,0,0,0|1,0,1]=4 4507 B10R1.4 Clc1ccccc1CCI Amb25048390 [1,1,0,0,0,0|1,0,1]=4 4508 B10R1.4 Clc1ccccc1C[Mg]Cl Amb19928783 [1,1,0,0,0,0|2,0,0]=4 4509 B10R1.4 Clc1ccccc1C[Zn]Cl Amb22000427 [1,1,0,0,0,0|2,0,0]=4 4510 B10R1.4 Clc1ccccc1\C=C\Br Amb24449703 [1,1,0,0,0,0|1,0,1]=4 4511 B10R1.4 FCCc1ccccc1Br Amb24754179 [1,1,0,0,0,0|1,0,1]=4 4512 B10R1.4 FCCc1ccccc1I Amb22739042 [1,1,0,0,0,0|1,0,1]=4 4513 B10R1.4 Fc1ccccc1C[Zn]Cl Amb17672035 [1,1,0,0,0,0|2,0,0]=4 4514 B10R1.4 Fc1ccccc1\C=C\Br Amb25141256 [1,1,0,0,0,0|1,0,1]=4 4515 B10R1.4 N#CCc1ccccc1Br Amb1140623 [1,1,0,0,0,0|1,0,1]=4 4516 B10R1.4 N#CCc1ccccc1C Amb1651450 [1,1,0,0,0,0|1,0,1]=4 4517 B10R1.4 N#CCc1ccccc1Cl Amb1644930 [1,1,0,0,0,0|1,0,1]=4 4518 B10R1.4 N#CCc1ccccc1N Amb17607888 [1,1,0,0,0,0|1,0,1]=4 4519 B10R1.4 N#CCc1ccccc1O Amb18642921 [1,1,0,0,0,0|1,0,1]=4 4520 B10R1.4 NCCc1ccccc1Br Amb22395128 [1,1,0,0,0,0|1,0,1]=4 4521 B10R1.4 NCCc1ccccc1C Amb1212557 [1,1,0,0,0,0|1,0,1]=4 4522 B10R1.4 NCCc1ccccc1Cl Amb22490604 [1,1,0,0,0,0|1,0,1]=4 4523 B10R1.4 NCCc1ccccc1F Amb22039505 [1,1,0,0,0,0|1,0,1]=4 4524 B10R1.4 NCCc1ccccc1O Amb10609215 [1,1,0,0,0,0|1,0,1]=4 4525 B10R1.4 NCCc1ccccc1S Amb25831177 [1,1,0,0,0,0|1,0,1]=4 4526 B10R1.4 NNCc1ccccc1Br Amb1116234 [1,1,0,0,0,0|2,0,0]=4 4527 B10R1.4 NNCc1ccccc1Br Amb19893262 [1,1,0,0,0,0|2,0,0]=4 4528 B10R1.4 NNCc1ccccc1C Amb1118964 [1,1,0,0,0,0|2,0,0]=4 4529 B10R1.4 NNCc1ccccc1Cl Amb21959997 [1,1,0,0,0,0|2,0,0]=4 4530 B10R1.4 NNCc1ccccc1F Amb19893256 [1,1,0,0,0,0|2,0,0]=4 4531 B10R1.4 NNCc1ccccc1O Amb24681968 [1,1,0,0,0,0|2,0,0]=4 4532 B10R1.4 NOCc1ccccc1Br Amb17091454 [1,1,0,0,0,0|2,0,0]=4 4533 B10R1.4 NOCc1ccccc1Br Amb21929112 [1,1,0,0,0,0|2,0,0]=4 4534 B10R1.4 NOCc1ccccc1C Amb17091424 [1,1,0,0,0,0|2,0,0]=4 4535 B10R1.4 NOCc1ccccc1Cl Amb19889789 [1,1,0,0,0,0|2,0,0]=4 4536 B10R1.4 NOCc1ccccc1F Amb19894376 [1,1,0,0,0,0|2,0,0]=4 4537 B10R1.4 NOCc1ccccc1I Amb22235087 [1,1,0,0,0,0|2,0,0]=4 4538 B10R1.4 NOCc1ccccc1O Amb24502260 [1,1,0,0,0,0|2,0,0]=4 4539 B10R1.4 N\C=N\c1ccccc1O Amb18643068 [1,1,0,0,0,0|2,0,0]=4 4540 B10R1.4 Nc1[n]c[n]cc1CC=O Amb24596788 [1,1,0,0,0,0|2,0,0]=4 4541 B10R1.4 Nc1cc[n]cc1CC=O Amb25703380 [1,1,0,0,0,0|1,0,0]=3 4542 B10R1.4 Nc1ccc[n]c1NC=O Amb24072116 [1,1,0,0,0,0|2,0,0]=4 4543 B10R1.4 Nc1ccccc1C=C=O Amb25331219 [1,1,0,0,0,0|0,0,2]=4 4544 B10R1.4 Nc1ccccc1CCBr Amb24079731 [1,1,0,0,0,0|1,0,1]=4 4545 B10R1.4 Nc1ccccc1CCBr Amb24573051 [1,1,0,0,0,0|1,0,1]=4 4546 B10R1.4 Nc1ccccc1CCF Amb24554505 [1,1,0,0,0,0|1,0,1]=4 4547 B10R1.4 Nc1ccccc1CCN Amb20670599 [1,1,0,0,0,0|1,0,1]=4 4548 B10R1.4 Nc1ccccc1CCP Amb25808564 [1,1,0,0,0,0|1,0,1]=4 4549 B10R1.4 Nc1ccccc1CCS Amb25114690 [1,1,0,0,0,0|0,1,1]=4 4550 B10R1.4 Nc1ccccc1CNN Amb25294794 [1,1,0,0,0,0|2,0,0]=4 4551 B10R1.4 Nc1ccccc1CNO Amb25345206 [1,1,0,0,0,0|1,0,1]=4 4552 B10R1.4 Nc1ccccc1N=C=O Amb24477326 [1,1,0,0,0,0|1,0,1]=4 4553 B10R1.4 Nc1ccccc1N=S=O Amb24482342 [1,1,0,0,0,0|2,0,0]=4 4554 B10R1.4 Nc1ccccc1NC=O Amb18643067 [1,1,0,0,0,0|1,0,0]=3 4555 B10R1.4 Nc1ccccc1NC=S Amb24390820 [1,1,0,0,0,0|1,1,0]=4 4556 B10R1.4 Nc1ccccc1\C=C\Br Amb25109193 [1,1,0,0,0,0|1,0,1]=4 4557 B10R1.4 O=CCN1C=CC=CC1=O Amb24059958 [1,1,0,0,0,0|1,0,0]=3 4558 B10R1.4 O=CCN1C=CC=CC1=S Amb24059961 [1,1,0,0,0,0|1,0,0]=3 4559 B10R1.4 O=CCN1C=CC=NC1=O Amb25123496 [1,1,0,0,0,0|2,0,0]=4 4560 B10R1.4 O=CCN1C=NC=CC1=O Amb25205968 [1,1,0,0,0,0|2,0,0]=4 4561 B10R1.4 O=CCc1cc[n]cc1Cl Amb25250526 [1,1,0,0,0,0|1,0,0]=3 4562 B10R1.4 O=CCc1cc[n]cc1F Amb24553979 [1,1,0,0,0,0|1,0,0]=3 4563 B10R1.4 O=CCc1ccc[n]c1Br Amb24746150 [1,1,0,0,0,0|1,0,0]=3 4564 B10R1.4 O=CCc1ccc[n]c1Cl Amb25768390 [1,1,0,0,0,0|1,0,0]=3 4565 B10R1.4 O=CCc1ccccc1Br Amb18634182 [1,1,0,0,0,0|0,0,0]=2 4566 B10R1.4 O=CCc1ccccc1C Amb10844840 [1,1,0,0,0,0|0,0,0]=2 4567 B10R1.4 O=CCc1ccccc1Cl Amb16230448 [1,1,0,0,0,0|0,0,0]=2 4568 B10R1.4 O=CCc1ccccc1F Amb10844839 [1,1,0,0,0,0|0,0,0]=2 4569 B10R1.4 O=CCc1ccccc1I Amb25377055 [1,1,0,0,0,0|0,0,0]=2 4570 B10R1.4 O=CNc1cc[n]cc1F Amb24679615 [1,1,0,0,0,0|2,0,0]=4 4571 B10R1.4 O=CNc1ccccc1F Amb24401130 [1,1,0,0,0,0|1,0,0]=3 4572 B10R1.4 O=COc1ccccc1O Amb17593488 [1,1,0,0,0,0|1,0,0]=3 4573 B10R1.4 O=S=Nc1ccccc1Cl Amb22411311 [1,1,0,0,0,0|2,0,0]=4 4574 B10R1.4 O=S=Nc1ccccc1F Amb22411336 [1,1,0,0,0,0|2,0,0]=4 4575 B10R1.4 O=c1[nH]cccc1NC=O Amb24072049 [1,1,0,0,0,0|2,0,0]=4 4576 B10R1.4 O=c1cc[nH]cc1NC=O Amb24072447 [1,1,0,0,0,0|2,0,0]=4 4577 B10R1.4 OCCc1ccccc1I Amb22753529 [1,1,0,0,0,0|0,0,2]=4 4578 B10R1.4 OCCc1ccccc1S Amb24672563 [1,1,0,0,0,0|0,0,2]=4 4579 B10R1.4 ONCc1ccccc1Br Amb23449448 [1,1,0,0,0,0|1,0,1]=4 4580 B10R1.4 ONCc1ccccc1Cl Amb25729506 [1,1,0,0,0,0|1,0,1]=4 4581 B10R1.4 Oc1ccccc1CCBr Amb18130684 [1,1,0,0,0,0|1,0,1]=4 4582 B10R1.4 Oc1ccccc1CCCl Amb25790019 [1,1,0,0,0,0|1,0,1]=4 4583 B10R1.4 Oc1ccccc1CCF Amb25768394 [1,1,0,0,0,0|1,0,1]=4 4584 B10R1.4 Oc1ccccc1CCI Amb25208761 [1,1,0,0,0,0|1,0,1]=4 4585 B10R1.4 Oc1ccccc1CCS Amb24362789 [1,1,0,0,0,0|0,1,1]=4 4586 B10R1.4 Oc1ccccc1CNO Amb25128279 [1,1,0,0,0,0|1,0,1]=4 4587 B10R1.4 Oc1ccccc1N=C=O Amb25110147 [1,1,0,0,0,0|1,0,1]=4 4588 B10R1.4 Oc1ccccc1\C=C/Cl Amb25774622 [1,1,0,0,0,0|1,0,1]=4 4589 B10R1.4 S=CNc1ccccc1Br Amb25803506 [1,1,0,0,0,0|1,1,0]=4 4590 B10R1.4 SCCc1ccccc1Br Amb25851259 [1,1,0,0,0,0|0,1,1]=4 4591 B10R1.4 SCCc1ccccc1C Amb17399938 [1,1,0,0,0,0|0,1,1]=4 4592 B10R1.4 SCCc1ccccc1Cl Amb17400374 [1,1,0,0,0,0|0,1,1]=4 4593 B10R1.4 SCCc1ccccc1F Amb17400004 [1,1,0,0,0,0|0,1,1]=4 4594 B10R1.4 SCCc1ccccc1I Amb24089655 [1,1,0,0,0,0|0,1,1]=4 4595 B10R1.4 [NH3+]OCc1ccccc1Br Amb2414824 [1,1,0,0,0,0|2,0,0]=4 4596 B10R1.4 [NH3+]OCc1ccccc1Cl Amb2437206 [1,1,0,0,0,0|2,0,0]=4 4597 B10R1.10 BrCCc1cc(I)ccc1 Amb25137377 [1,1,0,0,0,0|1,0,1]=4 4598 B10R1.10 Br[Zn]Cc1cccc(I)c1 Amb22000468 [1,1,0,0,0,0|2,0,0]=4 4599 B10R1.10 Brc1cc(\C=C/I)ccc1 Amb22231752 [1,1,0,0,0,0|1,0,1]=4 4600 B10R1.10 Brc1cccc(CCBr)c1 Amb18048758 [1,1,0,0,0,0|1,0,1]=4 4601 B10R1.10 Brc1cccc(C[Mg]Br)c1 Amb22000537 [1,1,0,0,0,0|2,0,0]=4 4602 B10R1.10 Brc1cccc(C[Zn]Br)c1 Amb22000431 [1,1,0,0,0,0|2,0,0]=4 4603 B10R1.10 Brc1cccc(c1)\C=C\Br Amb22831297 [1,1,0,0,0,0|1,0,1]=4 4604 B10R1.10 C=CC[n+]1cc(Br)ccc1 Amb25722840 [1,1,0,0,0,0|2,0,0]=4 4605 B10R1.10 C=CC[n+]1cc(O)ccc1 Amb25781445 [1,1,0,0,0,0|2,0,0]=4 4606 B10R1.10 C=CCc1c[n]cc(Cl)c1 Amb25137887 [1,1,0,0,0,0|2,0,0]=4 4607 B10R1.10 C=CCc1c[n]cc(F)c1 Amb25772526 [1,1,0,0,0,0|2,0,0]=4 4608 B10R1.10 C=CCc1cc[n]c(Cl)c1 Amb24101015 [1,1,0,0,0,0|2,0,0]=4 4609 B10R1.10 C=CCc1cccc(Br)[n]1 Amb25363953 [1,1,0,0,0,0|2,0,0]=4 4610 B10R1.10 C=CCc1cccc(N)c1 Amb25147344 [1,1,0,0,0,0|1,0,0]=3 4611 B10R1.10 C=CCc1cccc(O)c1 Amb22735821 [1,1,0,0,0,0|1,0,0]=3 4612 B10R1.10 C=COc1cccc(Br)c1 Amb25248086 [1,1,0,0,0,0|2,0,0]=4 4613 B10R1.10 C=COc1cccc(Cl)c1 Amb24092694 [1,1,0,0,0,0|2,0,0]=4 4614 B10R1.10 C=COc1cccc(I)c1 Amb25144604 [1,1,0,0,0,0|2,0,0]=4 4615 B10R1.10 C=COc1cccc(N)c1 Amb18124447 [1,1,0,0,0,0|2,0,0]=4 4616 B10R1.10 CCCc1cc(Br)ccc1 Amb25736130 [1,1,0,0,0,0|1,0,1]=4 4617 B10R1.10 CCCc1cc(F)ccc1 Amb22235098 [1,1,0,0,0,0|1,0,1]=4 4618 B10R1.10 CCCc1cc(N)ccc1 Amb18643014 [1,1,0,0,0,0|1,0,1]=4 4619 B10R1.10 CNCc1cccc(Br)c1 Amb17935918 [1,1,0,0,0,0|2,0,0]=4 4620 B10R1.10 CNCc1cccc(Cl)c1 Amb19958745 [1,1,0,0,0,0|2,0,0]=4 4621 B10R1.10 CNCc1cccc(I)c1 Amb23569027 [1,1,0,0,0,0|2,0,0]=4 4622 B10R1.10 CNCc1cccc(O)c1 Amb19115406 [1,1,0,0,0,0|2,0,0]=4 4623 B10R1.10 CNCc1cccc(c1)Br Amb1114712 [1,1,0,0,0,0|2,0,0]=4 4624 B10R1.10 CNCc1cccc(c1)C Amb1116082 [1,1,0,0,0,0|2,0,0]=4 4625 B10R1.10 CNCc1cccc(c1)Cl Amb1648830 [1,1,0,0,0,0|2,0,0]=4 4626 B10R1.10 CNCc1cccc(c1)F Amb1647905 [1,1,0,0,0,0|2,0,0]=4 4627 B10R1.10 CNCc1cccc(c1)O Amb1131158 [1,1,0,0,0,0|2,0,0]=4 4628 B10R1.10 COCc1cccc(Br)c1 Amb18320155 [1,1,0,0,0,0|2,0,0]=4 4629 B10R1.10 COCc1cccc(Cl)c1 Amb24092696 [1,1,0,0,0,0|2,0,0]=4 4630 B10R1.10 COCc1cccc(F)c1 Amb20241023 [1,1,0,0,0,0|2,0,0]=4 4631 B10R1.10 COCc1cccc(I)c1 Amb24478076 [1,1,0,0,0,0|2,0,0]=4 4632 B10R1.10 COCc1cccc(O)c1 Amb19301751 [1,1,0,0,0,0|2,0,0]=4 4633 B10R1.10 CSCc1cccc(Br)c1 Amb22058705 [1,1,0,0,0,0|2,0,0]=4 4634 B10R1.10 CSCc1cccc(N)c1 Amb18951026 [1,1,0,0,0,0|2,0,0]=4 4635 B10R1.10 CSCc1cccc(O)c1 Amb23443323 [1,1,0,0,0,0|2,0,0]=4 4636 B10R1.10 C\C=C\c1cccc(O)c1 Amb18124427 [1,1,0,0,0,0|1,0,1]=4 4637 B10R1.10 Cc1cc(CCCl)ccc1 Amb18181942 [1,1,0,0,0,0|1,0,1]=4 4638 B10R1.10 Cc1cc(CNN)ccc1 Amb19890111 [1,1,0,0,0,0|2,0,0]=4 4639 B10R1.10 Cc1cc(CNO)ccc1 Amb25784359 [1,1,0,0,0,0|1,0,1]=4 4640 B10R1.10 Cc1cc(C[Zn]Cl)ccc1 Amb22000456 [1,1,0,0,0,0|2,0,0]=4 4641 B10R1.10 Cc1cc(\C=C/Br)ccc1 Amb24737652 [1,1,0,0,0,0|1,0,1]=4 4642 B10R1.10 Cc1cc(c[n]c1)NC=O Amb24643577 [1,1,0,0,0,0|2,0,0]=4 4643 B10R1.10 Cc1cc(ccc1)N=S=O Amb22411325 [1,1,0,0,0,0|2,0,0]=4 4644 B10R1.10 Cc1cc(ccc1)NC=N Amb24548031 [1,1,0,0,0,0|2,0,0]=4 4645 B10R1.10 Cc1cccc(CCC)c1 Amb22232362 [1,1,0,0,0,0|1,0,1]=4 4646 B10R1.10 Cc1cccc(CSC)c1 Amb24416576 [1,1,0,0,0,0|2,0,0]=4 4647 B10R1.10 Cc1cccc(OC=C)c1 Amb17674187 [1,1,0,0,0,0|2,0,0]=4 4648 B10R1.10 ClCCc1cc(Br)ccc1 Amb24502263 [1,1,0,0,0,0|1,0,1]=4 4649 B10R1.10 Clc1cc(\C=C\Br)ccc1 Amb25262044 [1,1,0,0,0,0|1,0,1]=4 4650 B10R1.10 Clc1cccc(CCCl)c1 Amb18185798 [1,1,0,0,0,0|1,0,1]=4 4651 B10R1.10 Clc1cccc(C[Mg]Cl)c1 Amb19928782 [1,1,0,0,0,0|2,0,0]=4 4652 B10R1.10 Clc1cccc(C[Zn]Cl)c1 Amb22000428 [1,1,0,0,0,0|2,0,0]=4 4653 B10R1.10 Fc1cc(CCI)ccc1 Amb25766475 [1,1,0,0,0,0|1,0,1]=4 4654 B10R1.10 Fc1cc(\C=C\I)ccc1 Amb25049507 [1,1,0,0,0,0|1,0,1]=4 4655 B10R1.10 Fc1cc(ccc1)NC=S Amb24695430 [1,1,0,0,0,0|1,1,0]=4 4656 B10R1.10 Fc1cccc(C[Mg]Cl)c1 Amb17672020 [1,1,0,0,0,0|2,0,0]=4 4657 B10R1.10 Fc1cccc(C[Zn]Cl)c1 Amb17938200 [1,1,0,0,0,0|2,0,0]=4 4658 B10R1.10 N#CCc1cccc(c1)Br Amb1138679 [1,1,0,0,0,0|1,0,1]=4 4659 B10R1.10 N#CCc1cccc(c1)Cl Amb1651451 [1,1,0,0,0,0|1,0,1]=4 4660 B10R1.10 N#CCc1cccc(c1)N Amb1215231 [1,1,0,0,0,0|1,0,1]=4 4661 B10R1.10 NCCc1cc(Br)ccc1 Amb22900947 [1,1,0,0,0,0|1,0,1]=4 4662 B10R1.10 NCCc1cc(Cl)ccc1 Amb22490605 [1,1,0,0,0,0|1,0,1]=4 4663 B10R1.10 NCCc1cc(I)ccc1 Amb25096322 [1,1,0,0,0,0|1,0,1]=4 4664 B10R1.10 NCCc1cccc(c1)C Amb1126573 [1,1,0,0,0,0|1,0,1]=4 4665 B10R1.10 NCCc1cccc(c1)C Amb13952645 [1,1,0,0,0,0|1,0,1]=4 4666 B10R1.10 NCCc1cccc(c1)Cl Amb1212556 [1,1,0,0,0,0|1,0,1]=4 4667 B10R1.10 NCCc1cccc(c1)F Amb1216921 [1,1,0,0,0,0|1,0,1]=4 4668 B10R1.10 NNCc1cccc(Br)c1 Amb19893263 [1,1,0,0,0,0|2,0,0]=4 4669 B10R1.10 NNCc1cccc(Br)c1 Amb20667747 [1,1,0,0,0,0|2,0,0]=4 4670 B10R1.10 NNCc1cccc(F)c1 Amb19893257 [1,1,0,0,0,0|2,0,0]=4 4671 B10R1.10 NNCc1cccc(F)c1 Amb20669586 [1,1,0,0,0,0|2,0,0]=4 4672 B10R1.10 NNCc1cccc(I)c1 Amb25355316 [1,1,0,0,0,0|2,0,0]=4 4673 B10R1.10 NNCc1cccc(c1)Br Amb1119246 [1,1,0,0,0,0|2,0,0]=4 4674 B10R1.10 NNCc1cccc(c1)C Amb1116333 [1,1,0,0,0,0|2,0,0]=4 4675 B10R1.10 NNCc1cccc(c1)Cl Amb1111798 [1,1,0,0,0,0|2,0,0]=4 4676 B10R1.10 NNCc1cccc(c1)Cl Amb13949121 [1,1,0,0,0,0|2,0,0]=4 4677 B10R1.10 NNCc1cccc(c1)F Amb1121411 [1,1,0,0,0,0|2,0,0]=4 4678 B10R1.10 NOCc1cccc(Br)c1 Amb22231355 [1,1,0,0,0,0|2,0,0]=4 4679 B10R1.10 NOCc1cccc(Cl)c1 Amb19889790 [1,1,0,0,0,0|2,0,0]=4 4680 B10R1.10 NOCc1cccc(F)c1 Amb19883930 [1,1,0,0,0,0|2,0,0]=4 4681 B10R1.10 NOCc1cccc(c1)Br Amb17091429 [1,1,0,0,0,0|2,0,0]=4 4682 B10R1.10 NOCc1cccc(c1)C Amb17091425 [1,1,0,0,0,0|2,0,0]=4 4683 B10R1.10 NOCc1cccc(c1)Cl Amb17091428 [1,1,0,0,0,0|2,0,0]=4 4684 B10R1.10 NOCc1cccc(c1)F Amb17091426 [1,1,0,0,0,0|2,0,0]=4 4685 B10R1.10 Nc1cc(CC#N)ccc1 Amb21857787 [1,1,0,0,0,0|1,0,1]=4 4686 B10R1.10 Nc1cc(CC=O)cc[n]1 Amb25146413 [1,1,0,0,0,0|1,0,0]=3 4687 B10R1.10 Nc1cc(CC=O)ccc1 Amb25147333 [1,1,0,0,0,0|0,0,0]=2 4688 B10R1.10 Nc1cc(CCCl)ccc1 Amb24748802 [1,1,0,0,0,0|1,0,1]=4 4689 B10R1.10 Nc1cc(CCO)ccc1 Amb21857105 [1,1,0,0,0,0|0,0,2]=4 4690 B10R1.10 Nc1cc(CCS)ccc1 Amb22728749 [1,1,0,0,0,0|0,1,1]=4 4691 B10R1.10 Nc1cccc(CCN)c1 Amb22733355 [1,1,0,0,0,0|1,0,1]=4 4692 B10R1.10 O=C=Nc1cccc(c1)C Amb2093133 [1,1,0,0,0,0|1,0,1]=4 4693 B10R1.10 O=C=Nc1cccc(c1)F Amb2093115 [1,1,0,0,0,0|1,0,1]=4 4694 B10R1.10 O=CCc1cc(Br)cc[n]1 Amb24482134 [1,1,0,0,0,0|1,0,0]=3 4695 B10R1.10 O=CCc1cccc(Br)[n]1 Amb21858958 [1,1,0,0,0,0|1,0,0]=3 4696 B10R1.10 O=CCc1cccc(F)c1 Amb19929928 [1,1,0,0,0,0|0,0,0]=2 4697 B10R1.10 O=CCc1cccc(c1)Br Amb16230449 [1,1,0,0,0,0|0,0,0]=2 4698 B10R1.10 O=CCc1cccc(c1)C Amb16230453 [1,1,0,0,0,0|0,0,0]=2 4699 B10R1.10 O=CCc1cccc(c1)Cl Amb10844835 [1,1,0,0,0,0|0,0,0]=2 4700 B10R1.10 O=CCc1cccc(c1)O Amb17089543 [1,1,0,0,0,0|0,0,0]=2 4701 B10R1.10 O=CNc1c[n]cc(Br)c1 Amb24354748 [1,1,0,0,0,0|2,0,0]=4 4702 B10R1.10 O=CNc1c[n]cc(F)c1 Amb24475259 [1,1,0,0,0,0|2,0,0]=4 4703 B10R1.10 O=CNc1cc[n]c(Br)c1 Amb25125305 [1,1,0,0,0,0|2,0,0]=4 4704 B10R1.10 O=CNc1ccc[n+](c1)[O-] Amb10560230 [1,1,0,0,0,0|2,0,0]=4 4705 B10R1.10 O=CNc1cccc(Br)[n]1 Amb24371374 [1,1,0,0,0,0|2,0,0]=4 4706 B10R1.10 O=CNc1cccc(Br)c1 Amb22367295 [1,1,0,0,0,0|1,0,0]=3 4707 B10R1.10 O=CNc1cccc(Cl)[n]1 Amb25805864 [1,1,0,0,0,0|2,0,0]=4 4708 B10R1.10 O=CNc1cccc(F)[n]1 Amb24072627 [1,1,0,0,0,0|2,0,0]=4 4709 B10R1.10 O=CNc1cccc(F)c1 Amb25830595 [1,1,0,0,0,0|1,0,0]=3 4710 B10R1.10 O=CNc1cccc(I)c1 Amb25240204 [1,1,0,0,0,0|1,0,0]=3 4711 B10R1.10 O=S=Nc1cccc(Br)c1 Amb22411349 [1,1,0,0,0,0|2,0,0]=4 4712 B10R1.10 O=S=Nc1cccc(Cl)c1 Amb22411319 [1,1,0,0,0,0|2,0,0]=4 4713 B10R1.10 O=S=Nc1cccc(F)c1 Amb22411338 [1,1,0,0,0,0|2,0,0]=4 4714 B10R1.10 OCCc1cc(I)ccc1 Amb24524319 [1,1,0,0,0,0|0,0,2]=4 4715 B10R1.10 ONCc1cccc(Br)c1 Amb23449439 [1,1,0,0,0,0|1,0,1]=4 4716 B10R1.10 ONCc1cccc(Cl)c1 Amb25210787 [1,1,0,0,0,0|1,0,1]=4 4717 B10R1.10 Oc1cc(CCBr)ccc1 Amb18130690 [1,1,0,0,0,0|1,0,1]=4 4718 B10R1.10 Oc1cc(\C=C\Br)ccc1 Amb24518614 [1,1,0,0,0,0|1,0,1]=4 4719 B10R1.10 Oc1cc(\C=C\Cl)ccc1 Amb24686373 [1,1,0,0,0,0|1,0,1]=4 4720 B10R1.10 Oc1cc(ccc1)N=C=O Amb18642976 [1,1,0,0,0,0|1,0,1]=4 4721 B10R1.10 Oc1cc(ccc1)OC=O Amb18643208 [1,1,0,0,0,0|1,0,0]=3 4722 B10R1.10 Oc1cccc(CNO)c1 Amb24524626 [1,1,0,0,0,0|1,0,1]=4 4723 B10R1.10 SCCc1cccc(c1)Br Amb17404678 [1,1,0,0,0,0|0,1,1]=4 4724 B10R1.10 SCCc1cccc(c1)C Amb17399939 [1,1,0,0,0,0|0,1,1]=4 4725 B10R1.10 SCCc1cccc(c1)Cl Amb17400375 [1,1,0,0,0,0|0,1,1]=4 4726 B10R1.10 SCCc1cccc(c1)F Amb17400006 [1,1,0,0,0,0|0,1,1]=4 4727 B10R1.10 Sc1cc(CCCl)ccc1 Amb24627571 [1,1,0,0,0,0|1,0,1]=4 4728 B10R1.10 [NH3+]OCc1cccc(c1)Br Amb2444298 [1,1,0,0,0,0|2,0,0]=4 4729 B10R1.10 [NH3+]OCc1cccc(c1)Cl Amb2405661 [1,1,0,0,0,0|2,0,0]=4 4730 B10R1.10 [NH3+]OCc1cccc(c1)F Amb2424153 [1,1,0,0,0,0|2,0,0]=4 4731 B10R1.10 [O-][n+]1cc(CC=O)ccc1 Amb24099139 [1,1,0,0,0,0|1,0,0]=3 4732 B10R1.17 BrC=C=Cc1ccccc1 Amb17673290 [1,1,0,0,0,0|1,0,1]=4 4733 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,1,0,0,0,0|1,0,1]=4 4734 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,1,0,0,0,0|1,0,1]=4 4735 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [1,1,0,0,0,0|1,0,1]=4 4736 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [1,1,0,0,0,0|1,0,1]=4 4737 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [1,1,0,0,0,0|1,0,0]=3 4738 B10R1.17 Br\C=N/Nc1ccccc1 Amb25783866 [1,1,0,0,0,0|2,0,0]=4 4739 B10R1.17 Br\C=N\Nc1ccccc1 Amb25274154 [1,1,0,0,0,0|2,0,0]=4 4740 B10R1.17 C#CCNc1ccccc1 Amb21953889 [1,1,0,0,0,0|1,0,1]=4 4741 B10R1.17 C#C\C=C\c1ccccc1 Amb25146407 [1,1,0,0,0,0|1,0,1]=4 4742 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [1,1,0,0,0,0|1,0,1]=4 4743 B10R1.17 C=C=CCc1cccc[n]1 Amb24649907 [1,1,0,0,0,0|2,0,0]=4 4744 B10R1.17 C=C=COc1ccccc1 Amb17673264 [1,1,0,0,0,0|2,0,0]=4 4745 B10R1.17 C=CC#Cc1ccccc1 Amb25696607 [1,1,0,0,0,0|1,0,1]=4 4746 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [1,1,0,0,0,0|2,0,0]=4 4747 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [1,1,0,0,0,0|2,0,0]=4 4748 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [1,1,0,0,0,0|2,0,0]=4 4749 B10R1.17 C=CCNc1cc[n]cc1 Amb18986519 [1,1,0,0,0,0|2,0,0]=4 4750 B10R1.17 C=CCOc1cc[n]cc1 Amb25234559 [1,1,0,0,0,0|2,0,0]=4 4751 B10R1.17 C=CCSc1cc[n]cc1 Amb25725359 [1,1,0,0,0,0|2,0,0]=4 4752 B10R1.17 C=CC[Se]c1cccc[n]1 Amb24101157 [1,1,0,0,0,0|2,0,0]=4 4753 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [1,1,0,0,0,0|1,0,0]=3 4754 B10R1.17 C=CNCc1ccccc1 Amb24505107 [1,1,0,0,0,0|1,0,0]=3 4755 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,1,0,0,0,0|1,0,0]=3 4756 B10R1.17 C=NOCc1ccccc1 Amb24704253 [1,1,0,0,0,0|2,0,0]=4 4757 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [1,1,0,0,0,0|1,0,1]=4 4758 B10R1.17 CCCNc1ccccc1 Amb22284540 [1,1,0,0,0,0|1,0,1]=4 4759 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,1,0,0,0,0|1,0,1]=4 4760 B10R1.17 CNCCc1ccccc1 Amb2119452 [1,1,0,0,0,0|1,0,1]=4 4761 B10R1.17 CNNCc1ccccc1 Amb10553073 [1,1,0,0,0,0|2,0,0]=4 4762 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,1,0,0,0,0|2,0,0]=4 4763 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [1,1,0,0,0,0|2,0,0]=4 4764 B10R1.17 COCNc1ccccc1 Amb10565397 [1,1,0,0,0,0|2,0,0]=4 4765 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,1,0,0,0,0|0,0,2]=4 4766 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,1,0,0,0,0|2,0,0]=4 4767 B10R1.17 CSCSc1ccccc1 Amb25162526 [1,1,0,0,0,0|2,0,0]=4 4768 B10R1.17 CSSCc1ccccc1 Amb22230274 [1,1,0,0,0,0|1,1,0]=4 4769 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [1,1,0,0,0,0|2,0,0]=4 4770 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [1,1,0,0,0,0|1,0,1]=4 4771 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,1,0,0,0,0|1,0,1]=4 4772 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [1,1,0,0,0,0|2,0,0]=4 4773 B10R1.17 ClC=C=Cc1ccccc1 Amb17670635 [1,1,0,0,0,0|1,0,1]=4 4774 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [1,1,0,0,0,0|1,0,0]=3 4775 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,1,0,0,0,0|1,0,1]=4 4776 B10R1.17 ClCCPc1ccccc1 Amb24390336 [1,1,0,0,0,0|1,0,1]=4 4777 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,1,0,0,0,0|1,0,1]=4 4778 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [1,1,0,0,0,0|1,0,1]=4 4779 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [1,1,0,0,0,0|1,0,1]=4 4780 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [1,1,0,0,0,0|2,0,0]=4 4781 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [1,1,0,0,0,0|2,0,0]=4 4782 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [1,1,0,0,0,0|1,0,0]=3 4783 B10R1.17 FCCCc1ccccc1 Amb25737014 [1,1,0,0,0,0|1,0,1]=4 4784 B10R1.17 FCCOc1ccccc1 Amb25350055 [1,1,0,0,0,0|1,0,1]=4 4785 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,1,0,0,0,0|1,0,1]=4 4786 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,1,0,0,0,0|1,0,1]=4 4787 B10R1.17 N#CCNc1ccccc1 Amb1651088 [1,1,0,0,0,0|1,0,1]=4 4788 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [1,1,0,0,0,0|1,0,1]=4 4789 B10R1.17 N#C\C=C\c1ccccc1 Amb1678044 [1,1,0,0,0,0|1,0,1]=4 4790 B10R1.17 N=COCc1ccccc1 Amb22269902 [1,1,0,0,0,0|1,0,0]=3 4791 B10R1.17 N=COCc1ccccc1 Amb24652885 [1,1,0,0,0,0|1,0,0]=3 4792 B10R1.17 NCCCc1ccccc1 Amb22490482 [1,1,0,0,0,0|1,0,1]=4 4793 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,1,0,0,0,0|1,0,1]=4 4794 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,1,0,0,0,0|1,0,1]=4 4795 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,1,0,0,0,0|1,0,1]=4 4796 B10R1.17 NCCPc1ccccc1 Amb24482461 [1,1,0,0,0,0|1,0,1]=4 4797 B10R1.17 NC\C=C/c1ccccc1 Amb24746209 [1,1,0,0,0,0|1,0,1]=4 4798 B10R1.17 NC\C=C\c1ccccc1 Amb16187112 [1,1,0,0,0,0|1,0,1]=4 4799 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,1,0,0,0,0|1,0,1]=4 4800 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,1,0,0,0,0|1,0,1]=4 4801 B10R1.17 O=C=C\C=C/1\C=CC=CN1 Amb25689817 [1,1,0,0,0,0|1,0,1]=4 4802 B10R1.17 O=C=NCc1cccnc1 Amb17090261 [1,1,0,0,0,0|1,0,1]=4 4803 B10R1.17 O=C=NCc1ccncc1 Amb17090262 [1,1,0,0,0,0|1,0,1]=4 4804 B10R1.17 O=CCCc1[n]ccc[n]1 Amb24056162 [1,1,0,0,0,0|2,0,0]=4 4805 B10R1.17 O=CCCc1c[n]c[n]c1 Amb24657168 [1,1,0,0,0,0|2,0,0]=4 4806 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,1,0,0,0,0|1,0,0]=3 4807 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,1,0,0,0,0|1,0,0]=3 4808 B10R1.17 O=CCNc1cccc[n]1 Amb24100487 [1,1,0,0,0,0|1,0,0]=3 4809 B10R1.17 O=CCNc1ccccc1 Amb24566865 [1,1,0,0,0,0|0,0,0]=2 4810 B10R1.17 O=CCOc1c[n]c[n]c1 Amb24083667 [1,1,0,0,0,0|2,0,0]=4 4811 B10R1.17 O=CCOc1c[n]ccc1 Amb24068437 [1,1,0,0,0,0|1,0,0]=3 4812 B10R1.17 O=CCOc1cc[n]c[n]1 Amb24478315 [1,1,0,0,0,0|2,0,0]=4 4813 B10R1.17 O=CCOc1cc[n]cc1 Amb24068570 [1,1,0,0,0,0|1,0,0]=3 4814 B10R1.17 O=CCSc1[n]ccc[n]1 Amb18799502 [1,1,0,0,0,0|2,0,0]=4 4815 B10R1.17 O=CCSc1c[n]cc[n]1 Amb25261998 [1,1,0,0,0,0|2,0,0]=4 4816 B10R1.17 O=CCSc1cc[n]c[n]1 Amb25825832 [1,1,0,0,0,0|2,0,0]=4 4817 B10R1.17 O=CCSc1cc[n]cc1 Amb24475471 [1,1,0,0,0,0|1,0,0]=3 4818 B10R1.17 O=CCSc1cccc[n]1 Amb18799459 [1,1,0,0,0,0|1,0,0]=3 4819 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,1,0,0,0,0|0,0,0]=2 4820 B10R1.17 O=CNCc1c[n]cc[n]1 Amb24478911 [1,1,0,0,0,0|2,0,0]=4 4821 B10R1.17 O=CNCc1cc[n]c[n]1 Amb24072457 [1,1,0,0,0,0|2,0,0]=4 4822 B10R1.17 O=CNCc1ccc[n][n]1 Amb25696123 [1,1,0,0,0,0|2,0,0]=4 4823 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [1,1,0,0,0,0|1,0,0]=3 4824 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,1,0,0,0,0|0,0,0]=2 4825 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [1,1,0,0,0,0|0,0,1]=3 4826 B10R1.17 O=C\C=C\c1cc[n]cc1 Amb24325387 [1,1,0,0,0,0|1,0,1]=4 4827 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [1,1,0,0,0,0|1,0,1]=4 4828 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [1,1,0,0,0,0|1,0,1]=4 4829 B10R1.17 O=C\C=C\c1ccncc1 Amb17334137 [1,1,0,0,0,0|1,0,1]=4 4830 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [1,1,0,0,0,0|0,0,1]=3 4831 B10R1.17 O=NC#Cc1ccccc1 Amb24068843 [1,1,0,0,0,0|0,0,2]=4 4832 B10R1.17 OCCNc1ccccc1 Amb24065196 [1,1,0,0,0,0|0,0,2]=4 4833 B10R1.17 OCCNc1ccccc1 Amb24065197 [1,1,0,0,0,0|0,0,2]=4 4834 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,1,0,0,0,0|0,0,2]=4 4835 B10R1.17 OCNCc1ccccc1 Amb24756521 [1,1,0,0,0,0|0,0,2]=4 4836 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,1,0,0,0,0|0,0,2]=4 4837 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [1,1,0,0,0,0|1,0,1]=4 4838 B10R1.17 ONCCc1ccccc1 Amb24117032 [1,1,0,0,0,0|0,0,2]=4 4839 B10R1.17 S=C=CNc1ccccc1 Amb25728146 [1,1,0,0,0,0|1,1,0]=4 4840 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,1,0,0,0,0|0,1,1]=4 4841 B10R1.17 SCCNc1ccccc1 Amb24065195 [1,1,0,0,0,0|0,1,1]=4 4842 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,1,0,0,0,0|0,1,1]=4 4843 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,1,0,0,0,0|1,0,1]=4 4844 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [1,1,0,0,0,0|2,0,0]=4 4845 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,1,0,0,0,0|1,0,1]=4 4846 B10R1.18 BrC(Br)=Cc1ccccc1 Amb17843371 [1,1,0,0,0,0|1,0,1]=4 4847 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [1,1,0,0,0,0|2,0,0]=4 4848 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [1,1,0,0,0,0|2,0,0]=4 4849 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [1,1,0,0,0,0|1,0,1]=4 4850 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,1,0,0,0,0|2,0,0]=4 4851 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,1,0,0,0,0|2,0,0]=4 4852 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,1,0,0,0,0|2,0,0]=4 4853 B10R1.18 CC(=O)CN1C=COC=C1 Amb25100926 [1,1,0,0,0,0|2,0,0]=4 4854 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,1,0,0,0,0|1,0,0]=3 4855 B10R1.18 CC(=O)Cc1[n]ccc[n]1 Amb21864927 [1,1,0,0,0,0|2,0,0]=4 4856 B10R1.18 CC(=O)Cc1c[n]c[n]c1 Amb25328576 [1,1,0,0,0,0|2,0,0]=4 4857 B10R1.18 CC(=O)Cc1cc[n][n]c1 Amb22008576 [1,1,0,0,0,0|2,0,0]=4 4858 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,1,0,0,0,0|1,0,0]=3 4859 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,1,0,0,0,0|1,0,0]=3 4860 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,1,0,0,0,0|1,0,0]=3 4861 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,1,0,0,0,0|1,0,0]=3 4862 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [1,1,0,0,0,0|2,0,0]=4 4863 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,1,0,0,0,0|1,0,0]=3 4864 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [1,1,0,0,0,0|2,0,0]=4 4865 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [1,1,0,0,0,0|2,0,0]=4 4866 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [1,1,0,0,0,0|2,0,0]=4 4867 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [1,1,0,0,0,0|2,0,0]=4 4868 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [1,1,0,0,0,0|2,0,0]=4 4869 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,1,0,0,0,0|1,0,0]=3 4870 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [1,1,0,0,0,0|2,0,0]=4 4871 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,1,0,0,0,0|1,0,0]=3 4872 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,1,0,0,0,0|1,0,0]=3 4873 B10R1.18 CC(=O)\C=C\1/C=CC=CS1 Amb24610243 [1,1,0,0,0,0|1,0,1]=4 4874 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,1,0,0,0,0|1,0,1]=4 4875 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,1,0,0,0,0|1,0,1]=4 4876 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,1,0,0,0,0|1,0,1]=4 4877 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,1,0,0,0,0|2,0,0]=4 4878 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,1,0,0,0,0|1,0,1]=4 4879 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,1,0,0,0,0|1,0,1]=4 4880 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,1,0,0,0,0|0,1,1]=4 4881 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,1,0,0,0,0|2,0,0]=4 4882 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,1,0,0,0,0|1,0,0]=3 4883 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,1,0,0,0,0|1,0,0]=3 4884 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,1,0,0,0,0|0,0,2]=4 4885 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,1,0,0,0,0|1,0,1]=4 4886 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,1,0,0,0,0|1,0,1]=4 4887 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,1,0,0,0,0|0,0,2]=4 4888 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,1,0,0,0,0|1,0,1]=4 4889 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,1,0,0,0,0|1,1,0]=4 4890 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,1,0,0,0,0|1,1,0]=4 4891 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,1,0,0,0,0|0,0,2]=4 4892 B10R1.18 ClB(Cl)Cc1ccccc1 Amb25832795 [1,1,0,0,0,0|2,0,0]=4 4893 B10R1.18 ClC(Cl)=Nc1ccccc1 Amb22336308 [1,1,0,0,0,0|2,0,0]=4 4894 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [1,1,0,0,0,0|1,0,1]=4 4895 B10R1.18 ClP(Cl)Cc1ccccc1 Amb25838123 [1,1,0,0,0,0|2,0,0]=4 4896 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [1,1,0,0,0,0|1,0,1]=4 4897 B10R1.18 F\C(\Br)=C\c1ccccc1 Amb24053589 [1,1,0,0,0,0|1,0,1]=4 4898 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [1,1,0,0,0,0|1,0,1]=4 4899 B10R1.18 NC(=N)Cc1cc[n]cc1 Amb22499359 [1,1,0,0,0,0|2,0,0]=4 4900 B10R1.18 NC(=N)Cc1ccc[n]c1 Amb19890175 [1,1,0,0,0,0|2,0,0]=4 4901 B10R1.18 NC(=N)Nc1ccccc1 Amb20249360 [1,1,0,0,0,0|2,0,0]=4 4902 B10R1.18 NC(=N)Nc1ccccc1 Amb22732584 [1,1,0,0,0,0|2,0,0]=4 4903 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,1,0,0,0,0|2,0,0]=4 4904 B10R1.18 NC(=O)C[n+]1ccccn1 Amb2228091 [1,1,0,0,0,0|2,0,0]=4 4905 B10R1.18 NC(=O)Cc1[n]ccc[n]1 Amb22277045 [1,1,0,0,0,0|2,0,0]=4 4906 B10R1.18 NC(=O)Cc1c[n]c[n]c1 Amb20092728 [1,1,0,0,0,0|2,0,0]=4 4907 B10R1.18 NC(=O)Cc1cc[n]c[n]1 Amb23440836 [1,1,0,0,0,0|2,0,0]=4 4908 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,1,0,0,0,0|1,0,0]=3 4909 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,1,0,0,0,0|0,0,0]=2 4910 B10R1.18 NC(=O)Nc1cc[n]cc1 Amb23581130 [1,1,0,0,0,0|2,0,0]=4 4911 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,1,0,0,0,0|1,0,0]=3 4912 B10R1.18 NC(=O)Nc1cccnc1 Amb1137270 [1,1,0,0,0,0|2,0,0]=4 4913 B10R1.18 NC(=O)Oc1cccc[n]1 Amb25772133 [1,1,0,0,0,0|2,0,0]=4 4914 B10R1.18 NC(=S)C[n+]1ccccc1 Amb17119656 [1,1,0,0,0,0|1,1,0]=4 4915 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,1,0,0,0,0|0,1,0]=3 4916 B10R1.18 NC(=[NH2+])Nc1ccccc1 Amb22734963 [1,1,0,0,0,0|2,0,0]=4 4917 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [1,1,0,0,0,0|0,0,2]=4 4918 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [1,1,0,0,0,0|2,0,0]=4 4919 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [1,1,0,0,0,0|0,0,2]=4 4920 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [1,1,0,0,0,0|0,0,2]=4 4921 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,1,0,0,0,0|1,0,0]=3 4922 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [1,1,0,0,0,0|1,0,0]=3 4923 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [1,1,0,0,0,0|1,0,0]=3 4924 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,1,0,0,0,0|1,0,0]=3 4925 B10R1.18 O=C(Cl)Sc1cccc[n]1 Amb25273872 [1,1,0,0,0,0|2,0,0]=4 4926 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,1,0,0,0,0|1,0,0]=3 4927 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [1,1,0,0,0,0|1,0,1]=4 4928 B10R1.18 OC(=O)CC=1CC=CCC1 Amb24120619 [1,1,0,0,0,0|0,0,2]=4 4929 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,1,0,0,0,0|0,0,0]=2 4930 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,1,0,0,0,0|1,0,0]=3 4931 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,1,0,0,0,0|1,0,0]=3 4932 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,1,0,0,0,0|1,0,0]=3 4933 B10R1.18 OC(=O)Cc1c[n]cc[n]1 Amb19929342 [1,1,0,0,0,0|2,0,0]=4 4934 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,1,0,0,0,0|1,0,0]=3 4935 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,1,0,0,0,0|1,0,0]=3 4936 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,1,0,0,0,0|1,0,0]=3 4937 B10R1.18 OC(=O)Cc1cnccn1 Amb10602133 [1,1,0,0,0,0|2,0,0]=4 4938 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [1,1,0,0,0,0|2,0,0]=4 4939 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [1,1,0,0,0,0|2,0,0]=4 4940 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,1,0,0,0,0|0,0,0]=2 4941 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [1,1,0,0,0,0|1,0,1]=4 4942 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,1,0,0,0,0|0,0,1]=3 4943 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [1,1,0,0,0,0|1,0,1]=4 4944 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [1,1,0,0,0,0|0,0,2]=4 4945 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [1,1,0,0,0,0|0,0,2]=4 4946 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [1,1,0,0,0,0|2,0,0]=4 4947 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,1,0,0,0,0|1,0,0]=3 4948 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,1,0,0,0,0|2,0,0]=4 4949 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,1,0,0,0,0|0,0,0]=2 4950 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,1,0,0,0,0|0,0,0]=2 4951 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,1,0,0,0,0|0,0,0]=2 4952 B10R1.18 S=C(Cl)Cc1cc[n]cc1 Amb24401128 [1,1,0,0,0,0|1,1,0]=4 4953 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,1,0,0,0,0|0,0,0]=2 4954 B10R1.18 [2H]C([2H])=Cc1ccccc1 Amb22363280 [1,1,0,0,0,0|1,0,1]=4 4955 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [1,1,0,0,0,0|1,0,0]=3 4956 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [1,1,0,0,0,0|1,0,0]=3 4957 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [1,1,0,0,0,0|1,0,0]=3 4958 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [1,1,0,0,0,0|1,0,0]=3 4959 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22496781 [1,1,0,0,0,0|2,0,0]=4 4960 B10R1.18 [O-]C(=O)Cc1cc[n][n]c1 Amb22899129 [1,1,0,0,0,0|2,0,0]=4 4961 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22755792 [1,1,0,0,0,0|2,0,0]=4 4962 B10R1.18 [O-]C(=O)Cc1cc[n]c[n]1 Amb22899178 [1,1,0,0,0,0|2,0,0]=4 4963 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb22499484 [1,1,0,0,0,0|2,0,0]=4 4964 B10R1.18 [O-]C(=O)Cc1ccc[n][n]1 Amb23439149 [1,1,0,0,0,0|2,0,0]=4 4965 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [1,1,0,0,0,0|1,0,0]=3 4966 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [1,1,0,0,0,0|1,0,0]=3 4967 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,1,0,0,0,0|0,0,0]=2 4968 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,1,0,0,0,0|0,0,0]=2 4969 B10R1.18 [O-][N+](=O)Cc1c[n]ccc1 Amb23589279 [1,1,0,0,0,0|2,0,0]=4 4970 B10R1.18 [O-][N+](=O)Cc1cc[n]cc1 Amb23589332 [1,1,0,0,0,0|2,0,0]=4 4971 B10R1.18 [O-][N+](=O)Cc1cccc[n]1 Amb22522599 [1,1,0,0,0,0|2,0,0]=4 4972 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,1,0,0,0,0|1,0,0]=3 4973 B10R1.18 [O-][N+](=O)Nc1ccccc1 Amb17939349 [1,1,0,0,0,0|2,0,0]=4 4974 B10R1.6 CC(C)(C=C)c1ccc[nH]1 Amb24478850 [0,1,0,0,1,0|2,0,0]=4 4975 B10R1.6 CC(C)(C=O)[n]1c[n]cc1 Amb18643277 [0,1,0,0,1,0|2,0,0]=4 4976 B10R1.6 CC(C)(C=O)c1c[s]cc1 Amb24361872 [0,1,0,0,1,0|1,0,0]=3 4977 B10R1.6 CC(C)(C=O)c1ccc[s]1 Amb24742612 [0,1,0,0,1,0|1,0,0]=3 4978 B10R1.6 CC(N)(C=C)c1ccc[nH]1 Amb25027969 [0,1,0,0,1,0|2,0,0]=4 4979 B10R1.6 CC(N)(C=C)c1ccco1 Amb24479407 [0,1,0,0,1,0|2,0,0]=4 4980 B10R1.6 CC(O)(C=C)c1ccc[s]1 Amb25685687 [0,1,0,0,1,0|2,0,0]=4 4981 B10R1.6 CC(O)(C=C)c1cocc1 Amb24396922 [0,1,0,0,1,0|2,0,0]=4 4982 B10R1.6 CC(O)(C=O)c1cc[s][n]1 Amb24734353 [0,1,0,0,1,0|2,0,0]=4 4983 B10R1.6 CC(O)(C=O)c1ccc[s]1 Amb24455180 [0,1,0,0,1,0|1,0,0]=3 4984 B10R1.6 CC(O)(C=O)c1ccco1 Amb25145283 [0,1,0,0,1,0|1,0,0]=3 4985 B10R1.6 CC(O)(C=O)c1cocc1 Amb25783530 [0,1,0,0,1,0|1,0,0]=3 4986 B10R1.6 C[C@](N)(C=C)c1c[s]cc1 Amb25244516 [0,1,0,0,1,0|2,0,0]=4 4987 B10R1.6 C[C@](N)(C=C)c1ccc[nH]1 Amb25197861 [0,1,0,0,1,0|2,0,0]=4 4988 B10R1.9 C=CC(CO)c1ccc[s]1 Amb25294653 [0,1,0,0,1,0|2,0,0]=4 4989 B10R1.9 CCC(C=O)c1c[s]cc1 Amb18644681 [0,1,0,0,1,0|1,0,0]=3 4990 B10R1.9 CCC(c1cccs1)C=O Amb17138456 [0,1,0,0,1,0|1,0,0]=3 4991 B10R1.9 CNC(C=C)c1c[s]cc1 Amb25088914 [0,1,0,0,1,0|2,0,0]=4 4992 B10R1.9 COC(C=O)c1c[n]c[s]1 Amb21928027 [0,1,0,0,1,0|2,0,0]=4 4993 B10R1.9 COC(C=O)c1ccc[s]1 Amb24514731 [0,1,0,0,1,0|1,0,0]=3 4994 B10R1.9 CO[C@@H](C=O)c1ccco1 Amb25309527 [0,1,0,0,1,0|1,0,0]=3 4995 B10R1.9 C\C=C(/C=O)\c1ccco1 Amb25756160 [0,1,0,0,1,0|1,0,1]=4 4996 B10R1.9 N#CC(C=O)c1c[s]cc1 Amb24477004 [0,1,0,0,1,0|1,0,1]=4 4997 B10R1.11 CC(CC=C)[n]1cccc1 Amb25268830 [0,1,0,0,1,0|2,0,0]=4 4998 B10R1.11 CC(CC=C)c1ccc[s]1 Amb24480842 [0,1,0,0,1,0|2,0,0]=4 4999 B10R1.11 CC(CC=O)c1c[n]co1 Amb18643388 [0,1,0,0,1,0|2,0,0]=4 5000 B10R1.11 CC(CC=O)c1c[s]cc1 Amb18644679 [0,1,0,0,1,0|1,0,0]=3 5001 B10R1.11 CC(CC=O)c1ccc[s]1 Amb18644676 [0,1,0,0,1,0|1,0,0]=3 5002 B10R1.11 CC(N=C=O)c1ccc[s]1 Amb25780438 [0,1,0,0,1,0|1,0,1]=4 5003 B10R1.11 CC(N=C=O)c1ccco1 Amb25702120 [0,1,0,0,1,0|1,0,1]=4 5004 B10R1.11 CC(NC=O)c1[n]cc[s]1 Amb24073021 [0,1,0,0,1,0|2,0,0]=4 5005 B10R1.11 CC(NC=O)c1c[nH][n]c1 Amb24716681 [0,1,0,0,1,0|2,0,0]=4 5006 B10R1.11 CC(NC=O)c1ccco1 Amb24462226 [0,1,0,0,1,0|1,0,0]=3 5007 B10R1.11 CC(\C=N\O)c1ccco1 Amb24727285 [0,1,0,0,1,0|1,0,1]=4 5008 B10R1.11 C[C@@H](CC=O)c1c[s]cc1 Amb24633645 [0,1,0,0,1,0|1,0,0]=3 5009 B10R1.11 C[C@H](NC=O)c1ccc[s]1 Amb24363901 [0,1,0,0,1,0|1,0,0]=3 5010 B10R1.11 C[C@H](NC=O)c1ccco1 Amb24630915 [0,1,0,0,1,0|1,0,0]=3 5011 B10R1.11 C\C(=C/C=O)\c1cc[s]c1 Amb24478200 [0,1,0,0,1,0|1,0,1]=4 5012 B10R1.11 C\C(=C/C=O)\c1ccco1 Amb18643065 [0,1,0,0,1,0|1,0,1]=4 5013 B10R1.11 C\C(=C\C=O)\c1cc[s]c1 Amb24580334 [0,1,0,0,1,0|1,0,1]=4 5014 B10R1.11 C\C(=C\C=O)\c1ccco1 Amb24558002 [0,1,0,0,1,0|1,0,1]=4 5015 B10R1.11 C\C(=C\C=O)\c1ccoc1 Amb24471708 [0,1,0,0,1,0|1,0,1]=4 5016 B10R1.11 O=CCC(c1ccco1)C Amb17593491 [0,1,0,0,1,0|1,0,0]=3 5017 B10R1.11 OC(CC=O)c1ccc[s]1 Amb25797666 [0,1,0,0,1,0|2,0,0]=4 5018 B10R1.11 OC(CC=O)c1ccco1 Amb24478201 [0,1,0,0,1,0|2,0,0]=4 5019 B10R1.14 CC(c1ccc(s1)Br)C=O Amb17195324 [0,1,0,0,1,0|1,0,0]=3 5020 B10R1.14 CC(c1ccc(s1)Cl)C=O Amb17194493 [0,1,0,0,1,0|1,0,0]=3 5021 B10R1.14 Cc1cc(c[s]1)C(O)C=O Amb24703481 [0,1,0,0,1,0|2,0,0]=4 5022 B10R1.14 OC(C=O)c1ccc(Cl)[s]1 Amb25124397 [0,1,0,0,1,0|2,0,0]=4 5023 B10R1.23 CC(=O)C(C)c1cc[nH][n]1 Amb18832198 [0,1,0,0,1,0|2,0,0]=4 5024 B10R1.23 CC(=O)C(C)c1coc[n]1 Amb18832113 [0,1,0,0,1,0|2,0,0]=4 5025 B10R1.23 CC(=O)C(N)c1cc[nH]c1 Amb25042145 [0,1,0,0,1,0|2,0,0]=4 5026 B10R1.23 CC(=O)C(N)c1ccc[s]1 Amb25836886 [0,1,0,0,1,0|2,0,0]=4 5027 B10R1.23 CC(=O)C(O)c1cc[s]c1 Amb25146543 [0,1,0,0,1,0|2,0,0]=4 5028 B10R1.23 CC(=O)C(O)c1ccc[nH]1 Amb24465067 [0,1,0,0,1,0|2,0,0]=4 5029 B10R1.23 CC(=O)C(O)c1ccc[s]1 Amb25146757 [0,1,0,0,1,0|2,0,0]=4 5030 B10R1.23 CC(=O)C(c1cccs1)Cl Amb17477839 [0,1,0,0,1,0|2,0,0]=4 5031 B10R1.23 CC(=O)[C@@H](O)c1ccoc1 Amb24709030 [0,1,0,0,1,0|2,0,0]=4 5032 B10R1.23 CC(=O)[C@H](O)c1cc[s]c1 Amb25028160 [0,1,0,0,1,0|2,0,0]=4 5033 B10R1.23 CC(=O)[C@H](O)c1ccc[s]1 Amb25146548 [0,1,0,0,1,0|2,0,0]=4 5034 B10R1.23 CC(C(=O)Cl)[n]1c[n]cc1 Amb24511636 [0,1,0,0,1,0|2,0,0]=4 5035 B10R1.23 CC(C(=O)Cl)c1ccc[s]1 Amb24638423 [0,1,0,0,1,0|1,0,0]=3 5036 B10R1.23 CC(C(N)=O)c1ccco1 Amb25106547 [0,1,0,0,1,0|1,0,0]=3 5037 B10R1.23 CC(C(O)=O)C=1CC=CC1 Amb24480439 [0,1,0,0,1,0|0,0,1]=3 5038 B10R1.23 CC(C(O)=O)c1[nH]cc[n]1 Amb18202882 [0,1,0,0,1,0|2,0,0]=4 5039 B10R1.23 CC(C(O)=O)c1c[nH]c[n]1 Amb18202883 [0,1,0,0,1,0|2,0,0]=4 5040 B10R1.23 CC(C(O)=O)c1c[n]c[s]1 Amb23580683 [0,1,0,0,1,0|2,0,0]=4 5041 B10R1.23 CC(C(O)=O)c1cc[nH][n]1 Amb18831919 [0,1,0,0,1,0|2,0,0]=4 5042 B10R1.23 CC(C(O)=O)c1cc[nH]c1 Amb18064932 [0,1,0,0,1,0|1,0,0]=3 5043 B10R1.23 CC(C(O)=O)c1cc[n][s]1 Amb18830642 [0,1,0,0,1,0|2,0,0]=4 5044 B10R1.23 CC(C(O)=O)c1cc[s]c1 Amb18284449 [0,1,0,0,1,0|1,0,0]=3 5045 B10R1.23 CC(C(O)=O)c1ccc[nH]1 Amb18643379 [0,1,0,0,1,0|1,0,0]=3 5046 B10R1.23 CC(C(O)=O)c1coc[n]1 Amb18202773 [0,1,0,0,1,0|2,0,0]=4 5047 B10R1.23 CC(n1cccc1)C(=O)O Amb1058873 [0,1,0,0,1,0|1,0,0]=3 5048 B10R1.23 C[C@@H](C(O)=O)[n]1c[n]cc1 Amb18202909 [0,1,0,0,1,0|2,0,0]=4 5049 B10R1.23 C[C@H](C(O)=O)[n]1ccc[n]1 Amb25717004 [0,1,0,0,1,0|2,0,0]=4 5050 B10R1.23 C[C@H](C(O)=O)c1ccc[s]1 Amb24710020 [0,1,0,0,1,0|1,0,0]=3 5051 B10R1.23 C[C@H](n1cccc1)C(=O)O Amb2236277 [0,1,0,0,1,0|1,0,0]=3 5052 B10R1.23 NC(=O)C(Cl)c1cc[s]c1 Amb18185842 [0,1,0,0,1,0|2,0,0]=4 5053 B10R1.23 NC(=O)C(Cl)c1ccc[s]1 Amb18808822 [0,1,0,0,1,0|2,0,0]=4 5054 B10R1.23 NC(=O)C(N)c1c[s]cc1 Amb18949670 [0,1,0,0,1,0|2,0,0]=4 5055 B10R1.23 NC(=O)C(O)c1cc[s]c1 Amb18799781 [0,1,0,0,1,0|2,0,0]=4 5056 B10R1.23 NC(=O)C(O)c1ccc[s]1 Amb18799782 [0,1,0,0,1,0|2,0,0]=4 5057 B10R1.23 NC(=O)C(O)c1ccco1 Amb25084322 [0,1,0,0,1,0|2,0,0]=4 5058 B10R1.23 NC(=O)C(c1ccco1)N Amb17334171 [0,1,0,0,1,0|2,0,0]=4 5059 B10R1.23 NC(=O)C(c1cccs1)N Amb17334394 [0,1,0,0,1,0|2,0,0]=4 5060 B10R1.23 NC(=O)[C@@H](N)c1c[s]cc1 Amb24402944 [0,1,0,0,1,0|2,0,0]=4 5061 B10R1.23 NC(=O)[C@H](N)c1ccc[s]1 Amb25197626 [0,1,0,0,1,0|2,0,0]=4 5062 B10R1.23 NC(C(O)=O)c1cc[nH]c1 Amb18862405 [0,1,0,0,1,0|2,0,0]=4 5063 B10R1.23 NC(C(O)=O)c1ccc[nH]1 Amb18831925 [0,1,0,0,1,0|2,0,0]=4 5064 B10R1.23 N[C@@H](C(O)=O)c1cc[s]c1 Amb22750704 [0,1,0,0,1,0|2,0,0]=4 5065 B10R1.23 N[C@@H](C(O)=O)c1ccc[s]1 Amb22747193 [0,1,0,0,1,0|2,0,0]=4 5066 B10R1.23 N[C@@H](C(O)=O)c1ccco1 Amb25068121 [0,1,0,0,1,0|2,0,0]=4 5067 B10R1.23 N[C@@H](C(O)=O)c1ccoc1 Amb25684655 [0,1,0,0,1,0|2,0,0]=4 5068 B10R1.23 N[C@H](C(O)=O)c1cc[nH]c1 Amb25063304 [0,1,0,0,1,0|2,0,0]=4 5069 B10R1.23 OC(=O)C(Br)c1ccc[s]1 Amb18658431 [0,1,0,0,1,0|2,0,0]=4 5070 B10R1.23 OC(=O)C(Cl)c1cc[nH]c1 Amb18563480 [0,1,0,0,1,0|2,0,0]=4 5071 B10R1.23 OC(=O)C(F)c1ccco1 Amb25825778 [0,1,0,0,1,0|2,0,0]=4 5072 B10R1.23 OC(=O)C(O)c1c[nH]cc1 Amb18862454 [0,1,0,0,1,0|2,0,0]=4 5073 B10R1.23 OC(=O)C(O)c1c[s]cc1 Amb18952015 [0,1,0,0,1,0|2,0,0]=4 5074 B10R1.23 OC(=O)C(O)c1ccc[nH]1 Amb24480945 [0,1,0,0,1,0|2,0,0]=4 5075 B10R1.23 OC(=O)C(c1ccco1)C Amb17087431 [0,1,0,0,1,0|1,0,0]=3 5076 B10R1.23 OC(=O)C(c1cccs1)C Amb10844027 [0,1,0,0,1,0|1,0,0]=3 5077 B10R1.23 OC(=O)C(c1cccs1)Cl Amb17233234 [0,1,0,0,1,0|2,0,0]=4 5078 B10R1.23 OC(=O)C(c1cccs1)N Amb1840251 [0,1,0,0,1,0|2,0,0]=4 5079 B10R1.23 OC(=O)C(c1cccs1)O Amb17232241 [0,1,0,0,1,0|2,0,0]=4 5080 B10R1.23 OC(=O)C(c1cocc1)O Amb10810585 [0,1,0,0,1,0|2,0,0]=4 5081 B10R1.23 OC(=O)C(c1cscc1)N Amb2425141 [0,1,0,0,1,0|2,0,0]=4 5082 B10R1.23 OC(=O)C(c1nccs1)C Amb10844026 [0,1,0,0,1,0|2,0,0]=4 5083 B10R1.23 OC(=O)C(n1cccn1)C Amb1138614 [0,1,0,0,1,0|2,0,0]=4 5084 B10R1.23 OC(=O)C(n1cncc1)C Amb1133434 [0,1,0,0,1,0|2,0,0]=4 5085 B10R1.23 OC(=O)[C@@H](O)c1c[s]cc1 Amb25074325 [0,1,0,0,1,0|2,0,0]=4 5086 B10R1.23 OC(=O)[C@@H](c1cccs1)C Amb10844019 [0,1,0,0,1,0|1,0,0]=3 5087 B10R1.23 OC(=O)[C@@H](c1cscc1)C Amb10844020 [0,1,0,0,1,0|1,0,0]=3 5088 B10R1.23 OC(=O)[C@H](O)c1ccco1 Amb24445445 [0,1,0,0,1,0|2,0,0]=4 5089 B10R1.23 OC(=O)[C@H](c1cscc1)C Amb10844030 [0,1,0,0,1,0|1,0,0]=3 5090 B10R1.23 OC(=O)[C@H](c1cscc1)N Amb16232233 [0,1,0,0,1,0|2,0,0]=4 5091 B10R1.149 CC(C=O)C1CC=CC1=O Amb24624951 [0,1,0,0,1,0|0,0,2]=4 5092 B10R1.149 Cc1[s]ccc1C(C)C=O Amb25234284 [0,1,0,0,1,0|1,0,0]=3 5093 B10R1.149 Cc1[s]ccc1C(O)C=O Amb24406279 [0,1,0,0,1,0|2,0,0]=4 5094 B10R1.149 Cc1occc1C(C)C=O Amb18643241 [0,1,0,0,1,0|1,0,0]=3 5095 B10R1.149 OC(C=O)c1cc[s]c1Cl Amb25114898 [0,1,0,0,1,0|2,0,0]=4 5096 B12R1.32 C=C=CC(O)Cc1ccccc1 Amb24420844 [0,1,0,0,0,1|2,0,0]=4 5097 B12R1.32 C=C=C[C@H](O)Cc1ccccc1 Amb25158000 [0,1,0,0,0,1|2,0,0]=4 5098 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,1,0,0,0,1|2,0,0]=4 5099 B12R1.32 C=CCC(Nc1ccccn1)C Amb10554010 [0,1,0,0,0,1|2,0,0]=4 5100 B12R1.32 CC#CC(C)Nc1ccccc1 Amb25040061 [0,1,0,0,0,1|1,0,1]=4 5101 B12R1.32 CC#C[C@@H](C)Oc1ccccc1 Amb24068913 [0,1,0,0,0,1|1,0,1]=4 5102 B12R1.32 CC(CC#N)Sc1ccccc1 Amb18795942 [0,1,0,0,0,1|1,0,1]=4 5103 B12R1.32 CC(CC=C)Nc1cc[n]cc1 Amb24585041 [0,1,0,0,0,1|2,0,0]=4 5104 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,1,0,0,0,1|1,0,1]=4 5105 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,1,0,0,0,1|1,0,1]=4 5106 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,1,0,0,0,1|0,0,1]=3 5107 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,1,0,0,0,1|0,1,1]=4 5108 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [0,1,0,0,0,1|2,0,0]=4 5109 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [0,1,0,0,0,1|1,0,1]=4 5110 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [0,1,0,0,0,1|0,1,0]=3 5111 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,1,0,0,0,1|1,0,1]=4 5112 B12R1.32 CC(Oc1ccccc1)CC#N Amb17232369 [0,1,0,0,0,1|1,0,1]=4 5113 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,1,0,0,0,1|1,0,1]=4 5114 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,1,0,0,0,1|1,0,1]=4 5115 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,1,0,0,0,1|1,0,1]=4 5116 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,1,0,0,0,1|1,0,1]=4 5117 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,1,0,0,0,1|1,0,0]=3 5118 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [0,1,0,0,0,1|1,0,1]=4 5119 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,1,0,0,0,1|0,0,2]=4 5120 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,1,0,0,0,1|0,1,1]=4 5121 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,1,0,0,0,1|1,0,1]=4 5122 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,1,0,0,0,1|0,0,2]=4 5123 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [0,1,0,0,0,1|2,0,0]=4 5124 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,1,0,0,0,1|0,0,0]=2 5125 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,1,0,0,0,1|1,0,1]=4 5126 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,1,0,0,0,1|0,0,2]=4 5127 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [0,1,0,0,0,1|2,0,0]=4 5128 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [0,1,0,0,0,1|0,0,1]=3 5129 B12R1.32 C\C(=C/C=O)\Oc1ccccc1 Amb25326052 [0,1,0,0,0,1|0,0,1]=3 5130 B12R1.32 C\C(=C/C=O)\Sc1ccccc1 Amb18648150 [0,1,0,0,0,1|0,0,1]=3 5131 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [0,1,0,0,0,1|0,0,1]=3 5132 B12R1.32 C\C(=C\CC)\Nc1ccccc1 Amb25678437 [0,1,0,0,0,1|1,0,1]=4 5133 B12R1.32 C\C(=C\c1ccccc1)\N=C=O Amb25231758 [0,1,0,0,0,1|0,0,2]=4 5134 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [0,1,0,0,0,1|0,0,1]=3 5135 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [0,1,0,0,0,1|0,0,1]=3 5136 B12R1.32 C\C(\Cc1ccccc1)=C\C#N Amb24595292 [0,1,0,0,0,1|1,0,1]=4 5137 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [0,1,0,0,0,1|1,0,1]=4 5138 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,1,0,0,0,1|2,0,0]=4 5139 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,1,0,0,0,1|2,0,0]=4 5140 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,1,0,0,0,1|2,0,0]=4 5141 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,1,0,0,0,1|1,0,1]=4 5142 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [0,1,0,0,0,1|1,0,1]=4 5143 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [0,1,0,0,0,1|1,0,1]=4 5144 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [0,1,0,0,0,1|1,0,1]=4 5145 B12R1.32 O=C=NC(Cc1cccnc1)C Amb17232404 [0,1,0,0,0,1|1,0,1]=4 5146 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,1,0,0,0,1|0,0,2]=4 5147 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,1,0,0,0,1|0,0,2]=4 5148 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [0,1,0,0,0,1|1,0,1]=4 5149 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [0,1,0,0,0,1|0,0,2]=4 5150 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,1,0,0,0,1|1,0,0]=3 5151 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,1,0,0,0,1|2,0,0]=4 5152 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,1,0,0,0,1|2,0,0]=4 5153 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,1,0,0,0,1|2,0,0]=4 5154 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,1,0,0,0,1|2,0,0]=4 5155 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,1,0,0,0,1|2,0,0]=4 5156 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,1,0,0,0,1|2,0,0]=4 5157 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,1,0,0,0,1|2,0,0]=4 5158 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,1,0,0,0,1|2,0,0]=4 5159 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,1,0,0,0,1|2,0,0]=4 5160 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,1,0,0,0,1|2,0,0]=4 5161 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,1,0,0,0,1|2,0,0]=4 5162 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,1,0,0,0,1|2,0,0]=4 5163 B12R1.34 CC(=C=O)C(=O)c1ccccc1 Amb24544636 [0,1,0,0,0,1|0,0,2]=4 5164 B12R1.34 CC(C#C)C(O)c1ccccc1 Amb25145323 [0,1,0,0,0,1|1,0,1]=4 5165 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,1,0,0,0,1|0,0,0]=2 5166 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,1,0,0,0,1|1,0,1]=4 5167 B12R1.34 CC(C(C)NN)c1ccccc1 Amb24488638 [0,1,0,0,0,1|2,0,0]=4 5168 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,1,0,0,0,1|1,0,0]=3 5169 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,1,0,0,0,1|2,0,0]=4 5170 B12R1.34 CC(C=C)C(N)c1cccc[n]1 Amb25159295 [0,1,0,0,0,1|2,0,0]=4 5171 B12R1.34 CC(C=C)C(O)c1cc[n]cc1 Amb24688275 [0,1,0,0,0,1|2,0,0]=4 5172 B12R1.34 CC(C=C)C(O)c1ccc[n]c1 Amb25681403 [0,1,0,0,0,1|2,0,0]=4 5173 B12R1.34 CC(C=O)C(=O)c1cc[n]cc1 Amb24680229 [0,1,0,0,0,1|1,0,0]=3 5174 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,1,0,0,0,1|0,0,0]=2 5175 B12R1.34 CC(C=O)C(O)c1cc[n]cc1 Amb25735254 [0,1,0,0,0,1|1,0,0]=3 5176 B12R1.34 CC(C=O)C(O)c1ccc[n]c1 Amb24669013 [0,1,0,0,0,1|1,0,0]=3 5177 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,1,0,0,0,1|1,0,1]=4 5178 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,1,0,0,0,1|1,0,1]=4 5179 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,1,0,0,0,1|1,0,1]=4 5180 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,1,0,0,0,1|1,0,1]=4 5181 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,1,0,0,0,1|1,0,1]=4 5182 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,1,0,0,0,1|1,0,1]=4 5183 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,1,0,0,0,1|1,0,1]=4 5184 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,1,0,0,0,1|1,0,1]=4 5185 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,1,0,0,0,1|0,0,2]=4 5186 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,1,0,0,0,1|0,0,2]=4 5187 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,1,0,0,0,1|0,0,2]=4 5188 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [0,1,0,0,0,1|1,0,0]=3 5189 B12R1.34 CC(N=O)C(=O)c1ccccc1 Amb24545660 [0,1,0,0,0,1|1,0,0]=3 5190 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,1,0,0,0,1|2,0,0]=4 5191 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,1,0,0,0,1|2,0,0]=4 5192 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,1,0,0,0,1|2,0,0]=4 5193 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,1,0,0,0,1|2,0,0]=4 5194 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,1,0,0,0,1|1,0,1]=4 5195 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,1,0,0,0,1|2,0,0]=4 5196 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,1,0,0,0,1|2,0,0]=4 5197 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,1,0,0,0,1|2,0,0]=4 5198 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,1,0,0,0,1|2,0,0]=4 5199 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,1,0,0,0,1|2,0,0]=4 5200 B12R1.34 CC(c1cc[n]cc1)N(C)C=O Amb24425339 [0,1,0,0,0,1|2,0,0]=4 5201 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [0,1,0,0,0,1|2,0,0]=4 5202 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,1,0,0,0,1|1,0,1]=4 5203 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,1,0,0,0,1|1,0,1]=4 5204 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,1,0,0,0,1|1,0,1]=4 5205 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,1,0,0,0,1|1,0,1]=4 5206 B12R1.34 CN(C=C)C(=O)c1ccccc1 Amb24096799 [0,1,0,0,0,1|2,0,0]=4 5207 B12R1.34 CN(C=O)C(=O)c1ccccc1 Amb24096619 [0,1,0,0,0,1|1,0,0]=3 5208 B12R1.34 CN(N=O)C(O)c1ccccc1 Amb25343971 [0,1,0,0,0,1|2,0,0]=4 5209 B12R1.34 CNC(C(=O)c1ccccc1)C Amb17616803 [0,1,0,0,0,1|2,0,0]=4 5210 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,1,0,0,0,1|2,0,0]=4 5211 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,1,0,0,0,1|2,0,0]=4 5212 B12R1.34 CN[C@@H](C)C(=C)c1ccccc1 Amb24758988 [0,1,0,0,0,1|2,0,0]=4 5213 B12R1.34 CN[C@@H](C)C(=O)c1ccccc1 Amb25312230 [0,1,0,0,0,1|2,0,0]=4 5214 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,1,0,0,0,1|2,0,0]=4 5215 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,1,0,0,0,1|2,0,0]=4 5216 B12R1.34 CN[C@H](C)C(=C)c1ccccc1 Amb24697574 [0,1,0,0,0,1|2,0,0]=4 5217 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,1,0,0,0,1|2,0,0]=4 5218 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,1,0,0,0,1|2,0,0]=4 5219 B12R1.34 CO[C@@H](C)C(=O)c1ccccc1 Amb25116501 [0,1,0,0,0,1|2,0,0]=4 5220 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,1|2,0,0]=4 5221 B12R1.34 C[C@@H](C=C)C(=O)c1ccccc1 Amb24621322 [0,1,0,0,0,1|1,0,0]=3 5222 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,1,0,0,0,1|1,0,0]=3 5223 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,1,0,0,0,1|1,0,0]=3 5224 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,1,0,0,0,1|1,0,0]=3 5225 B12R1.34 C[C@@H](C=C)[C@H](O)c1cccc[n]1 Amb25306439 [0,1,0,0,0,1|2,0,0]=4 5226 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,1,0,0,0,1|1,0,0]=3 5227 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,1,0,0,0,1|0,0,0]=2 5228 B12R1.34 C[C@@H](C=O)[C@@H](O)c1ccc[n]c1 Amb25767826 [0,1,0,0,0,1|1,0,0]=3 5229 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,1,0,0,0,1|0,0,0]=2 5230 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,1,0,0,0,1|1,0,1]=4 5231 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,1,0,0,0,1|1,0,1]=4 5232 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,1,0,0,0,1|0,0,2]=4 5233 B12R1.34 C[C@@H](CO)S(=O)c1ccccc1 Amb24733124 [0,1,0,0,0,1|0,0,2]=4 5234 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,1,0,0,0,1|0,0,2]=4 5235 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,1,0,0,0,1|0,0,2]=4 5236 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,1,0,0,0,1|0,0,2]=4 5237 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,1,0,0,0,1|0,0,2]=4 5238 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,1,0,0,0,1|2,0,0]=4 5239 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,1,0,0,0,1|2,0,0]=4 5240 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,1,0,0,0,1|2,0,0]=4 5241 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,1,0,0,0,1|2,0,0]=4 5242 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,1,0,0,0,1|2,0,0]=4 5243 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,1,0,0,0,1|2,0,0]=4 5244 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,1,0,0,0,1|2,0,0]=4 5245 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,1,0,0,0,1|2,0,0]=4 5246 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,1,0,0,0,1|2,0,0]=4 5247 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,1,0,0,0,1|1,0,0]=3 5248 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,1,0,0,0,1|1,0,0]=3 5249 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [0,1,0,0,0,1|0,0,2]=4 5250 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,1,0,0,0,1|1,0,0]=3 5251 B12R1.34 C[C@H](C=C)[C@@H](O)c1cc[n]cc1 Amb24576652 [0,1,0,0,0,1|2,0,0]=4 5252 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,1,0,0,0,1|1,0,0]=3 5253 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,1,0,0,0,1|0,0,0]=2 5254 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,1,0,0,0,1|1,0,1]=4 5255 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,1,0,0,0,1|1,0,1]=4 5256 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,1,0,0,0,1|1,0,1]=4 5257 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,1,0,0,0,1|1,0,1]=4 5258 B12R1.34 C[C@H](CO)C(=O)c1ccccc1 Amb25139941 [0,1,0,0,0,1|0,0,2]=4 5259 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,1,0,0,0,1|0,0,2]=4 5260 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,1,0,0,0,1|0,0,2]=4 5261 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,1,0,0,0,1|0,0,2]=4 5262 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,1,0,0,0,1|2,0,0]=4 5263 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,1,0,0,0,1|2,0,0]=4 5264 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,1,0,0,0,1|2,0,0]=4 5265 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,1,0,0,0,1|2,0,0]=4 5266 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,1,0,0,0,1|2,0,0]=4 5267 B12R1.34 C[C@H](NN)[C@H](O)c1ccccc1 Amb25346319 [0,1,0,0,0,1|2,0,0]=4 5268 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,1,0,0,0,1|1,0,1]=4 5269 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,1,0,0,0,1|2,0,0]=4 5270 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,1,0,0,0,1|2,0,0]=4 5271 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,1,0,0,0,1|2,0,0]=4 5272 B12R1.34 C\C(=C(\F)/C=O)\c1ccccc1 Amb24757282 [0,1,0,0,0,1|1,0,1]=4 5273 B12R1.34 C\C(=C/F)\C(=O)c1ccccc1 Amb24737404 [0,1,0,0,0,1|1,0,1]=4 5274 B12R1.34 C\C(=C/N)\C(=O)c1ccccc1 Amb25320935 [0,1,0,0,0,1|1,0,1]=4 5275 B12R1.34 C\C(=C\C)\C(=O)c1ccccc1 Amb25730208 [0,1,0,0,0,1|1,0,1]=4 5276 B12R1.34 C\C(=C\O)\C(=O)c1ccccc1 Amb24725291 [0,1,0,0,0,1|0,0,2]=4 5277 B12R1.34 C\C(\C=O)=C(\Cl)/c1ccccc1 Amb18648444 [0,1,0,0,0,1|0,0,1]=3 5278 B12R1.34 C\C(\C=O)=C(\S)/c1ccccc1 Amb18648152 [0,1,0,0,0,1|0,0,1]=3 5279 B12R1.34 C\C(\c1ccccc1)=C(\C)/C=O Amb18645379 [0,1,0,0,0,1|0,0,1]=3 5280 B12R1.34 NC(C=O)C(=O)c1ccccc1 Amb24106087 [0,1,0,0,0,1|1,0,0]=3 5281 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,1,0,0,0,1|1,0,1]=4 5282 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,1,0,0,0,1|1,0,1]=4 5283 B12R1.34 N\C=C(/C(=O)c1ccccc1)\C Amb2386654 [0,1,0,0,0,1|1,0,1]=4 5284 B12R1.34 O=C(C(Cl)N=O)c1ccccc1 Amb24104253 [0,1,0,0,0,1|2,0,0]=4 5285 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,1,0,0,0,1|1,0,0]=3 5286 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,1,0,0,0,1|1,0,0]=3 5287 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [0,1,0,0,0,1|2,0,0]=4 5288 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,1,0,0,0,1|1,0,0]=3 5289 B12R1.34 O=C\C(\F)=C(/F)\c1ccccc1 Amb18646831 [0,1,0,0,0,1|1,0,1]=4 5290 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,1,0,0,0,1|1,0,0]=3 5291 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,1,0,0,0,1|1,0,0]=3 5292 B12R1.34 [O-]\C=C(\C(=O)c1ccccc1)/C Amb10553865 [0,1,0,0,0,1|0,0,2]=4 5293 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,1,0,0,0,1|1,0,0]=3 5294 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [0,1,0,0,0,1|2,0,0]=4 5295 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,1,0,0,0,1|2,0,0]=4 5296 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,1,0,0,0,1|1,0,0]=3 5297 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,1,0,0,0,1|1,0,0]=3 5298 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,1,0,0,0,1|1,0,1]=4 5299 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,1,0,0,0,1|0,0,2]=4 5300 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,1,0,0,0,1|0,0,2]=4 5301 B12R1.43 C=C(Sc1ccccc1)C(N)=O Amb24739855 [0,1,0,0,0,1|0,0,2]=4 5302 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,1,0,0,0,1|2,0,0]=4 5303 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,1,0,0,0,1|2,0,0]=4 5304 B12R1.43 CC(=Cc1ccccc1)C(=O)Cl Amb24061289 [0,1,0,0,0,1|0,0,1]=3 5305 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,1,0,0,0,1|0,0,2]=4 5306 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,1,0,0,0,1|1,0,1]=4 5307 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [0,1,0,0,0,1|1,0,0]=3 5308 B12R1.43 CC(=O)C(C)Oc1cccc[n]1 Amb25120521 [0,1,0,0,0,1|1,0,0]=3 5309 B12R1.43 CC(=O)C(C)Sc1cc[n]c[n]1 Amb25142834 [0,1,0,0,0,1|2,0,0]=4 5310 B12R1.43 CC(=O)C(C)Sc1cc[n]cc1 Amb25792214 [0,1,0,0,0,1|1,0,0]=3 5311 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [0,1,0,0,0,1|2,0,0]=4 5312 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [0,1,0,0,0,1|2,0,0]=4 5313 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [0,1,0,0,0,1|2,0,0]=4 5314 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [0,1,0,0,0,1|2,0,0]=4 5315 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,1,0,0,0,1|1,0,0]=3 5316 B12R1.43 CC(=O)C(Oc1cccnc1)C Amb2407640 [0,1,0,0,0,1|1,0,0]=3 5317 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [0,1,0,0,0,1|2,0,0]=4 5318 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,1,0,0,0,1|1,0,0]=3 5319 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,1,0,0,0,1|2,0,0]=4 5320 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [0,1,0,0,0,1|1,0,0]=3 5321 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,1,0,0,0,1|0,0,0]=2 5322 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,1,0,0,0,1|0,0,0]=2 5323 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,1,0,0,0,1|1,0,0]=3 5324 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,1,0,0,0,1|1,0,0]=3 5325 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [0,1,0,0,0,1|1,0,0]=3 5326 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,1,0,0,0,1|0,0,0]=2 5327 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,1,0,0,0,1|1,0,1]=4 5328 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,1,0,0,0,1|1,1,0]=4 5329 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,1,0,0,0,1|0,0,0]=2 5330 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,1,0,0,0,1|0,0,0]=2 5331 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,1,0,0,0,1|0,0,0]=2 5332 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,1,0,0,0,1|0,0,0]=2 5333 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,1,0,0,0,1|0,0,0]=2 5334 B12R1.43 CC(C(=O)O)Nc1ncccn1 Amb2372391 [0,1,0,0,0,1|2,0,0]=4 5335 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,1,0,0,0,1|0,0,0]=2 5336 B12R1.43 CC(C(=O)O)Sc1cnccn1 Amb2446097 [0,1,0,0,0,1|2,0,0]=4 5337 B12R1.43 CC(C(=S)N)Oc1ccccc1 Amb17233851 [0,1,0,0,0,1|0,1,0]=3 5338 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [0,1,0,0,0,1|1,0,1]=4 5339 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,1,0,0,0,1|0,0,2]=4 5340 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 Amb25375808 [0,1,0,0,0,1|1,0,1]=4 5341 B12R1.43 CC(Cc1c[n]c[n]c1)C(O)=O Amb24375035 [0,1,0,0,0,1|2,0,0]=4 5342 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [0,1,0,0,0,1|1,0,1]=4 5343 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [0,1,0,0,0,1|1,0,1]=4 5344 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,1,0,0,0,1|1,0,0]=3 5345 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [0,1,0,0,0,1|2,0,0]=4 5346 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [0,1,0,0,0,1|2,0,0]=4 5347 B12R1.43 CC(Nc1c[n]c[n]c1)C(O)=O Amb18270384 [0,1,0,0,0,1|2,0,0]=4 5348 B12R1.43 CC(Nc1cc[n][n]c1)C(O)=O Amb25261344 [0,1,0,0,0,1|2,0,0]=4 5349 B12R1.43 CC(Nc1cc[n]c[n]1)C(N)=O Amb18290777 [0,1,0,0,0,1|2,0,0]=4 5350 B12R1.43 CC(Nc1cc[n]c[n]1)C(O)=O Amb18973870 [0,1,0,0,0,1|2,0,0]=4 5351 B12R1.43 CC(Nc1ccc[n][n]1)C(N)=O Amb18298701 [0,1,0,0,0,1|2,0,0]=4 5352 B12R1.43 CC(Nc1ccc[n][n]1)C(O)=O Amb18991526 [0,1,0,0,0,1|2,0,0]=4 5353 B12R1.43 CC(Nc1ccc[n]c1)C(O)=O Amb18270393 [0,1,0,0,0,1|1,0,0]=3 5354 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [0,1,0,0,0,1|1,0,1]=4 5355 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,1,0,0,0,1|1,0,0]=3 5356 B12R1.43 CC(OC1=CC=CNN1)C(O)=O Amb25775008 [0,1,0,0,0,1|2,0,0]=4 5357 B12R1.43 CC(Oc1ccc[n]c1)C(N)=O Amb24760938 [0,1,0,0,0,1|1,0,0]=3 5358 B12R1.43 CC(Oc1ccccc1)C(C)Cl Amb24532569 [0,1,0,0,0,1|1,0,1]=4 5359 B12R1.43 CC(Oc1ccccc1)C(C)N Amb18291409 [0,1,0,0,0,1|1,0,1]=4 5360 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [0,1,0,0,0,1|0,0,2]=4 5361 B12R1.43 CC(Oc1ccccc1)C(N)=N Amb18798297 [0,1,0,0,0,1|1,0,0]=3 5362 B12R1.43 CC(Oc1ccccc1)[C@H](C)N Amb25089792 [0,1,0,0,0,1|1,0,1]=4 5363 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,1,0,0,0,1|0,0,0]=2 5364 B12R1.43 CC(Sc1[n]ccc[n]1)C(N)=O Amb19074352 [0,1,0,0,0,1|2,0,0]=4 5365 B12R1.43 CC(Sc1c[n]cc[n]1)C(N)=O Amb25058836 [0,1,0,0,0,1|2,0,0]=4 5366 B12R1.43 CC(Sc1cc[n]c[n]1)C(N)=O Amb25848003 [0,1,0,0,0,1|2,0,0]=4 5367 B12R1.43 CC(Sc1cc[n]c[n]1)C(O)=O Amb18973866 [0,1,0,0,0,1|2,0,0]=4 5368 B12R1.43 CC(Sc1ccc[n][n]1)C(N)=O Amb24344024 [0,1,0,0,0,1|2,0,0]=4 5369 B12R1.43 CC(Sc1ccc[n][n]1)C(O)=O Amb18991532 [0,1,0,0,0,1|2,0,0]=4 5370 B12R1.43 CC(Sc1cccc[n]1)C(N)=N Amb18805335 [0,1,0,0,0,1|2,0,0]=4 5371 B12R1.43 CC(Sc1ccccc1)C(C)Cl Amb25290258 [0,1,0,0,0,1|1,0,1]=4 5372 B12R1.43 CC(Sc1ccccc1)C(C)N Amb18648553 [0,1,0,0,0,1|1,0,1]=4 5373 B12R1.43 CC(Sc1ccccc1)C(N)=N Amb18805146 [0,1,0,0,0,1|1,0,0]=3 5374 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [0,1,0,0,0,1|1,0,0]=3 5375 B12R1.43 CN(Cc1cc[n]cc1)C(=O)Cl Amb24357639 [0,1,0,0,0,1|2,0,0]=4 5376 B12R1.43 CN(Cc1ccc[n]c1)C(=O)Cl Amb25034672 [0,1,0,0,0,1|2,0,0]=4 5377 B12R1.43 CN(Cc1ccccc1)C(N)=N Amb22586446 [0,1,0,0,0,1|2,0,0]=4 5378 B12R1.43 CN(Nc1ccccc1)C(N)=N Amb24557748 [0,1,0,0,0,1|2,0,0]=4 5379 B12R1.43 CN(Nc1ccccc1)C(N)=S Amb24440854 [0,1,0,0,0,1|1,1,0]=4 5380 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,1,0,0,0,1|0,0,0]=2 5381 B12R1.43 C[C@@H](C(=O)O)Nc1ccncc1 Amb10604191 [0,1,0,0,0,1|1,0,0]=3 5382 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,1,0,0,0,1|0,0,2]=4 5383 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,1,0,0,0,1|0,0,0]=2 5384 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [0,1,0,0,0,1|2,0,0]=4 5385 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,1,0,0,0,1|0,0,2]=4 5386 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [0,1,0,0,0,1|1,0,1]=4 5387 B12R1.43 C[C@@H](Nc1[n]ccc[n]1)C(O)=O Amb24707746 [0,1,0,0,0,1|2,0,0]=4 5388 B12R1.43 C[C@@H](Nc1cccc[n]1)C(O)=O Amb24475793 [0,1,0,0,0,1|1,0,0]=3 5389 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,1,0,0,0,1|0,0,0]=2 5390 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [0,1,0,0,0,1|1,0,1]=4 5391 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [0,1,0,0,0,1|0,0,2]=4 5392 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,1,0,0,0,1|0,0,0]=2 5393 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [0,1,0,0,0,1|0,0,2]=4 5394 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)N Amb24407272 [0,1,0,0,0,1|1,0,1]=4 5395 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [0,1,0,0,0,1|0,0,2]=4 5396 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)N Amb25074048 [0,1,0,0,0,1|1,0,1]=4 5397 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [0,1,0,0,0,1|0,0,2]=4 5398 B12R1.43 C[C@@H](Sc1ccccc1)[C@H](C)Cl Amb24444921 [0,1,0,0,0,1|1,0,1]=4 5399 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,1,0,0,0,1|0,0,0]=2 5400 B12R1.43 C[C@H](C(=O)O)Nc1cnccn1 Amb16233069 [0,1,0,0,0,1|2,0,0]=4 5401 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,1,0,0,0,1|0,0,2]=4 5402 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,1,0,0,0,1|0,0,2]=4 5403 B12R1.43 C[C@H](Nc1[n]ccc[n]1)C(N)=O Amb25150914 [0,1,0,0,0,1|2,0,0]=4 5404 B12R1.43 C[C@H](Nc1c[n]cc[n]1)C(O)=O Amb25829931 [0,1,0,0,0,1|2,0,0]=4 5405 B12R1.43 C[C@H](Nc1ccc[n][n]1)C(O)=O Amb25268668 [0,1,0,0,0,1|2,0,0]=4 5406 B12R1.43 C[C@H](Nc1ccc[n]c1)C(O)=O Amb25320831 [0,1,0,0,0,1|1,0,0]=3 5407 B12R1.43 C[C@H](Nc1cccc[n]1)C(O)=O Amb24066967 [0,1,0,0,0,1|1,0,0]=3 5408 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,1,0,0,0,1|0,0,0]=2 5409 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,1,0,0,0,1|0,0,0]=2 5410 B12R1.43 C[C@H](Sc1cccc[n]1)C(O)=O Amb22388633 [0,1,0,0,0,1|1,0,0]=3 5411 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,1,0,0,0,1|0,0,0]=2 5412 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [0,1,0,0,0,1|0,0,2]=4 5413 B12R1.43 C\C(=C/c1c[n]ccc1)\C(C)=O Amb25373091 [0,1,0,0,0,1|1,0,1]=4 5414 B12R1.43 C\C(=C/c1cc[n]cc1)\C(C)=O Amb24424922 [0,1,0,0,0,1|1,0,1]=4 5415 B12R1.43 C\C(=C/c1cccc[n]1)\C(C)=O Amb25066316 [0,1,0,0,0,1|1,0,1]=4 5416 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,1,0,0,0,1|0,0,1]=3 5417 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,1,0,0,0,1|0,0,1]=3 5418 B12R1.43 C\C(=C\c1ccccc1)\C(N)=O Amb24388896 [0,1,0,0,0,1|0,0,1]=3 5419 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,1,0,0,0,1|0,0,1]=3 5420 B12R1.43 C\C(=C\c1ccccc1)\[N+]([O-])=O Amb21520351 [0,1,0,0,0,1|1,0,1]=4 5421 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,1,0,0,0,1|0,0,1]=3 5422 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,1,0,0,0,1|0,0,1]=3 5423 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,1,0,0,0,1|1,0,0]=3 5424 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [0,1,0,0,0,1|2,0,0]=4 5425 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,1,0,0,0,1|1,0,0]=3 5426 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,1,0,0,0,1|1,0,0]=3 5427 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,1,0,0,0,1|1,0,0]=3 5428 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,1,0,0,0,1|1,0,1]=4 5429 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,1,0,0,0,1|1,0,1]=4 5430 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,1,0,0,0,1|1,0,1]=4 5431 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,1,0,0,0,1|2,0,0]=4 5432 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,1,0,0,0,1|1,0,0]=3 5433 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,1,0,0,0,1|1,0,0]=3 5434 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,1,0,0,0,1|1,0,0]=3 5435 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,1,0,0,0,1|1,0,0]=3 5436 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,1,0,0,0,1|1,0,0]=3 5437 B12R1.43 NC(=O)C(Sc1ccccn1)C Amb13953849 [0,1,0,0,0,1|1,0,0]=3 5438 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,1,0,0,0,1|1,0,0]=3 5439 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,1,0,0,0,1|1,0,0]=3 5440 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,1,0,0,0,1|1,1,0]=4 5441 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,1,0,0,0,1|1,1,0]=4 5442 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,1,0,0,0,1|1,0,0]=3 5443 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,1,0,0,0,1|1,0,0]=3 5444 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,1,0,0,0,1|2,0,0]=4 5445 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,1,0,0,0,1|2,0,0]=4 5446 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,1,0,0,0,1|2,0,0]=4 5447 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,1,0,0,0,1|2,0,0]=4 5448 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,1,0,0,0,1|1,0,0]=3 5449 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,1,0,0,0,1|1,0,0]=3 5450 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,1,0,0,0,1|1,0,0]=3 5451 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,1,0,0,0,1|1,0,0]=3 5452 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,1,0,0,0,1|1,0,0]=3 5453 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,1,0,0,0,1|1,0,0]=3 5454 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,1,0,0,0,1|1,0,0]=3 5455 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,1,0,0,0,1|1,0,0]=3 5456 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,1,0,0,0,1|1,0,0]=3 5457 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,1,0,0,0,1|1,0,0]=3 5458 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,1,0,0,0,1|1,0,0]=3 5459 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,1,0,0,0,1|1,0,0]=3 5460 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,1,0,0,0,1|2,0,0]=4 5461 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,1,0,0,0,1|2,0,0]=4 5462 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,1,0,0,0,1|2,0,0]=4 5463 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,1,0,0,0,1|1,0,0]=3 5464 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,1,0,0,0,1|2,0,0]=4 5465 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,1,0,0,0,1|2,0,0]=4 5466 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,1,0,0,0,1|2,0,0]=4 5467 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,1,0,0,0,1|1,0,0]=3 5468 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,1,0,0,0,1|2,0,0]=4 5469 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,1,0,0,0,1|1,0,1]=4 5470 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,1,0,0,0,1|1,0,1]=4 5471 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,1,0,0,0,1|1,0,0]=3 5472 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,1,0,0,0,1|1,0,1]=4 5473 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,1,0,0,0,1|1,0,1]=4 5474 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,1,0,0,0,1|1,0,0]=3 5475 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,1,0,0,0,1|1,0,0]=3 5476 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,1,0,0,0,1|2,0,0]=4 5477 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,1,0,0,0,1|1,0,0]=3 5478 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,1,0,0,0,1|1,0,1]=4 5479 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,1,0,0,0,1|1,0,0]=3 5480 B12R1.43 OC(=O)C(F)Sc1cc[n]cc1 Amb24487398 [0,1,0,0,0,1|2,0,0]=4 5481 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,1,0,0,0,1|1,0,0]=3 5482 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,1,0,0,0,1|1,0,0]=3 5483 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,1,0,0,0,1|2,0,0]=4 5484 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,1,0,0,0,1|2,0,0]=4 5485 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,1,0,0,0,1|2,0,0]=4 5486 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,1,0,0,0,1|1,0,0]=3 5487 B12R1.43 OC(=O)C(Sc1ccccn1)C Amb1139396 [0,1,0,0,0,1|1,0,0]=3 5488 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,1,0,0,0,1|1,0,0]=3 5489 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,1,0,0,0,1|1,0,0]=3 5490 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,1,0,0,0,1|2,0,0]=4 5491 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,1,0,0,0,1|1,0,0]=3 5492 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,1,0,0,0,1|1,0,0]=3 5493 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,1,0,0,0,1|2,0,0]=4 5494 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,1,0,0,0,1|2,0,0]=4 5495 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,1,0,0,0,1|1,0,1]=4 5496 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,1,0,0,0,1|1,0,1]=4 5497 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,1,0,0,0,1|1,0,1]=4 5498 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,1,0,0,0,1|2,0,0]=4 5499 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,1,0,0,0,1|1,0,1]=4 5500 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,1,0,0,0,1|1,0,1]=4 5501 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,1,0,0,0,1|1,0,1]=4 5502 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,1,0,0,0,1|1,0,1]=4 5503 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,1,0,0,0,1|1,0,0]=3 5504 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,1,0,0,0,1|1,0,1]=4 5505 B12R1.49 BrCC(Oc1ccc(cc1)Br)C Amb17291822 [0,1,0,0,0,1|1,0,1]=4 5506 B12R1.49 BrCC(Oc1ccc(cc1)C)C Amb17248433 [0,1,0,0,0,1|1,0,1]=4 5507 B12R1.49 BrCC(Oc1ccc(cc1)Cl)C Amb17261131 [0,1,0,0,0,1|1,0,1]=4 5508 B12R1.49 BrCC(Oc1ccc(cc1)F)C Amb17250551 [0,1,0,0,0,1|1,0,1]=4 5509 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [0,1,0,0,0,1|0,0,2]=4 5510 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [0,1,0,0,0,1|0,0,2]=4 5511 B12R1.49 C=CC(Cl)Cc1ccc(Cl)cc1 Amb25318302 [0,1,0,0,0,1|2,0,0]=4 5512 B12R1.49 C=CC(N)Cc1ccc(Br)cc1 Amb25126467 [0,1,0,0,0,1|2,0,0]=4 5513 B12R1.49 C=CC(N)Cc1ccc(Cl)cc1 Amb25148723 [0,1,0,0,0,1|2,0,0]=4 5514 B12R1.49 C=CC(N)Cc1ccc(F)cc1 Amb24695153 [0,1,0,0,0,1|2,0,0]=4 5515 B12R1.49 C=CC(O)Cc1ccc(Br)cc1 Amb24474552 [0,1,0,0,0,1|2,0,0]=4 5516 B12R1.49 C=CC(O)Cc1ccc(Cl)cc1 Amb25686541 [0,1,0,0,0,1|2,0,0]=4 5517 B12R1.49 C=CC(O)Cc1ccc(F)cc1 Amb25832059 [0,1,0,0,0,1|2,0,0]=4 5518 B12R1.49 C=CC(O)Cc1ccc(O)cc1 Amb25735226 [0,1,0,0,0,1|2,0,0]=4 5519 B12R1.49 CC(C#C)Nc1ccc(Br)cc1 Amb25061738 [0,1,0,0,0,1|1,0,1]=4 5520 B12R1.49 CC(C#C)Nc1ccc(Cl)cc1 Amb24595436 [0,1,0,0,0,1|1,0,1]=4 5521 B12R1.49 CC(C#C)Nc1ccc(I)cc1 Amb24475168 [0,1,0,0,0,1|1,0,1]=4 5522 B12R1.49 CC(C#C)Oc1ccc(N)cc1 Amb24379533 [0,1,0,0,0,1|1,0,1]=4 5523 B12R1.49 CC(C#N)Nc1ccc(O)cc1 Amb25667047 [0,1,0,0,0,1|1,0,1]=4 5524 B12R1.49 CC(C#N)Oc1ccc(N)cc1 Amb18283545 [0,1,0,0,0,1|1,0,1]=4 5525 B12R1.49 CC(C#N)Oc1ccc(O)cc1 Amb18798180 [0,1,0,0,0,1|1,0,1]=4 5526 B12R1.49 CC(C#N)Sc1ccc(Cl)cc1 Amb18330810 [0,1,0,0,0,1|1,0,1]=4 5527 B12R1.49 CC(C#N)Sc1ccc(N)cc1 Amb18283517 [0,1,0,0,0,1|1,0,1]=4 5528 B12R1.49 CC(C#N)Sc1ccc(O)cc1 Amb18796145 [0,1,0,0,0,1|1,0,1]=4 5529 B12R1.49 CC(C=C)Nc1ccc(Br)cc1 Amb25049662 [0,1,0,0,0,1|1,0,0]=3 5530 B12R1.49 CC(C=C)Nc1ccc(F)c[n]1 Amb24419523 [0,1,0,0,0,1|2,0,0]=4 5531 B12R1.49 CC(C=C)Nc1ccc(N)[n]c1 Amb25692544 [0,1,0,0,0,1|2,0,0]=4 5532 B12R1.49 CC(C=C)Oc1ccc(Cl)cc1 Amb24484184 [0,1,0,0,0,1|1,0,0]=3 5533 B12R1.49 CC(C=C)Oc1ccc(I)cc1 Amb25137309 [0,1,0,0,0,1|1,0,0]=3 5534 B12R1.49 CC(C=C)Oc1ccc(N)cc1 Amb18990276 [0,1,0,0,0,1|1,0,0]=3 5535 B12R1.49 CC(C=C)Oc1ccc(O)cc1 Amb18798279 [0,1,0,0,0,1|1,0,0]=3 5536 B12R1.49 CC(C=C)Sc1ccc(Cl)cc1 Amb25787821 [0,1,0,0,0,1|1,0,0]=3 5537 B12R1.49 CC(C=C)Sc1ccc(N)[n]c1 Amb18990259 [0,1,0,0,0,1|2,0,0]=4 5538 B12R1.49 CC(C=C)Sc1ccc(N)c[n]1 Amb18990258 [0,1,0,0,0,1|2,0,0]=4 5539 B12R1.49 CC(C=C)Sc1ccc(N)cc1 Amb18990255 [0,1,0,0,0,1|1,0,0]=3 5540 B12R1.49 CC(C=C)Sc1ccc(O)cc1 Amb18796334 [0,1,0,0,0,1|1,0,0]=3 5541 B12R1.49 CC(CN)Cc1ccc(Br)cc1 Amb18992228 [0,1,0,0,0,1|1,0,1]=4 5542 B12R1.49 CC(CN)Cc1ccc(I)cc1 Amb25054279 [0,1,0,0,0,1|1,0,1]=4 5543 B12R1.49 CC(CN)Cc1ccc(O)cc1 Amb25738797 [0,1,0,0,0,1|1,0,1]=4 5544 B12R1.49 CC(CN)Nc1ccc(Cl)cc1 Amb18909433 [0,1,0,0,0,1|1,0,1]=4 5545 B12R1.49 CC(CN)Nc1ccc(F)cc1 Amb18908738 [0,1,0,0,0,1|1,0,1]=4 5546 B12R1.49 CC(CN)Oc1ccc(I)cc1 Amb25035111 [0,1,0,0,0,1|1,0,1]=4 5547 B12R1.49 CC(CN)Oc1ccc(O)cc1 Amb24664519 [0,1,0,0,0,1|1,0,1]=4 5548 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb18992812 [0,1,0,0,0,1|1,0,1]=4 5549 B12R1.49 CC(CN)Sc1ccc(Br)cc1 Amb19350751 [0,1,0,0,0,1|1,0,1]=4 5550 B12R1.49 CC(CN)Sc1ccc(F)cc1 Amb18992823 [0,1,0,0,0,1|1,0,1]=4 5551 B12R1.49 CC(CN)Sc1ccc(N)cc1 Amb18909305 [0,1,0,0,0,1|1,0,1]=4 5552 B12R1.49 CC(CN)Sc1ccc(O)cc1 Amb18909348 [0,1,0,0,0,1|1,0,1]=4 5553 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [0,1,0,0,0,1|0,0,2]=4 5554 B12R1.49 CC(CO)Nc1ccc(Br)cc1 Amb18290179 [0,1,0,0,0,1|0,0,2]=4 5555 B12R1.49 CC(CO)Nc1ccc(Cl)cc1 Amb18290161 [0,1,0,0,0,1|0,0,2]=4 5556 B12R1.49 CC(CO)Nc1ccc(F)cc1 Amb18290165 [0,1,0,0,0,1|0,0,2]=4 5557 B12R1.49 CC(CO)Nc1ccc(I)cc1 Amb24493605 [0,1,0,0,0,1|0,0,2]=4 5558 B12R1.49 CC(CO)Oc1ccc(I)cc1 Amb24379893 [0,1,0,0,0,1|0,0,2]=4 5559 B12R1.49 CC(CO)Sc1ccc(Br)cc1 Amb23449854 [0,1,0,0,0,1|0,0,2]=4 5560 B12R1.49 CC(Cc1ccc(Br)cc1)C#N Amb24540446 [0,1,0,0,0,1|1,0,1]=4 5561 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [0,1,0,0,0,1|0,0,0]=2 5562 B12R1.49 CC(Cc1ccc(Br)cc1)CBr Amb25366059 [0,1,0,0,0,1|1,0,1]=4 5563 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [0,1,0,0,0,1|0,0,0]=2 5564 B12R1.49 CC(Cc1ccc(Cl)cc1)NN Amb25152282 [0,1,0,0,0,1|2,0,0]=4 5565 B12R1.49 CC(Cc1ccc(F)cc1)C#N Amb25050633 [0,1,0,0,0,1|1,0,1]=4 5566 B12R1.49 CC(Cc1ccc(F)cc1)CBr Amb25115291 [0,1,0,0,0,1|1,0,1]=4 5567 B12R1.49 CC(Cc1ccc(F)cc1)NN Amb25709190 [0,1,0,0,0,1|2,0,0]=4 5568 B12R1.49 CC(Cc1ccc(I)cc1)NN Amb24716530 [0,1,0,0,0,1|2,0,0]=4 5569 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [0,1,0,0,0,1|0,0,0]=2 5570 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [0,1,0,0,0,1|0,0,2]=4 5571 B12R1.49 CC(Cc1ccc(O)cc1)NN Amb25189495 [0,1,0,0,0,1|2,0,0]=4 5572 B12R1.49 CC(Nc1ccc(cc1)Br)C#N Amb17406666 [0,1,0,0,0,1|1,0,1]=4 5573 B12R1.49 CC(Nc1ccc(cc1)C)C#N Amb17400078 [0,1,0,0,0,1|1,0,1]=4 5574 B12R1.49 CC(Nc1ccc(cc1)Cl)C#N Amb17400853 [0,1,0,0,0,1|1,0,1]=4 5575 B12R1.49 CC(Nc1ccc(cc1)F)C#N Amb17400148 [0,1,0,0,0,1|1,0,1]=4 5576 B12R1.49 CC(Sc1ccc(cc1)Br)C#N Amb10665599 [0,1,0,0,0,1|1,0,1]=4 5577 B12R1.49 CC(Sc1ccc(cc1)C)C#N Amb10670383 [0,1,0,0,0,1|1,0,1]=4 5578 B12R1.49 CC(Sc1ccc(cc1)F)C#N Amb10665259 [0,1,0,0,0,1|1,0,1]=4 5579 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [0,1,0,0,0,1|1,0,1]=4 5580 B12R1.49 CCC(C)Oc1ccc(F)cc1 Amb24568831 [0,1,0,0,0,1|1,0,1]=4 5581 B12R1.49 CCC(C)Sc1ccc(Cl)cc1 Amb25284129 [0,1,0,0,0,1|1,0,1]=4 5582 B12R1.49 CCC(C)Sc1ccc(O)cc1 Amb18321724 [0,1,0,0,0,1|1,0,1]=4 5583 B12R1.49 CCC(Oc1ccc(cc1)N)C Amb2189169 [0,1,0,0,0,1|1,0,1]=4 5584 B12R1.49 CC[C@@H](C)Oc1ccc(N)cc1 Amb24103201 [0,1,0,0,0,1|1,0,1]=4 5585 B12R1.49 CN(Cc1ccc(F)cc1)N=O Amb25238622 [0,1,0,0,0,1|2,0,0]=4 5586 B12R1.49 CN(Cc1ccc(O)cc1)C=C Amb24408917 [0,1,0,0,0,1|2,0,0]=4 5587 B12R1.49 CN(Cc1ccc(O)cc1)C=O Amb18792633 [0,1,0,0,0,1|1,0,0]=3 5588 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [0,1,0,0,0,1|2,0,0]=4 5589 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [0,1,0,0,0,1|2,0,0]=4 5590 B12R1.49 CNC(Cc1ccc(cc1)O)C Amb17619384 [0,1,0,0,0,1|2,0,0]=4 5591 B12R1.49 CN[C@@H](C)Cc1ccc(Cl)cc1 Amb25123418 [0,1,0,0,0,1|2,0,0]=4 5592 B12R1.49 CN[C@@H](C)Cc1ccc(N)cc1 Amb24710324 [0,1,0,0,0,1|2,0,0]=4 5593 B12R1.49 CN[C@@H](C)Cc1ccc(O)cc1 Amb24451652 [0,1,0,0,0,1|2,0,0]=4 5594 B12R1.49 C[C@@H](CN)Oc1ccc(Cl)cc1 Amb24701895 [0,1,0,0,0,1|1,0,1]=4 5595 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [0,1,0,0,0,1|0,0,2]=4 5596 B12R1.49 C[C@@H](CO)Oc1ccc(Cl)cc1 Amb25179930 [0,1,0,0,0,1|0,0,2]=4 5597 B12R1.49 C[C@@H](CO)Oc1ccc(F)cc1 Amb24497746 [0,1,0,0,0,1|0,0,2]=4 5598 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [0,1,0,0,0,1|0,0,2]=4 5599 B12R1.49 C[C@H](CN)Oc1ccc(Cl)cc1 Amb25697013 [0,1,0,0,0,1|1,0,1]=4 5600 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [0,1,0,0,0,1|0,0,2]=4 5601 B12R1.49 C[C@H](CO)Oc1ccc(Cl)cc1 Amb25831906 [0,1,0,0,0,1|0,0,2]=4 5602 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [0,1,0,0,0,1|0,0,2]=4 5603 B12R1.49 C\C(=C\c1ccc(N)cc1)\C=O Amb24605302 [0,1,0,0,0,1|0,0,1]=3 5604 B12R1.49 C\C(\C=O)=C\c1ccc(Br)cc1 Amb25823713 [0,1,0,0,0,1|0,0,1]=3 5605 B12R1.49 C\C(\C=O)=C\c1ccc(F)cc1 Amb25857570 [0,1,0,0,0,1|0,0,1]=3 5606 B12R1.49 C\C(\C=O)=C\c1ccc(I)cc1 Amb24571541 [0,1,0,0,0,1|0,0,1]=3 5607 B12R1.49 C\C=C(\C)/Nc1ccc(C)cc1 Amb24536767 [0,1,0,0,0,1|1,0,1]=4 5608 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [0,1,0,0,0,1|0,0,2]=4 5609 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [0,1,0,0,0,1|1,0,1]=4 5610 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [0,1,0,0,0,1|0,0,0]=2 5611 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [0,1,0,0,0,1|1,0,1]=4 5612 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [0,1,0,0,0,1|1,0,1]=4 5613 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [0,1,0,0,0,1|1,0,1]=4 5614 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [0,1,0,0,0,1|0,0,2]=4 5615 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [0,1,0,0,0,1|1,0,0]=3 5616 B12R1.49 Cc1ccc(CC(O)C=C)cc1 Amb25845662 [0,1,0,0,0,1|2,0,0]=4 5617 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [0,1,0,0,0,1|1,0,0]=3 5618 B12R1.49 Cc1ccc(CN(C)C=O)cc1 Amb24601810 [0,1,0,0,0,1|1,0,0]=3 5619 B12R1.49 Cc1ccc(CN(C)N=O)cc1 Amb25154359 [0,1,0,0,0,1|2,0,0]=4 5620 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [0,1,0,0,0,1|0,0,2]=4 5621 B12R1.49 Cc1ccc(C[C@@H](C)NC)cc1 Amb25233407 [0,1,0,0,0,1|2,0,0]=4 5622 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [0,1,0,0,0,1|0,0,2]=4 5623 B12R1.49 Cc1ccc(NC(C)C=C)[n]c1 Amb25287885 [0,1,0,0,0,1|2,0,0]=4 5624 B12R1.49 Cc1ccc([n]c1)SC(C)C=C Amb24613336 [0,1,0,0,0,1|2,0,0]=4 5625 B12R1.49 Cc1ccc(\C=C(/O)\C=O)cc1 Amb18645658 [0,1,0,0,0,1|1,0,1]=4 5626 B12R1.49 Cc1ccc(\C=C(\C)/C=O)cc1 Amb25667362 [0,1,0,0,0,1|0,0,1]=3 5627 B12R1.49 Cc1ccc(\C=C(\Cl)/C=O)cc1 Amb25674237 [0,1,0,0,0,1|1,0,1]=4 5628 B12R1.49 Cc1ccc(\C=C(\O)/C=O)cc1 Amb25179856 [0,1,0,0,0,1|1,0,1]=4 5629 B12R1.49 Cc1ccc(cc1)NC(=O)C=O Amb25690866 [0,1,0,0,0,1|1,0,1]=4 5630 B12R1.49 Cc1ccc(cc1)NC(C)CN Amb18646166 [0,1,0,0,0,1|1,0,1]=4 5631 B12R1.49 Cc1ccc(cc1)NC(C)CO Amb18971798 [0,1,0,0,0,1|0,0,2]=4 5632 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CC Amb24635875 [0,1,0,0,0,1|1,0,1]=4 5633 B12R1.49 Cc1ccc(cc1)OC(C)C=C Amb24484185 [0,1,0,0,0,1|1,0,0]=3 5634 B12R1.49 Cc1ccc(cc1)SC(=C)C=O Amb24497102 [0,1,0,0,0,1|0,0,2]=4 5635 B12R1.49 Cc1ccc(cc1)SC(C)C=C Amb25153247 [0,1,0,0,0,1|1,0,0]=3 5636 B12R1.49 Cc1ccc(cc1)SC(C)C=O Amb18648416 [0,1,0,0,0,1|0,0,0]=2 5637 B12R1.49 Cc1ccc(cc1)SC(C)CO Amb24387756 [0,1,0,0,0,1|0,0,2]=4 5638 B12R1.49 Cc1ccc(cc1)S[C@@H](C)C=O Amb25122785 [0,1,0,0,0,1|0,0,0]=2 5639 B12R1.49 Cc1ccc(cc1)S[C@@H](C)CO Amb24733445 [0,1,0,0,0,1|0,0,2]=4 5640 B12R1.49 Cc1ccc(cc1)S[C@H](C)C=O Amb25039916 [0,1,0,0,0,1|0,0,0]=2 5641 B12R1.49 Cc1ccc(cc1)S[C@H](C)CO Amb24719675 [0,1,0,0,0,1|0,0,2]=4 5642 B12R1.49 ClCC(Oc1ccc(cc1)Br)C Amb17261134 [0,1,0,0,0,1|1,0,1]=4 5643 B12R1.49 ClCC(Oc1ccc(cc1)C)C Amb17234170 [0,1,0,0,0,1|1,0,1]=4 5644 B12R1.49 ClCC(Oc1ccc(cc1)Cl)C Amb17238291 [0,1,0,0,0,1|1,0,1]=4 5645 B12R1.49 ClCC(Oc1ccc(cc1)F)C Amb17234615 [0,1,0,0,0,1|1,0,1]=4 5646 B12R1.49 NCC(Nc1ccc(cc1)Br)C Amb17226676 [0,1,0,0,0,1|1,0,1]=4 5647 B12R1.49 NCC(Oc1ccc(cc1)F)C Amb2089060 [0,1,0,0,0,1|1,0,1]=4 5648 B12R1.49 NCC(Sc1ccc(cc1)C)C Amb17485974 [0,1,0,0,0,1|1,0,1]=4 5649 B12R1.49 NCC(Sc1ccc(cc1)Cl)C Amb17485977 [0,1,0,0,0,1|1,0,1]=4 5650 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [0,1,0,0,0,1|1,0,0]=3 5651 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [0,1,0,0,0,1|1,0,0]=3 5652 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [0,1,0,0,0,1|1,0,0]=3 5653 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [0,1,0,0,0,1|1,0,0]=3 5654 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [0,1,0,0,0,1|1,0,0]=3 5655 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [0,1,0,0,0,1|1,0,0]=3 5656 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [0,1,0,0,0,1|1,0,0]=3 5657 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [0,1,0,0,0,1|1,0,0]=3 5658 B12R1.49 O=C\C(=C\c1ccc(cc1)Br)\C Amb17343202 [0,1,0,0,0,1|0,0,1]=3 5659 B12R1.49 O=C\C(=C\c1ccc(cc1)C)\C Amb17334499 [0,1,0,0,0,1|0,0,1]=3 5660 B12R1.49 O=C\C(=C\c1ccc(cc1)Cl)\C Amb17335458 [0,1,0,0,0,1|0,0,1]=3 5661 B12R1.49 O=C\C(=C\c1ccc(cc1)F)\C Amb17334600 [0,1,0,0,0,1|0,0,1]=3 5662 B12R1.49 O=C\C(=C\c1ccc(cc1)O)\C Amb17334556 [0,1,0,0,0,1|0,0,1]=3 5663 B12R1.49 O=C\C(\F)=C/c1ccc(Cl)cc1 Amb24697918 [0,1,0,0,0,1|1,0,1]=4 5664 B12R1.49 O=C\C(\F)=C/c1ccc(F)cc1 Amb25326695 [0,1,0,0,0,1|1,0,1]=4 5665 B12R1.49 O=C\C(\F)=C\c1ccc(F)cc1 Amb24736150 [0,1,0,0,0,1|1,0,1]=4 5666 B12R1.49 OC(Cc1ccc(Br)c[n]1)C=O Amb24492910 [0,1,0,0,0,1|2,0,0]=4 5667 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [0,1,0,0,0,1|1,0,0]=3 5668 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [0,1,0,0,0,1|1,0,0]=3 5669 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [0,1,0,0,0,1|1,0,0]=3 5670 B12R1.49 OCC(Oc1ccc(cc1)Br)C Amb17249278 [0,1,0,0,0,1|0,0,2]=4 5671 B12R1.49 OCC(Oc1ccc(cc1)C)C Amb17232602 [0,1,0,0,0,1|0,0,2]=4 5672 B12R1.49 OCC(Oc1ccc(cc1)Cl)C Amb17234358 [0,1,0,0,0,1|0,0,2]=4 5673 B12R1.49 OCC(Oc1ccc(cc1)F)C Amb17232741 [0,1,0,0,0,1|0,0,2]=4 5674 B12R1.49 O\C(\C=O)=C/c1ccc(Cl)cc1 Amb18648698 [0,1,0,0,0,1|1,0,1]=4 5675 B12R1.49 O\C(\C=O)=C\c1ccc(F)cc1 Amb25240049 [0,1,0,0,0,1|1,0,1]=4 5676 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [0,1,0,0,0,1|1,0,1]=4 5677 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [0,1,0,0,0,1|1,0,0]=3 5678 B12R1.49 Oc1ccc(\C=C(/F)\C=O)cc1 Amb24497168 [0,1,0,0,0,1|1,0,1]=4 5679 B12R1.50 BrCC(Oc1cccc(c1)Br)C Amb17291821 [0,1,0,0,0,1|1,0,1]=4 5680 B12R1.50 BrCC(Oc1cccc(c1)C)C Amb17248432 [0,1,0,0,0,1|1,0,1]=4 5681 B12R1.50 BrCC(Oc1cccc(c1)Cl)C Amb17261130 [0,1,0,0,0,1|1,0,1]=4 5682 B12R1.50 BrCC(Oc1cccc(c1)F)C Amb17250550 [0,1,0,0,0,1|1,0,1]=4 5683 B12R1.50 C=CC(N)Cc1cccc(Cl)c1 Amb25126466 [0,1,0,0,0,1|2,0,0]=4 5684 B12R1.50 C=CC(O)Cc1cccc(Cl)c1 Amb25343968 [0,1,0,0,0,1|2,0,0]=4 5685 B12R1.50 CC(C#N)Oc1cccc(Cl)c1 Amb18809670 [0,1,0,0,0,1|1,0,1]=4 5686 B12R1.50 CC(C#N)Oc1cccc(F)c1 Amb18183521 [0,1,0,0,0,1|1,0,1]=4 5687 B12R1.50 CC(C#N)Oc1cccc(N)c1 Amb18283543 [0,1,0,0,0,1|1,0,1]=4 5688 B12R1.50 CC(C#N)Oc1cccc(O)c1 Amb18798182 [0,1,0,0,0,1|1,0,1]=4 5689 B12R1.50 CC(C#N)Sc1cccc(Br)c1 Amb20642032 [0,1,0,0,0,1|1,0,1]=4 5690 B12R1.50 CC(C#N)Sc1cccc(Cl)c1 Amb19065874 [0,1,0,0,0,1|1,0,1]=4 5691 B12R1.50 CC(C#N)Sc1cccc(F)c1 Amb25375372 [0,1,0,0,0,1|1,0,1]=4 5692 B12R1.50 CC(C#N)Sc1cccc(O)c1 Amb25266523 [0,1,0,0,0,1|1,0,1]=4 5693 B12R1.50 CC(C=C)Nc1c[n]cc(Br)c1 Amb25783577 [0,1,0,0,0,1|2,0,0]=4 5694 B12R1.50 CC(C=C)Nc1cccc(Br)c1 Amb24591347 [0,1,0,0,0,1|1,0,0]=3 5695 B12R1.50 CC(C=C)Nc1cccc(Cl)[n]1 Amb24396310 [0,1,0,0,0,1|2,0,0]=4 5696 B12R1.50 CC(C=C)Oc1c[n]cc(Br)c1 Amb24457942 [0,1,0,0,0,1|2,0,0]=4 5697 B12R1.50 CC(C=C)Oc1cccc(Br)c1 Amb25212875 [0,1,0,0,0,1|1,0,0]=3 5698 B12R1.50 CC(C=C)Oc1cccc(N)c1 Amb18990275 [0,1,0,0,0,1|1,0,0]=3 5699 B12R1.50 CC(C=C)Oc1cccc(O)c1 Amb18798281 [0,1,0,0,0,1|1,0,0]=3 5700 B12R1.50 CC(C=C)Sc1cccc(O)c1 Amb25280610 [0,1,0,0,0,1|1,0,0]=3 5701 B12R1.50 CC(C=O)Oc1cccc(Cl)c1 Amb19045647 [0,1,0,0,0,1|0,0,0]=2 5702 B12R1.50 CC(CCl)Cc1cc(Br)ccc1 Amb24728303 [0,1,0,0,0,1|1,0,1]=4 5703 B12R1.50 CC(CN)Cc1cc(Br)ccc1 Amb18992227 [0,1,0,0,0,1|1,0,1]=4 5704 B12R1.50 CC(CN)Cc1cc(F)ccc1 Amb18299465 [0,1,0,0,0,1|1,0,1]=4 5705 B12R1.50 CC(CN)Cc1cc(O)ccc1 Amb24537853 [0,1,0,0,0,1|1,0,1]=4 5706 B12R1.50 CC(CN)Nc1cccc(F)c1 Amb18908739 [0,1,0,0,0,1|1,0,1]=4 5707 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb18299442 [0,1,0,0,0,1|1,0,1]=4 5708 B12R1.50 CC(CN)Oc1cccc(Cl)c1 Amb19148897 [0,1,0,0,0,1|1,0,1]=4 5709 B12R1.50 CC(CN)Oc1cccc(F)c1 Amb18299439 [0,1,0,0,0,1|1,0,1]=4 5710 B12R1.50 CC(CN)Sc1cccc(Br)c1 Amb18301433 [0,1,0,0,0,1|1,0,1]=4 5711 B12R1.50 CC(CN)Sc1cccc(Cl)c1 Amb18299920 [0,1,0,0,0,1|1,0,1]=4 5712 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [0,1,0,0,0,1|0,0,2]=4 5713 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [0,1,0,0,0,1|0,0,2]=4 5714 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [0,1,0,0,0,1|0,0,2]=4 5715 B12R1.50 CC(CO)Nc1cccc(Br)c1 Amb18290175 [0,1,0,0,0,1|0,0,2]=4 5716 B12R1.50 CC(CO)Nc1cccc(Cl)c1 Amb18290158 [0,1,0,0,0,1|0,0,2]=4 5717 B12R1.50 CC(CO)Nc1cccc(F)c1 Amb18971844 [0,1,0,0,0,1|0,0,2]=4 5718 B12R1.50 CC(CO)Oc1cc(O)ccc1 Amb25320205 [0,1,0,0,0,1|0,0,2]=4 5719 B12R1.50 CC(CO)Oc1cccc(N)c1 Amb25849749 [0,1,0,0,0,1|0,0,2]=4 5720 B12R1.50 CC(CO)Sc1cc(O)ccc1 Amb25130867 [0,1,0,0,0,1|0,0,2]=4 5721 B12R1.50 CC(CO)Sc1cccc(Br)c1 Amb24361119 [0,1,0,0,0,1|0,0,2]=4 5722 B12R1.50 CC(CO)Sc1cccc(F)c1 Amb25792582 [0,1,0,0,0,1|0,0,2]=4 5723 B12R1.50 CC(CO)Sc1cccc(N)c1 Amb24697150 [0,1,0,0,0,1|0,0,2]=4 5724 B12R1.50 CC(Cc1c[n]cc(F)c1)C=O Amb25152372 [0,1,0,0,0,1|1,0,0]=3 5725 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [0,1,0,0,0,1|0,0,2]=4 5726 B12R1.50 CC(Cc1cccc(Br)c1)C#N Amb25159927 [0,1,0,0,0,1|1,0,1]=4 5727 B12R1.50 CC(Cc1cccc(Br)c1)NN Amb25342052 [0,1,0,0,0,1|2,0,0]=4 5728 B12R1.50 CC(Cc1cccc(Cl)c1)C#N Amb25762801 [0,1,0,0,0,1|1,0,1]=4 5729 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [0,1,0,0,0,1|0,0,0]=2 5730 B12R1.50 CC(Cc1cccc(Cl)c1)NN Amb24434144 [0,1,0,0,0,1|2,0,0]=4 5731 B12R1.50 CC(Cc1cccc(F)c1)NN Amb25056305 [0,1,0,0,0,1|2,0,0]=4 5732 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [0,1,0,0,0,1|1,0,1]=4 5733 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [0,1,0,0,0,1|0,0,0]=2 5734 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [0,1,0,0,0,1|0,0,0]=2 5735 B12R1.50 CC(Cc1cccc(O)c1)CBr Amb24444691 [0,1,0,0,0,1|1,0,1]=4 5736 B12R1.50 CC(Cc1cccc(O)c1)CCl Amb24537852 [0,1,0,0,0,1|1,0,1]=4 5737 B12R1.50 CCC(C)Oc1cccc(I)c1 Amb24422625 [0,1,0,0,0,1|1,0,1]=4 5738 B12R1.50 CCC(C)Sc1cccc(Br)c1 Amb25706089 [0,1,0,0,0,1|1,0,1]=4 5739 B12R1.50 CCC(C)Sc1cccc(N)c1 Amb18289356 [0,1,0,0,0,1|1,0,1]=4 5740 B12R1.50 CCC(C)Sc1cccc(O)c1 Amb25136875 [0,1,0,0,0,1|1,0,1]=4 5741 B12R1.50 CCC(Oc1cccc(c1)N)C Amb2189170 [0,1,0,0,0,1|1,0,1]=4 5742 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [0,1,0,0,0,1|1,0,1]=4 5743 B12R1.50 CN(Cc1cccc(Cl)c1)N=O Amb25053417 [0,1,0,0,0,1|2,0,0]=4 5744 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [0,1,0,0,0,1|2,0,0]=4 5745 B12R1.50 CNC(C)Cc1cccc(S)c1 Amb24542790 [0,1,0,0,0,1|2,0,0]=4 5746 B12R1.50 CNC(Cc1cccc(c1)F)C Amb17614425 [0,1,0,0,0,1|2,0,0]=4 5747 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [0,1,0,0,0,1|2,0,0]=4 5748 B12R1.50 C[C@@H](CO)Nc1cccc(Cl)c1 Amb22831872 [0,1,0,0,0,1|0,0,2]=4 5749 B12R1.50 C[C@@H](CO)Oc1cccc(Cl)c1 Amb24618891 [0,1,0,0,0,1|0,0,2]=4 5750 B12R1.50 C[C@H](CO)Oc1cccc(Cl)c1 Amb24414999 [0,1,0,0,0,1|0,0,2]=4 5751 B12R1.50 C\C(=C/c1cccc(N)c1)\C=O Amb25264395 [0,1,0,0,0,1|0,0,1]=3 5752 B12R1.50 C\C(\C=O)=C\c1cccc(F)c1 Amb25857569 [0,1,0,0,0,1|0,0,1]=3 5753 B12R1.50 C\C(\C=O)=C\c1cccc(I)c1 Amb24493268 [0,1,0,0,0,1|0,0,1]=3 5754 B12R1.50 Cc1c[n]cc(CC(C)C=O)c1 Amb24423759 [0,1,0,0,0,1|1,0,0]=3 5755 B12R1.50 Cc1cc(CC(O)C=C)ccc1 Amb24431083 [0,1,0,0,0,1|2,0,0]=4 5756 B12R1.50 Cc1cc(C[C@@H](O)C=C)ccc1 Amb25155807 [0,1,0,0,0,1|2,0,0]=4 5757 B12R1.50 Cc1cc(\C=C(/F)\C=O)ccc1 Amb24497238 [0,1,0,0,0,1|1,0,1]=4 5758 B12R1.50 Cc1cc(cc[n]1)NC(C)C=C Amb25793365 [0,1,0,0,0,1|2,0,0]=4 5759 B12R1.50 Cc1cc(ccc1)NC(=O)C=O Amb24468252 [0,1,0,0,0,1|1,0,1]=4 5760 B12R1.50 Cc1cc[n]c(c1)\C=C(/C)\C=O Amb24497065 [0,1,0,0,0,1|1,0,1]=4 5761 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [0,1,0,0,0,1|0,0,0]=2 5762 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [0,1,0,0,0,1|0,0,2]=4 5763 B12R1.50 Cc1cccc(NC(C)C=C)[n]1 Amb24738119 [0,1,0,0,0,1|2,0,0]=4 5764 B12R1.50 Cc1cccc(c1)NC(C)CN Amb18251702 [0,1,0,0,0,1|1,0,1]=4 5765 B12R1.50 Cc1cccc(c1)NC(C)CO Amb18971818 [0,1,0,0,0,1|0,0,2]=4 5766 B12R1.50 Cc1cccc(c1)OC(C)C=C Amb24484277 [0,1,0,0,0,1|1,0,0]=3 5767 B12R1.50 Cc1cccc(c1)OC(C)C=O Amb25780101 [0,1,0,0,0,1|0,0,0]=2 5768 B12R1.50 Cc1cccc(c1)OC(C)CC Amb24484235 [0,1,0,0,0,1|1,0,1]=4 5769 B12R1.50 Cc1cccc(c1)SC(C)C#N Amb18184232 [0,1,0,0,0,1|1,0,1]=4 5770 B12R1.50 Cc1cccc(c1)SC(C)C=C Amb25153316 [0,1,0,0,0,1|1,0,0]=3 5771 B12R1.50 Cc1cccc(c1)SC(C)CN Amb18992832 [0,1,0,0,0,1|1,0,1]=4 5772 B12R1.50 Cc1cccc(c1)SC(C)CO Amb25792350 [0,1,0,0,0,1|0,0,2]=4 5773 B12R1.50 ClCC(Oc1cccc(c1)Br)C Amb17261133 [0,1,0,0,0,1|1,0,1]=4 5774 B12R1.50 ClCC(Oc1cccc(c1)C)C Amb17234169 [0,1,0,0,0,1|1,0,1]=4 5775 B12R1.50 ClCC(Oc1cccc(c1)Cl)C Amb17238290 [0,1,0,0,0,1|1,0,1]=4 5776 B12R1.50 ClCC(Oc1cccc(c1)F)C Amb17234614 [0,1,0,0,0,1|1,0,1]=4 5777 B12R1.50 N#CC(Nc1cccc(c1)Br)C Amb17406669 [0,1,0,0,0,1|1,0,1]=4 5778 B12R1.50 N#CC(Nc1cccc(c1)C)C Amb17400077 [0,1,0,0,0,1|1,0,1]=4 5779 B12R1.50 N#CC(Nc1cccc(c1)Cl)C Amb17400852 [0,1,0,0,0,1|1,0,1]=4 5780 B12R1.50 N#CC(Nc1cccc(c1)F)C Amb17400149 [0,1,0,0,0,1|1,0,1]=4 5781 B12R1.50 NCC(Nc1cccc(c1)Cl)C Amb17226673 [0,1,0,0,0,1|1,0,1]=4 5782 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [0,1,0,0,0,1|1,0,1]=4 5783 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [0,1,0,0,0,1|1,0,0]=3 5784 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [0,1,0,0,0,1|1,0,0]=3 5785 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [0,1,0,0,0,1|1,0,0]=3 5786 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [0,1,0,0,0,1|1,0,0]=3 5787 B12R1.50 O=CC(Cl)Cc1c[n]cc(F)c1 Amb25701253 [0,1,0,0,0,1|2,0,0]=4 5788 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [0,1,0,0,0,1|1,0,0]=3 5789 B12R1.50 O=C\C(=C\c1cccc(c1)Br)\C Amb17343200 [0,1,0,0,0,1|0,0,1]=3 5790 B12R1.50 O=C\C(=C\c1cccc(c1)C)\C Amb17334497 [0,1,0,0,0,1|0,0,1]=3 5791 B12R1.50 O=C\C(=C\c1cccc(c1)Cl)\C Amb17335456 [0,1,0,0,0,1|0,0,1]=3 5792 B12R1.50 O=C\C(=C\c1cccc(c1)O)\C Amb17334558 [0,1,0,0,0,1|0,0,1]=3 5793 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [0,1,0,0,0,1|1,0,0]=3 5794 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [0,1,0,0,0,1|1,0,0]=3 5795 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [0,1,0,0,0,1|1,0,0]=3 5796 B12R1.50 OCC(Oc1cccc(c1)Br)C Amb17249277 [0,1,0,0,0,1|0,0,2]=4 5797 B12R1.50 OCC(Oc1cccc(c1)C)C Amb17232601 [0,1,0,0,0,1|0,0,2]=4 5798 B12R1.50 OCC(Oc1cccc(c1)Cl)C Amb17234357 [0,1,0,0,0,1|0,0,2]=4 5799 B12R1.50 OCC(Oc1cccc(c1)F)C Amb17232740 [0,1,0,0,0,1|0,0,2]=4 5800 B12R1.50 O\C(\C=O)=C/c1cccc(F)c1 Amb25130617 [0,1,0,0,0,1|1,0,1]=4 5801 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [0,1,0,0,0,1|1,0,0]=3 5802 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [0,1,0,0,0,1|1,0,1]=4 5803 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [0,1,0,0,0,1|0,0,2]=4 5804 B12R1.118 C=CC(CO)Nc1cc[n]cc1 Amb24343558 [0,1,0,0,0,1|2,0,0]=4 5805 B12R1.118 C=C[C@@H](CO)Nc1ccccc1 Amb25763187 [0,1,0,0,0,1|1,0,0]=3 5806 B12R1.118 C=C\C(\C=O)=C\c1ccccc1 Amb24553053 [0,1,0,0,0,1|0,0,2]=4 5807 B12R1.118 CCC(C#C)Nc1ccccc1 Amb25689867 [0,1,0,0,0,1|1,0,1]=4 5808 B12R1.118 CCC(C#N)Nc1ccccc1 Amb18289853 [0,1,0,0,0,1|1,0,1]=4 5809 B12R1.118 CCC(C#N)Oc1ccccc1 Amb18797968 [0,1,0,0,0,1|1,0,1]=4 5810 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [0,1,0,0,0,1|1,0,1]=4 5811 B12R1.118 CCC(CO)Oc1ccccc1 Amb23538023 [0,1,0,0,0,1|0,0,2]=4 5812 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [0,1,0,0,0,1|1,0,1]=4 5813 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [0,1,0,0,0,1|1,0,1]=4 5814 B12R1.118 CCC(Nc1ccccc1)CO Amb13952611 [0,1,0,0,0,1|0,0,2]=4 5815 B12R1.118 CCC(Sc1ccccc1)C#N Amb10565503 [0,1,0,0,0,1|1,0,1]=4 5816 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [0,1,0,0,0,1|1,0,0]=3 5817 B12R1.118 CCN(Cc1ccccc1)N=O Amb24376725 [0,1,0,0,0,1|2,0,0]=4 5818 B12R1.118 CC\C(=C/c1ccccn1)\C=O Amb17334523 [0,1,0,0,0,1|1,0,1]=4 5819 B12R1.118 CC\C(=C/c1cccnc1)\C=O Amb17334524 [0,1,0,0,0,1|1,0,1]=4 5820 B12R1.118 CC\C(=C/c1ccncc1)\C=O Amb17334525 [0,1,0,0,0,1|1,0,1]=4 5821 B12R1.118 CC\C(\C=O)=C\c1cc[n]cc1 Amb25271672 [0,1,0,0,0,1|1,0,1]=4 5822 B12R1.118 CC\C(\C=O)=C\c1cccc[n]1 Amb24474541 [0,1,0,0,0,1|1,0,1]=4 5823 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [0,1,0,0,0,1|1,0,1]=4 5824 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [0,1,0,0,0,1|0,0,2]=4 5825 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [0,1,0,0,0,1|1,0,1]=4 5826 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [0,1,0,0,0,1|1,0,1]=4 5827 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [0,1,0,0,0,1|1,0,1]=4 5828 B12R1.118 COC(OC)Sc1ccccc1 Amb22347498 [0,1,0,0,0,1|2,0,0]=4 5829 B12R1.118 CO[SiH](Cc1ccccc1)C=C Amb22231750 [0,1,0,0,0,1|1,1,0]=4 5830 B12R1.118 CO\C(=C\c1ccccc1)\C=O Amb17594035 [0,1,0,0,0,1|0,0,1]=3 5831 B12R1.118 CO\C(\C=O)=C/c1ccc[n]c1 Amb25713631 [0,1,0,0,0,1|1,0,1]=4 5832 B12R1.118 CSC(Cc1ccccc1)C#N Amb17594511 [0,1,0,0,0,1|1,0,1]=4 5833 B12R1.118 C\C=C(/C=C)\Oc1ccccc1 Amb24068923 [0,1,0,0,0,1|1,0,1]=4 5834 B12R1.118 C\C=C(/C=O)\Oc1ccccc1 Amb24697807 [0,1,0,0,0,1|0,0,1]=3 5835 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [0,1,0,0,0,1|0,0,1]=3 5836 B12R1.118 C\C=C(\C=O)/Sc1ccccc1 Amb18648151 [0,1,0,0,0,1|0,0,1]=3 5837 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [0,1,0,0,0,1|0,0,1]=3 5838 B12R1.118 Cl\C=C(/CCl)\Sc1ccccc1 Amb24655750 [0,1,0,0,0,1|1,0,1]=4 5839 B12R1.118 N#CC(C=O)Sc1ccccc1 Amb24422403 [0,1,0,0,0,1|0,0,1]=3 5840 B12R1.118 N#CC(CBr)Cc1ccccc1 Amb25821723 [0,1,0,0,0,1|1,0,1]=4 5841 B12R1.118 N#CC(CCl)Cc1ccccc1 Amb24753458 [0,1,0,0,0,1|1,0,1]=4 5842 B12R1.118 N#CC(CCl)Nc1ccccc1 Amb25151143 [0,1,0,0,0,1|1,0,1]=4 5843 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [0,1,0,0,0,1|1,0,1]=4 5844 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [0,1,0,0,0,1|0,0,1]=3 5845 B12R1.118 N#C\C(\C=O)=C/c1ccccc1 Amb24566216 [0,1,0,0,0,1|0,0,2]=4 5846 B12R1.118 N#C\C(\C=O)=C\c1ccccc1 Amb18644900 [0,1,0,0,0,1|0,0,2]=4 5847 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [0,1,0,0,0,1|0,0,2]=4 5848 B12R1.118 NCC(CO)Nc1ccccc1 Amb25776544 [0,1,0,0,0,1|0,0,2]=4 5849 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [0,1,0,0,0,1|1,0,1]=4 5850 B12R1.118 O=CC(=Cc1ccccc1)C=O Amb18645276 [0,1,0,0,0,1|0,0,2]=4 5851 B12R1.118 O=C\C(\CCl)=C\c1ccccc1 Amb25669592 [0,1,0,0,0,1|0,0,1]=3 5852 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [0,1,0,0,0,1|0,0,2]=4 5853 B12R1.118 OCC(CO)Nc1ccccc1 Amb25060728 [0,1,0,0,0,1|0,0,2]=4 5854 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [0,1,0,0,0,1|1,0,1]=4 5855 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [0,1,0,0,0,1|0,0,2]=4 5856 B12R1.194 BrCC(Oc1ccccc1)(C)C Amb17248430 [0,1,0,0,0,1|1,0,1]=4 5857 B12R1.194 C#CC(Cc1ccccc1)(O)C Amb1083082 [0,1,0,0,0,1|1,0,1]=4 5858 B12R1.194 CC(C)(C=O)Oc1c[n]ccc1 Amb24497229 [0,1,0,0,0,1|1,0,0]=3 5859 B12R1.194 CC(C)(C=O)Oc1ccccc1 Amb25104993 [0,1,0,0,0,1|0,0,0]=2 5860 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [0,1,0,0,0,1|1,0,1]=4 5861 B12R1.194 CC(C)(CN)Oc1ccccc1 Amb19515084 [0,1,0,0,0,1|1,0,1]=4 5862 B12R1.194 CC(C)(CN)Sc1ccccc1 Amb18909240 [0,1,0,0,0,1|1,0,1]=4 5863 B12R1.194 CC(C)(CO)Nc1ccccc1 Amb18269010 [0,1,0,0,0,1|0,0,2]=4 5864 B12R1.194 CC(C)(CO)Sc1ccccc1 Amb24557142 [0,1,0,0,0,1|0,0,2]=4 5865 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [0,1,0,0,0,1|1,0,0]=3 5866 B12R1.194 CC(C)(Cc1ccccc1)NC Amb22349936 [0,1,0,0,0,1|2,0,0]=4 5867 B12R1.194 CC(C)(Cc1ccccc1)NN Amb18646155 [0,1,0,0,0,1|2,0,0]=4 5868 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [0,1,0,0,0,1|1,0,1]=4 5869 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [0,1,0,0,0,1|0,0,2]=4 5870 B12R1.194 CC(Cl)(Cc1ccccc1)C#N Amb18791085 [0,1,0,0,0,1|1,0,1]=4 5871 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [0,1,0,0,0,1|0,0,2]=4 5872 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [0,1,0,0,0,1|1,0,1]=4 5873 B12R1.194 CC(O)(Cc1ccccc1)C#N Amb18177733 [0,1,0,0,0,1|1,0,1]=4 5874 B12R1.194 CC(O)(Cc1ccccc1)NN Amb25361538 [0,1,0,0,0,1|2,0,0]=4 5875 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [0,1,0,0,0,1|1,0,1]=4 5876 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [0,1,0,0,0,1|2,0,0]=4 5877 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [0,1,0,0,0,1|0,0,0]=2 5878 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [0,1,0,0,0,1|0,0,2]=4 5879 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [0,1,0,0,0,1|0,0,2]=4 5880 B12R1.194 C[Si](C)(Cc1ccccc1)C=C Amb22733718 [0,1,0,0,0,1|1,1,0]=4 5881 B12R1.194 ClCC(Oc1ccccc1)(C)C Amb17234167 [0,1,0,0,0,1|1,0,1]=4 5882 B12R1.194 N#CC(Cc1ccccc1)(C)C Amb17333794 [0,1,0,0,0,1|1,0,1]=4 5883 B12R1.194 N#CC(Cc1ccccc1)(N)C Amb17232330 [0,1,0,0,0,1|1,0,1]=4 5884 B12R1.194 N#CC(Nc1ccccc1)(C)C Amb2496330 [0,1,0,0,0,1|1,0,1]=4 5885 B12R1.194 NCC(Cc1ccccc1)(C)C Amb17333839 [0,1,0,0,0,1|1,0,1]=4 5886 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [0,1,0,0,0,1|1,0,1]=4 5887 B12R1.194 NCC(Oc1ccccc1)(C)C Amb17074797 [0,1,0,0,0,1|1,0,1]=4 5888 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [0,1,0,0,0,1|1,0,0]=3 5889 B12R1.194 O=CC(Sc1ccccc1)(C)C Amb2412521 [0,1,0,0,0,1|0,0,0]=2 5890 B12R1.194 OCC(Oc1ccccc1)(C)C Amb17232597 [0,1,0,0,0,1|0,0,2]=4 5891 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [0,1,0,0,0,1|1,0,1]=4 5892 B12R1.371 BrCC(Oc1ccccc1Br)C Amb17291820 [0,1,0,0,0,1|1,0,1]=4 5893 B12R1.371 BrCC(Oc1ccccc1C)C Amb17248431 [0,1,0,0,0,1|1,0,1]=4 5894 B12R1.371 BrCC(Oc1ccccc1Cl)C Amb17261129 [0,1,0,0,0,1|1,0,1]=4 5895 B12R1.371 BrCC(Oc1ccccc1F)C Amb17250549 [0,1,0,0,0,1|1,0,1]=4 5896 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [0,1,0,0,0,1|0,0,2]=4 5897 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [0,1,0,0,0,1|0,0,2]=4 5898 B12R1.371 C=CC(Cl)Cc1ccccc1Cl Amb25123891 [0,1,0,0,0,1|2,0,0]=4 5899 B12R1.371 C=CC(N)Cc1ccccc1F Amb24471242 [0,1,0,0,0,1|2,0,0]=4 5900 B12R1.371 C=CC(O)Cc1ccccc1Br Amb24523932 [0,1,0,0,0,1|2,0,0]=4 5901 B12R1.371 CC(C#C)Nc1ccccc1Br Amb24709830 [0,1,0,0,0,1|1,0,1]=4 5902 B12R1.371 CC(C#C)Nc1ccccc1F Amb25690167 [0,1,0,0,0,1|1,0,1]=4 5903 B12R1.371 CC(C#C)Nc1ccccc1N Amb25779959 [0,1,0,0,0,1|1,0,1]=4 5904 B12R1.371 CC(C#C)Oc1ccccc1N Amb25724852 [0,1,0,0,0,1|1,0,1]=4 5905 B12R1.371 CC(C#C)Oc1ccccc1O Amb24466963 [0,1,0,0,0,1|1,0,1]=4 5906 B12R1.371 CC(C#N)Oc1ccccc1F Amb18800884 [0,1,0,0,0,1|1,0,1]=4 5907 B12R1.371 CC(C#N)Oc1ccccc1N Amb18283546 [0,1,0,0,0,1|1,0,1]=4 5908 B12R1.371 CC(C#N)Oc1ccccc1O Amb18798181 [0,1,0,0,0,1|1,0,1]=4 5909 B12R1.371 CC(C#N)Sc1ccccc1N Amb18956276 [0,1,0,0,0,1|1,0,1]=4 5910 B12R1.371 CC(C#N)Sc1ccccc1O Amb18791045 [0,1,0,0,0,1|1,0,1]=4 5911 B12R1.371 CC(C=C)Nc1[n]cccc1Br Amb25054274 [0,1,0,0,0,1|2,0,0]=4 5912 B12R1.371 CC(C=C)Nc1[n]cccc1N Amb25303361 [0,1,0,0,0,1|2,0,0]=4 5913 B12R1.371 CC(C=C)Nc1c[n]ccc1N Amb24554254 [0,1,0,0,0,1|2,0,0]=4 5914 B12R1.371 CC(C=C)Nc1cc[n]cc1Cl Amb25088184 [0,1,0,0,0,1|2,0,0]=4 5915 B12R1.371 CC(C=C)Nc1cc[n]cc1N Amb24368072 [0,1,0,0,0,1|2,0,0]=4 5916 B12R1.371 CC(C=C)Nc1ccccc1Br Amb24657117 [0,1,0,0,0,1|1,0,0]=3 5917 B12R1.371 CC(C=C)Nc1ccccc1Cl Amb25702696 [0,1,0,0,0,1|1,0,0]=3 5918 B12R1.371 CC(C=C)Nc1ccccc1F Amb25219959 [0,1,0,0,0,1|1,0,0]=3 5919 B12R1.371 CC(C=C)Nc1ccccc1I Amb25088843 [0,1,0,0,0,1|1,0,0]=3 5920 B12R1.371 CC(C=C)Nc1ccccc1N Amb24524947 [0,1,0,0,0,1|1,0,0]=3 5921 B12R1.371 CC(C=C)Oc1ccc[n]c1Cl Amb24485403 [0,1,0,0,0,1|2,0,0]=4 5922 B12R1.371 CC(C=C)Oc1ccccc1N Amb24100513 [0,1,0,0,0,1|1,0,0]=3 5923 B12R1.371 CC(C=C)Oc1ccccc1O Amb18798280 [0,1,0,0,0,1|1,0,0]=3 5924 B12R1.371 CC(C=C)Sc1[n]cccc1Cl Amb24412549 [0,1,0,0,0,1|2,0,0]=4 5925 B12R1.371 CC(C=C)Sc1[n]cccc1N Amb18990257 [0,1,0,0,0,1|2,0,0]=4 5926 B12R1.371 CC(C=C)Sc1cc[n]cc1N Amb18990256 [0,1,0,0,0,1|2,0,0]=4 5927 B12R1.371 CC(C=C)Sc1ccccc1Cl Amb24490566 [0,1,0,0,0,1|1,0,0]=3 5928 B12R1.371 CC(C=C)Sc1ccccc1F Amb25681159 [0,1,0,0,0,1|1,0,0]=3 5929 B12R1.371 CC(C=C)Sc1ccccc1N Amb18296542 [0,1,0,0,0,1|1,0,0]=3 5930 B12R1.371 CC(C=C)Sc1ccccc1O Amb18805139 [0,1,0,0,0,1|1,0,0]=3 5931 B12R1.371 CC(C=O)Oc1ccccc1Cl Amb25224007 [0,1,0,0,0,1|0,0,0]=2 5932 B12R1.371 CC(CCl)Oc1ccccc1O Amb24096843 [0,1,0,0,0,1|1,0,1]=4 5933 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [0,1,0,0,0,1|1,0,1]=4 5934 B12R1.371 CC(CN)Nc1ccccc1Cl Amb18909432 [0,1,0,0,0,1|1,0,1]=4 5935 B12R1.371 CC(CN)Nc1ccccc1F Amb18908737 [0,1,0,0,0,1|1,0,1]=4 5936 B12R1.371 CC(CN)Nc1ccccc1I Amb24551694 [0,1,0,0,0,1|1,0,1]=4 5937 B12R1.371 CC(CN)Oc1ccccc1Cl Amb19148877 [0,1,0,0,0,1|1,0,1]=4 5938 B12R1.371 CC(CN)Oc1ccccc1F Amb18299438 [0,1,0,0,0,1|1,0,1]=4 5939 B12R1.371 CC(CN)Sc1ccccc1Br Amb18992815 [0,1,0,0,0,1|1,0,1]=4 5940 B12R1.371 CC(CN)Sc1ccccc1Cl Amb18992821 [0,1,0,0,0,1|1,0,1]=4 5941 B12R1.371 CC(CN)Sc1ccccc1F Amb18992820 [0,1,0,0,0,1|1,0,1]=4 5942 B12R1.371 CC(CN)Sc1ccccc1N Amb18909296 [0,1,0,0,0,1|1,0,1]=4 5943 B12R1.371 CC(CN)Sc1ccccc1O Amb18909347 [0,1,0,0,0,1|1,0,1]=4 5944 B12R1.371 CC(CN1C=CC=CC1=O)C=O Amb24727711 [0,1,0,0,0,1|1,0,0]=3 5945 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [0,1,0,0,0,1|0,0,2]=4 5946 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [0,1,0,0,0,1|0,0,2]=4 5947 B12R1.371 CC(CO)Nc1ccccc1Br Amb18290138 [0,1,0,0,0,1|0,0,2]=4 5948 B12R1.371 CC(CO)Nc1ccccc1Cl Amb18971813 [0,1,0,0,0,1|0,0,2]=4 5949 B12R1.371 CC(CO)Nc1ccccc1F Amb18971852 [0,1,0,0,0,1|0,0,2]=4 5950 B12R1.371 CC(CO)Oc1ccccc1I Amb25828459 [0,1,0,0,0,1|0,0,2]=4 5951 B12R1.371 CC(CO)Oc1ccccc1O Amb24559693 [0,1,0,0,0,1|0,0,2]=4 5952 B12R1.371 CC(CO)Sc1ccccc1F Amb25330415 [0,1,0,0,0,1|0,0,2]=4 5953 B12R1.371 CC(CO)Sc1ccccc1N Amb25266122 [0,1,0,0,0,1|0,0,2]=4 5954 B12R1.371 CC(Cc1c[n]ccc1N)C=O Amb25057141 [0,1,0,0,0,1|1,0,0]=3 5955 B12R1.371 CC(Cc1ccc[n]c1N)C=O Amb25219354 [0,1,0,0,0,1|1,0,0]=3 5956 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [0,1,0,0,0,1|0,0,0]=2 5957 B12R1.371 CC(Cc1ccccc1Br)CBr Amb25040689 [0,1,0,0,0,1|1,0,1]=4 5958 B12R1.371 CC(Cc1ccccc1Cl)C#N Amb25717018 [0,1,0,0,0,1|1,0,1]=4 5959 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [0,1,0,0,0,1|0,0,0]=2 5960 B12R1.371 CC(Cc1ccccc1F)CBr Amb25741700 [0,1,0,0,0,1|1,0,1]=4 5961 B12R1.371 CC(Cc1ccccc1F)CCl Amb25349982 [0,1,0,0,0,1|1,0,1]=4 5962 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [0,1,0,0,0,1|0,0,0]=2 5963 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [0,1,0,0,0,1|0,0,0]=2 5964 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [0,1,0,0,0,1|1,0,1]=4 5965 B12R1.371 CCC(C)Oc1ccccc1I Amb24531541 [0,1,0,0,0,1|1,0,1]=4 5966 B12R1.371 CCC(C)Sc1ccccc1O Amb19045078 [0,1,0,0,0,1|1,0,1]=4 5967 B12R1.371 CN(Cc1ccccc1F)C=O Amb25211597 [0,1,0,0,0,1|1,0,0]=3 5968 B12R1.371 CN(Cc1ccccc1O)C=O Amb25349061 [0,1,0,0,0,1|1,0,0]=3 5969 B12R1.371 CN(Cc1ccccc1O)N=O Amb25780455 [0,1,0,0,0,1|2,0,0]=4 5970 B12R1.371 CNC(C)Cc1ccccc1Br Amb25149882 [0,1,0,0,0,1|2,0,0]=4 5971 B12R1.371 CN[C@@H](C)Cc1ccccc1F Amb25264769 [0,1,0,0,0,1|2,0,0]=4 5972 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [0,1,0,0,0,1|2,0,0]=4 5973 B12R1.371 COC(C)Oc1ccccc1O Amb25334885 [0,1,0,0,0,1|2,0,0]=4 5974 B12R1.371 C[C@@H](CO)Oc1ccccc1Cl Amb24407533 [0,1,0,0,0,1|0,0,2]=4 5975 B12R1.371 C[C@@H](CO)Oc1ccccc1I Amb22746638 [0,1,0,0,0,1|0,0,2]=4 5976 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [0,1,0,0,0,1|0,0,2]=4 5977 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [0,1,0,0,0,1|0,0,2]=4 5978 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [0,1,0,0,0,1|0,0,2]=4 5979 B12R1.371 C[C@H](CO)Oc1ccccc1I Amb25150105 [0,1,0,0,0,1|0,0,2]=4 5980 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [0,1,0,0,0,1|0,0,2]=4 5981 B12R1.371 C\C(\C=O)=C\c1ccccc1Br Amb24639745 [0,1,0,0,0,1|0,0,1]=3 5982 B12R1.371 C\C(\C=O)=C\c1ccccc1Cl Amb25827711 [0,1,0,0,0,1|0,0,1]=3 5983 B12R1.371 C\C(\C=O)=C\c1ccccc1F Amb25793939 [0,1,0,0,0,1|0,0,1]=3 5984 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [0,1,0,0,0,1|1,0,1]=4 5985 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [0,1,0,0,0,1|1,0,1]=4 5986 B12R1.371 Cc1c[n]ccc1NC(C)C=C Amb24442653 [0,1,0,0,0,1|2,0,0]=4 5987 B12R1.371 Cc1c[n]ccc1\C=C(\C)/C=O Amb24600808 [0,1,0,0,0,1|1,0,1]=4 5988 B12R1.371 Cc1cc[n]cc1CC(C)C=O Amb24685546 [0,1,0,0,0,1|1,0,0]=3 5989 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [0,1,0,0,0,1|0,0,0]=2 5990 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [0,1,0,0,0,1|1,0,1]=4 5991 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [0,1,0,0,0,1|0,0,2]=4 5992 B12R1.371 Cc1ccccc1CC(C)NC Amb24271197 [0,1,0,0,0,1|2,0,0]=4 5993 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [0,1,0,0,0,1|1,0,0]=3 5994 B12R1.371 Cc1ccccc1CN(C)C=O Amb25088109 [0,1,0,0,0,1|1,0,0]=3 5995 B12R1.371 Cc1ccccc1NC(C)C#C Amb25187507 [0,1,0,0,0,1|1,0,1]=4 5996 B12R1.371 Cc1ccccc1NC(C)CN Amb18251701 [0,1,0,0,0,1|1,0,1]=4 5997 B12R1.371 Cc1ccccc1NC(C)CO Amb18971809 [0,1,0,0,0,1|0,0,2]=4 5998 B12R1.371 Cc1ccccc1SC(C)C#N Amb18790889 [0,1,0,0,0,1|1,0,1]=4 5999 B12R1.371 Cc1ccccc1SC(C)C=C Amb25098335 [0,1,0,0,0,1|1,0,0]=3 6000 B12R1.371 Cc1ccccc1SC(C)CN Amb18299446 [0,1,0,0,0,1|1,0,1]=4 6001 B12R1.371 Cc1ccccc1\C=C(\C)/C=O Amb25230198 [0,1,0,0,0,1|0,0,1]=3 6002 B12R1.371 Cc1ccccc1\C=C(\F)/C=O Amb24612450 [0,1,0,0,0,1|1,0,1]=4 6003 B12R1.371 ClCC(Oc1ccccc1Br)C Amb17261132 [0,1,0,0,0,1|1,0,1]=4 6004 B12R1.371 ClCC(Oc1ccccc1C)C Amb17234168 [0,1,0,0,0,1|1,0,1]=4 6005 B12R1.371 ClCC(Oc1ccccc1Cl)C Amb17238289 [0,1,0,0,0,1|1,0,1]=4 6006 B12R1.371 ClCC(Oc1ccccc1F)C Amb17234613 [0,1,0,0,0,1|1,0,1]=4 6007 B12R1.371 N#CC(Nc1ccccc1Br)C Amb17406668 [0,1,0,0,0,1|1,0,1]=4 6008 B12R1.371 N#CC(Nc1ccccc1C)C Amb17400076 [0,1,0,0,0,1|1,0,1]=4 6009 B12R1.371 N#CC(Nc1ccccc1Cl)C Amb17400851 [0,1,0,0,0,1|1,0,1]=4 6010 B12R1.371 N#CC(Nc1ccccc1F)C Amb17400147 [0,1,0,0,0,1|1,0,1]=4 6011 B12R1.371 N#CC(Sc1ccccc1Br)C Amb10619954 [0,1,0,0,0,1|1,0,1]=4 6012 B12R1.371 N#CC(Sc1ccccc1F)C Amb10665504 [0,1,0,0,0,1|1,0,1]=4 6013 B12R1.371 Nc1[n]cccc1CC(O)C=O Amb24388693 [0,1,0,0,0,1|2,0,0]=4 6014 B12R1.371 Nc1cc[n]cc1CC(O)C=O Amb25115388 [0,1,0,0,0,1|2,0,0]=4 6015 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [0,1,0,0,0,1|1,0,0]=3 6016 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [0,1,0,0,0,1|1,0,0]=3 6017 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [0,1,0,0,0,1|1,0,0]=3 6018 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [0,1,0,0,0,1|1,0,0]=3 6019 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [0,1,0,0,0,1|1,0,0]=3 6020 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [0,1,0,0,0,1|1,0,0]=3 6021 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [0,1,0,0,0,1|1,0,0]=3 6022 B12R1.371 O=C\C(=C\c1ccccc1C)\C Amb17334495 [0,1,0,0,0,1|0,0,1]=3 6023 B12R1.371 O=C\C(=C\c1ccccc1Cl)\C Amb17335454 [0,1,0,0,0,1|0,0,1]=3 6024 B12R1.371 O=C\C(=C\c1ccccc1F)\C Amb17334598 [0,1,0,0,0,1|0,0,1]=3 6025 B12R1.371 OC(Cc1[n]cccc1Br)C=O Amb25817354 [0,1,0,0,0,1|2,0,0]=4 6026 B12R1.371 OC(Cc1cc[n]cc1Cl)C=O Amb25789139 [0,1,0,0,0,1|2,0,0]=4 6027 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [0,1,0,0,0,1|1,0,0]=3 6028 B12R1.371 OCC(Oc1ccccc1Br)C Amb17249276 [0,1,0,0,0,1|0,0,2]=4 6029 B12R1.371 OCC(Oc1ccccc1C)C Amb17232600 [0,1,0,0,0,1|0,0,2]=4 6030 B12R1.371 OCC(Oc1ccccc1Cl)C Amb17234356 [0,1,0,0,0,1|0,0,2]=4 6031 B12R1.371 OCC(Oc1ccccc1F)C Amb17232739 [0,1,0,0,0,1|0,0,2]=4 6032 B12R1.371 ON(Cc1ccccc1Cl)C=O Amb22469654 [0,1,0,0,0,1|2,0,0]=4 6033 B12R1.371 O\C(\C=O)=C/c1ccccc1F Amb24532563 [0,1,0,0,0,1|1,0,1]=4 6034 B12R1.371 O\C(\C=O)=C\c1ccccc1F Amb24621919 [0,1,0,0,0,1|1,0,1]=4 6035 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [0,1,0,0,0,1|1,0,0]=3 6036 B12R1.365 CN(N=O)C1=CC=CC=CC1=O Amb25128922 [0,1,0,0,0,1|2,0,0]=4 6037 B12R1.1161 CC(C)(C=O)C1C=CC=CC=C1 Amb25082754 [0,1,0,0,0,1|0,0,1]=3 6038 B12R1.1287 N#CC(C=O)=C1C=CC=CC=C1 Amb25707728 [0,1,0,0,0,1|0,0,2]=4 6039 B12R1.1287 O=CC(C=O)=C1C=CC=CC=C1 Amb25325038 [0,1,0,0,0,1|0,0,2]=4 6040 B12R1.1287 [O-]\C=C(\C=O)/C=1C=CCC=CC1 Amb25785580 [0,1,0,0,0,1|0,0,2]=4 6041 B12R1.1287 [O-]\C=C(\C=O)/C=1CC=CC=CC1 Amb24567154 [0,1,0,0,0,1|0,0,2]=4 6042 B12R1.1564 CC(N=C=O)C=1CC=CC=CC1 Amb25690250 [0,1,0,0,0,1|0,0,1]=3 6043 B12R1.1564 O=C\C=C(/Cl)\C=1CC=CC=CC1 Amb25143404 [0,1,0,0,0,1|1,0,1]=4 6044 B12R1.2197 CC(C(O)=O)C=1CC=CC=CC1 Amb24711216 [0,1,0,0,0,1|0,0,0]=2 6045 B12R1.2197 NC(C1C=CC=CC=C1)C(O)=O Amb25751352 [0,1,0,0,0,1|1,0,1]=4 6046 B12R1.9 BrCC(c1ccc(cc1)Br)(C)C Amb17176661 [0,2,0,0,0,0|1,0,1]=4 6047 B12R1.9 BrCC(c1ccc(cc1)C)(C)C Amb17142266 [0,2,0,0,0,0|1,0,1]=4 6048 B12R1.9 BrCC(c1ccc(cc1)Cl)(C)C Amb17160232 [0,2,0,0,0,0|1,0,1]=4 6049 B12R1.9 BrCC(c1ccc(cc1)F)(C)C Amb17142693 [0,2,0,0,0,0|1,0,1]=4 6050 B12R1.9 C#CC(c1ccc(cc1)C)(O)C Amb10877520 [0,2,0,0,0,0|1,0,1]=4 6051 B12R1.9 CC(C)(C#N)c1ccc(N)cc1 Amb19374557 [0,2,0,0,0,0|1,0,1]=4 6052 B12R1.9 CC(C)(C#N)c1ccc(O)cc1 Amb18645500 [0,2,0,0,0,0|1,0,1]=4 6053 B12R1.9 CC(C)(CC)c1ccc(Br)cc1 Amb22059809 [0,2,0,0,0,0|1,0,1]=4 6054 B12R1.9 CC(C)(CC)c1ccc(Cl)cc1 Amb25782461 [0,2,0,0,0,0|1,0,1]=4 6055 B12R1.9 CC(C)(CC)c1ccc(S)cc1 Amb25697742 [0,2,0,0,0,0|1,0,1]=4 6056 B12R1.9 CC(C)(CCl)c1ccc(O)cc1 Amb18649047 [0,2,0,0,0,0|1,0,1]=4 6057 B12R1.9 CC(C)(CF)c1ccc(Cl)cc1 Amb24738517 [0,2,0,0,0,0|1,0,1]=4 6058 B12R1.9 CC(C)(CN)c1ccc(N)cc1 Amb18062052 [0,2,0,0,0,0|1,0,1]=4 6059 B12R1.9 CC(C)(CN)c1ccc(O)cc1 Amb25108120 [0,2,0,0,0,0|1,0,1]=4 6060 B12R1.9 CC(C)(CO)c1ccc(N)cc1 Amb18062042 [0,2,0,0,0,0|0,0,2]=4 6061 B12R1.9 CC(C)(NC)c1ccc(Br)cc1 Amb18571608 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.9 CC(C)(NC)c1ccc(Cl)cc1 Amb18564269 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.9 CC(C)(NC)c1ccc(F)cc1 Amb18563814 [0,2,0,0,0,0|2,0,0]=4 6064 B12R1.9 CC(C)(OC)c1ccc(Br)cc1 Amb24697553 [0,2,0,0,0,0|2,0,0]=4 6065 B12R1.9 CC(F)(C#N)c1ccc(Cl)cc1 Amb22546820 [0,2,0,0,0,0|1,0,1]=4 6066 B12R1.9 CC(F)(CBr)c1ccc(I)cc1 Amb22227536 [0,2,0,0,0,0|1,0,1]=4 6067 B12R1.9 CC(F)(CN)c1ccc(Cl)cc1 Amb25843368 [0,2,0,0,0,0|1,0,1]=4 6068 B12R1.9 CC(F)(CN)c1ccc(F)cc1 Amb25721976 [0,2,0,0,0,0|1,0,1]=4 6069 B12R1.9 CC(F)(CO)c1ccc(Cl)cc1 Amb22547012 [0,2,0,0,0,0|0,0,2]=4 6070 B12R1.9 CC(N)(C#N)c1ccc(Br)cc1 Amb22901050 [0,2,0,0,0,0|1,0,1]=4 6071 B12R1.9 CC(N)(C#N)c1ccc(N)cc1 Amb25308213 [0,2,0,0,0,0|1,0,1]=4 6072 B12R1.9 CC(N)(C=C)c1ccc(Br)cc1 Amb25089359 [0,2,0,0,0,0|1,0,0]=3 6073 B12R1.9 CC(N)(C=C)c1ccc(Cl)cc1 Amb24341852 [0,2,0,0,0,0|1,0,0]=3 6074 B12R1.9 CC(N)(C=C)c1ccc(F)cc1 Amb25222617 [0,2,0,0,0,0|1,0,0]=3 6075 B12R1.9 CC(N)(CC)c1ccc(O)cc1 Amb24683865 [0,2,0,0,0,0|1,0,1]=4 6076 B12R1.9 CC(N)(CC)c1ccc(S)cc1 Amb24752387 [0,2,0,0,0,0|1,0,1]=4 6077 B12R1.9 CC(N)(CF)c1ccc(Cl)cc1 Amb24495722 [0,2,0,0,0,0|1,0,1]=4 6078 B12R1.9 CC(N)(CF)c1ccc(F)cc1 Amb24497201 [0,2,0,0,0,0|1,0,1]=4 6079 B12R1.9 CC(N)(CN)c1ccc(Cl)cc1 Amb25803435 [0,2,0,0,0,0|1,0,1]=4 6080 B12R1.9 CC(N)(CO)c1ccc(Br)cc1 Amb18951193 [0,2,0,0,0,0|0,0,2]=4 6081 B12R1.9 CC(N)(CO)c1ccc(Cl)cc1 Amb18951180 [0,2,0,0,0,0|0,0,2]=4 6082 B12R1.9 CC(N)(CO)c1ccc(I)cc1 Amb25364992 [0,2,0,0,0,0|0,0,2]=4 6083 B12R1.9 CC(N)(CO)c1ccc(N)cc1 Amb24581213 [0,2,0,0,0,0|0,0,2]=4 6084 B12R1.9 CC(N)(CO)c1ccc(O)cc1 Amb18951187 [0,2,0,0,0,0|0,0,2]=4 6085 B12R1.9 CC(O)(C#C)c1ccc(F)cc1 Amb22337400 [0,2,0,0,0,0|1,0,1]=4 6086 B12R1.9 CC(O)(C#C)c1ccc(I)cc1 Amb25159882 [0,2,0,0,0,0|1,0,1]=4 6087 B12R1.9 CC(O)(C#C)c1ccc(O)cc1 Amb24466978 [0,2,0,0,0,0|1,0,1]=4 6088 B12R1.9 CC(O)(C#N)c1ccc(Br)cc1 Amb23443397 [0,2,0,0,0,0|1,0,1]=4 6089 B12R1.9 CC(O)(C#N)c1ccc(Cl)cc1 Amb24685194 [0,2,0,0,0,0|1,0,1]=4 6090 B12R1.9 CC(O)(C#N)c1ccc(F)cc1 Amb24079185 [0,2,0,0,0,0|1,0,1]=4 6091 B12R1.9 CC(O)(C#N)c1ccc(O)cc1 Amb25159905 [0,2,0,0,0,0|1,0,1]=4 6092 B12R1.9 CC(O)(C=C)c1ccc(I)cc1 Amb25159815 [0,2,0,0,0,0|1,0,0]=3 6093 B12R1.9 CC(O)(C=C)c1ccc(N)cc1 Amb24744464 [0,2,0,0,0,0|1,0,0]=3 6094 B12R1.9 CC(O)(C=O)c1ccc(Cl)cc1 Amb25148971 [0,2,0,0,0,0|0,0,0]=2 6095 B12R1.9 CC(O)(C=O)c1ccc(F)cc1 Amb25149978 [0,2,0,0,0,0|0,0,0]=2 6096 B12R1.9 CC(O)(CCl)c1ccc(Cl)cc1 Amb25327523 [0,2,0,0,0,0|1,0,1]=4 6097 B12R1.9 CC(O)(CCl)c1ccc(O)cc1 Amb18649470 [0,2,0,0,0,0|1,0,1]=4 6098 B12R1.9 CC(O)(CN)c1ccc(O)cc1 Amb18251883 [0,2,0,0,0,0|1,0,1]=4 6099 B12R1.9 CC(O)(CO)c1ccc(Br)cc1 Amb23596478 [0,2,0,0,0,0|0,0,2]=4 6100 B12R1.9 CC(O)(CO)c1ccc(F)cc1 Amb25761688 [0,2,0,0,0,0|0,0,2]=4 6101 B12R1.9 CC(O)(CO)c1ccc(I)cc1 Amb25159883 [0,2,0,0,0,0|0,0,2]=4 6102 B12R1.9 CC(O)(OC)c1ccc(N)cc1 Amb25376968 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.9 CCC(C)(O)c1ccc(C)cc1 Amb17778025 [0,2,0,0,0,0|1,0,1]=4 6104 B12R1.9 CCC(c1ccc(cc1)N)(C)C Amb16233831 [0,2,0,0,0,0|1,0,1]=4 6105 B12R1.9 C[C@@](N)(C#N)c1ccc(Cl)cc1 Amb25352610 [0,2,0,0,0,0|1,0,1]=4 6106 B12R1.9 C[C@@](N)(C#N)c1ccc(F)cc1 Amb25089200 [0,2,0,0,0,0|1,0,1]=4 6107 B12R1.9 C[C@@](N)(C#N)c1ccc(N)cc1 Amb24525120 [0,2,0,0,0,0|1,0,1]=4 6108 B12R1.9 C[C@@](N)(C#N)c1ccc(O)cc1 Amb25775242 [0,2,0,0,0,0|1,0,1]=4 6109 B12R1.9 C[C@@](N)(C=C)c1ccc(Br)cc1 Amb24395397 [0,2,0,0,0,0|1,0,0]=3 6110 B12R1.9 C[C@@](N)(C=C)c1ccc(Cl)cc1 Amb25308047 [0,2,0,0,0,0|1,0,0]=3 6111 B12R1.9 C[C@@](N)(C=C)c1ccc(F)cc1 Amb25070792 [0,2,0,0,0,0|1,0,0]=3 6112 B12R1.9 C[C@@](N)(C=C)c1ccc(N)cc1 Amb25734783 [0,2,0,0,0,0|1,0,0]=3 6113 B12R1.9 C[C@@](N)(C=C)c1ccc(O)cc1 Amb24586383 [0,2,0,0,0,0|1,0,0]=3 6114 B12R1.9 C[C@@](N)(CC)c1ccc(F)cc1 Amb25841687 [0,2,0,0,0,0|1,0,1]=4 6115 B12R1.9 C[C@@](N)(CC)c1ccc(O)cc1 Amb24384289 [0,2,0,0,0,0|1,0,1]=4 6116 B12R1.9 C[C@@](N)(CO)c1ccc(Cl)cc1 Amb25148573 [0,2,0,0,0,0|0,0,2]=4 6117 B12R1.9 C[C@@](O)(CO)c1ccc(Cl)cc1 Amb24748426 [0,2,0,0,0,0|0,0,2]=4 6118 B12R1.9 C[C@@](O)(CO)c1ccc(F)cc1 Amb25332367 [0,2,0,0,0,0|0,0,2]=4 6119 B12R1.9 C[C@](N)(C#N)c1ccc(F)cc1 Amb25085035 [0,2,0,0,0,0|1,0,1]=4 6120 B12R1.9 C[C@](N)(C#N)c1ccc(N)cc1 Amb25699050 [0,2,0,0,0,0|1,0,1]=4 6121 B12R1.9 C[C@](N)(C=C)c1ccc(F)cc1 Amb25853605 [0,2,0,0,0,0|1,0,0]=3 6122 B12R1.9 C[C@](N)(CC)c1ccc(Br)cc1 Amb25341308 [0,2,0,0,0,0|1,0,1]=4 6123 B12R1.9 C[C@](N)(CC)c1ccc(Cl)cc1 Amb24597715 [0,2,0,0,0,0|1,0,1]=4 6124 B12R1.9 C[C@](N)(CC)c1ccc(F)cc1 Amb25353793 [0,2,0,0,0,0|1,0,1]=4 6125 B12R1.9 C[C@](N)(CO)c1ccc(Br)cc1 Amb25312038 [0,2,0,0,0,0|0,0,2]=4 6126 B12R1.9 C[C@](N)(CO)c1ccc(O)cc1 Amb25703567 [0,2,0,0,0,0|0,0,2]=4 6127 B12R1.9 C[C@](N)(CO)c1ccc(S)cc1 Amb25830476 [0,2,0,0,0,0|0,0,2]=4 6128 B12R1.9 C[C@](O)(CO)c1ccc(Cl)cc1 Amb24497751 [0,2,0,0,0,0|0,0,2]=4 6129 B12R1.9 C[Si](C)(C=C)c1ccc(N)cc1 Amb24537620 [0,2,0,0,0,0|1,1,0]=4 6130 B12R1.9 Cc1ccc(cc1)C(C)(C)C#N Amb18039834 [0,2,0,0,0,0|1,0,1]=4 6131 B12R1.9 Cc1ccc(cc1)C(C)(C)NC Amb18563592 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.9 Cc1ccc(cc1)C(C)(F)CN Amb24385756 [0,2,0,0,0,0|1,0,1]=4 6133 B12R1.9 Cc1ccc(cc1)C(C)(N)CF Amb24470767 [0,2,0,0,0,0|1,0,1]=4 6134 B12R1.9 Cc1ccc(cc1)C(C)(N)CO Amb18951186 [0,2,0,0,0,0|0,0,2]=4 6135 B12R1.9 Cc1ccc(cc1)C(F)(F)C=O Amb25667436 [0,2,0,0,0,0|1,0,0]=3 6136 B12R1.9 Cc1ccc(cc1)[C@@](C)(N)CO Amb25090443 [0,2,0,0,0,0|0,0,2]=4 6137 B12R1.9 Cc1ccc(cc1)[C@@](C)(O)CO Amb25846225 [0,2,0,0,0,0|0,0,2]=4 6138 B12R1.9 Cc1ccc(cc1)[C@](C)(N)C#N Amb24729712 [0,2,0,0,0,0|1,0,1]=4 6139 B12R1.9 Cc1ccc(cc1)[C@](C)(N)C=C Amb24403134 [0,2,0,0,0,0|1,0,0]=3 6140 B12R1.9 Cc1ccc(cc1)[C@](C)(O)C=O Amb24364108 [0,2,0,0,0,0|0,0,0]=2 6141 B12R1.9 ClCC(c1ccc(cc1)Br)(C)C Amb17160229 [0,2,0,0,0,0|1,0,1]=4 6142 B12R1.9 ClCC(c1ccc(cc1)C)(C)C Amb17139046 [0,2,0,0,0,0|1,0,1]=4 6143 B12R1.9 ClCC(c1ccc(cc1)Cl)(C)C Amb17139903 [0,2,0,0,0,0|1,0,1]=4 6144 B12R1.9 ClCC(c1ccc(cc1)F)(C)C Amb17139158 [0,2,0,0,0,0|1,0,1]=4 6145 B12R1.9 N#CC(c1ccc(cc1)Br)(N)C Amb1126882 [0,2,0,0,0,0|1,0,1]=4 6146 B12R1.9 N#CC(c1ccc(cc1)C)(N)C Amb1126682 [0,2,0,0,0,0|1,0,1]=4 6147 B12R1.9 N#CC(c1ccc(cc1)Cl)(C)C Amb17400749 [0,2,0,0,0,0|1,0,1]=4 6148 B12R1.9 N#CC(c1ccc(cc1)Cl)(N)C Amb1131748 [0,2,0,0,0,0|1,0,1]=4 6149 B12R1.9 N#CC(c1ccc(cc1)F)(C)C Amb17400128 [0,2,0,0,0,0|1,0,1]=4 6150 B12R1.9 N#CC(c1ccc(cc1)F)(N)C Amb1127738 [0,2,0,0,0,0|1,0,1]=4 6151 B12R1.9 NCC(c1ccc(cc1)Cl)(O)C Amb1993839 [0,2,0,0,0,0|1,0,1]=4 6152 B12R1.9 NCC(c1ccc(cc1)Cl)(O)C Amb1993965 [0,2,0,0,0,0|1,0,1]=4 6153 B12R1.9 O=CC(F)(F)c1ccc(Cl)cc1 Amb24669100 [0,2,0,0,0,0|1,0,0]=3 6154 B12R1.9 O=CC(F)(F)c1ccc(F)cc1 Amb24418037 [0,2,0,0,0,0|1,0,0]=3 6155 B12R1.9 O=CC(c1ccc(cc1)Br)(C)C Amb17247623 [0,2,0,0,0,0|0,0,0]=2 6156 B12R1.9 O=CC(c1ccc(cc1)C)(C)C Amb17232410 [0,2,0,0,0,0|0,0,0]=2 6157 B12R1.9 O=CC(c1ccc(cc1)Cl)(C)C Amb17233962 [0,2,0,0,0,0|0,0,0]=2 6158 B12R1.9 O=CC(c1ccc(cc1)F)(C)C Amb17232577 [0,2,0,0,0,0|0,0,0]=2 6159 B12R1.9 OCC(c1ccc(cc1)Br)(C)C Amb17142529 [0,2,0,0,0,0|0,0,2]=4 6160 B12R1.9 OCC(c1ccc(cc1)C)(C)C Amb17138580 [0,2,0,0,0,0|0,0,2]=4 6161 B12R1.9 OCC(c1ccc(cc1)F)(C)C Amb17138634 [0,2,0,0,0,0|0,0,2]=4 6162 B12R1.10 BrCC(c1cccc(c1)Br)(C)C Amb17176660 [0,2,0,0,0,0|1,0,1]=4 6163 B12R1.10 BrCC(c1cccc(c1)C)(C)C Amb17142265 [0,2,0,0,0,0|1,0,1]=4 6164 B12R1.10 BrCC(c1cccc(c1)Cl)(C)C Amb17160231 [0,2,0,0,0,0|1,0,1]=4 6165 B12R1.10 BrCC(c1cccc(c1)F)(C)C Amb17142692 [0,2,0,0,0,0|1,0,1]=4 6166 B12R1.10 CC(C)(C#N)c1cccc(Br)c1 Amb22001515 [0,2,0,0,0,0|1,0,1]=4 6167 B12R1.10 CC(C)(C#N)c1cccc(Cl)c1 Amb18796202 [0,2,0,0,0,0|1,0,1]=4 6168 B12R1.10 CC(C)(C#N)c1cccc(F)c1 Amb18792472 [0,2,0,0,0,0|1,0,1]=4 6169 B12R1.10 CC(C)(C#N)c1cccc(N)c1 Amb19958105 [0,2,0,0,0,0|1,0,1]=4 6170 B12R1.10 CC(C)(C#N)c1cccc(O)c1 Amb18645503 [0,2,0,0,0,0|1,0,1]=4 6171 B12R1.10 CC(C)(C#N)c1cccc(S)c1 Amb25096160 [0,2,0,0,0,0|1,0,1]=4 6172 B12R1.10 CC(C)(C=O)c1c[n]cc(Br)c1 Amb25160094 [0,2,0,0,0,0|1,0,0]=3 6173 B12R1.10 CC(C)(C=O)c1cccc(O)c1 Amb24399260 [0,2,0,0,0,0|0,0,0]=2 6174 B12R1.10 CC(C)(CC)c1cccc(Br)c1 Amb25780961 [0,2,0,0,0,0|1,0,1]=4 6175 B12R1.10 CC(C)(CC)c1cccc(N)c1 Amb25111077 [0,2,0,0,0,0|1,0,1]=4 6176 B12R1.10 CC(C)(CN)c1cc(N)ccc1 Amb18062066 [0,2,0,0,0,0|1,0,1]=4 6177 B12R1.10 CC(C)(CN)c1cccc(F)c1 Amb21856717 [0,2,0,0,0,0|1,0,1]=4 6178 B12R1.10 CC(C)(CN)c1cccc(O)c1 Amb25150967 [0,2,0,0,0,0|1,0,1]=4 6179 B12R1.10 CC(C)(CO)c1cc(O)ccc1 Amb25714284 [0,2,0,0,0,0|0,0,2]=4 6180 B12R1.10 CC(C)(CO)c1cccc(N)c1 Amb18062063 [0,2,0,0,0,0|0,0,2]=4 6181 B12R1.10 CC(C)(NC)c1cccc(Br)c1 Amb18068461 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.10 CC(C)(NC)c1cccc(Cl)c1 Amb18564268 [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.10 CC(C)(NC)c1cccc(F)c1 Amb18563816 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.10 CC(Cl)(CC)c1cccc(O)c1 Amb24588962 [0,2,0,0,0,0|1,0,1]=4 6185 B12R1.10 CC(F)(CN)c1cc(F)ccc1 Amb24760874 [0,2,0,0,0,0|1,0,1]=4 6186 B12R1.10 CC(F)(CN)c1cccc(O)c1 Amb24637007 [0,2,0,0,0,0|1,0,1]=4 6187 B12R1.10 CC(N)(C=C)c1cc(N)ccc1 Amb24686717 [0,2,0,0,0,0|1,0,0]=3 6188 B12R1.10 CC(N)(C=C)c1cccc(Br)c1 Amb24384150 [0,2,0,0,0,0|1,0,0]=3 6189 B12R1.10 CC(N)(CC)c1cccc(O)c1 Amb24658664 [0,2,0,0,0,0|1,0,1]=4 6190 B12R1.10 CC(N)(CC)c1cccc(S)c1 Amb25107711 [0,2,0,0,0,0|1,0,1]=4 6191 B12R1.10 CC(N)(CO)c1cc(O)ccc1 Amb18951190 [0,2,0,0,0,0|0,0,2]=4 6192 B12R1.10 CC(N)(CO)c1cccc(Br)c1 Amb18951179 [0,2,0,0,0,0|0,0,2]=4 6193 B12R1.10 CC(N)(CO)c1cccc(Cl)c1 Amb18951185 [0,2,0,0,0,0|0,0,2]=4 6194 B12R1.10 CC(N)(CO)c1cccc(F)c1 Amb18951200 [0,2,0,0,0,0|0,0,2]=4 6195 B12R1.10 CC(N)(CO)c1cccc(S)c1 Amb24618194 [0,2,0,0,0,0|0,0,2]=4 6196 B12R1.10 CC(O)(C#C)c1cccc(F)c1 Amb22337398 [0,2,0,0,0,0|1,0,1]=4 6197 B12R1.10 CC(O)(C#N)c1cc(O)ccc1 Amb25127706 [0,2,0,0,0,0|1,0,1]=4 6198 B12R1.10 CC(O)(C#N)c1cccc(Br)c1 Amb25699184 [0,2,0,0,0,0|1,0,1]=4 6199 B12R1.10 CC(O)(C=C)c1cccc(F)c1 Amb25275001 [0,2,0,0,0,0|1,0,0]=3 6200 B12R1.10 CC(O)(C=O)c1c[n]cc(F)c1 Amb25297312 [0,2,0,0,0,0|1,0,0]=3 6201 B12R1.10 CC(O)(C=O)c1cccc(Cl)c1 Amb24362178 [0,2,0,0,0,0|0,0,0]=2 6202 B12R1.10 CC(O)(C=O)c1cccc(F)c1 Amb24672954 [0,2,0,0,0,0|0,0,0]=2 6203 B12R1.10 CC(O)(CCl)c1cc(Cl)ccc1 Amb24724591 [0,2,0,0,0,0|1,0,1]=4 6204 B12R1.10 CC(O)(CN)c1cc(O)ccc1 Amb18827193 [0,2,0,0,0,0|1,0,1]=4 6205 B12R1.10 CC(O)(CN)c1cccc(Br)c1 Amb18964412 [0,2,0,0,0,0|1,0,1]=4 6206 B12R1.10 CC(O)(CN)c1cccc(Cl)c1 Amb18287268 [0,2,0,0,0,0|1,0,1]=4 6207 B12R1.10 CC(O)(CN)c1cccc(F)c1 Amb18287327 [0,2,0,0,0,0|1,0,1]=4 6208 B12R1.10 CC(O)(CO)c1cccc(Cl)c1 Amb25380667 [0,2,0,0,0,0|0,0,2]=4 6209 B12R1.10 CCC(C)(N)c1cc(N)ccc1 Amb25844234 [0,2,0,0,0,0|1,0,1]=4 6210 B12R1.10 CC[C@@](C)(N)c1cc(N)ccc1 Amb25329698 [0,2,0,0,0,0|1,0,1]=4 6211 B12R1.10 C[C@@](N)(C=C)c1cc(N)ccc1 Amb25329821 [0,2,0,0,0,0|1,0,0]=3 6212 B12R1.10 C[C@@](N)(C=C)c1cccc(O)c1 Amb24445166 [0,2,0,0,0,0|1,0,0]=3 6213 B12R1.10 C[C@@](N)(CC)c1cccc(O)c1 Amb25140887 [0,2,0,0,0,0|1,0,1]=4 6214 B12R1.10 C[C@@](N)(CO)c1cccc(Br)c1 Amb24182165 [0,2,0,0,0,0|0,0,2]=4 6215 B12R1.10 C[C@@](N)(CO)c1cccc(F)c1 Amb25152292 [0,2,0,0,0,0|0,0,2]=4 6216 B12R1.10 C[C@](N)(C#N)c1cc(N)ccc1 Amb25090995 [0,2,0,0,0,0|1,0,1]=4 6217 B12R1.10 C[C@](N)(C#N)c1cccc(O)c1 Amb24462986 [0,2,0,0,0,0|1,0,1]=4 6218 B12R1.10 C[C@](N)(CO)c1cc(O)ccc1 Amb24392857 [0,2,0,0,0,0|0,0,2]=4 6219 B12R1.10 C[C@](N)(CO)c1cccc(Cl)c1 Amb25148572 [0,2,0,0,0,0|0,0,2]=4 6220 B12R1.10 C[C@](N)(CO)c1cccc(I)c1 Amb24615723 [0,2,0,0,0,0|0,0,2]=4 6221 B12R1.10 C[C@](N)(CO)c1cccc(S)c1 Amb25667229 [0,2,0,0,0,0|0,0,2]=4 6222 B12R1.10 C[C@](O)(CO)c1cccc(Br)c1 Amb25699969 [0,2,0,0,0,0|0,0,2]=4 6223 B12R1.10 Cc1cccc(c1)C(C)(C)C#N Amb18792116 [0,2,0,0,0,0|1,0,1]=4 6224 B12R1.10 Cc1cccc(c1)C(C)(C)NC Amb18563591 [0,2,0,0,0,0|2,0,0]=4 6225 B12R1.10 Cc1cccc(c1)C(C)(F)CN Amb24655335 [0,2,0,0,0,0|1,0,1]=4 6226 B12R1.10 Cc1cccc(c1)C(C)(N)C=C Amb25315319 [0,2,0,0,0,0|1,0,0]=3 6227 B12R1.10 Cc1cccc(c1)C(C)(N)CO Amb18953087 [0,2,0,0,0,0|0,0,2]=4 6228 B12R1.10 Cc1cccc(c1)C(C)(O)C#N Amb24497478 [0,2,0,0,0,0|1,0,1]=4 6229 B12R1.10 Cc1cccc(c1)C(C)(O)C=O Amb24374068 [0,2,0,0,0,0|0,0,0]=2 6230 B12R1.10 Cc1cccc(c1)C(C)(O)CN Amb18964289 [0,2,0,0,0,0|1,0,1]=4 6231 B12R1.10 Cc1cccc(c1)[C@@](C)(N)C=C Amb25849973 [0,2,0,0,0,0|1,0,0]=3 6232 B12R1.10 Cc1cccc(c1)[C@@](C)(N)CC Amb25342528 [0,2,0,0,0,0|1,0,1]=4 6233 B12R1.10 Cc1cccc(c1)[C@@](C)(O)CO Amb25107665 [0,2,0,0,0,0|0,0,2]=4 6234 B12R1.10 Cc1cccc(c1)[C@](C)(N)CO Amb24656973 [0,2,0,0,0,0|0,0,2]=4 6235 B12R1.10 ClCC(c1cccc(c1)Br)(C)C Amb17160228 [0,2,0,0,0,0|1,0,1]=4 6236 B12R1.10 ClCC(c1cccc(c1)C)(C)C Amb17139045 [0,2,0,0,0,0|1,0,1]=4 6237 B12R1.10 ClCC(c1cccc(c1)Cl)(C)C Amb17139902 [0,2,0,0,0,0|1,0,1]=4 6238 B12R1.10 ClCC(c1cccc(c1)F)(C)C Amb17139157 [0,2,0,0,0,0|1,0,1]=4 6239 B12R1.10 NCC(c1cccc(c1)Br)(C)C Amb13952522 [0,2,0,0,0,0|1,0,1]=4 6240 B12R1.10 NCC(c1cccc(c1)C)(C)C Amb13951490 [0,2,0,0,0,0|1,0,1]=4 6241 B12R1.10 O=CC(c1cccc(c1)Br)(C)C Amb17247622 [0,2,0,0,0,0|0,0,0]=2 6242 B12R1.10 O=CC(c1cccc(c1)C)(C)C Amb17232409 [0,2,0,0,0,0|0,0,0]=2 6243 B12R1.10 O=CC(c1cccc(c1)Cl)(C)C Amb17233961 [0,2,0,0,0,0|0,0,0]=2 6244 B12R1.10 OCC(c1cccc(c1)Br)(C)C Amb17142528 [0,2,0,0,0,0|0,0,2]=4 6245 B12R1.10 OCC(c1cccc(c1)C)(C)C Amb17138579 [0,2,0,0,0,0|0,0,2]=4 6246 B12R1.10 OCC(c1cccc(c1)Cl)(C)C Amb17139098 [0,2,0,0,0,0|0,0,2]=4 6247 B12R1.10 OCC(c1cccc(c1)F)(C)C Amb17138633 [0,2,0,0,0,0|0,0,2]=4 6248 B12R1.39 C=CC[N+](c1ccccc1)(C)C Amb2228411 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.39 C=CC[Si](c1ccccc1)(C)C Amb2389294 [0,2,0,0,0,0|1,1,0]=4 6250 B12R1.39 CC(C)(CC#N)c1ccccc1 Amb18645224 [0,2,0,0,0,0|1,0,1]=4 6251 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [0,2,0,0,0,0|1,0,0]=3 6252 B12R1.39 CC(C)(CC=O)c1cccc[n]1 Amb24458826 [0,2,0,0,0,0|1,0,0]=3 6253 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,2,0,0,0,0|0,0,0]=2 6254 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,2,0,0,0,0|1,0,1]=4 6255 B12R1.39 CC(C)(CCN)c1ccccc1 Amb22755963 [0,2,0,0,0,0|1,0,1]=4 6256 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,2,0,0,0,0|0,0,2]=4 6257 B12R1.39 CC(C)(C[Hg]Cl)c1ccccc1 Amb22347662 [0,2,0,0,0,0|1,0,1]=4 6258 B12R1.39 CC(C)(C[Mg]Cl)c1ccccc1 Amb22336292 [0,2,0,0,0,0|1,0,1]=4 6259 B12R1.39 CC(C)(C[Zn]Cl)c1ccccc1 Amb22897847 [0,2,0,0,0,0|1,0,1]=4 6260 B12R1.39 CC(C)(N=[N+]=[N-])c1ccccc1 Amb25159577 [0,2,0,0,0,0|2,0,0]=4 6261 B12R1.39 CC(F)(CC#N)c1ccccc1 Amb24702719 [0,2,0,0,0,0|1,0,1]=4 6262 B12R1.39 CC(N)(CC=C)c1cc[n]cc1 Amb24405750 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.39 CC(N)(CC=C)c1cccc[n]1 Amb24555088 [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,2,0,0,0,0|0,0,2]=4 6265 B12R1.39 CC(O)(C#CBr)c1ccccc1 Amb22445849 [0,2,0,0,0,0|1,0,1]=4 6266 B12R1.39 CC(O)(CC=O)c1c[n]c[n]c1 Amb25148961 [0,2,0,0,0,0|2,0,0]=4 6267 B12R1.39 CC(O)(CC=O)c1c[n]cc[n]1 Amb25148959 [0,2,0,0,0,0|2,0,0]=4 6268 B12R1.39 CC(O)(CC=O)c1c[n]ccc1 Amb24631274 [0,2,0,0,0,0|1,0,0]=3 6269 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [0,2,0,0,0,0|0,0,0]=2 6270 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [0,2,0,0,0,0|1,0,1]=4 6271 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,2,0,0,0,0|0,0,2]=4 6272 B12R1.39 CC(O)(\C=C\Cl)c1ccccc1 Amb25257949 [0,2,0,0,0,0|1,0,0]=3 6273 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,2,0,0,0,0|0,0,2]=4 6274 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [0,2,0,0,0,0|1,0,1]=4 6275 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [0,2,0,0,0,0|0,0,2]=4 6276 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [0,2,0,0,0,0|0,0,2]=4 6277 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [0,2,0,0,0,0|0,0,2]=4 6278 B12R1.39 CP(=S)(CC=O)c1ccccc1 Amb25743462 [0,2,0,0,0,0|1,0,0]=3 6279 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [0,2,0,0,0,0|0,1,1]=4 6280 B12R1.39 C[C@@](N)(CC#N)c1ccccc1 Amb25059074 [0,2,0,0,0,0|1,0,1]=4 6281 B12R1.39 C[C@@](N)(CC=C)c1cc[n]cc1 Amb24414079 [0,2,0,0,0,0|2,0,0]=4 6282 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [0,2,0,0,0,0|1,0,0]=3 6283 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,2,0,0,0,0|0,0,2]=4 6284 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [0,2,0,0,0,0|1,0,1]=4 6285 B12R1.39 C[C@](N)(CC#N)c1ccccc1 Amb24559923 [0,2,0,0,0,0|1,0,1]=4 6286 B12R1.39 C[C@](N)(CC=C)c1c[n]ccc1 Amb25751494 [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.39 C[C@](N)(CC=C)c1cccc[n]1 Amb25141113 [0,2,0,0,0,0|2,0,0]=4 6288 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [0,2,0,0,0,0|1,0,1]=4 6289 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,2,0,0,0,0|0,0,2]=4 6290 B12R1.39 C[Si](C)(CC=O)c1ccccc1 Amb25264011 [0,2,0,0,0,0|0,1,0]=3 6291 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [0,2,0,0,0,0|1,0,1]=4 6292 B12R1.39 NNCC(c1ccccc1)(O)C Amb17232616 [0,2,0,0,0,0|1,0,1]=4 6293 B12R1.39 O=C=NC(Cl)(Cl)c1ccccc1 Amb24392248 [0,2,0,0,0,0|1,0,1]=4 6294 B12R1.39 O=C=NC(c1ccccc1)(C)C Amb17232367 [0,2,0,0,0,0|0,0,1]=3 6295 B12R1.39 O=CCS(=O)(=O)c1ccccc1 Amb19045395 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.39 [BH3-][P+](C)(CC=O)c1ccccc1 Amb24378353 [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.195 BrCC(c1ccccc1C)(C)C Amb17142264 [0,2,0,0,0,0|1,0,1]=4 6298 B12R1.195 BrCC(c1ccccc1Cl)(C)C Amb17160230 [0,2,0,0,0,0|1,0,1]=4 6299 B12R1.195 BrCC(c1ccccc1F)(C)C Amb17142691 [0,2,0,0,0,0|1,0,1]=4 6300 B12R1.195 CC(C)(C#C)c1ccccc1O Amb25294406 [0,2,0,0,0,0|1,0,1]=4 6301 B12R1.195 CC(C)(C#N)c1ccccc1Br Amb25068118 [0,2,0,0,0,0|1,0,1]=4 6302 B12R1.195 CC(C)(C#N)c1ccccc1Cl Amb18809276 [0,2,0,0,0,0|1,0,1]=4 6303 B12R1.195 CC(C)(C#N)c1ccccc1F Amb18792474 [0,2,0,0,0,0|1,0,1]=4 6304 B12R1.195 CC(C)(C#N)c1ccccc1I Amb25223176 [0,2,0,0,0,0|1,0,1]=4 6305 B12R1.195 CC(C)(C#N)c1ccccc1N Amb21856996 [0,2,0,0,0,0|1,0,1]=4 6306 B12R1.195 CC(C)(C=C)c1ccccc1N Amb18645541 [0,2,0,0,0,0|1,0,0]=3 6307 B12R1.195 CC(C)(C=C)c1ccccc1O Amb18645699 [0,2,0,0,0,0|1,0,0]=3 6308 B12R1.195 CC(C)(CC)c1ccccc1O Amb22232339 [0,2,0,0,0,0|1,0,1]=4 6309 B12R1.195 CC(C)(CN)c1ccccc1Cl Amb18028407 [0,2,0,0,0,0|1,0,1]=4 6310 B12R1.195 CC(C)(CN)c1ccccc1N Amb18062059 [0,2,0,0,0,0|1,0,1]=4 6311 B12R1.195 CC(C)(CO)c1ccccc1I Amb24413815 [0,2,0,0,0,0|0,0,2]=4 6312 B12R1.195 CC(C)(CO)c1ccccc1N Amb18559548 [0,2,0,0,0,0|0,0,2]=4 6313 B12R1.195 CC(C)(CO)c1ccccc1O Amb18646549 [0,2,0,0,0,0|0,0,2]=4 6314 B12R1.195 CC(C)(CO)c1ccccc1S Amb25157816 [0,2,0,0,0,0|0,0,2]=4 6315 B12R1.195 CC(C)(CS)c1ccccc1Br Amb24728573 [0,2,0,0,0,0|0,1,1]=4 6316 B12R1.195 CC(C)(CS)c1ccccc1Cl Amb25159818 [0,2,0,0,0,0|0,1,1]=4 6317 B12R1.195 CC(C)(NC)c1ccccc1Cl Amb18564267 [0,2,0,0,0,0|2,0,0]=4 6318 B12R1.195 CC(C)(NC)c1ccccc1F Amb18563813 [0,2,0,0,0,0|2,0,0]=4 6319 B12R1.195 CC(C)(OC)c1ccccc1O Amb25322841 [0,2,0,0,0,0|2,0,0]=4 6320 B12R1.195 CC(F)(CBr)c1ccccc1Cl Amb24385980 [0,2,0,0,0,0|1,0,1]=4 6321 B12R1.195 CC(F)(CN)c1ccccc1Cl Amb25716786 [0,2,0,0,0,0|1,0,1]=4 6322 B12R1.195 CC(F)(CN)c1ccccc1O Amb25208136 [0,2,0,0,0,0|1,0,1]=4 6323 B12R1.195 CC(N)(C=C)c1ccccc1Br Amb25688845 [0,2,0,0,0,0|1,0,0]=3 6324 B12R1.195 CC(N)(C=C)c1ccccc1F Amb25716891 [0,2,0,0,0,0|1,0,0]=3 6325 B12R1.195 CC(N)(C=C)c1ccccc1O Amb24591522 [0,2,0,0,0,0|1,0,0]=3 6326 B12R1.195 CC(N)(CN)c1ccccc1Cl Amb23555684 [0,2,0,0,0,0|1,0,1]=4 6327 B12R1.195 CC(N)(CO)c1ccccc1Br Amb18951183 [0,2,0,0,0,0|0,0,2]=4 6328 B12R1.195 CC(N)(CO)c1ccccc1Cl Amb18281684 [0,2,0,0,0,0|0,0,2]=4 6329 B12R1.195 CC(N)(CO)c1ccccc1F Amb18951197 [0,2,0,0,0,0|0,0,2]=4 6330 B12R1.195 CC(N)(CO)c1ccccc1I Amb24483865 [0,2,0,0,0,0|0,0,2]=4 6331 B12R1.195 CC(N)(CO)c1ccccc1N Amb24763767 [0,2,0,0,0,0|0,0,2]=4 6332 B12R1.195 CC(O)(C#C)c1ccccc1Br Amb25307865 [0,2,0,0,0,0|1,0,1]=4 6333 B12R1.195 CC(O)(C#C)c1ccccc1F Amb22337399 [0,2,0,0,0,0|1,0,1]=4 6334 B12R1.195 CC(O)(C#C)c1ccccc1N Amb25208377 [0,2,0,0,0,0|1,0,1]=4 6335 B12R1.195 CC(O)(C=C)c1ccccc1O Amb18646041 [0,2,0,0,0,0|1,0,0]=3 6336 B12R1.195 CC(O)(C=O)c1c[n]ccc1N Amb24718775 [0,2,0,0,0,0|1,0,0]=3 6337 B12R1.195 CC(O)(C=O)c1ccc[n]c1N Amb25057137 [0,2,0,0,0,0|1,0,0]=3 6338 B12R1.195 CC(O)(C=O)c1ccccc1Cl Amb25237346 [0,2,0,0,0,0|0,0,0]=2 6339 B12R1.195 CC(O)(CC)c1ccccc1N Amb23571658 [0,2,0,0,0,0|1,0,1]=4 6340 B12R1.195 CC(O)(CI)c1ccccc1Br Amb25100334 [0,2,0,0,0,0|1,0,1]=4 6341 B12R1.195 CC(O)(CI)c1ccccc1F Amb25850561 [0,2,0,0,0,0|1,0,1]=4 6342 B12R1.195 CC(O)(CN)c1ccccc1Br Amb18964413 [0,2,0,0,0,0|1,0,1]=4 6343 B12R1.195 CC(O)(CN)c1ccccc1Cl Amb18964290 [0,2,0,0,0,0|1,0,1]=4 6344 B12R1.195 CC(O)(CN)c1ccccc1F Amb18964415 [0,2,0,0,0,0|1,0,1]=4 6345 B12R1.195 CC(O)(CO)c1ccccc1F Amb24524966 [0,2,0,0,0,0|0,0,2]=4 6346 B12R1.195 C[C@@](N)(C#N)c1ccccc1Cl Amb24420483 [0,2,0,0,0,0|1,0,1]=4 6347 B12R1.195 C[C@@](N)(C#N)c1ccccc1F Amb25049439 [0,2,0,0,0,0|1,0,1]=4 6348 B12R1.195 C[C@@](N)(CC)c1ccccc1O Amb25849972 [0,2,0,0,0,0|1,0,1]=4 6349 B12R1.195 C[C@@](N)(CO)c1ccccc1Br Amb24443858 [0,2,0,0,0,0|0,0,2]=4 6350 B12R1.195 C[C@@](N)(CO)c1ccccc1O Amb24745490 [0,2,0,0,0,0|0,0,2]=4 6351 B12R1.195 C[C@](N)(C#N)c1ccccc1Cl Amb24396049 [0,2,0,0,0,0|1,0,1]=4 6352 B12R1.195 C[C@](N)(C=C)c1ccccc1Br Amb24427193 [0,2,0,0,0,0|1,0,0]=3 6353 B12R1.195 C[C@](N)(CC)c1ccccc1O Amb25751482 [0,2,0,0,0,0|1,0,1]=4 6354 B12R1.195 C[C@](N)(CO)c1ccccc1I Amb24537865 [0,2,0,0,0,0|0,0,2]=4 6355 B12R1.195 Cc1cc[n]cc1C(C)(O)C=O Amb25089669 [0,2,0,0,0,0|1,0,0]=3 6356 B12R1.195 Cc1ccccc1C(C)(C)C#N Amb18179921 [0,2,0,0,0,0|1,0,1]=4 6357 B12R1.195 Cc1ccccc1C(C)(C)NC Amb18563590 [0,2,0,0,0,0|2,0,0]=4 6358 B12R1.195 Cc1ccccc1C(C)(F)CN Amb25329909 [0,2,0,0,0,0|1,0,1]=4 6359 B12R1.195 Cc1ccccc1C(C)(N)CN Amb23555678 [0,2,0,0,0,0|1,0,1]=4 6360 B12R1.195 Cc1ccccc1C(C)(N)CO Amb18951191 [0,2,0,0,0,0|0,0,2]=4 6361 B12R1.195 Cc1ccccc1C(C)(O)C#C Amb25687091 [0,2,0,0,0,0|1,0,1]=4 6362 B12R1.195 Cc1ccccc1C(C)(O)C=O Amb24674444 [0,2,0,0,0,0|0,0,0]=2 6363 B12R1.195 Cc1ccccc1C(C)(O)CN Amb18287323 [0,2,0,0,0,0|1,0,1]=4 6364 B12R1.195 Cc1ccccc1[C@@](C)(N)C=C Amb25692262 [0,2,0,0,0,0|1,0,0]=3 6365 B12R1.195 Cc1ccccc1[C@](C)(N)C=C Amb25265683 [0,2,0,0,0,0|1,0,0]=3 6366 B12R1.195 ClCC(c1ccccc1C)(C)C Amb17139044 [0,2,0,0,0,0|1,0,1]=4 6367 B12R1.195 ClCC(c1ccccc1Cl)(C)C Amb17139901 [0,2,0,0,0,0|1,0,1]=4 6368 B12R1.195 ClCC(c1ccccc1F)(C)C Amb17139156 [0,2,0,0,0,0|1,0,1]=4 6369 B12R1.195 N#CC(c1ccccc1C)(N)C Amb1141404 [0,2,0,0,0,0|1,0,1]=4 6370 B12R1.195 N#CC(c1ccccc1Cl)(N)C Amb1136017 [0,2,0,0,0,0|1,0,1]=4 6371 B12R1.195 NCC(c1ccccc1Br)(C)C Amb17106795 [0,2,0,0,0,0|1,0,1]=4 6372 B12R1.195 NCC(c1ccccc1C)(C)C Amb13951568 [0,2,0,0,0,0|1,0,1]=4 6373 B12R1.195 O=CC(c1ccccc1C)(C)C Amb17232408 [0,2,0,0,0,0|0,0,0]=2 6374 B12R1.195 O=CC(c1ccccc1Cl)(C)C Amb17233960 [0,2,0,0,0,0|0,0,0]=2 6375 B12R1.195 O=CC(c1ccccc1F)(C)C Amb17232576 [0,2,0,0,0,0|0,0,0]=2 6376 B12R1.195 OCC(c1ccccc1C)(C)C Amb17138578 [0,2,0,0,0,0|0,0,2]=4 6377 B12R1.195 OCC(c1ccccc1Cl)(C)C Amb17139097 [0,2,0,0,0,0|0,0,2]=4 6378 B12R1.195 OCC(c1ccccc1F)(C)C Amb17138632 [0,2,0,0,0,0|0,0,2]=4 6379 B12R1.253 CC(=C)C(C)(N)c1ccccc1 Amb18645556 [0,2,0,0,0,0|1,0,0]=3 6380 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb24738601 [0,2,0,0,0,0|0,0,0]=2 6381 B12R1.253 CC(=O)C(F)(F)c1ccc[n]c1 Amb25770743 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.253 CC(=O)C(F)(F)c1cccc[n]1 Amb24414131 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.253 CC(=O)C(F)(F)c1ccccc1 Amb24105402 [0,2,0,0,0,0|1,0,0]=3 6384 B12R1.253 CC(=O)C(c1cccnc1)(O)C Amb1084728 [0,2,0,0,0,0|1,0,0]=3 6385 B12R1.253 CC(Br)(C(O)=O)c1ccccc1 Amb18135055 [0,2,0,0,0,0|0,0,0]=2 6386 B12R1.253 CC(C)(C(N)=N)c1cccc[n]1 Amb25109254 [0,2,0,0,0,0|2,0,0]=4 6387 B12R1.253 CC(C)(C(N)=S)c1ccccc1 Amb18791064 [0,2,0,0,0,0|0,1,0]=3 6388 B12R1.253 CC(C)(C(O)=O)c1c[n]c[n]c1 Amb18962097 [0,2,0,0,0,0|2,0,0]=4 6389 B12R1.253 CC(C)(C(O)=O)c1c[n]cc[n]1 Amb18827857 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.253 CC(C)(C(O)=O)c1cc[n]c[n]1 Amb18827921 [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.253 CC(C)(C(O)=O)c1cc[n]cc1 Amb18828397 [0,2,0,0,0,0|1,0,0]=3 6392 B12R1.253 CC(C)(C(O)=O)c1ccc[n][n]1 Amb25769960 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.253 CC(C)(C(O)=O)c1ccc[n]c1 Amb18285914 [0,2,0,0,0,0|1,0,0]=3 6394 B12R1.253 CC(C)(C(O)=O)c1cccc[n]1 Amb19930001 [0,2,0,0,0,0|1,0,0]=3 6395 B12R1.253 CC(C)(C(O)=O)c1ccccc1 Amb17773441 [0,2,0,0,0,0|0,0,0]=2 6396 B12R1.253 CC(C)(C([O-])=O)c1cccc[n]1 Amb19944551 [0,2,0,0,0,0|1,0,0]=3 6397 B12R1.253 CC(C)(C([O-])=O)c1ccncc1 Amb17748502 [0,2,0,0,0,0|1,0,0]=3 6398 B12R1.253 CC(C)(C([O-])=O)c1cnccn1 Amb17779859 [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.253 CC(C)[C@@](C)(N)c1ccccc1 Amb19889809 [0,2,0,0,0,0|1,0,1]=4 6400 B12R1.253 CC(Cl)(C(O)=O)c1ccccc1 Amb18649035 [0,2,0,0,0,0|0,0,0]=2 6401 B12R1.253 CC(F)(C(N)=O)c1cccc[n]1 Amb22547024 [0,2,0,0,0,0|1,0,0]=3 6402 B12R1.253 CC(F)(C(N)=O)c1ccccc1 Amb22547011 [0,2,0,0,0,0|0,0,0]=2 6403 B12R1.253 CC(F)(C(O)=O)c1ccccc1 Amb22547630 [0,2,0,0,0,0|0,0,0]=2 6404 B12R1.253 CC(F)C(C)(N)c1ccccc1 Amb24381495 [0,2,0,0,0,0|1,0,1]=4 6405 B12R1.253 CC(N)(C(F)F)c1ccccc1 Amb25684393 [0,2,0,0,0,0|1,0,1]=4 6406 B12R1.253 CC(N)(C(O)=O)c1c[n]c[n]c1 Amb25840848 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.253 CC(N)(C(O)=O)c1c[n]cc[n]1 Amb25339411 [0,2,0,0,0,0|2,0,0]=4 6408 B12R1.253 CC(N)(c1c[n]ccc1)C(N)=O Amb18281146 [0,2,0,0,0,0|1,0,0]=3 6409 B12R1.253 CC(N)(c1cc[n]cc1)C(N)=O Amb18949666 [0,2,0,0,0,0|1,0,0]=3 6410 B12R1.253 CC(N)(c1cccc[n]1)C(N)=O Amb18949664 [0,2,0,0,0,0|1,0,0]=3 6411 B12R1.253 CC(N)C(C)(F)c1ccccc1 Amb25152439 [0,2,0,0,0,0|1,0,1]=4 6412 B12R1.253 CC(N)C(C)(O)c1ccccc1 Amb22460632 [0,2,0,0,0,0|1,0,1]=4 6413 B12R1.253 CC(O)(C(F)F)c1ccccc1 Amb19895456 [0,2,0,0,0,0|1,0,1]=4 6414 B12R1.253 CC(O)(C(N)=N)c1cccc[n]1 Amb24396260 [0,2,0,0,0,0|2,0,0]=4 6415 B12R1.253 CC(O)(C(N)=O)c1c[n]cc[n]1 Amb25822018 [0,2,0,0,0,0|2,0,0]=4 6416 B12R1.253 CC(O)(C(N)=O)c1cc[n]cc1 Amb18801016 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.253 CC(O)(C(N)=O)c1ccc[n]c1 Amb18801015 [0,2,0,0,0,0|1,0,0]=3 6418 B12R1.253 CC(O)(C(N)=O)c1cccc[n]1 Amb18801014 [0,2,0,0,0,0|1,0,0]=3 6419 B12R1.253 CC(O)(c1c[n]ccc1)C(O)=O Amb18951996 [0,2,0,0,0,0|1,0,0]=3 6420 B12R1.253 CC(O)(c1cc[n]c[n]1)C(O)=O Amb25335828 [0,2,0,0,0,0|2,0,0]=4 6421 B12R1.253 CC(O)(c1cc[n]cc1)C(O)=O Amb18952010 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.253 CC(O)(c1cccc[n]1)C(O)=O Amb18952001 [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.253 CC(O)(c1cccc[sH]1)C(O)=O Amb22547022 [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.253 CC(O)(c1ccccc1)C(O)=O Amb22347941 [0,2,0,0,0,0|0,0,0]=2 6425 B12R1.253 CC(O)C(C)(C)c1ccccc1 Amb18177805 [0,2,0,0,0,0|0,0,2]=4 6426 B12R1.253 CC(O)C(C)(N)c1ccccc1 Amb24678253 [0,2,0,0,0,0|0,0,2]=4 6427 B12R1.253 CN(C)C(C)(C)c1ccccc1 Amb25052796 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.253 CS(=O)C(C)(C)c1ccccc1 Amb24388215 [0,2,0,0,0,0|1,0,0]=3 6429 B12R1.253 C[C@@H](F)[C@](C)(N)c1ccccc1 Amb25152323 [0,2,0,0,0,0|1,0,1]=4 6430 B12R1.253 C[C@@H](N)C(C)(C)c1ccccc1 Amb25751364 [0,2,0,0,0,0|1,0,1]=4 6431 B12R1.253 C[C@@H](N)C(C)(F)c1ccccc1 Amb25090887 [0,2,0,0,0,0|1,0,1]=4 6432 B12R1.253 C[C@@H](N)[C@@](C)(F)c1ccccc1 Amb25106861 [0,2,0,0,0,0|1,0,1]=4 6433 B12R1.253 C[C@@H](N)[C@@](C)(N)c1ccccc1 Amb25212905 [0,2,0,0,0,0|1,0,1]=4 6434 B12R1.253 C[C@@H](N)[C@@](C)(O)c1ccccc1 Amb25068831 [0,2,0,0,0,0|1,0,1]=4 6435 B12R1.253 C[C@@H](N)[C@](C)(O)c1ccccc1 Amb25360926 [0,2,0,0,0,0|1,0,1]=4 6436 B12R1.253 C[C@@H](O)C(C)(C)c1ccccc1 Amb24459428 [0,2,0,0,0,0|0,0,2]=4 6437 B12R1.253 C[C@@H](O)[C@@](C)(O)c1ccccc1 Amb24421586 [0,2,0,0,0,0|0,0,2]=4 6438 B12R1.253 C[C@@H](O)[C@](C)(F)c1ccccc1 Amb25234752 [0,2,0,0,0,0|0,0,2]=4 6439 B12R1.253 C[C@@H](O)[C@](C)(O)c1ccccc1 Amb25098651 [0,2,0,0,0,0|0,0,2]=4 6440 B12R1.253 C[C@@](F)(C(O)=O)c1ccccc1 Amb25279569 [0,2,0,0,0,0|0,0,0]=2 6441 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]c[n]c1 Amb24443519 [0,2,0,0,0,0|2,0,0]=4 6442 B12R1.253 C[C@@](N)(C(O)=O)c1c[n]cc[n]1 Amb25142458 [0,2,0,0,0,0|2,0,0]=4 6443 B12R1.253 C[C@@](N)(C(O)=O)c1ccc[n]c1 Amb24716336 [0,2,0,0,0,0|1,0,0]=3 6444 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22225774 [0,2,0,0,0,0|0,0,0]=2 6445 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22747027 [0,2,0,0,0,0|0,0,0]=2 6446 B12R1.253 C[C@@](N)(c1ccccc1)C(N)=O Amb24341528 [0,2,0,0,0,0|0,0,0]=2 6447 B12R1.253 C[C@@](O)(C(N)=N)c1ccccc1 Amb25061216 [0,2,0,0,0,0|1,0,0]=3 6448 B12R1.253 C[C@@](O)(C(N)=O)c1ccccc1 Amb24595768 [0,2,0,0,0,0|0,0,0]=2 6449 B12R1.253 C[C@H](N)[C@@](C)(N)c1ccccc1 Amb24468395 [0,2,0,0,0,0|1,0,1]=4 6450 B12R1.253 C[C@H](N)[C@](C)(F)c1ccccc1 Amb25320985 [0,2,0,0,0,0|1,0,1]=4 6451 B12R1.253 C[C@H](O)C(C)(C)c1ccccc1 Amb24461815 [0,2,0,0,0,0|0,0,2]=4 6452 B12R1.253 C[C@H](O)[C@@](C)(F)c1ccccc1 Amb25356375 [0,2,0,0,0,0|0,0,2]=4 6453 B12R1.253 C[C@](F)(C(O)=O)c1ccccc1 Amb25100972 [0,2,0,0,0,0|0,0,0]=2 6454 B12R1.253 C[C@](N)(C(O)=O)c1cc[n]cc1 Amb24341761 [0,2,0,0,0,0|1,0,0]=3 6455 B12R1.253 C[C@](N)(C(O)=O)c1cccc[n]1 Amb24562027 [0,2,0,0,0,0|1,0,0]=3 6456 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb19929597 [0,2,0,0,0,0|0,0,0]=2 6457 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb25692685 [0,2,0,0,0,0|0,0,0]=2 6458 B12R1.253 C[C@](N)(c1ccccc1)C(N)=O Amb25374916 [0,2,0,0,0,0|0,0,0]=2 6459 B12R1.253 C[C@](O)(c1ccccc1)C(O)=O Amb22226510 [0,2,0,0,0,0|0,0,0]=2 6460 B12R1.253 C[Si](C)(C(N)=O)c1ccccc1 Amb24497249 [0,2,0,0,0,0|0,1,0]=3 6461 B12R1.253 NC(=O)C(c1ccccc1)(F)F Amb1104586 [0,2,0,0,0,0|1,0,0]=3 6462 B12R1.253 NC(=O)C(c1ccccc1)(N)C Amb13952027 [0,2,0,0,0,0|0,0,0]=2 6463 B12R1.253 NC(=O)C(c1ccccn1)(F)F Amb10840433 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.253 NC(=S)C(Cl)(Cl)c1ccccc1 Amb19148545 [0,2,0,0,0,0|1,1,0]=4 6465 B12R1.253 NC(O)(c1ccccc1)C(O)=O Amb24092513 [0,2,0,0,0,0|1,0,0]=3 6466 B12R1.253 O=C(F)C(F)(F)c1ccccc1 Amb25108603 [0,2,0,0,0,0|1,0,0]=3 6467 B12R1.253 OC(=O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,2,0,0,0,0|1,0,0]=3 6468 B12R1.253 OC(=O)C(Cl)(Cl)c1ccccc1 Amb25674448 [0,2,0,0,0,0|1,0,0]=3 6469 B12R1.253 OC(=O)C(F)(Cl)c1ccccc1 Amb24532752 [0,2,0,0,0,0|1,0,0]=3 6470 B12R1.253 OC(=O)C(F)(F)c1cc[n]cc1 Amb23585649 [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.253 OC(=O)C(F)(F)c1ccc[n]c1 Amb18183748 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.253 OC(=O)C(F)(F)c1cccc[n]1 Amb20668303 [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.253 OC(=O)C(O)(O)c1ccccc1 Amb25684790 [0,2,0,0,0,0|1,0,0]=3 6474 B12R1.253 OC(=O)C(c1ccccc1)(F)F Amb1197472 [0,2,0,0,0,0|1,0,0]=3 6475 B12R1.253 OC(=O)C(c1ccccc1)(N)C Amb10711147 [0,2,0,0,0,0|0,0,0]=2 6476 B12R1.253 OC(=O)C(c1ccccn1)(F)F Amb10840437 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.253 [2H]C([2H])(C(O)=O)c1ccccc1 Amb22353301 [0,2,0,0,0,0|1,0,0]=3 6478 B12R1.253 [O-][N+](=O)C(F)(F)c1ccccc1 Amb24616890 [0,2,0,0,0,0|2,0,0]=4 6479 B12R1.475 C=CC(O)(C=O)c1ccccc1 Amb18645644 [0,2,0,0,0,0|0,0,1]=3 6480 B12R1.475 C=CC(O)(CO)c1ccccc1 Amb25712102 [0,2,0,0,0,0|1,0,0]=3 6481 B12R1.475 CC(C#N)(C#N)c1ccccc1 Amb25148544 [0,2,0,0,0,0|1,0,1]=4 6482 B12R1.475 CC(C=C)(C=O)c1ccccc1 Amb18126262 [0,2,0,0,0,0|0,0,0]=2 6483 B12R1.475 CC(C=O)(C=O)c1ccccc1 Amb24357143 [0,2,0,0,0,0|0,0,0]=2 6484 B12R1.475 CC(CBr)(CBr)c1ccccc1 Amb24378809 [0,2,0,0,0,0|1,0,1]=4 6485 B12R1.475 CC(CCl)(CCl)c1ccccc1 Amb24663734 [0,2,0,0,0,0|1,0,1]=4 6486 B12R1.475 CC(CN)(CF)c1ccccc1 Amb24554503 [0,2,0,0,0,0|1,0,1]=4 6487 B12R1.475 CC(CN)(CN)c1ccccc1 Amb23454492 [0,2,0,0,0,0|1,0,1]=4 6488 B12R1.475 CC(CO)(C#N)c1ccccc1 Amb25144485 [0,2,0,0,0,0|0,0,2]=4 6489 B12R1.475 CC(CO)(C=O)c1ccccc1 Amb18646084 [0,2,0,0,0,0|0,0,0]=2 6490 B12R1.475 CCC(C)(C#N)c1ccccc1 Amb18645230 [0,2,0,0,0,0|1,0,1]=4 6491 B12R1.475 CCC(C)(C=O)c1ccccc1 Amb18645703 [0,2,0,0,0,0|0,0,0]=2 6492 B12R1.475 CCC(C)(CBr)c1ccccc1 Amb25853127 [0,2,0,0,0,0|1,0,1]=4 6493 B12R1.475 CCC(C)(CCl)c1ccccc1 Amb25322041 [0,2,0,0,0,0|1,0,1]=4 6494 B12R1.475 CCC(C)(CN)c1ccccc1 Amb18300554 [0,2,0,0,0,0|1,0,1]=4 6495 B12R1.475 CCC(C)(NC)c1ccccc1 Amb24352807 [0,2,0,0,0,0|1,0,1]=4 6496 B12R1.475 CCC(Cl)(CO)c1ccccc1 Amb24430055 [0,2,0,0,0,0|0,0,2]=4 6497 B12R1.475 CCC(F)(C=O)c1ccccc1 Amb25298478 [0,2,0,0,0,0|0,0,0]=2 6498 B12R1.475 CCC(F)(CO)c1ccccc1 Amb24698657 [0,2,0,0,0,0|0,0,2]=4 6499 B12R1.475 CCC(N)(CC)c1ccccc1 Amb19957478 [0,2,0,0,0,0|1,0,1]=4 6500 B12R1.475 CCC(N)(CO)c1ccccc1 Amb18290224 [0,2,0,0,0,0|0,0,2]=4 6501 B12R1.475 CCC(N)(CO)c1ccccc1 Amb19373407 [0,2,0,0,0,0|0,0,2]=4 6502 B12R1.475 CCC(N)(CS)c1ccccc1 Amb25667246 [0,2,0,0,0,0|0,1,1]=4 6503 B12R1.475 CCC(O)(C#C)c1ccccc1 Amb23401450 [0,2,0,0,0,0|1,0,1]=4 6504 B12R1.475 CCC(O)(C=C)c1ccccc1 Amb25736633 [0,2,0,0,0,0|1,0,0]=3 6505 B12R1.475 CCC(O)(C=O)c1ccccc1 Amb18646070 [0,2,0,0,0,0|0,0,0]=2 6506 B12R1.475 CCC(O)(CCl)c1ccccc1 Amb24652403 [0,2,0,0,0,0|1,0,1]=4 6507 B12R1.475 CCC(c1ccccc1)(C#N)N Amb1140176 [0,2,0,0,0,0|1,0,1]=4 6508 B12R1.475 CCC(c1ccccc1)(CN)N Amb16233834 [0,2,0,0,0,0|1,0,1]=4 6509 B12R1.475 CCC(c1ccccc1)(CN)O Amb17138589 [0,2,0,0,0,0|1,0,1]=4 6510 B12R1.475 CC[C@@](C)(CO)c1ccccc1 Amb25036257 [0,2,0,0,0,0|0,0,2]=4 6511 B12R1.475 CC[C@@](F)(CO)c1ccccc1 Amb25156781 [0,2,0,0,0,0|0,0,2]=4 6512 B12R1.475 CC[C@@](N)(CO)c1ccccc1 Amb25210477 [0,2,0,0,0,0|0,0,2]=4 6513 B12R1.475 CC[C@](C)(CCl)c1ccccc1 Amb25232624 [0,2,0,0,0,0|1,0,1]=4 6514 B12R1.475 CC[C@](C)(CN)c1ccccc1 Amb25689582 [0,2,0,0,0,0|1,0,1]=4 6515 B12R1.475 CC[C@](Cl)(CO)c1ccccc1 Amb24735157 [0,2,0,0,0,0|0,0,2]=4 6516 B12R1.475 CC[C@](F)(C=O)c1ccccc1 Amb25759520 [0,2,0,0,0,0|0,0,0]=2 6517 B12R1.475 CC[C@](O)(CN)c1ccccc1 Amb25858770 [0,2,0,0,0,0|1,0,1]=4 6518 B12R1.475 CNC(C)(C=C)c1ccccc1 Amb18645552 [0,2,0,0,0,0|1,0,0]=3 6519 B12R1.475 CNC(C)(CCl)c1ccccc1 Amb24350800 [0,2,0,0,0,0|1,0,1]=4 6520 B12R1.475 CNC(C)(CN)c1ccccc1 Amb21967952 [0,2,0,0,0,0|1,0,1]=4 6521 B12R1.475 CNC(C)(CO)c1ccccc1 Amb18971895 [0,2,0,0,0,0|0,0,2]=4 6522 B12R1.475 COC(C)(C=O)c1ccccc1 Amb18646077 [0,2,0,0,0,0|0,0,0]=2 6523 B12R1.475 COC(C)(CBr)c1ccccc1 Amb25741588 [0,2,0,0,0,0|1,0,1]=4 6524 B12R1.475 COC(C)(CCl)c1ccccc1 Amb25322139 [0,2,0,0,0,0|1,0,1]=4 6525 B12R1.475 COC(F)(CCl)c1ccccc1 Amb25034745 [0,2,0,0,0,0|1,0,1]=4 6526 B12R1.475 COC(O)(CCl)c1ccccc1 Amb24711228 [0,2,0,0,0,0|1,0,1]=4 6527 B12R1.475 COC(O)(OC)c1ccccc1 Amb22749916 [0,2,0,0,0,0|2,0,0]=4 6528 B12R1.475 CO[Si](C)(C=C)c1ccccc1 Amb22734542 [0,2,0,0,0,0|1,1,0]=4 6529 B12R1.475 CSC(C)(C=O)c1ccccc1 Amb18648422 [0,2,0,0,0,0|0,0,0]=2 6530 B12R1.475 C[C@@](CO)(C#N)c1ccccc1 Amb25847761 [0,2,0,0,0,0|0,0,2]=4 6531 B12R1.475 C[C@](CN)(CO)c1ccccc1 Amb24652475 [0,2,0,0,0,0|0,0,2]=4 6532 B12R1.475 C[Si](C=C)(C=C)c1ccccc1 Amb24595514 [0,2,0,0,0,0|1,1,0]=4 6533 B12R1.475 C[Si](CCl)(C=C)c1ccccc1 Amb25774500 [0,2,0,0,0,0|1,1,0]=4 6534 B12R1.475 FC(CCl)(CCl)c1ccccc1 Amb24428652 [0,2,0,0,0,0|1,0,1]=4 6535 B12R1.475 N#CC(O)(CO)c1ccccc1 Amb25156796 [0,2,0,0,0,0|1,0,1]=4 6536 B12R1.475 NC(CO)(CO)c1ccccc1 Amb18646766 [0,2,0,0,0,0|0,0,2]=4 6537 B12R1.475 NCC(F)(CO)c1ccccc1 Amb24374560 [0,2,0,0,0,0|0,0,2]=4 6538 B12R1.475 NCC(O)(CO)c1ccccc1 Amb23515129 [0,2,0,0,0,0|0,0,2]=4 6539 B12R1.475 NCC(c1ccccc1)(OC)C Amb17605899 [0,2,0,0,0,0|1,0,1]=4 6540 B12R1.475 NNC(c1ccccc1)(C#N)C Amb17400095 [0,2,0,0,0,0|1,0,1]=4 6541 B12R1.475 OC(CCl)(CCl)c1ccccc1 Amb24443786 [0,2,0,0,0,0|1,0,1]=4 6542 B12R1.475 OC(CS)(CCl)c1ccccc1 Amb25695357 [0,2,0,0,0,0|0,1,1]=4 6543 B12R1.475 OCC(c1ccccc1)(OC)C Amb16218119 [0,2,0,0,0,0|0,0,2]=4 6544 B12R1.475 OC[C@@](O)(CCl)c1ccccc1 Amb25295510 [0,2,0,0,0,0|0,0,2]=4 6545 B12R1.475 [2H]C(CC)(CC)c1ccccc1 Amb22345960 [0,2,0,0,0,0|1,0,1]=4 6546 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,2,0,0,0,0|1,0,1]=4 6547 B12R1.3 C#CC(c1ccccc1)CC#C Amb10072781 [0,2,0,0,0,0|1,0,1]=4 6548 B12R1.3 C#CCC(C=O)c1ccccc1 Amb24741811 [0,2,0,0,0,0|0,0,0]=2 6549 B12R1.3 C#C\C(=C\C=O)\c1ccccc1 Amb25759544 [0,2,0,0,0,0|0,0,2]=4 6550 B12R1.3 C=C=C(CC=O)c1ccccc1 Amb25277163 [0,2,0,0,0,0|0,0,2]=4 6551 B12R1.3 C=C=CC(CO)c1ccccc1 Amb25837883 [0,2,0,0,0,0|1,0,0]=3 6552 B12R1.3 C=CC(N=C=O)c1ccccc1 Amb24375334 [0,2,0,0,0,0|0,0,2]=4 6553 B12R1.3 C=CC(NC#N)c1ccccc1 Amb25159530 [0,2,0,0,0,0|1,0,1]=4 6554 B12R1.3 C=CC(NC=O)c1ccccc1 Amb24668872 [0,2,0,0,0,0|0,0,1]=3 6555 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,2,0,0,0,0|1,0,1]=4 6556 B12R1.3 C=C\C(=C\CO)\c1ccccc1 Amb24619165 [0,2,0,0,0,0|1,0,1]=4 6557 B12R1.3 C=C\C=C(\C=O)/c1ccccc1 Amb25768466 [0,2,0,0,0,0|0,0,2]=4 6558 B12R1.3 CCC(N=C=S)c1ccccc1 Amb18809003 [0,2,0,0,0,0|0,1,1]=4 6559 B12R1.3 CCC(NC#N)c1ccccc1 Amb18800414 [0,2,0,0,0,0|1,0,1]=4 6560 B12R1.3 CCC(NOC)c1ccccc1 Amb22896961 [0,2,0,0,0,0|1,0,1]=4 6561 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,2,0,0,0,0|1,0,1]=4 6562 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,2,0,0,0,0|0,0,0]=2 6563 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,2,0,0,0,0|1,0,1]=4 6564 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,2,0,0,0,0|1,0,1]=4 6565 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,2,0,0,0,0|0,0,2]=4 6566 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,2,0,0,0,0|1,0,1]=4 6567 B12R1.3 CCCN(c1ccccn1)C=O Amb10553724 [0,2,0,0,0,0|2,0,0]=4 6568 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,2,0,0,0,0|1,0,1]=4 6569 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,2,0,0,0,0|0,0,2]=4 6570 B12R1.3 CC[C@@H](N=[N+]=[N-])c1ccccc1 Amb25758807 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.3 CC[C@@H](NC=O)c1ccccc1 Amb24756579 [0,2,0,0,0,0|0,0,0]=2 6572 B12R1.3 CC[C@H](N=C=O)c1ccccc1 Amb22045308 [0,2,0,0,0,0|0,0,1]=3 6573 B12R1.3 CC[C@H](N=C=S)c1ccccc1 Amb22045322 [0,2,0,0,0,0|0,1,1]=4 6574 B12R1.3 CC[C@H](N=[N+]=[N-])c1ccccc1 Amb24698404 [0,2,0,0,0,0|2,0,0]=4 6575 B12R1.3 CC[C@H](NC=S)c1ccccc1 Amb25700860 [0,2,0,0,0,0|0,1,0]=3 6576 B12R1.3 CC\C(=C/C=O)\c1ccccc1 Amb24356754 [0,2,0,0,0,0|0,0,1]=3 6577 B12R1.3 CC\C(=C\C#N)\c1ccccc1 Amb25189390 [0,2,0,0,0,0|1,0,1]=4 6578 B12R1.3 CC\C(=C\C=O)\c1ccccc1 Amb18645367 [0,2,0,0,0,0|0,0,1]=3 6579 B12R1.3 CC\C(=C\CN)\c1ccccc1 Amb25050568 [0,2,0,0,0,0|1,0,1]=4 6580 B12R1.3 CC\C(=C\CO)\c1ccccc1 Amb25816528 [0,2,0,0,0,0|0,0,2]=4 6581 B12R1.3 CC\C=C(/c1ccccc1)\C=O Amb10807890 [0,2,0,0,0,0|0,0,1]=3 6582 B12R1.3 CC\C=C(\CO)/c1ccccc1 Amb24397985 [0,2,0,0,0,0|1,0,1]=4 6583 B12R1.3 CNC(C=C=C)c1ccccc1 Amb24427541 [0,2,0,0,0,0|1,0,0]=3 6584 B12R1.3 CNC(CC#C)c1ccccc1 Amb18800161 [0,2,0,0,0,0|1,0,1]=4 6585 B12R1.3 CNC(CC#C)c1ccccc1 Amb19514703 [0,2,0,0,0,0|1,0,1]=4 6586 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,2,0,0,0,0|1,0,1]=4 6587 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,2,0,0,0,0|0,0,2]=4 6588 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [0,2,0,0,0,0|1,0,1]=4 6589 B12R1.3 CN\C(=C\C=O)\c1ccccc1 Amb25176166 [0,2,0,0,0,0|0,0,1]=3 6590 B12R1.3 CN\C=C(/C=S)\c1ccccc1 Amb24637960 [0,2,0,0,0,0|0,1,1]=4 6591 B12R1.3 CN\C=C(\C=S)/c1ccccc1 Amb24642034 [0,2,0,0,0,0|0,1,1]=4 6592 B12R1.3 COC(CC#N)c1ccccc1 Amb18797978 [0,2,0,0,0,0|1,0,1]=4 6593 B12R1.3 COC(N=C=O)c1ccccc1 Amb25102728 [0,2,0,0,0,0|0,0,1]=3 6594 B12R1.3 COC(\C=C/Cl)c1ccccc1 Amb24426163 [0,2,0,0,0,0|1,0,0]=3 6595 B12R1.3 COCC(C#N)c1ccccc1 Amb25728276 [0,2,0,0,0,0|1,0,1]=4 6596 B12R1.3 CONC(C#C)c1ccccc1 Amb24351536 [0,2,0,0,0,0|1,0,1]=4 6597 B12R1.3 CO\C(=C/C=O)\c1ccccc1 Amb18645645 [0,2,0,0,0,0|0,0,1]=3 6598 B12R1.3 CO\C=C(/C=O)\c1ccccc1 Amb18126326 [0,2,0,0,0,0|0,0,1]=3 6599 B12R1.3 CO\C=C(\C=O)/c1ccccc1 Amb24497332 [0,2,0,0,0,0|0,0,1]=3 6600 B12R1.3 CO\N=C(\c1ccccc1)/C=O Amb10572536 [0,2,0,0,0,0|0,0,1]=3 6601 B12R1.3 CSC(CC#N)c1ccccc1 Amb18804687 [0,2,0,0,0,0|1,0,1]=4 6602 B12R1.3 CS\C(=C/C=O)\c1ccccc1 Amb18648154 [0,2,0,0,0,0|0,0,1]=3 6603 B12R1.3 CS\C(=C\C=O)\c1ccccc1 Amb25798313 [0,2,0,0,0,0|0,0,1]=3 6604 B12R1.3 CS\C=C(/C=O)\c1ccccc1 Amb18648149 [0,2,0,0,0,0|0,0,1]=3 6605 B12R1.3 CS\C=C(\C=O)/c1ccccc1 Amb24605059 [0,2,0,0,0,0|0,0,1]=3 6606 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,2,0,0,0,0|1,0,1]=4 6607 B12R1.3 C\C=C(\CCO)/c1ccccc1 Amb25256435 [0,2,0,0,0,0|1,0,1]=4 6608 B12R1.3 C\C=C(\N=C=O)/c1ccccc1 Amb25095730 [0,2,0,0,0,0|0,0,2]=4 6609 B12R1.3 C\C=C\C(C=O)c1ccccc1 Amb24628954 [0,2,0,0,0,0|0,0,0]=2 6610 B12R1.3 C\C=C\C(CN)c1ccccc1 Amb24483889 [0,2,0,0,0,0|1,0,0]=3 6611 B12R1.3 C\C=C\C(CO)c1ccccc1 Amb24431887 [0,2,0,0,0,0|1,0,0]=3 6612 B12R1.3 C\C=C\C(NC)c1ccccc1 Amb18645551 [0,2,0,0,0,0|1,0,0]=3 6613 B12R1.3 C\C=N\C(CO)c1ccccc1 Amb25038797 [0,2,0,0,0,0|1,0,0]=3 6614 B12R1.3 C\C=N\[C@@H](CO)c1ccccc1 Amb25236547 [0,2,0,0,0,0|1,0,0]=3 6615 B12R1.3 C\N=C(\N=C=O)/c1ccccc1 Amb25159376 [0,2,0,0,0,0|0,0,2]=4 6616 B12R1.3 N#CC(CCCl)c1ccccc1 Amb18648314 [0,2,0,0,0,0|1,0,1]=4 6617 B12R1.3 N#CN[C@H](CO)c1ccccc1 Amb25085864 [0,2,0,0,0,0|1,0,1]=4 6618 B12R1.3 N#C\C=C(\CCl)/c1ccccc1 Amb24519442 [0,2,0,0,0,0|1,0,1]=4 6619 B12R1.3 NCC(c1ccccc1)OCC Amb17605997 [0,2,0,0,0,0|1,0,1]=4 6620 B12R1.3 NCCC(c1ccccc1)CN Amb1111605 [0,2,0,0,0,0|1,0,1]=4 6621 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [0,2,0,0,0,0|1,0,1]=4 6622 B12R1.3 O=C\C(=C\CCl)\c1ccccc1 Amb25139392 [0,2,0,0,0,0|0,0,1]=3 6623 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,2,0,0,0,0|1,0,1]=4 6624 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,2,0,0,0,0|0,0,2]=4 6625 B12R1.3 OC[C@@H](N=C=O)c1ccccc1 Amb25137163 [0,2,0,0,0,0|0,0,1]=3 6626 B12R1.3 OC[C@H](c1ccccc1)NC=O Amb16203101 [0,2,0,0,0,0|0,0,0]=2 6627 B12R1.3 OC\C=C(\CF)/c1ccccc1 Amb25769424 [0,2,0,0,0,0|0,0,2]=4 6628 B12R1.3 ON/C=C(\C=O)c1ccccc1 Amb17777667 [0,2,0,0,0,0|0,0,2]=4 6629 B12R1.3 O\N=C\C(C=O)c1ccccc1 Amb25302254 [0,2,0,0,0,0|0,0,1]=3 6630 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,2,0,0,0,0|2,0,0]=4 6631 B12R1.3 [N-]=[N+]=NC(C=O)c1ccccc1 Amb25804121 [0,2,0,0,0,0|1,0,0]=3 6632 B12R1.3 [N-]=[N+]=NC(CCl)c1ccccc1 Amb25350559 [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.3 [N-]=[N+]=NC(CO)c1ccccc1 Amb25806192 [0,2,0,0,0,0|2,0,0]=4 6634 B12R1.3 [N-]=[N+]=N[C@@H](CO)c1ccccc1 Amb25772941 [0,2,0,0,0,0|2,0,0]=4 6635 B12R1.12 C=CC(NN)c1ccc(Cl)cc1 Amb25764711 [0,2,0,0,0,0|2,0,0]=4 6636 B12R1.12 C=CC(NN)c1ccc(F)cc1 Amb25820268 [0,2,0,0,0,0|2,0,0]=4 6637 B12R1.12 C=CC(NN)c1ccc(I)cc1 Amb25342063 [0,2,0,0,0,0|2,0,0]=4 6638 B12R1.12 C=C[C@@H](CO)c1ccc(Cl)cc1 Amb25205096 [0,2,0,0,0,0|1,0,0]=3 6639 B12R1.12 C=C[C@@H](CO)c1ccc(F)cc1 Amb24448126 [0,2,0,0,0,0|1,0,0]=3 6640 B12R1.12 C=C[C@H](CO)c1ccc(F)cc1 Amb25257209 [0,2,0,0,0,0|1,0,0]=3 6641 B12R1.12 CCC(C#N)c1ccc(N)cc1 Amb25227456 [0,2,0,0,0,0|1,0,1]=4 6642 B12R1.12 CCC(C#N)c1ccc(O)cc1 Amb25318786 [0,2,0,0,0,0|1,0,1]=4 6643 B12R1.12 CCC(C=O)c1ccc(I)cc1 Amb24559579 [0,2,0,0,0,0|0,0,0]=2 6644 B12R1.12 CCC(C=O)c1ccc(N)cc1 Amb24564157 [0,2,0,0,0,0|0,0,0]=2 6645 B12R1.12 CCC(CN)c1ccc(F)cc1 Amb22900952 [0,2,0,0,0,0|1,0,1]=4 6646 B12R1.12 CCC(CN)c1ccc(N)cc1 Amb18908639 [0,2,0,0,0,0|1,0,1]=4 6647 B12R1.12 CCC(CO)c1ccc(N)cc1 Amb18646343 [0,2,0,0,0,0|0,0,2]=4 6648 B12R1.12 CCC(NC)c1ccc(Br)cc1 Amb18015146 [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.12 CCC(NC)c1ccc(I)cc1 Amb25796401 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.12 CCC(NO)c1ccc(Br)cc1 Amb18747021 [0,2,0,0,0,0|1,0,1]=4 6651 B12R1.12 CCC(NO)c1ccc(Cl)cc1 Amb24361452 [0,2,0,0,0,0|1,0,1]=4 6652 B12R1.12 CCC(NO)c1ccc(F)cc1 Amb25808480 [0,2,0,0,0,0|1,0,1]=4 6653 B12R1.12 CCC(NO)c1ccc(O)cc1 Amb25221842 [0,2,0,0,0,0|1,0,1]=4 6654 B12R1.12 CCC(OC)c1ccc(Br)cc1 Amb23443744 [0,2,0,0,0,0|1,0,1]=4 6655 B12R1.12 CCC(OC)c1ccc(N)cc1 Amb23568698 [0,2,0,0,0,0|1,0,1]=4 6656 B12R1.12 CCC(OC)c1ccc(S)cc1 Amb23568721 [0,2,0,0,0,0|1,0,1]=4 6657 B12R1.12 CCC(SC)c1ccc(Br)cc1 Amb23443751 [0,2,0,0,0,0|1,0,1]=4 6658 B12R1.12 CCC(SC)c1ccc(Cl)cc1 Amb25119645 [0,2,0,0,0,0|1,0,1]=4 6659 B12R1.12 CCC(c1ccc(cc1)Br)C#N Amb17089250 [0,2,0,0,0,0|1,0,1]=4 6660 B12R1.12 CCC(c1ccc(cc1)Br)C=O Amb17142263 [0,2,0,0,0,0|0,0,0]=2 6661 B12R1.12 CCC(c1ccc(cc1)Br)CBr Amb17290539 [0,2,0,0,0,0|1,0,1]=4 6662 B12R1.12 CCC(c1ccc(cc1)Br)CCl Amb17259617 [0,2,0,0,0,0|1,0,1]=4 6663 B12R1.12 CCC(c1ccc(cc1)Br)CN Amb17087295 [0,2,0,0,0,0|1,0,1]=4 6664 B12R1.12 CCC(c1ccc(cc1)Br)CO Amb17248425 [0,2,0,0,0,0|0,0,2]=4 6665 B12R1.12 CCC(c1ccc(cc1)Br)NC Amb1136813 [0,2,0,0,0,0|1,0,1]=4 6666 B12R1.12 CCC(c1ccc(cc1)C)C=O Amb17138540 [0,2,0,0,0,0|0,0,0]=2 6667 B12R1.12 CCC(c1ccc(cc1)C)CBr Amb17247627 [0,2,0,0,0,0|1,0,1]=4 6668 B12R1.12 CCC(c1ccc(cc1)C)CCl Amb17233969 [0,2,0,0,0,0|1,0,1]=4 6669 B12R1.12 CCC(c1ccc(cc1)C)CO Amb17232489 [0,2,0,0,0,0|0,0,2]=4 6670 B12R1.12 CCC(c1ccc(cc1)C)NC Amb1112139 [0,2,0,0,0,0|1,0,1]=4 6671 B12R1.12 CCC(c1ccc(cc1)Cl)C#N Amb17089249 [0,2,0,0,0,0|1,0,1]=4 6672 B12R1.12 CCC(c1ccc(cc1)Cl)C=O Amb17139040 [0,2,0,0,0,0|0,0,0]=2 6673 B12R1.12 CCC(c1ccc(cc1)Cl)CBr Amb17259615 [0,2,0,0,0,0|1,0,1]=4 6674 B12R1.12 CCC(c1ccc(cc1)Cl)CCl Amb17237596 [0,2,0,0,0,0|1,0,1]=4 6675 B12R1.12 CCC(c1ccc(cc1)Cl)CN Amb17087294 [0,2,0,0,0,0|1,0,1]=4 6676 B12R1.12 CCC(c1ccc(cc1)Cl)CO Amb17234156 [0,2,0,0,0,0|0,0,2]=4 6677 B12R1.12 CCC(c1ccc(cc1)Cl)NC Amb1139852 [0,2,0,0,0,0|1,0,1]=4 6678 B12R1.12 CCC(c1ccc(cc1)F)C=O Amb17138602 [0,2,0,0,0,0|0,0,0]=2 6679 B12R1.12 CCC(c1ccc(cc1)F)CBr Amb17249284 [0,2,0,0,0,0|1,0,1]=4 6680 B12R1.12 CCC(c1ccc(cc1)F)CCl Amb17234365 [0,2,0,0,0,0|1,0,1]=4 6681 B12R1.12 CCC(c1ccc(cc1)F)CO Amb17232667 [0,2,0,0,0,0|0,0,2]=4 6682 B12R1.12 CCC(c1ccc(cc1)F)NC Amb1113198 [0,2,0,0,0,0|1,0,1]=4 6683 B12R1.12 CCC(c1ccc(cc1)O)CC Amb17594075 [0,2,0,0,0,0|1,0,1]=4 6684 B12R1.12 CCC(c1ccc(cc1)O)NC Amb1116807 [0,2,0,0,0,0|1,0,1]=4 6685 B12R1.12 CCN(N=O)c1ccc(O)cc1 Amb25735736 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.12 CC[C@@H](NC)c1ccc(F)cc1 Amb25794239 [0,2,0,0,0,0|1,0,1]=4 6687 B12R1.12 CC[C@@H](NO)c1ccc(Br)cc1 Amb24701450 [0,2,0,0,0,0|1,0,1]=4 6688 B12R1.12 CC[C@@H](NO)c1ccc(O)cc1 Amb24360554 [0,2,0,0,0,0|1,0,1]=4 6689 B12R1.12 CC[C@H](NC)c1ccc(F)cc1 Amb25374928 [0,2,0,0,0,0|1,0,1]=4 6690 B12R1.12 CC[C@H](NO)c1ccc(Cl)cc1 Amb25776106 [0,2,0,0,0,0|1,0,1]=4 6691 B12R1.12 CC[C@H](NO)c1ccc(F)cc1 Amb25826150 [0,2,0,0,0,0|1,0,1]=4 6692 B12R1.12 CNC(C#C)c1ccc(F)cc1 Amb25148719 [0,2,0,0,0,0|1,0,1]=4 6693 B12R1.12 CNC(C#N)c1ccc(Cl)cc1 Amb22736548 [0,2,0,0,0,0|1,0,1]=4 6694 B12R1.12 CNC(C#N)c1ccc(I)cc1 Amb24493264 [0,2,0,0,0,0|1,0,1]=4 6695 B12R1.12 CNC(C=C)c1ccc(Cl)c[n]1 Amb25679292 [0,2,0,0,0,0|2,0,0]=4 6696 B12R1.12 CNC(C=C)c1ccc(F)cc1 Amb24399629 [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.12 CNC(C=C)c1ccc(I)cc1 Amb24424831 [0,2,0,0,0,0|1,0,0]=3 6698 B12R1.12 CNC(CN)c1ccc(Br)cc1 Amb18985318 [0,2,0,0,0,0|1,0,1]=4 6699 B12R1.12 CNC(CN)c1ccc(Cl)cc1 Amb18985319 [0,2,0,0,0,0|1,0,1]=4 6700 B12R1.12 CNC(CN)c1ccc(F)cc1 Amb18985325 [0,2,0,0,0,0|1,0,1]=4 6701 B12R1.12 CNC(CO)c1ccc(N)cc1 Amb25690306 [0,2,0,0,0,0|0,0,2]=4 6702 B12R1.12 CNC(CO)c1ccc(O)cc1 Amb18290213 [0,2,0,0,0,0|0,0,2]=4 6703 B12R1.12 CNC(c1ccc(cc1)C)CO Amb17232549 [0,2,0,0,0,0|0,0,2]=4 6704 B12R1.12 CN[C@@H](C#N)c1ccc(F)cc1 Amb25209936 [0,2,0,0,0,0|1,0,1]=4 6705 B12R1.12 CN[C@@H](CO)c1ccc(I)cc1 Amb25737133 [0,2,0,0,0,0|0,0,2]=4 6706 B12R1.12 CN[C@@H](CO)c1ccc(N)cc1 Amb25117437 [0,2,0,0,0,0|0,0,2]=4 6707 B12R1.12 CN[C@@H](CO)c1ccc(O)cc1 Amb25821839 [0,2,0,0,0,0|0,0,2]=4 6708 B12R1.12 CN[C@H](C#N)c1ccc(F)cc1 Amb25774488 [0,2,0,0,0,0|1,0,1]=4 6709 B12R1.12 CN[C@H](CO)c1ccc(I)cc1 Amb25804808 [0,2,0,0,0,0|0,0,2]=4 6710 B12R1.12 CN[C@H](CO)c1ccc(S)cc1 Amb24365265 [0,2,0,0,0,0|0,0,2]=4 6711 B12R1.12 COC(C#N)c1ccc(Br)cc1 Amb25121393 [0,2,0,0,0,0|1,0,1]=4 6712 B12R1.12 COC(C#N)c1ccc(F)cc1 Amb19149310 [0,2,0,0,0,0|1,0,1]=4 6713 B12R1.12 COC(C=O)c1ccc(Br)c[n]1 Amb25108804 [0,2,0,0,0,0|1,0,0]=3 6714 B12R1.12 COC(C=O)c1ccc(Br)cc1 Amb24711608 [0,2,0,0,0,0|0,0,0]=2 6715 B12R1.12 COC(C=O)c1ccc(Cl)cc1 Amb25299865 [0,2,0,0,0,0|0,0,0]=2 6716 B12R1.12 COC(C=O)c1ccc(F)cc1 Amb25309723 [0,2,0,0,0,0|0,0,0]=2 6717 B12R1.12 COC(C=O)c1ccc(I)cc1 Amb25088585 [0,2,0,0,0,0|0,0,0]=2 6718 B12R1.12 COC(CBr)c1ccc(F)cc1 Amb24449281 [0,2,0,0,0,0|1,0,1]=4 6719 B12R1.12 COC(CI)c1ccc(F)cc1 Amb24412461 [0,2,0,0,0,0|1,0,1]=4 6720 B12R1.12 COC(CN)c1ccc(Cl)cc1 Amb19375327 [0,2,0,0,0,0|1,0,1]=4 6721 B12R1.12 COC(CN)c1ccc(F)cc1 Amb19149303 [0,2,0,0,0,0|1,0,1]=4 6722 B12R1.12 COC(OC)c1ccc(I)cc1 Amb24066120 [0,2,0,0,0,0|2,0,0]=4 6723 B12R1.12 COC(OC)c1ccc(O)cc1 Amb25830071 [0,2,0,0,0,0|2,0,0]=4 6724 B12R1.12 COC(OC)c1ccc(S)cc1 Amb24525111 [0,2,0,0,0,0|2,0,0]=4 6725 B12R1.12 COC(c1ccc(cc1)Br)OC Amb10601607 [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.12 COC(c1ccc(cc1)C)CN Amb17334642 [0,2,0,0,0,0|1,0,1]=4 6727 B12R1.12 CO[C@H](CN)c1ccc(O)cc1 Amb25106940 [0,2,0,0,0,0|1,0,1]=4 6728 B12R1.12 CSC(CN)c1ccc(Br)cc1 Amb18980148 [0,2,0,0,0,0|1,0,1]=4 6729 B12R1.12 CSC(CN)c1ccc(Cl)cc1 Amb18980145 [0,2,0,0,0,0|1,0,1]=4 6730 B12R1.12 CSC(CN)c1ccc(F)cc1 Amb18980135 [0,2,0,0,0,0|1,0,1]=4 6731 B12R1.12 CSC(SC)c1ccc(O)cc1 Amb25236944 [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.12 C\C=C(/C=O)\c1ccc(F)cc1 Amb24388628 [0,2,0,0,0,0|0,0,1]=3 6733 B12R1.12 C\C=C(/CC)\c1ccc(O)cc1 Amb24633465 [0,2,0,0,0,0|1,0,1]=4 6734 B12R1.12 C\C=C(\C=O)/c1ccc(Cl)cc1 Amb24741822 [0,2,0,0,0,0|0,0,1]=3 6735 B12R1.12 C\C=C(\C=O)/c1ccc(F)cc1 Amb24497271 [0,2,0,0,0,0|0,0,1]=3 6736 B12R1.12 C\C=C(\CC)/c1ccc(F)cc1 Amb24614841 [0,2,0,0,0,0|1,0,1]=4 6737 B12R1.12 C\C=C(\CC)/c1ccc(O)cc1 Amb24408326 [0,2,0,0,0,0|1,0,1]=4 6738 B12R1.12 Cc1ccc(c[n]1)C(C=C)NC Amb24426551 [0,2,0,0,0,0|2,0,0]=4 6739 B12R1.12 Cc1ccc(c[n]1)C(CC)C=O Amb24578962 [0,2,0,0,0,0|1,0,0]=3 6740 B12R1.12 Cc1ccc(cc1)C(=CO)C=O Amb24062092 [0,2,0,0,0,0|0,0,2]=4 6741 B12R1.12 Cc1ccc(cc1)C(C#N)NC Amb22736540 [0,2,0,0,0,0|1,0,1]=4 6742 B12R1.12 Cc1ccc(cc1)C(C#N)OC Amb24447186 [0,2,0,0,0,0|1,0,1]=4 6743 B12R1.12 Cc1ccc(cc1)C(C=C)NN Amb24727909 [0,2,0,0,0,0|2,0,0]=4 6744 B12R1.12 Cc1ccc(cc1)C(C=N)C=O Amb25125311 [0,2,0,0,0,0|0,0,1]=3 6745 B12R1.12 Cc1ccc(cc1)C(CBr)OC Amb25713167 [0,2,0,0,0,0|1,0,1]=4 6746 B12R1.12 Cc1ccc(cc1)C(CCl)CCl Amb24467969 [0,2,0,0,0,0|1,0,1]=4 6747 B12R1.12 Cc1ccc(cc1)C(CCl)SC Amb24392803 [0,2,0,0,0,0|1,0,1]=4 6748 B12R1.12 Cc1ccc(cc1)C(CI)OC Amb25851917 [0,2,0,0,0,0|1,0,1]=4 6749 B12R1.12 Cc1ccc(cc1)C(CN)CN Amb18563650 [0,2,0,0,0,0|1,0,1]=4 6750 B12R1.12 Cc1ccc(cc1)C(CN)CO Amb18563696 [0,2,0,0,0,0|0,0,2]=4 6751 B12R1.12 Cc1ccc(cc1)C(CN)NC Amb18985312 [0,2,0,0,0,0|1,0,1]=4 6752 B12R1.12 Cc1ccc(cc1)C(CN)SC Amb18980118 [0,2,0,0,0,0|1,0,1]=4 6753 B12R1.12 Cc1ccc(cc1)C(CO)CF Amb24564192 [0,2,0,0,0,0|0,0,2]=4 6754 B12R1.12 Cc1ccc(cc1)C(CO)OC Amb25816517 [0,2,0,0,0,0|0,0,2]=4 6755 B12R1.12 Cc1ccc(cc1)C(OC)OC Amb24066891 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.12 Cc1ccc(cc1)N(CC)C=O Amb24761331 [0,2,0,0,0,0|1,0,0]=3 6757 B12R1.12 Cc1ccc(cc1)[C@@H](CC)C=O Amb24497014 [0,2,0,0,0,0|0,0,0]=2 6758 B12R1.12 Cc1ccc(cc1)[C@@H](CO)NC Amb25149807 [0,2,0,0,0,0|0,0,2]=4 6759 B12R1.12 Cc1ccc(cc1)[C@@H](CO)NO Amb24684910 [0,2,0,0,0,0|1,0,1]=4 6760 B12R1.12 Cc1ccc(cc1)[C@H](C=O)OC Amb25829013 [0,2,0,0,0,0|0,0,0]=2 6761 B12R1.12 Cc1ccc(cc1)[C@H](CC)C=O Amb24686461 [0,2,0,0,0,0|0,0,0]=2 6762 B12R1.12 Cc1ccc(cc1)[C@H](CN)CO Amb24663560 [0,2,0,0,0,0|0,0,2]=4 6763 B12R1.12 Cc1ccc(cc1)[C@H](CO)C=C Amb24457900 [0,2,0,0,0,0|1,0,0]=3 6764 B12R1.12 Cc1ccc(cc1)\C(=C/Cl)\OC Amb25138718 [0,2,0,0,0,0|1,0,1]=4 6765 B12R1.12 Cc1ccc(cc1)\C(\C=O)=C/C Amb24612104 [0,2,0,0,0,0|0,0,1]=3 6766 B12R1.12 ClCC(CCl)c1ccc(Br)cc1 Amb25311832 [0,2,0,0,0,0|1,0,1]=4 6767 B12R1.12 Clc1ccc(cc1)C(CBr)CBr Amb24691120 [0,2,0,0,0,0|1,0,1]=4 6768 B12R1.12 Fc1ccc(cc1)C(CCl)CCl Amb25737798 [0,2,0,0,0,0|1,0,1]=4 6769 B12R1.12 N#CC(CO)c1ccc(Br)cc1 Amb25242809 [0,2,0,0,0,0|1,0,1]=4 6770 B12R1.12 N#CC(CO)c1ccc(Cl)cc1 Amb24466230 [0,2,0,0,0,0|1,0,1]=4 6771 B12R1.12 N=CC(C=O)c1ccc(F)cc1 Amb24448991 [0,2,0,0,0,0|0,0,1]=3 6772 B12R1.12 NCC(CF)c1ccc(F)cc1 Amb25352010 [0,2,0,0,0,0|1,0,1]=4 6773 B12R1.12 NCC(CN)c1ccc(Br)cc1 Amb18070431 [0,2,0,0,0,0|1,0,1]=4 6774 B12R1.12 NCC(CN)c1ccc(Cl)cc1 Amb18564315 [0,2,0,0,0,0|1,0,1]=4 6775 B12R1.12 NCC(CN)c1ccc(F)cc1 Amb18563848 [0,2,0,0,0,0|1,0,1]=4 6776 B12R1.12 NCC(CN)c1ccc(O)cc1 Amb25700341 [0,2,0,0,0,0|1,0,1]=4 6777 B12R1.12 NCC(CO)c1ccc(Br)cc1 Amb18070489 [0,2,0,0,0,0|0,0,2]=4 6778 B12R1.12 NCC(CO)c1ccc(Cl)cc1 Amb18564355 [0,2,0,0,0,0|0,0,2]=4 6779 B12R1.12 NCC(CO)c1ccc(F)cc1 Amb18563897 [0,2,0,0,0,0|0,0,2]=4 6780 B12R1.12 NCC(c1ccc(cc1)Br)OC Amb17344449 [0,2,0,0,0,0|1,0,1]=4 6781 B12R1.12 NCC(c1ccc(cc1)Cl)OC Amb17335809 [0,2,0,0,0,0|1,0,1]=4 6782 B12R1.12 NC[C@@H](CO)c1ccc(F)cc1 Amb22746745 [0,2,0,0,0,0|0,0,2]=4 6783 B12R1.12 NC[C@H](CO)c1ccc(Br)cc1 Amb24636971 [0,2,0,0,0,0|0,0,2]=4 6784 B12R1.12 NC[C@H](CO)c1ccc(F)cc1 Amb24579800 [0,2,0,0,0,0|0,0,2]=4 6785 B12R1.12 NC\C(=C\Br)\c1ccc(O)cc1 Amb25375282 [0,2,0,0,0,0|1,0,1]=4 6786 B12R1.12 NC\C(=C\F)\c1ccc(Cl)cc1 Amb25290824 [0,2,0,0,0,0|1,0,1]=4 6787 B12R1.12 NC\C(=C\F)\c1ccc(O)cc1 Amb25375989 [0,2,0,0,0,0|1,0,1]=4 6788 B12R1.12 Nc1ccc(cc1)C(CO)CO Amb25701566 [0,2,0,0,0,0|0,0,2]=4 6789 B12R1.12 O=CC(c1ccc(cc1)Cl)C#N Amb1903844 [0,2,0,0,0,0|0,0,1]=3 6790 B12R1.12 OCC(CF)c1ccc(F)cc1 Amb24514072 [0,2,0,0,0,0|0,0,2]=4 6791 B12R1.12 OCC(NO)c1ccc(F)cc1 Amb24718633 [0,2,0,0,0,0|1,0,1]=4 6792 B12R1.12 OCC(c1ccc(cc1)Br)CO Amb17344705 [0,2,0,0,0,0|0,0,2]=4 6793 B12R1.12 OCC(c1ccc(cc1)Br)NC Amb17248847 [0,2,0,0,0,0|0,0,2]=4 6794 B12R1.12 OCC(c1ccc(cc1)Cl)CO Amb17335891 [0,2,0,0,0,0|0,0,2]=4 6795 B12R1.12 OCC(c1ccc(cc1)Cl)NC Amb17234267 [0,2,0,0,0,0|0,0,2]=4 6796 B12R1.12 OCC(c1ccc(cc1)F)CO Amb17334792 [0,2,0,0,0,0|0,0,2]=4 6797 B12R1.12 OCC(c1ccc(cc1)F)NC Amb17232701 [0,2,0,0,0,0|0,0,2]=4 6798 B12R1.12 OC[C@@H](NO)c1ccc(Cl)cc1 Amb25840217 [0,2,0,0,0,0|1,0,1]=4 6799 B12R1.12 OC[C@H](NO)c1ccc(Br)cc1 Amb25324729 [0,2,0,0,0,0|1,0,1]=4 6800 B12R1.12 OC\C(=C\F)\c1ccc(Cl)cc1 Amb25846249 [0,2,0,0,0,0|1,0,1]=4 6801 B12R1.12 O\C=C(/c1ccc(cc1)C)\C=O Amb10069607 [0,2,0,0,0,0|0,0,2]=4 6802 B12R1.12 O\C=C(/c1ccc(cc1)F)\C=O Amb10845767 [0,2,0,0,0,0|0,0,2]=4 6803 B12R1.12 O\C=C(\C=O)/c1ccc(Br)cc1 Amb25247781 [0,2,0,0,0,0|0,0,2]=4 6804 B12R1.12 [C-]#[N+]C(CF)c1ccc(F)cc1 Amb25270285 [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.13 C=CC(NN)c1cccc(Br)c1 Amb25816994 [0,2,0,0,0,0|2,0,0]=4 6806 B12R1.13 C=CC(NN)c1cccc(Cl)c1 Amb25820267 [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.13 C=C[C@@H](CO)c1cccc(Cl)c1 Amb25156884 [0,2,0,0,0,0|1,0,0]=3 6808 B12R1.13 CCC(C#N)c1cccc(N)c1 Amb25107740 [0,2,0,0,0,0|1,0,1]=4 6809 B12R1.13 CCC(C#N)c1cccc(O)c1 Amb25078076 [0,2,0,0,0,0|1,0,1]=4 6810 B12R1.13 CCC(C=O)c1cccc(I)c1 Amb25243333 [0,2,0,0,0,0|0,0,0]=2 6811 B12R1.13 CCC(CBr)c1cc(Cl)ccc1 Amb25730415 [0,2,0,0,0,0|1,0,1]=4 6812 B12R1.13 CCC(CN)c1cc(Br)ccc1 Amb25739095 [0,2,0,0,0,0|1,0,1]=4 6813 B12R1.13 CCC(CO)c1cccc(O)c1 Amb25143472 [0,2,0,0,0,0|0,0,2]=4 6814 B12R1.13 CCC(NC)c1cccc(F)c1 Amb19000445 [0,2,0,0,0,0|1,0,1]=4 6815 B12R1.13 CCC(NC)c1cccc(I)c1 Amb24642103 [0,2,0,0,0,0|1,0,1]=4 6816 B12R1.13 CCC(NN)c1cccc(I)c1 Amb25077695 [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.13 CCC(NO)c1cc(O)ccc1 Amb25802069 [0,2,0,0,0,0|1,0,1]=4 6818 B12R1.13 CCC(OC)c1cccc(Br)c1 Amb23443782 [0,2,0,0,0,0|1,0,1]=4 6819 B12R1.13 CCC(OC)c1cccc(N)c1 Amb23443785 [0,2,0,0,0,0|1,0,1]=4 6820 B12R1.13 CCC(OC)c1cccc(S)c1 Amb23443781 [0,2,0,0,0,0|1,0,1]=4 6821 B12R1.13 CCC(SC)c1cccc(N)c1 Amb25132178 [0,2,0,0,0,0|1,0,1]=4 6822 B12R1.13 CCC(c1cccc(c1)C)CN Amb17232448 [0,2,0,0,0,0|1,0,1]=4 6823 B12R1.13 CCC(c1cccc(c1)Cl)CN Amb17234049 [0,2,0,0,0,0|1,0,1]=4 6824 B12R1.13 CCC(c1cccc(c1)Cl)NC Amb1128373 [0,2,0,0,0,0|1,0,1]=4 6825 B12R1.13 CCC(c1cccc(c1)F)CN Amb17232647 [0,2,0,0,0,0|1,0,1]=4 6826 B12R1.13 CCN(C=O)c1cccc(F)c1 Amb25150902 [0,2,0,0,0,0|1,0,0]=3 6827 B12R1.13 CCN(C=O)c1cccc(O)c1 Amb25299005 [0,2,0,0,0,0|1,0,0]=3 6828 B12R1.13 CCN(N=O)c1cccc(O)c1 Amb24532559 [0,2,0,0,0,0|2,0,0]=4 6829 B12R1.13 CC[C@@H](NO)c1cccc(Br)c1 Amb24405036 [0,2,0,0,0,0|1,0,1]=4 6830 B12R1.13 CC[C@H](NO)c1cccc(Br)c1 Amb25329521 [0,2,0,0,0,0|1,0,1]=4 6831 B12R1.13 CC[C@H](NO)c1cccc(F)c1 Amb25341408 [0,2,0,0,0,0|1,0,1]=4 6832 B12R1.13 CNC(C#C)c1cccc(F)c1 Amb25363704 [0,2,0,0,0,0|1,0,1]=4 6833 B12R1.13 CNC(C#N)c1cccc(I)c1 Amb24493263 [0,2,0,0,0,0|1,0,1]=4 6834 B12R1.13 CNC(C=C)c1c[n]cc(Br)c1 Amb24704721 [0,2,0,0,0,0|2,0,0]=4 6835 B12R1.13 CNC(C=C)c1c[n]cc(Cl)c1 Amb24739872 [0,2,0,0,0,0|2,0,0]=4 6836 B12R1.13 CNC(C=C)c1c[n]cc(F)c1 Amb24567529 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.13 CNC(CF)c1cccc(Cl)c1 Amb24514388 [0,2,0,0,0,0|1,0,1]=4 6838 B12R1.13 CNC(CN)c1cccc(Br)c1 Amb18985326 [0,2,0,0,0,0|1,0,1]=4 6839 B12R1.13 CNC(CN)c1cccc(Cl)c1 Amb18294971 [0,2,0,0,0,0|1,0,1]=4 6840 B12R1.13 CNC(CN)c1cccc(F)c1 Amb18985314 [0,2,0,0,0,0|1,0,1]=4 6841 B12R1.13 CNC(CO)c1cc(O)ccc1 Amb18971860 [0,2,0,0,0,0|0,0,2]=4 6842 B12R1.13 CNC(CO)c1cccc(F)c1 Amb18971906 [0,2,0,0,0,0|0,0,2]=4 6843 B12R1.13 CNC(CO)c1cccc(S)c1 Amb25375658 [0,2,0,0,0,0|0,0,2]=4 6844 B12R1.13 CNC(c1cccc(c1)Br)C#N Amb17044545 [0,2,0,0,0,0|1,0,1]=4 6845 B12R1.13 CNC(c1cccc(c1)Br)CO Amb17248844 [0,2,0,0,0,0|0,0,2]=4 6846 B12R1.13 CNC(c1cccc(c1)C)CO Amb17232546 [0,2,0,0,0,0|0,0,2]=4 6847 B12R1.13 CNC(c1cccc(c1)Cl)C#N Amb16206533 [0,2,0,0,0,0|1,0,1]=4 6848 B12R1.13 CNC(c1cccc(c1)Cl)CO Amb17234264 [0,2,0,0,0,0|0,0,2]=4 6849 B12R1.13 CN[C@@H](CO)c1cccc(Cl)c1 Amb25770646 [0,2,0,0,0,0|0,0,2]=4 6850 B12R1.13 CN[C@@H](CO)c1cccc(I)c1 Amb25103805 [0,2,0,0,0,0|0,0,2]=4 6851 B12R1.13 CN[C@@H](CO)c1cccc(N)c1 Amb25301876 [0,2,0,0,0,0|0,0,2]=4 6852 B12R1.13 COC(C#N)c1cccc(Cl)c1 Amb19148908 [0,2,0,0,0,0|1,0,1]=4 6853 B12R1.13 COC(C#N)c1cccc(F)c1 Amb24367033 [0,2,0,0,0,0|1,0,1]=4 6854 B12R1.13 COC(C=O)c1cccc(Cl)c1 Amb24434154 [0,2,0,0,0,0|0,0,0]=2 6855 B12R1.13 COC(C=O)c1cccc(O)c1 Amb25352148 [0,2,0,0,0,0|0,0,0]=2 6856 B12R1.13 COC(CBr)c1cc(Br)ccc1 Amb25099785 [0,2,0,0,0,0|1,0,1]=4 6857 B12R1.13 COC(CBr)c1cccc(F)c1 Amb25667134 [0,2,0,0,0,0|1,0,1]=4 6858 B12R1.13 COC(CI)c1cccc(Br)c1 Amb24618952 [0,2,0,0,0,0|1,0,1]=4 6859 B12R1.13 COC(CI)c1cccc(F)c1 Amb25823221 [0,2,0,0,0,0|1,0,1]=4 6860 B12R1.13 COC(CN)c1cccc(Cl)c1 Amb19148902 [0,2,0,0,0,0|1,0,1]=4 6861 B12R1.13 COC(CN)c1cccc(I)c1 Amb24343626 [0,2,0,0,0,0|1,0,1]=4 6862 B12R1.13 COC(CN)c1cccc(O)c1 Amb24579215 [0,2,0,0,0,0|1,0,1]=4 6863 B12R1.13 COC(OC)c1cccc(Cl)c1 Amb24092692 [0,2,0,0,0,0|2,0,0]=4 6864 B12R1.13 COC(OC)c1cccc(O)c1 Amb25717781 [0,2,0,0,0,0|2,0,0]=4 6865 B12R1.13 COC(c1cccc(c1)Br)CN Amb17605858 [0,2,0,0,0,0|1,0,1]=4 6866 B12R1.13 COC(c1cccc(c1)Br)OC Amb10601608 [0,2,0,0,0,0|2,0,0]=4 6867 B12R1.13 COC(c1cccc(c1)Cl)CN Amb17605898 [0,2,0,0,0,0|1,0,1]=4 6868 B12R1.13 COC(c1cccc(c1)N)OC Amb10571314 [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.13 CSC(CN)c1cccc(Br)c1 Amb18293096 [0,2,0,0,0,0|1,0,1]=4 6870 B12R1.13 CSC(CN)c1cccc(Cl)c1 Amb18293084 [0,2,0,0,0,0|1,0,1]=4 6871 B12R1.13 CSC(CN)c1cccc(F)c1 Amb18293088 [0,2,0,0,0,0|1,0,1]=4 6872 B12R1.13 Cc1cc(cc[n]1)C(C=C)NC Amb24747588 [0,2,0,0,0,0|2,0,0]=4 6873 B12R1.13 Cc1cc(ccc1)C(CBr)CBr Amb25086999 [0,2,0,0,0,0|1,0,1]=4 6874 B12R1.13 Cc1cc(ccc1)C(CCl)CCl Amb24398993 [0,2,0,0,0,0|1,0,1]=4 6875 B12R1.13 Cc1cc(ccc1)C(CN)CF Amb24514633 [0,2,0,0,0,0|1,0,1]=4 6876 B12R1.13 Cc1cc(ccc1)C(CN)CN Amb18563649 [0,2,0,0,0,0|1,0,1]=4 6877 B12R1.13 Cc1cc(ccc1)C(CN)CO Amb18563695 [0,2,0,0,0,0|0,0,2]=4 6878 B12R1.13 Cc1cccc([n]1)C(C=C)NC Amb25731355 [0,2,0,0,0,0|2,0,0]=4 6879 B12R1.13 Cc1cccc(c1)C(C#C)NC Amb25316509 [0,2,0,0,0,0|1,0,1]=4 6880 B12R1.13 Cc1cccc(c1)C(C=C)NC Amb24483846 [0,2,0,0,0,0|1,0,0]=3 6881 B12R1.13 Cc1cccc(c1)C(CC)C#N Amb25075531 [0,2,0,0,0,0|1,0,1]=4 6882 B12R1.13 Cc1cccc(c1)C(CC)NC Amb18968341 [0,2,0,0,0,0|1,0,1]=4 6883 B12R1.13 Cc1cccc(c1)C(CC)NN Amb24502048 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.13 Cc1cccc(c1)C(CC)NO Amb25787227 [0,2,0,0,0,0|1,0,1]=4 6885 B12R1.13 Cc1cccc(c1)C(CI)OC Amb25188246 [0,2,0,0,0,0|1,0,1]=4 6886 B12R1.13 Cc1cccc(c1)C(CN)NC Amb18985313 [0,2,0,0,0,0|1,0,1]=4 6887 B12R1.13 Cc1cccc(c1)C(CN)OC Amb18980157 [0,2,0,0,0,0|1,0,1]=4 6888 B12R1.13 Cc1cccc(c1)C(CN)SC Amb18980159 [0,2,0,0,0,0|1,0,1]=4 6889 B12R1.13 Cc1cccc(c1)C(CO)CC Amb25330340 [0,2,0,0,0,0|0,0,2]=4 6890 B12R1.13 Cc1cccc(c1)N(CC)C=O Amb24553259 [0,2,0,0,0,0|1,0,0]=3 6891 B12R1.13 Cc1cccc(c1)[C@H](CO)NC Amb25209506 [0,2,0,0,0,0|0,0,2]=4 6892 B12R1.13 Clc1cc(ccc1)C(CBr)CBr Amb24378810 [0,2,0,0,0,0|1,0,1]=4 6893 B12R1.13 Clc1cccc(c1)C(CCl)CCl Amb24381309 [0,2,0,0,0,0|1,0,1]=4 6894 B12R1.13 Fc1cc(ccc1)C(CCl)CCl Amb25806856 [0,2,0,0,0,0|1,0,1]=4 6895 B12R1.13 N#CC(C=O)C1=CC=CC(=O)N1 Amb25066891 [0,2,0,0,0,0|1,0,1]=4 6896 B12R1.13 NCC(CF)c1cc(Cl)ccc1 Amb25195447 [0,2,0,0,0,0|1,0,1]=4 6897 B12R1.13 NCC(CN)c1cccc(Br)c1 Amb18070430 [0,2,0,0,0,0|1,0,1]=4 6898 B12R1.13 NCC(CN)c1cccc(Cl)c1 Amb18564314 [0,2,0,0,0,0|1,0,1]=4 6899 B12R1.13 NCC(CN)c1cccc(F)c1 Amb18563849 [0,2,0,0,0,0|1,0,1]=4 6900 B12R1.13 NCC(CO)c1cc(Br)ccc1 Amb18070487 [0,2,0,0,0,0|0,0,2]=4 6901 B12R1.13 NCC(CO)c1cc(Cl)ccc1 Amb18564354 [0,2,0,0,0,0|0,0,2]=4 6902 B12R1.13 NCC(CO)c1cc(F)ccc1 Amb25256135 [0,2,0,0,0,0|0,0,2]=4 6903 B12R1.13 NC[C@H](CO)c1cccc(O)c1 Amb25328893 [0,2,0,0,0,0|0,0,2]=4 6904 B12R1.13 NC\C(=C\F)\c1cccc(O)c1 Amb25242523 [0,2,0,0,0,0|1,0,1]=4 6905 B12R1.13 Nc1cccc(c1)C(CO)CN Amb23399741 [0,2,0,0,0,0|0,0,2]=4 6906 B12R1.13 Nc1cccc(c1)C(CO)CN Amb25258508 [0,2,0,0,0,0|0,0,2]=4 6907 B12R1.13 O=CC(CF)c1cccc(Cl)c1 Amb24708231 [0,2,0,0,0,0|0,0,0]=2 6908 B12R1.13 O=CC(c1cccc(c1)C)C#N Amb17334454 [0,2,0,0,0,0|0,0,1]=3 6909 B12R1.13 O=CC(c1cccc(c1)Cl)C#N Amb1903848 [0,2,0,0,0,0|0,0,1]=3 6910 B12R1.13 OCC(CF)c1cc(Cl)ccc1 Amb24559028 [0,2,0,0,0,0|0,0,2]=4 6911 B12R1.13 OCC(CO)c1cccc(F)c1 Amb20668211 [0,2,0,0,0,0|0,0,2]=4 6912 B12R1.13 OCC(NO)c1cccc(Br)c1 Amb25036338 [0,2,0,0,0,0|1,0,1]=4 6913 B12R1.13 OCC(NO)c1cccc(Cl)c1 Amb25343657 [0,2,0,0,0,0|1,0,1]=4 6914 B12R1.13 OCC(c1cccc(c1)Br)CO Amb17344704 [0,2,0,0,0,0|0,0,2]=4 6915 B12R1.13 OCC(c1cccc(c1)C)CO Amb17334674 [0,2,0,0,0,0|0,0,2]=4 6916 B12R1.13 OCC(c1cccc(c1)Cl)CO Amb17335890 [0,2,0,0,0,0|0,0,2]=4 6917 B12R1.13 OC[C@@H](NO)c1cccc(Cl)c1 Amb24534165 [0,2,0,0,0,0|1,0,1]=4 6918 B12R1.13 OC[C@@H](NO)c1cccc(F)c1 Amb25687299 [0,2,0,0,0,0|1,0,1]=4 6919 B12R1.13 OC[C@H](NO)c1cccc(Br)c1 Amb25714427 [0,2,0,0,0,0|1,0,1]=4 6920 B12R1.13 OC[C@H](NO)c1cccc(Cl)c1 Amb24662260 [0,2,0,0,0,0|1,0,1]=4 6921 B12R1.13 O\C=C(\C=O)/c1cccc(Br)c1 Amb24567221 [0,2,0,0,0,0|0,0,2]=4 6922 B12R1.13 Oc1cc(ccc1)\C(\C=O)=C/O Amb24639189 [0,2,0,0,0,0|0,0,2]=4 6923 B12R1.13 Oc1cc(ccc1)\C(\CO)=C/F Amb24512391 [0,2,0,0,0,0|1,0,1]=4 6924 B12R1.243 C=CC(C=C)c1ccccc1O Amb18645360 [0,2,0,0,0,0|1,0,1]=4 6925 B12R1.243 C=CC(CO)N1C=CC=CC1=O Amb24403782 [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.243 C=CC(NN)c1ccccc1Br Amb25307683 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.243 C=CC(NN)c1ccccc1I Amb25307685 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.243 C=CC(NN)c1ccccc1N Amb25282426 [0,2,0,0,0,0|2,0,0]=4 6929 B12R1.243 C=C[C@@H](CO)N1C=CC=CC1=O Amb24719800 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.243 CCC(C#N)c1ccccc1Br Amb25257226 [0,2,0,0,0,0|1,0,1]=4 6931 B12R1.243 CCC(C#N)c1ccccc1F Amb24591661 [0,2,0,0,0,0|1,0,1]=4 6932 B12R1.243 CCC(C=C)c1ccccc1O Amb24408310 [0,2,0,0,0,0|1,0,0]=3 6933 B12R1.243 CCC(C=O)c1ccccc1I Amb24610779 [0,2,0,0,0,0|0,0,0]=2 6934 B12R1.243 CCC(CC)c1ccccc1N Amb24400405 [0,2,0,0,0,0|1,0,1]=4 6935 B12R1.243 CCC(CC)c1ccccc1O Amb24676779 [0,2,0,0,0,0|1,0,1]=4 6936 B12R1.243 CCC(CCl)c1ccccc1F Amb24416114 [0,2,0,0,0,0|1,0,1]=4 6937 B12R1.243 CCC(CN)c1ccccc1Br Amb18659760 [0,2,0,0,0,0|1,0,1]=4 6938 B12R1.243 CCC(CN)c1ccccc1O Amb25071535 [0,2,0,0,0,0|1,0,1]=4 6939 B12R1.243 CCC(NC)c1ccccc1Cl Amb19057380 [0,2,0,0,0,0|1,0,1]=4 6940 B12R1.243 CCC(NC)c1ccccc1I Amb25057922 [0,2,0,0,0,0|1,0,1]=4 6941 B12R1.243 CCC(NN)c1ccccc1I Amb25350612 [0,2,0,0,0,0|2,0,0]=4 6942 B12R1.243 CCC(OC)c1ccccc1O Amb24706761 [0,2,0,0,0,0|1,0,1]=4 6943 B12R1.243 CCC(c1ccccc1C)CN Amb17232445 [0,2,0,0,0,0|1,0,1]=4 6944 B12R1.243 CCC(c1ccccc1Cl)CN Amb17234046 [0,2,0,0,0,0|1,0,1]=4 6945 B12R1.243 CCC(c1ccccc1F)CN Amb17232644 [0,2,0,0,0,0|1,0,1]=4 6946 B12R1.243 CCC(c1ccccc1F)NC Amb10840806 [0,2,0,0,0,0|1,0,1]=4 6947 B12R1.243 CCC(c1ccccc1O)NC Amb1119874 [0,2,0,0,0,0|1,0,1]=4 6948 B12R1.243 CCN(C=O)c1ccccc1F Amb24476191 [0,2,0,0,0,0|1,0,0]=3 6949 B12R1.243 CCN(N=O)c1ccccc1C Amb17939333 [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.243 CCN(N=O)c1ccccc1O Amb25282856 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.243 CC[C@@H](NO)c1ccccc1Br Amb24342181 [0,2,0,0,0,0|1,0,1]=4 6952 B12R1.243 CC[C@@H](NO)c1ccccc1Cl Amb25692177 [0,2,0,0,0,0|1,0,1]=4 6953 B12R1.243 CC[C@@H](NO)c1ccccc1O Amb24492899 [0,2,0,0,0,0|1,0,1]=4 6954 B12R1.243 CC[C@H](NC)c1ccccc1F Amb25279369 [0,2,0,0,0,0|1,0,1]=4 6955 B12R1.243 CC[C@H](NO)c1ccccc1Br Amb24472229 [0,2,0,0,0,0|1,0,1]=4 6956 B12R1.243 CC[C@H](NO)c1ccccc1Cl Amb24524949 [0,2,0,0,0,0|1,0,1]=4 6957 B12R1.243 CC[C@H](NO)c1ccccc1F Amb25125995 [0,2,0,0,0,0|1,0,1]=4 6958 B12R1.243 CNC(C#C)c1ccccc1Br Amb25148678 [0,2,0,0,0,0|1,0,1]=4 6959 B12R1.243 CNC(C#C)c1ccccc1Cl Amb24637551 [0,2,0,0,0,0|1,0,1]=4 6960 B12R1.243 CNC(C#C)c1ccccc1F Amb25148771 [0,2,0,0,0,0|1,0,1]=4 6961 B12R1.243 CNC(C=C)c1[n]cccc1Br Amb25762257 [0,2,0,0,0,0|2,0,0]=4 6962 B12R1.243 CNC(C=C)c1cc[n]cc1Br Amb25240987 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.243 CNC(C=C)c1cc[n]cc1F Amb25039118 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.243 CNC(CF)c1ccccc1Cl Amb24497481 [0,2,0,0,0,0|1,0,1]=4 6965 B12R1.243 CNC(CF)c1ccccc1F Amb25248858 [0,2,0,0,0,0|1,0,1]=4 6966 B12R1.243 CNC(CN)c1ccccc1Br Amb18985340 [0,2,0,0,0,0|1,0,1]=4 6967 B12R1.243 CNC(CN)c1ccccc1F Amb18985336 [0,2,0,0,0,0|1,0,1]=4 6968 B12R1.243 CNC(CO)c1ccccc1Br Amb18290215 [0,2,0,0,0,0|0,0,2]=4 6969 B12R1.243 CNC(c1ccccc1C)CO Amb17232543 [0,2,0,0,0,0|0,0,2]=4 6970 B12R1.243 CNC(c1ccccc1Cl)CN Amb10879687 [0,2,0,0,0,0|1,0,1]=4 6971 B12R1.243 CNC(c1ccccc1Cl)CO Amb17234261 [0,2,0,0,0,0|0,0,2]=4 6972 B12R1.243 CNC(c1ccccc1F)CO Amb17232698 [0,2,0,0,0,0|0,0,2]=4 6973 B12R1.243 CN[C@@H](CO)c1ccccc1Br Amb25771029 [0,2,0,0,0,0|0,0,2]=4 6974 B12R1.243 CN[C@@H](CO)c1ccccc1Cl Amb25090265 [0,2,0,0,0,0|0,0,2]=4 6975 B12R1.243 CN[C@@H](CO)c1ccccc1N Amb24667781 [0,2,0,0,0,0|0,0,2]=4 6976 B12R1.243 CN[C@H](CO)c1ccccc1Br Amb25744502 [0,2,0,0,0,0|0,0,2]=4 6977 B12R1.243 CN[C@H](CO)c1ccccc1Cl Amb25340452 [0,2,0,0,0,0|0,0,2]=4 6978 B12R1.243 CN[C@H](CO)c1ccccc1F Amb25149852 [0,2,0,0,0,0|0,0,2]=4 6979 B12R1.243 COC(C#N)c1ccccc1Cl Amb20668091 [0,2,0,0,0,0|1,0,1]=4 6980 B12R1.243 COC(C#N)c1ccccc1F Amb25123031 [0,2,0,0,0,0|1,0,1]=4 6981 B12R1.243 COC(CBr)c1ccccc1Cl Amb25707157 [0,2,0,0,0,0|1,0,1]=4 6982 B12R1.243 COC(CN)c1ccccc1Br Amb18293119 [0,2,0,0,0,0|1,0,1]=4 6983 B12R1.243 COC(CN)c1ccccc1Cl Amb20629933 [0,2,0,0,0,0|1,0,1]=4 6984 B12R1.243 COC(CN)c1ccccc1O Amb24756886 [0,2,0,0,0,0|1,0,1]=4 6985 B12R1.243 COC(CO)c1ccccc1Cl Amb25158083 [0,2,0,0,0,0|0,0,2]=4 6986 B12R1.243 COC(OC)c1ccccc1Br Amb20242663 [0,2,0,0,0,0|2,0,0]=4 6987 B12R1.243 COC(OC)c1ccccc1F Amb19895505 [0,2,0,0,0,0|2,0,0]=4 6988 B12R1.243 COC(OC)c1ccccc1I Amb20242836 [0,2,0,0,0,0|2,0,0]=4 6989 B12R1.243 COC(c1ccccc1C)CN Amb17605868 [0,2,0,0,0,0|1,0,1]=4 6990 B12R1.243 COC(c1ccccc1Cl)CN Amb17605860 [0,2,0,0,0,0|1,0,1]=4 6991 B12R1.243 CSC(C=O)c1ccc[n]c1N Amb25308960 [0,2,0,0,0,0|1,0,0]=3 6992 B12R1.243 CSC(CN)c1ccccc1Br Amb18293121 [0,2,0,0,0,0|1,0,1]=4 6993 B12R1.243 CSC(CN)c1ccccc1Cl Amb18293085 [0,2,0,0,0,0|1,0,1]=4 6994 B12R1.243 CSC(CN)c1ccccc1F Amb18293112 [0,2,0,0,0,0|1,0,1]=4 6995 B12R1.243 C\C=C(/C=O)\c1ccccc1Cl Amb18648450 [0,2,0,0,0,0|0,0,1]=3 6996 B12R1.243 C\C=C(/c1ccccc1C)\C=O Amb10553471 [0,2,0,0,0,0|0,0,1]=3 6997 B12R1.243 C\C=C(\C=O)/c1ccccc1Cl Amb24567049 [0,2,0,0,0,0|0,0,1]=3 6998 B12R1.243 C\C=C(\CC)/c1ccccc1N Amb25061354 [0,2,0,0,0,0|1,0,1]=4 6999 B12R1.243 C\C=C(\CC)/c1ccccc1O Amb25035033 [0,2,0,0,0,0|1,0,1]=4 7000 B12R1.243 C\C=C(\OC)/c1ccccc1O Amb24654968 [0,2,0,0,0,0|1,0,1]=4 7001 B12R1.243 C\C=C(\SC)/c1ccccc1O Amb24617246 [0,2,0,0,0,0|1,0,1]=4 7002 B12R1.243 Cc1ccc[n]c1C(C=C)NC Amb25047145 [0,2,0,0,0,0|2,0,0]=4 7003 B12R1.243 Cc1ccccc1C(C#C)NC Amb25852233 [0,2,0,0,0,0|1,0,1]=4 7004 B12R1.243 Cc1ccccc1C(C#N)OC Amb25150131 [0,2,0,0,0,0|1,0,1]=4 7005 B12R1.243 Cc1ccccc1C(CBr)CC Amb25265591 [0,2,0,0,0,0|1,0,1]=4 7006 B12R1.243 Cc1ccccc1C(CC)C#N Amb25837991 [0,2,0,0,0,0|1,0,1]=4 7007 B12R1.243 Cc1ccccc1C(CC)NC Amb18301845 [0,2,0,0,0,0|1,0,1]=4 7008 B12R1.243 Cc1ccccc1C(CN)CF Amb25268672 [0,2,0,0,0,0|1,0,1]=4 7009 B12R1.243 Cc1ccccc1C(CN)CN Amb18563648 [0,2,0,0,0,0|1,0,1]=4 7010 B12R1.243 Cc1ccccc1C(CN)CO Amb18563694 [0,2,0,0,0,0|0,0,2]=4 7011 B12R1.243 Cc1ccccc1C(CN)NC Amb18985311 [0,2,0,0,0,0|1,0,1]=4 7012 B12R1.243 Cc1ccccc1C(CN)SC Amb18293103 [0,2,0,0,0,0|1,0,1]=4 7013 B12R1.243 Cc1ccccc1C(CO)CC Amb25717030 [0,2,0,0,0,0|0,0,2]=4 7014 B12R1.243 Cc1ccccc1N(CC)C=O Amb25150813 [0,2,0,0,0,0|1,0,0]=3 7015 B12R1.243 Cc1ccccc1[C@@H](CO)CC Amb25333556 [0,2,0,0,0,0|0,0,2]=4 7016 B12R1.243 Cc1ccccc1[C@@H](CO)NC Amb25378752 [0,2,0,0,0,0|0,0,2]=4 7017 B12R1.243 Cc1ccccc1[C@@H](CO)NO Amb24630438 [0,2,0,0,0,0|1,0,1]=4 7018 B12R1.243 Cc1ccccc1\C(=C/O)\C=O Amb25667645 [0,2,0,0,0,0|0,0,2]=4 7019 B12R1.243 Cc1ccccc1\C(\C=O)=C\C Amb18645370 [0,2,0,0,0,0|0,0,1]=3 7020 B12R1.243 Fc1ccccc1C(CBr)CBr Amb24665360 [0,2,0,0,0,0|1,0,1]=4 7021 B12R1.243 Fc1ccccc1C(CCl)CCl Amb25212183 [0,2,0,0,0,0|1,0,1]=4 7022 B12R1.243 N#CC(C=O)c1ccc[n]c1Cl Amb24423425 [0,2,0,0,0,0|1,0,1]=4 7023 B12R1.243 N#CC(C=O)c1ccccc1Br Amb25237056 [0,2,0,0,0,0|0,0,1]=3 7024 B12R1.243 NCC(CCl)c1ccccc1Cl Amb25314247 [0,2,0,0,0,0|1,0,1]=4 7025 B12R1.243 NCC(CF)c1ccccc1Cl Amb25225893 [0,2,0,0,0,0|1,0,1]=4 7026 B12R1.243 NCC(CF)c1ccccc1O Amb25135361 [0,2,0,0,0,0|1,0,1]=4 7027 B12R1.243 NCC(CN)c1ccccc1Br Amb18070432 [0,2,0,0,0,0|1,0,1]=4 7028 B12R1.243 NCC(CN)c1ccccc1Cl Amb18564313 [0,2,0,0,0,0|1,0,1]=4 7029 B12R1.243 NCC(CN)c1ccccc1F Amb18563847 [0,2,0,0,0,0|1,0,1]=4 7030 B12R1.243 NCC(CO)c1ccccc1Cl Amb18564353 [0,2,0,0,0,0|0,0,2]=4 7031 B12R1.243 NCC(CO)c1ccccc1F Amb18563896 [0,2,0,0,0,0|0,0,2]=4 7032 B12R1.243 NCC(CO)c1ccccc1O Amb24414167 [0,2,0,0,0,0|0,0,2]=4 7033 B12R1.243 Nc1ccccc1C(CO)CO Amb18646733 [0,2,0,0,0,0|0,0,2]=4 7034 B12R1.243 O=CC(C=O)c1ccccc1Br Amb25041468 [0,2,0,0,0,0|0,0,1]=3 7035 B12R1.243 O=CC(CF)c1ccccc1Cl Amb25178227 [0,2,0,0,0,0|0,0,0]=2 7036 B12R1.243 O=CC(CF)c1ccccc1F Amb24527523 [0,2,0,0,0,0|0,0,0]=2 7037 B12R1.243 O=CC(c1ccccc1C)C=O Amb17334560 [0,2,0,0,0,0|0,0,1]=3 7038 B12R1.243 O=CC(c1ccccc1Cl)C#N Amb17335385 [0,2,0,0,0,0|0,0,1]=3 7039 B12R1.243 O=CC(c1ccccc1Cl)C=O Amb17335586 [0,2,0,0,0,0|0,0,1]=3 7040 B12R1.243 O=CC(c1ccccc1F)C#N Amb17334572 [0,2,0,0,0,0|0,0,1]=3 7041 B12R1.243 O=CC(c1ccccc1F)C=O Amb17334660 [0,2,0,0,0,0|0,0,1]=3 7042 B12R1.243 OCC(CF)c1ccccc1F Amb25217403 [0,2,0,0,0,0|0,0,2]=4 7043 B12R1.243 OCC(CO)c1ccccc1I Amb25697555 [0,2,0,0,0,0|0,0,2]=4 7044 B12R1.243 OCC(NO)c1ccccc1Br Amb24672586 [0,2,0,0,0,0|1,0,1]=4 7045 B12R1.243 OCC(c1ccccc1C)CO Amb17334673 [0,2,0,0,0,0|0,0,2]=4 7046 B12R1.243 OCC(c1ccccc1Cl)CO Amb17335889 [0,2,0,0,0,0|0,0,2]=4 7047 B12R1.243 OCC(c1ccccc1F)CO Amb17334791 [0,2,0,0,0,0|0,0,2]=4 7048 B12R1.243 OC[C@@H](NO)c1ccccc1Cl Amb25303902 [0,2,0,0,0,0|1,0,1]=4 7049 B12R1.243 OC[C@H](NO)c1ccccc1Br Amb25133780 [0,2,0,0,0,0|1,0,1]=4 7050 B12R1.243 O\C=C(\c1ccccc1C)/C=O Amb17334561 [0,2,0,0,0,0|0,0,2]=4 7051 B12R1.243 O\C=C(\c1ccccc1Cl)/C=O Amb17335587 [0,2,0,0,0,0|0,0,2]=4 7052 B12R1.243 O\C=C(\c1ccccc1F)/C=O Amb17334661 [0,2,0,0,0,0|0,0,2]=4 7053 B12R1.243 Oc1ccccc1C(CF)C=O Amb24596103 [0,2,0,0,0,0|0,0,0]=2 7054 B12R1.243 Oc1ccccc1C(CO)NO Amb25796313 [0,2,0,0,0,0|1,0,1]=4 7055 B12R1.243 [C-]#[N+]C(CF)c1ccccc1F Amb25267917 [0,2,0,0,0,0|2,0,0]=4 7056 B12R1.478 BrCC(c1ccccc1)C(C)C Amb17247625 [0,2,0,0,0,0|1,0,1]=4 7057 B12R1.478 C/C(O)=C(/C=O)c1ccccc1 Amb17777663 [0,2,0,0,0,0|0,0,1]=3 7058 B12R1.478 C=C=C(C(O)=O)c1ccccc1 Amb24717361 [0,2,0,0,0,0|0,0,2]=4 7059 B12R1.478 C=CC(C(N)=O)c1ccccc1 Amb25361995 [0,2,0,0,0,0|0,0,1]=3 7060 B12R1.478 C=CC(C(O)=O)c1ccccc1 Amb18645652 [0,2,0,0,0,0|0,0,1]=3 7061 B12R1.478 C=NC(C(O)=O)c1ccccc1 Amb24068840 [0,2,0,0,0,0|0,0,1]=3 7062 B12R1.478 CC(=C)C(NC)c1c[n]ccc1 Amb25091471 [0,2,0,0,0,0|2,0,0]=4 7063 B12R1.478 CC(=C)C(NN)c1ccccc1 Amb24438127 [0,2,0,0,0,0|2,0,0]=4 7064 B12R1.478 CC(=C)[C@@H](CO)c1ccccc1 Amb25157975 [0,2,0,0,0,0|1,0,0]=3 7065 B12R1.478 CC(=O)C(/c1ccccc1)=C\N Amb17777807 [0,2,0,0,0,0|0,0,2]=4 7066 B12R1.478 CC(=O)C(=C=O)c1ccccc1 Amb25730145 [0,2,0,0,0,0|0,0,2]=4 7067 B12R1.478 CC(=O)C(=[N+]=[N-])c1ccccc1 Amb17593995 [0,2,0,0,0,0|1,0,1]=4 7068 B12R1.478 CC(=O)C(C=C)c1ccccc1 Amb24736196 [0,2,0,0,0,0|0,0,1]=3 7069 B12R1.478 CC(=O)C(C=N)c1ccccc1 Amb21952033 [0,2,0,0,0,0|0,0,1]=3 7070 B12R1.478 CC(=O)C(C=O)c1ccccc1 Amb18126328 [0,2,0,0,0,0|0,0,0]=2 7071 B12R1.478 CC(=O)C(CC)c1c[n]ccc1 Amb24448949 [0,2,0,0,0,0|1,0,0]=3 7072 B12R1.478 CC(=O)C(CC)c1cc[n]cc1 Amb25354421 [0,2,0,0,0,0|1,0,0]=3 7073 B12R1.478 CC(=O)C(CCl)c1ccccc1 Amb24565751 [0,2,0,0,0,0|0,0,0]=2 7074 B12R1.478 CC(=O)C(CN)c1ccccc1 Amb25148601 [0,2,0,0,0,0|0,0,0]=2 7075 B12R1.478 CC(=O)C(CO)c1ccccc1 Amb21962499 [0,2,0,0,0,0|0,0,0]=2 7076 B12R1.478 CC(=O)C(N=O)c1ccccc1 Amb25322912 [0,2,0,0,0,0|1,0,0]=3 7077 B12R1.478 CC(=O)C(OC)c1c[n]ccc1 Amb25115527 [0,2,0,0,0,0|1,0,0]=3 7078 B12R1.478 CC(=O)N(C=C)c1ccccc1 Amb24563080 [0,2,0,0,0,0|1,0,1]=4 7079 B12R1.478 CC(=O)N(CC)c1c[n]ccc1 Amb25069485 [0,2,0,0,0,0|2,0,0]=4 7080 B12R1.478 CC(=O)\C(=C\C)\c1ccccc1 Amb24378467 [0,2,0,0,0,0|0,0,1]=3 7081 B12R1.478 CC(=O)\C(=C\N)\c1ccccc1 Amb25238332 [0,2,0,0,0,0|0,0,2]=4 7082 B12R1.478 CC(=O)\C(=N\O)\c1ccccc1 Amb24700799 [0,2,0,0,0,0|1,0,1]=4 7083 B12R1.478 CC(=S)N(CC)c1ccccc1 Amb24096611 [0,2,0,0,0,0|1,1,0]=4 7084 B12R1.478 CC(C)=C(C=O)c1ccccc1 Amb18645378 [0,2,0,0,0,0|0,0,1]=3 7085 B12R1.478 CC(C)=C(NC)c1ccccc1 Amb24443878 [0,2,0,0,0,0|1,0,1]=4 7086 B12R1.478 CC(C)C(C=O)c1cc[n]cc1 Amb24727519 [0,2,0,0,0,0|1,0,0]=3 7087 B12R1.478 CC(C)C(C=O)c1cccc[n]1 Amb25376240 [0,2,0,0,0,0|1,0,0]=3 7088 B12R1.478 CC(C)C(CC)c1ccccc1 Amb25281082 [0,2,0,0,0,0|1,0,1]=4 7089 B12R1.478 CC(C)C(NN)c1ccccc1 Amb18792589 [0,2,0,0,0,0|2,0,0]=4 7090 B12R1.478 CC(C)C(OC)c1ccccc1 Amb23568503 [0,2,0,0,0,0|1,0,1]=4 7091 B12R1.478 CC(C)[C@@H](CCl)c1ccccc1 Amb24426185 [0,2,0,0,0,0|1,0,1]=4 7092 B12R1.478 CC(C)[C@@H](CN)c1ccccc1 Amb25072543 [0,2,0,0,0,0|1,0,1]=4 7093 B12R1.478 CC(C)[C@H](C=O)c1ccccc1 Amb24497169 [0,2,0,0,0,0|0,0,0]=2 7094 B12R1.478 CC(C)[C@H](CO)c1ccccc1 Amb25333656 [0,2,0,0,0,0|0,0,2]=4 7095 B12R1.478 CC(N)C(CC)c1ccccc1 Amb25667182 [0,2,0,0,0,0|1,0,1]=4 7096 B12R1.478 CC(N)C(CO)c1ccccc1 Amb25159957 [0,2,0,0,0,0|0,0,2]=4 7097 B12R1.478 CC(N)C(OC)c1ccccc1 Amb18980113 [0,2,0,0,0,0|1,0,1]=4 7098 B12R1.478 CC(N)C(SC)c1ccccc1 Amb18980114 [0,2,0,0,0,0|1,0,1]=4 7099 B12R1.478 CC(N)\C(=C\Cl)\c1ccccc1 Amb24670393 [0,2,0,0,0,0|1,0,1]=4 7100 B12R1.478 CC(O)C(NC)c1ccccc1 Amb18646387 [0,2,0,0,0,0|0,0,2]=4 7101 B12R1.478 CC(O)C(OC)c1ccccc1 Amb25700350 [0,2,0,0,0,0|0,0,2]=4 7102 B12R1.478 CC(O)C(SC)c1ccccc1 Amb25796298 [0,2,0,0,0,0|0,0,2]=4 7103 B12R1.478 CCC(C(N)=N)c1ccccc1 Amb24726150 [0,2,0,0,0,0|1,0,0]=3 7104 B12R1.478 CCC(C(O)=O)c1c[n]c[n]c1 Amb18300654 [0,2,0,0,0,0|2,0,0]=4 7105 B12R1.478 CCC(C(O)=O)c1c[n]cc[n]1 Amb18827856 [0,2,0,0,0,0|2,0,0]=4 7106 B12R1.478 CCC(C(O)=O)c1cc[n]c[n]1 Amb18827920 [0,2,0,0,0,0|2,0,0]=4 7107 B12R1.478 CCC(C(O)=O)c1ccc[n]c1 Amb18999434 [0,2,0,0,0,0|1,0,0]=3 7108 B12R1.478 CCC(C(O)=O)c1cccc[n]1 Amb25116759 [0,2,0,0,0,0|1,0,0]=3 7109 B12R1.478 CCC(c1ccccc1)=C(F)F Amb25036284 [0,2,0,0,0,0|1,0,1]=4 7110 B12R1.478 CCC(c1ccccc1)[N+]([O-])=O Amb24730815 [0,2,0,0,0,0|1,0,0]=3 7111 B12R1.478 CCN(C(N)=O)c1cc[n]cc1 Amb25139930 [0,2,0,0,0,0|2,0,0]=4 7112 B12R1.478 CCN(C(S)=S)c1ccccc1 Amb24678260 [0,2,0,0,0,0|1,1,0]=4 7113 B12R1.478 CCN(c1ccccc1)C(=O)Cl Amb17563104 [0,2,0,0,0,0|1,0,0]=3 7114 B12R1.478 CCN(c1ccccc1)C(=O)N Amb1138727 [0,2,0,0,0,0|1,0,0]=3 7115 B12R1.478 CCN(c1ccccc1)C(=S)N Amb1126151 [0,2,0,0,0,0|1,1,0]=4 7116 B12R1.478 CCN(c1ccccc1)C([S-])=S Amb22733659 [0,2,0,0,0,0|1,1,0]=4 7117 B12R1.478 CC[C@@H](C(=O)Cl)c1ccccc1 Amb25207875 [0,2,0,0,0,0|0,0,0]=2 7118 B12R1.478 CC[C@@H](C(N)=O)c1ccccc1 Amb25034606 [0,2,0,0,0,0|0,0,0]=2 7119 B12R1.478 CC[C@@H](c1ccccc1)N(C)C Amb24385295 [0,2,0,0,0,0|1,0,1]=4 7120 B12R1.478 CN(C(c1ccccc1)C#N)C Amb1397749 [0,2,0,0,0,0|1,0,1]=4 7121 B12R1.478 CN(C(c1ccccc1)C#N)C Amb17621589 [0,2,0,0,0,0|1,0,1]=4 7122 B12R1.478 CN(C)C(C=O)c1ccccc1 Amb24728369 [0,2,0,0,0,0|0,0,0]=2 7123 B12R1.478 CN(C)[C@@H](CN)c1ccccc1 Amb24649763 [0,2,0,0,0,0|1,0,1]=4 7124 B12R1.478 CN(C)[C@@H](CO)c1ccccc1 Amb25859368 [0,2,0,0,0,0|0,0,2]=4 7125 B12R1.478 CN(C)[C@H](CCl)c1ccccc1 Amb25053864 [0,2,0,0,0,0|1,0,1]=4 7126 B12R1.478 CN(N)C(CO)c1ccccc1 Amb25357517 [0,2,0,0,0,0|0,0,2]=4 7127 B12R1.478 CNC(C(O)=O)c1cc[n]cc1 Amb23555580 [0,2,0,0,0,0|1,0,0]=3 7128 B12R1.478 CNC(C(O)=O)c1cccc[n]1 Amb25159848 [0,2,0,0,0,0|1,0,0]=3 7129 B12R1.478 CNC(C(O)=O)c1ccccc1 Amb19346335 [0,2,0,0,0,0|0,0,0]=2 7130 B12R1.478 CNC(c1ccccc1)C(=O)N Amb17334616 [0,2,0,0,0,0|0,0,0]=2 7131 B12R1.478 CNC(c1ccccn1)C(=O)N Amb17334638 [0,2,0,0,0,0|1,0,0]=3 7132 B12R1.478 CNC(c1cccnc1)C(=O)N Amb17334639 [0,2,0,0,0,0|1,0,0]=3 7133 B12R1.478 CNC(c1ccncc1)C(=O)N Amb17334640 [0,2,0,0,0,0|1,0,0]=3 7134 B12R1.478 CNN(C(N)=S)c1ccccc1 Amb25772831 [0,2,0,0,0,0|1,1,0]=4 7135 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O Amb16183859 [0,2,0,0,0,0|0,0,0]=2 7136 B12R1.478 CN[C@H](c1ccccc1)C(=O)O Amb16183947 [0,2,0,0,0,0|0,0,0]=2 7137 B12R1.478 COC(C(F)Cl)c1ccccc1 Amb25362062 [0,2,0,0,0,0|1,0,1]=4 7138 B12R1.478 COC(C(O)=O)c1c[n]c[n]c1 Amb24607583 [0,2,0,0,0,0|2,0,0]=4 7139 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb23440840 [0,2,0,0,0,0|0,0,0]=2 7140 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb24325342 [0,2,0,0,0,0|0,0,0]=2 7141 B12R1.478 COC(c1ccccc1)C(=O)C Amb10562726 [0,2,0,0,0,0|0,0,0]=2 7142 B12R1.478 COC(c1ccccc1)C(=O)N Amb10769824 [0,2,0,0,0,0|0,0,0]=2 7143 B12R1.478 COC(c1ccccc1)C(=O)O Amb2099459 [0,2,0,0,0,0|0,0,0]=2 7144 B12R1.478 CON(C(N)=O)[n+]1ccccc1 Amb24562858 [0,2,0,0,0,0|2,0,0]=4 7145 B12R1.478 CO[C@@H](C(N)=O)c1ccccc1 Amb25363386 [0,2,0,0,0,0|0,0,0]=2 7146 B12R1.478 CS(=O)[C@@H](CO)c1ccccc1 Amb25831961 [0,2,0,0,0,0|1,0,0]=3 7147 B12R1.478 CSC(C(N)=O)c1ccccc1 Amb25066103 [0,2,0,0,0,0|0,0,0]=2 7148 B12R1.478 CSC(C(O)=O)c1ccccc1 Amb18971615 [0,2,0,0,0,0|0,0,0]=2 7149 B12R1.478 C[C@@H](Cl)[C@@H](OC)c1ccccc1 Amb24390884 [0,2,0,0,0,0|1,0,1]=4 7150 B12R1.478 C[C@@H](O)[C@@H](C#N)c1ccccc1 Amb25357376 [0,2,0,0,0,0|1,0,1]=4 7151 B12R1.478 C[C@@H](O)[C@@H](C=C)c1ccccc1 Amb25069723 [0,2,0,0,0,0|1,0,0]=3 7152 B12R1.478 C[C@@H](O)[C@@H](CC)c1ccccc1 Amb25347649 [0,2,0,0,0,0|0,0,2]=4 7153 B12R1.478 C[C@@H](O)[C@@H](CN)c1ccccc1 Amb24627923 [0,2,0,0,0,0|0,0,2]=4 7154 B12R1.478 C[C@@H](O)[C@@H](SC)c1ccccc1 Amb25332276 [0,2,0,0,0,0|0,0,2]=4 7155 B12R1.478 C[C@H](Cl)[C@@H](OC)c1ccccc1 Amb24726335 [0,2,0,0,0,0|1,0,1]=4 7156 B12R1.478 C[C@H](N)C(OC)c1ccccc1 Amb25106860 [0,2,0,0,0,0|1,0,1]=4 7157 B12R1.478 C[C@H](N)[C@@H](OC)c1ccccc1 Amb25309446 [0,2,0,0,0,0|1,0,1]=4 7158 B12R1.478 C[C@H](N)[C@H](CN)c1ccccc1 Amb25132197 [0,2,0,0,0,0|1,0,1]=4 7159 B12R1.478 C[C@H](N)[C@H](OC)c1ccccc1 Amb24594937 [0,2,0,0,0,0|1,0,1]=4 7160 B12R1.478 C[C@H](O)[C@@H](CO)c1ccccc1 Amb25179958 [0,2,0,0,0,0|0,0,2]=4 7161 B12R1.478 C[C@H](O)[C@@H](OC)c1ccccc1 Amb24403890 [0,2,0,0,0,0|0,0,2]=4 7162 B12R1.478 C[C@H](O)[C@H](CC)c1ccccc1 Amb24497690 [0,2,0,0,0,0|0,0,2]=4 7163 B12R1.478 C[C@H](O)[C@H](NC)c1ccccc1 Amb24341991 [0,2,0,0,0,0|0,0,2]=4 7164 B12R1.478 C\C(\Cl)=C(\C=O)/c1ccccc1 Amb18648445 [0,2,0,0,0,0|0,0,1]=3 7165 B12R1.478 C\C=C(/C(C)N)\c1ccccc1 Amb18645554 [0,2,0,0,0,0|1,0,1]=4 7166 B12R1.478 C\N=C(\C(O)=O)/c1ccccc1 Amb24652432 [0,2,0,0,0,0|0,0,1]=3 7167 B12R1.478 ClCC(c1ccccc1)C(C)C Amb17233967 [0,2,0,0,0,0|1,0,1]=4 7168 B12R1.478 ClCC(c1ccccc1)N(C)C Amb17234042 [0,2,0,0,0,0|1,0,1]=4 7169 B12R1.478 N#CC(C(O)=O)c1cc[n]cc1 Amb24669640 [0,2,0,0,0,0|1,0,1]=4 7170 B12R1.478 N#CC(C(O)=O)c1ccc[n]c1 Amb24487451 [0,2,0,0,0,0|1,0,1]=4 7171 B12R1.478 N#CC(c1ccccc1)C(=O)C Amb2504502 [0,2,0,0,0,0|0,0,1]=3 7172 B12R1.478 N#CC(c1ccccc1)C(=O)O Amb1783147 [0,2,0,0,0,0|0,0,1]=3 7173 B12R1.478 NC(=N)C(CO)c1ccccc1 Amb25061991 [0,2,0,0,0,0|1,0,0]=3 7174 B12R1.478 NC(=O)C(C#N)c1ccccc1 Amb18787947 [0,2,0,0,0,0|0,0,1]=3 7175 B12R1.478 NC(=O)C(CN)c1cccc[n]1 Amb23571970 [0,2,0,0,0,0|1,0,0]=3 7176 B12R1.478 NC(=O)C(CN)c1ccccc1 Amb18999177 [0,2,0,0,0,0|0,0,0]=2 7177 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [0,2,0,0,0,0|0,0,0]=2 7178 B12R1.478 NC(=O)C(NO)c1ccccc1 Amb24373087 [0,2,0,0,0,0|1,0,0]=3 7179 B12R1.478 NC(=O)N(N=O)c1ccccc1 Amb20000996 [0,2,0,0,0,0|2,0,0]=4 7180 B12R1.478 NC(=O)\C(=C\Cl)\c1ccccc1 Amb24538838 [0,2,0,0,0,0|0,0,2]=4 7181 B12R1.478 NC(=O)\C(=C\O)\c1ccccc1 Amb25231959 [0,2,0,0,0,0|0,0,2]=4 7182 B12R1.478 NC(=O)\C(=N/F)\c1ccccc1 Amb25708534 [0,2,0,0,0,0|1,0,1]=4 7183 B12R1.478 NC(=O)\C(=N\F)\c1ccccc1 Amb25336557 [0,2,0,0,0,0|1,0,1]=4 7184 B12R1.478 NC(=O)\C(=N\N)\c1ccccc1 Amb25785115 [0,2,0,0,0,0|1,0,1]=4 7185 B12R1.478 NC(=O)\C(=N\O)\c1ccccc1 Amb23481030 [0,2,0,0,0,0|1,0,1]=4 7186 B12R1.478 NC(=S)C(C#N)c1ccccc1 Amb24400626 [0,2,0,0,0,0|0,1,1]=4 7187 B12R1.478 NCC(B(O)O)c1ccccc1 Amb25840910 [0,2,0,0,0,0|1,0,1]=4 7188 B12R1.478 NCC(C(O)=O)c1c[n]cc[n]1 Amb18827270 [0,2,0,0,0,0|2,0,0]=4 7189 B12R1.478 NCC(C(O)=O)c1cc[n]c[n]1 Amb18827271 [0,2,0,0,0,0|2,0,0]=4 7190 B12R1.478 NCC(c1ccccc1)=C(Br)Br Amb24717278 [0,2,0,0,0,0|1,0,1]=4 7191 B12R1.478 NCC(c1ccccc1)N(C)C Amb1216534 [0,2,0,0,0,0|1,0,1]=4 7192 B12R1.478 NCC(c1ccccn1)C(=O)O Amb17400194 [0,2,0,0,0,0|1,0,0]=3 7193 B12R1.478 NCC(c1ccncc1)C(=O)O Amb17400195 [0,2,0,0,0,0|1,0,0]=3 7194 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22756742 [0,2,0,0,0,0|0,0,0]=2 7195 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22757442 [0,2,0,0,0,0|0,0,0]=2 7196 B12R1.478 NC[C@H](C(O)=O)c1ccccc1 Amb24674068 [0,2,0,0,0,0|0,0,0]=2 7197 B12R1.478 NNC(c1ccccc1)C(=O)O Amb17400196 [0,2,0,0,0,0|1,0,0]=3 7198 B12R1.478 NNC(c1ccccn1)C(=O)O Amb17400231 [0,2,0,0,0,0|2,0,0]=4 7199 B12R1.478 NNC(c1cccnc1)C(=O)O Amb17400232 [0,2,0,0,0,0|2,0,0]=4 7200 B12R1.478 NNC(c1ccncc1)C(=O)O Amb17400233 [0,2,0,0,0,0|2,0,0]=4 7201 B12R1.478 NN[C@@H](C(O)=O)c1ccccc1 Amb24562213 [0,2,0,0,0,0|1,0,0]=3 7202 B12R1.478 NN[C@H](C(O)=O)c1ccccc1 Amb25132135 [0,2,0,0,0,0|1,0,0]=3 7203 B12R1.478 N\N=C(/C(O)=O)\c1ccccc1 Amb24068345 [0,2,0,0,0,0|1,0,1]=4 7204 B12R1.478 N\N=C(\C(O)=O)/c1ccccc1 Amb25701762 [0,2,0,0,0,0|1,0,1]=4 7205 B12R1.478 O=C(Cl)C(CCl)c1ccccc1 Amb25159574 [0,2,0,0,0,0|0,0,0]=2 7206 B12R1.478 O=CC(c1ccccc1)C(C)C Amb17138541 [0,2,0,0,0,0|0,0,0]=2 7207 B12R1.478 O=CN(c1ccccn1)C(C)C Amb10553725 [0,2,0,0,0,0|2,0,0]=4 7208 B12R1.478 O=CN(c1cccnc1)C(C)C Amb10553726 [0,2,0,0,0,0|2,0,0]=4 7209 B12R1.478 OC(=O)C(CBr)c1ccccc1 Amb24097514 [0,2,0,0,0,0|0,0,0]=2 7210 B12R1.478 OC(=O)C(CCl)c1ccccc1 Amb24099910 [0,2,0,0,0,0|0,0,0]=2 7211 B12R1.478 OC(=O)C(CF)c1ccccc1 Amb25201999 [0,2,0,0,0,0|0,0,0]=2 7212 B12R1.478 OC(=O)C(CS)c1ccccc1 Amb18303086 [0,2,0,0,0,0|0,0,0]=2 7213 B12R1.478 OC(=O)[C@@H](CF)c1ccccc1 Amb24470137 [0,2,0,0,0,0|0,0,0]=2 7214 B12R1.478 OC(=O)[C@@H](CO)c1ccccc1 Amb25109240 [0,2,0,0,0,0|0,0,0]=2 7215 B12R1.478 OC(=O)[C@H](NO)c1ccccc1 Amb25700967 [0,2,0,0,0,0|1,0,0]=3 7216 B12R1.478 OC(=O)\C(=C\O)\c1ccccc1 Amb24598641 [0,2,0,0,0,0|0,0,2]=4 7217 B12R1.478 OC(=O)\C(=N\O)\c1ccccc1 Amb22230611 [0,2,0,0,0,0|1,0,1]=4 7218 B12R1.478 OCC(c1ccccc1)N(C)C Amb17232542 [0,2,0,0,0,0|0,0,2]=4 7219 B12R1.478 ONC(c1ccccc1)C(C)C Amb10605007 [0,2,0,0,0,0|1,0,1]=4 7220 B12R1.478 O\N=C(\c1ccccc1)/C(=O)N Amb2153257 [0,2,0,0,0,0|1,0,1]=4 7221 B12R1.478 [C-]#[N+]C(C(O)=O)c1ccccc1 Amb25290234 [0,2,0,0,0,0|0,0,1]=3 7222 B12R1.478 [C@H](C)(O)C(CC)c1ccccc1 Amb17678947 [0,2,0,0,0,0|0,0,2]=4 7223 B12R1.478 [NH3+]CC(C(O)=O)c1ccccc1 Amb22546483 [0,2,0,0,0,0|0,0,0]=2 7224 B12R1.478 [O-]\C=C(\c1ccccc1)/C(=O)C Amb10553866 [0,2,0,0,0,0|0,0,2]=4 7225 B12R1.16 BrCCC(c1ccc(cc1)Br)C Amb17290540 [0,2,0,0,0,0|1,0,1]=4 7226 B12R1.16 BrCCC(c1ccc(cc1)Cl)C Amb17259616 [0,2,0,0,0,0|1,0,1]=4 7227 B12R1.16 BrCCC(c1ccc(cc1)F)C Amb17249285 [0,2,0,0,0,0|1,0,1]=4 7228 B12R1.16 C=C(NC=O)c1ccc(Cl)cc1 Amb25123323 [0,2,0,0,0,0|0,0,2]=4 7229 B12R1.16 C=C=CC(O)c1ccc(Cl)cc1 Amb24497749 [0,2,0,0,0,0|2,0,0]=4 7230 B12R1.16 C=C=C[C@@H](O)c1ccc(F)cc1 Amb25205006 [0,2,0,0,0,0|2,0,0]=4 7231 B12R1.16 C=C=C[C@H](O)c1ccc(F)cc1 Amb24748631 [0,2,0,0,0,0|2,0,0]=4 7232 B12R1.16 C=CCC(Cl)c1ccc(Cl)cc1 Amb25039265 [0,2,0,0,0,0|2,0,0]=4 7233 B12R1.16 C=CCC(N)c1ccc(Br)cc1 Amb18977585 [0,2,0,0,0,0|2,0,0]=4 7234 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,2,0,0,0,0|2,0,0]=4 7235 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb19889920 [0,2,0,0,0,0|2,0,0]=4 7236 B12R1.16 C=CCC(N)c1ccc(S)cc1 Amb24744499 [0,2,0,0,0,0|2,0,0]=4 7237 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,2,0,0,0,0|2,0,0]=4 7238 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [0,2,0,0,0,0|2,0,0]=4 7239 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [0,2,0,0,0,0|2,0,0]=4 7240 B12R1.16 C=CCC(c1ccc(cc1)Cl)N Amb17226689 [0,2,0,0,0,0|2,0,0]=4 7241 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,2,0,0,0,0|2,0,0]=4 7242 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)cc1 Amb22831187 [0,2,0,0,0,0|2,0,0]=4 7243 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb22831777 [0,2,0,0,0,0|2,0,0]=4 7244 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,2,0,0,0,0|2,0,0]=4 7245 B12R1.16 C=CC[C@@H](N)c1ccc(O)cc1 Amb25113869 [0,2,0,0,0,0|2,0,0]=4 7246 B12R1.16 C=CC[C@@H](N)c1ccc(S)cc1 Amb25127949 [0,2,0,0,0,0|2,0,0]=4 7247 B12R1.16 C=CC[C@H](N)c1ccc(Br)cc1 Amb24682606 [0,2,0,0,0,0|2,0,0]=4 7248 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cc1 Amb25698455 [0,2,0,0,0,0|2,0,0]=4 7249 B12R1.16 C=CC[C@H](N)c1ccc(O)cc1 Amb25737463 [0,2,0,0,0,0|2,0,0]=4 7250 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [0,2,0,0,0,0|2,0,0]=4 7251 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [0,2,0,0,0,0|2,0,0]=4 7252 B12R1.16 CC(CC#N)c1ccc(Br)cc1 Amb25794629 [0,2,0,0,0,0|1,0,1]=4 7253 B12R1.16 CC(CC=O)c1[n]cc(F)c[n]1 Amb24611043 [0,2,0,0,0,0|2,0,0]=4 7254 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,2,0,0,0,0|1,0,1]=4 7255 B12R1.16 CC(CCN)c1ccc(N)cc1 Amb25856793 [0,2,0,0,0,0|1,0,1]=4 7256 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,2,0,0,0,0|0,0,2]=4 7257 B12R1.16 CC(CCS)c1ccc(N)cc1 Amb24442941 [0,2,0,0,0,0|0,1,1]=4 7258 B12R1.16 CC(N=C=O)c1ccc(Cl)cc1 Amb24709048 [0,2,0,0,0,0|0,0,1]=3 7259 B12R1.16 CC(N=C=O)c1ccc(O)cc1 Amb24636992 [0,2,0,0,0,0|0,0,1]=3 7260 B12R1.16 CC(N=C=S)c1ccc(Br)cc1 Amb25045923 [0,2,0,0,0,0|0,1,1]=4 7261 B12R1.16 CC(N=[N+]=[N-])c1ccc(Br)cc1 Amb25296094 [0,2,0,0,0,0|2,0,0]=4 7262 B12R1.16 CC(NC#N)c1ccc(Br)cc1 Amb25285975 [0,2,0,0,0,0|1,0,1]=4 7263 B12R1.16 CC(NC#N)c1ccc(Cl)cc1 Amb18809458 [0,2,0,0,0,0|1,0,1]=4 7264 B12R1.16 CC(NC#N)c1ccc(F)cc1 Amb18800781 [0,2,0,0,0,0|1,0,1]=4 7265 B12R1.16 CC(NC=O)c1ccc(Cl)cc1 Amb24692281 [0,2,0,0,0,0|0,0,0]=2 7266 B12R1.16 CC(NC=O)c1ccc(F)c[n]1 Amb24753711 [0,2,0,0,0,0|1,0,0]=3 7267 B12R1.16 CC(NC=O)c1ccc(F)cc1 Amb25793871 [0,2,0,0,0,0|0,0,0]=2 7268 B12R1.16 CC(NC=O)c1ccc(O)cc1 Amb24432160 [0,2,0,0,0,0|0,0,0]=2 7269 B12R1.16 CC(SC#N)c1ccc(O)cc1 Amb25039082 [0,2,0,0,0,0|1,0,1]=4 7270 B12R1.16 CC(c1ccc(cc1)Br)N=C=O Amb10808012 [0,2,0,0,0,0|0,0,1]=3 7271 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,2,0,0,0,0|1,0,1]=4 7272 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,2,0,0,0,0|1,0,1]=4 7273 B12R1.16 CCNC(c1ccc(cc1)Br)C Amb1095032 [0,2,0,0,0,0|1,0,1]=4 7274 B12R1.16 CCNC(c1ccc(cc1)F)C Amb10188230 [0,2,0,0,0,0|1,0,1]=4 7275 B12R1.16 CCN[C@@H](C)c1ccc(Cl)cc1 Amb25138514 [0,2,0,0,0,0|1,0,1]=4 7276 B12R1.16 CCN[C@H](C)c1ccc(Br)cc1 Amb25788596 [0,2,0,0,0,0|1,0,1]=4 7277 B12R1.16 CCN[C@H](C)c1ccc(Cl)cc1 Amb24383514 [0,2,0,0,0,0|1,0,1]=4 7278 B12R1.16 CCOC(C)c1ccc(Br)cc1 Amb23443733 [0,2,0,0,0,0|1,0,1]=4 7279 B12R1.16 CCOC(C)c1ccc(N)cc1 Amb18974004 [0,2,0,0,0,0|1,0,1]=4 7280 B12R1.16 CCOC(C)c1ccc(S)cc1 Amb23568732 [0,2,0,0,0,0|1,0,1]=4 7281 B12R1.16 CCSC(C)c1ccc(N)cc1 Amb18974009 [0,2,0,0,0,0|1,0,1]=4 7282 B12R1.16 CN(CC=C)c1ccc(F)cc1 Amb24370860 [0,2,0,0,0,0|2,0,0]=4 7283 B12R1.16 CN(CC=C)c1ccc(I)cc1 Amb24541418 [0,2,0,0,0,0|2,0,0]=4 7284 B12R1.16 CN(CC=O)c1ccc(F)cc1 Amb18788556 [0,2,0,0,0,0|1,0,0]=3 7285 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [0,2,0,0,0,0|1,0,1]=4 7286 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [0,2,0,0,0,0|1,0,1]=4 7287 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [0,2,0,0,0,0|1,0,1]=4 7288 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [0,2,0,0,0,0|1,0,1]=4 7289 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [0,2,0,0,0,0|1,0,1]=4 7290 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [0,2,0,0,0,0|0,0,2]=4 7291 B12R1.16 CONC(C)c1ccc(Br)cc1 Amb18747016 [0,2,0,0,0,0|1,0,1]=4 7292 B12R1.16 CONC(C)c1ccc(F)cc1 Amb25109738 [0,2,0,0,0,0|1,0,1]=4 7293 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,2,0,0,0,0|1,0,1]=4 7294 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,2,0,0,0,0|0,0,2]=4 7295 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,2,0,0,0,0|0,0,2]=4 7296 B12R1.16 C[C@@H](N=C=O)c1ccc(Br)cc1 Amb22053849 [0,2,0,0,0,0|0,0,1]=3 7297 B12R1.16 C[C@@H](N=C=S)c1ccc(F)cc1 Amb22045282 [0,2,0,0,0,0|0,1,1]=4 7298 B12R1.16 C[C@@H](N=[N+]=[N-])c1ccc(Br)cc1 Amb25131793 [0,2,0,0,0,0|2,0,0]=4 7299 B12R1.16 C[C@@H](N=[N+]=[N-])c1ccc(I)cc1 Amb25131792 [0,2,0,0,0,0|2,0,0]=4 7300 B12R1.16 C[C@@H](NC#N)c1ccc(Br)cc1 Amb25145005 [0,2,0,0,0,0|1,0,1]=4 7301 B12R1.16 C[C@@H](NC#N)c1ccc(Cl)cc1 Amb24391197 [0,2,0,0,0,0|1,0,1]=4 7302 B12R1.16 C[C@@H](NC=O)c1ccc(F)cc1 Amb25088808 [0,2,0,0,0,0|0,0,0]=2 7303 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [0,2,0,0,0,0|0,0,0]=2 7304 B12R1.16 C[C@H](N=C=O)c1ccc(Br)cc1 Amb22045324 [0,2,0,0,0,0|0,0,1]=3 7305 B12R1.16 C[C@H](N=C=O)c1ccc(Cl)cc1 Amb22045301 [0,2,0,0,0,0|0,0,1]=3 7306 B12R1.16 C[C@H](N=C=O)c1ccc(F)cc1 Amb22045303 [0,2,0,0,0,0|0,0,1]=3 7307 B12R1.16 C[C@H](N=C=S)c1ccc(Br)cc1 Amb22045323 [0,2,0,0,0,0|0,1,1]=4 7308 B12R1.16 C[C@H](N=C=S)c1ccc(Cl)cc1 Amb22045279 [0,2,0,0,0,0|0,1,1]=4 7309 B12R1.16 C[C@H](N=C=S)c1ccc(F)cc1 Amb22045283 [0,2,0,0,0,0|0,1,1]=4 7310 B12R1.16 C[C@H](NC#N)c1ccc(Cl)cc1 Amb24442761 [0,2,0,0,0,0|1,0,1]=4 7311 B12R1.16 C[C@H](NC=O)c1ccc(Br)cc1 Amb25674481 [0,2,0,0,0,0|0,0,0]=2 7312 B12R1.16 C[C@H](NC=O)c1ccc(F)cc1 Amb25039112 [0,2,0,0,0,0|0,0,0]=2 7313 B12R1.16 C\C(=C/C=O)\c1ccc(Cl)cc1 Amb24678835 [0,2,0,0,0,0|0,0,1]=3 7314 B12R1.16 C\C(=C/C=O)\c1ccc(F)cc1 Amb25773437 [0,2,0,0,0,0|0,0,1]=3 7315 B12R1.16 C\C(=C/C=O)\c1ccc(O)cc1 Amb24532739 [0,2,0,0,0,0|0,0,1]=3 7316 B12R1.16 C\C(=C/CCl)\c1ccc(Cl)cc1 Amb25300391 [0,2,0,0,0,0|1,0,1]=4 7317 B12R1.16 C\C(=C\C#N)\c1ccc(Br)cc1 Amb25853243 [0,2,0,0,0,0|1,0,1]=4 7318 B12R1.16 C\C(=C\C#N)\c1ccc(I)cc1 Amb24415927 [0,2,0,0,0,0|1,0,1]=4 7319 B12R1.16 C\C(=C\C#N)\c1ccc(O)cc1 Amb25179642 [0,2,0,0,0,0|1,0,1]=4 7320 B12R1.16 C\C(=C\CN)\c1ccc(Br)cc1 Amb25273473 [0,2,0,0,0,0|1,0,1]=4 7321 B12R1.16 C\C(=C\CN)\c1ccc(Cl)cc1 Amb25273472 [0,2,0,0,0,0|1,0,1]=4 7322 B12R1.16 C\C(=C\CN)\c1ccc(F)cc1 Amb24662850 [0,2,0,0,0,0|1,0,1]=4 7323 B12R1.16 C\C(=C\CN)\c1ccc(I)cc1 Amb24660584 [0,2,0,0,0,0|1,0,1]=4 7324 B12R1.16 C\C(=C\CO)\c1ccc(Br)cc1 Amb24579789 [0,2,0,0,0,0|0,0,2]=4 7325 B12R1.16 C\C(=C\CO)\c1ccc(F)cc1 Amb25848827 [0,2,0,0,0,0|0,0,2]=4 7326 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [0,2,0,0,0,0|1,0,0]=3 7327 B12R1.16 C\C=C\C(C)c1ccc(O)cc1 Amb24737403 [0,2,0,0,0,0|1,0,0]=3 7328 B12R1.16 Cc1ccc(c[n]1)C(O)CC=O Amb25242914 [0,2,0,0,0,0|2,0,0]=4 7329 B12R1.16 Cc1ccc(cc1)C(=O)NC=O Amb24096616 [0,2,0,0,0,0|1,0,1]=4 7330 B12R1.16 Cc1ccc(cc1)C(=S)CC=O Amb25667637 [0,2,0,0,0,0|1,0,1]=4 7331 B12R1.16 Cc1ccc(cc1)C(=S)NC=O Amb25375932 [0,2,0,0,0,0|1,0,1]=4 7332 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [0,2,0,0,0,0|1,0,0]=3 7333 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [0,2,0,0,0,0|0,0,0]=2 7334 B12R1.16 Cc1ccc(cc1)C(C)N=C=O Amb25189504 [0,2,0,0,0,0|0,0,1]=3 7335 B12R1.16 Cc1ccc(cc1)C(C)N=C=S Amb18795946 [0,2,0,0,0,0|0,1,1]=4 7336 B12R1.16 Cc1ccc(cc1)C(C)NC#N Amb18800413 [0,2,0,0,0,0|1,0,1]=4 7337 B12R1.16 Cc1ccc(cc1)C(C)NC=O Amb25675923 [0,2,0,0,0,0|0,0,0]=2 7338 B12R1.16 Cc1ccc(cc1)C(C)NOC Amb25829141 [0,2,0,0,0,0|1,0,1]=4 7339 B12R1.16 Cc1ccc(cc1)C(Cl)CC=C Amb25772787 [0,2,0,0,0,0|2,0,0]=4 7340 B12R1.16 Cc1ccc(cc1)C(Cl)\C=C\C Amb25779946 [0,2,0,0,0,0|2,0,0]=4 7341 B12R1.16 Cc1ccc(cc1)C(N)CC=C Amb18977589 [0,2,0,0,0,0|2,0,0]=4 7342 B12R1.16 Cc1ccc(cc1)C(O)C=C=C Amb25317608 [0,2,0,0,0,0|2,0,0]=4 7343 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [0,2,0,0,0,0|2,0,0]=4 7344 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [0,2,0,0,0,0|1,0,0]=3 7345 B12R1.16 Cc1ccc(cc1)N(C)CC=O Amb18788188 [0,2,0,0,0,0|1,0,0]=3 7346 B12R1.16 Cc1ccc(cc1)S(=O)CC=O Amb18129100 [0,2,0,0,0,0|2,0,0]=4 7347 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,2,0,0,0,0|0,0,2]=4 7348 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCC Amb24425911 [0,2,0,0,0,0|1,0,1]=4 7349 B12R1.16 Cc1ccc(cc1)[C@@H](N)CC=C Amb22831227 [0,2,0,0,0,0|2,0,0]=4 7350 B12R1.16 Cc1ccc(cc1)[C@@H](O)C=C=C Amb24412915 [0,2,0,0,0,0|2,0,0]=4 7351 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [0,2,0,0,0,0|0,0,0]=2 7352 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,2,0,0,0,0|0,0,2]=4 7353 B12R1.16 Cc1ccc(cc1)[C@H](C)N=[N+]=[N-] Amb25791441 [0,2,0,0,0,0|2,0,0]=4 7354 B12R1.16 Cc1ccc(cc1)[C@H](C)NC#N Amb25362970 [0,2,0,0,0,0|1,0,1]=4 7355 B12R1.16 Cc1ccc(cc1)[C@H](C)NC=O Amb24442760 [0,2,0,0,0,0|0,0,0]=2 7356 B12R1.16 Cc1ccc(cc1)[C@H](C)NCC Amb24415678 [0,2,0,0,0,0|1,0,1]=4 7357 B12R1.16 Cc1ccc(cc1)\C(\C)=C/C=O Amb18645364 [0,2,0,0,0,0|0,0,1]=3 7358 B12R1.16 Cc1ccc(cc1)\C(\C)=C/NC Amb25804209 [0,2,0,0,0,0|1,0,1]=4 7359 B12R1.16 Cc1ccc(cc1)\C(\C)=C\C=O Amb25124863 [0,2,0,0,0,0|0,0,1]=3 7360 B12R1.16 Cc1ccc(cc1)\C(\Cl)=C\C=O Amb25056994 [0,2,0,0,0,0|1,0,1]=4 7361 B12R1.16 Cc1ccc(cc1)\C(\N)=C\C=O Amb24417234 [0,2,0,0,0,0|1,0,1]=4 7362 B12R1.16 ClCCC(c1ccc(cc1)Br)C Amb17259618 [0,2,0,0,0,0|1,0,1]=4 7363 B12R1.16 ClCCC(c1ccc(cc1)C)C Amb17233970 [0,2,0,0,0,0|1,0,1]=4 7364 B12R1.16 ClCCC(c1ccc(cc1)Cl)C Amb17237597 [0,2,0,0,0,0|1,0,1]=4 7365 B12R1.16 ClCCC(c1ccc(cc1)F)C Amb17234366 [0,2,0,0,0,0|1,0,1]=4 7366 B12R1.16 O=C(CC=O)c1ccc(I)cc1 Amb24748951 [0,2,0,0,0,0|1,0,1]=4 7367 B12R1.16 O=C=NC(Cl)c1ccc(Cl)cc1 Amb24443718 [0,2,0,0,0,0|1,0,1]=4 7368 B12R1.16 O=CC=C(c1ccc(cc1)Br)Cl Amb17258082 [0,2,0,0,0,0|1,0,1]=4 7369 B12R1.16 O=CC=C(c1ccc(cc1)C)Cl Amb17233768 [0,2,0,0,0,0|1,0,1]=4 7370 B12R1.16 O=CC=C(c1ccc(cc1)Cl)Cl Amb17237218 [0,2,0,0,0,0|1,0,1]=4 7371 B12R1.16 O=CC=C(c1ccc(cc1)F)Cl Amb17234142 [0,2,0,0,0,0|1,0,1]=4 7372 B12R1.16 O=CCS(=O)c1ccc(Cl)cc1 Amb25675894 [0,2,0,0,0,0|2,0,0]=4 7373 B12R1.16 O=C\C=C(/c1ccc(cc1)Br)\Cl Amb10608566 [0,2,0,0,0,0|1,0,1]=4 7374 B12R1.16 O=C\C=C(\Cl)/c1ccc(I)cc1 Amb25681745 [0,2,0,0,0,0|1,0,1]=4 7375 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [0,2,0,0,0,0|1,0,0]=3 7376 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [0,2,0,0,0,0|1,0,0]=3 7377 B12R1.16 OC=NC(c1cc[n+](cc1)C)C Amb10573543 [0,2,0,0,0,0|1,0,1]=4 7378 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,2,0,0,0,0|0,0,2]=4 7379 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,2,0,0,0,0|0,0,2]=4 7380 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,2,0,0,0,0|0,0,2]=4 7381 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,2,0,0,0,0|0,0,2]=4 7382 B12R1.16 Oc1ccc(cc1)C(=O)NC=O Amb25255361 [0,2,0,0,0,0|1,0,1]=4 7383 B12R1.16 Oc1ccc(cc1)C(O)\C=N\O Amb24697867 [0,2,0,0,0,0|1,0,1]=4 7384 B12R1.17 C=C=CC(O)c1cccc(Cl)c1 Amb24457897 [0,2,0,0,0,0|2,0,0]=4 7385 B12R1.17 C=C=C[C@@H](O)c1cccc(Cl)c1 Amb25058583 [0,2,0,0,0,0|2,0,0]=4 7386 B12R1.17 C=C=C[C@H](O)c1cccc(Cl)c1 Amb25205005 [0,2,0,0,0,0|2,0,0]=4 7387 B12R1.17 C=CCC(N)c1cc(N)ccc1 Amb24417276 [0,2,0,0,0,0|2,0,0]=4 7388 B12R1.17 C=CCC(N)c1cccc(Br)c1 Amb18292095 [0,2,0,0,0,0|2,0,0]=4 7389 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,2,0,0,0,0|2,0,0]=4 7390 B12R1.17 C=CCC(N)c1cccc(F)c1 Amb18977587 [0,2,0,0,0,0|2,0,0]=4 7391 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [0,2,0,0,0,0|2,0,0]=4 7392 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,2,0,0,0,0|2,0,0]=4 7393 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [0,2,0,0,0,0|2,0,0]=4 7394 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb19929879 [0,2,0,0,0,0|2,0,0]=4 7395 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb22831442 [0,2,0,0,0,0|2,0,0]=4 7396 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)c1 Amb22831578 [0,2,0,0,0,0|2,0,0]=4 7397 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [0,2,0,0,0,0|2,0,0]=4 7398 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [0,2,0,0,0,0|2,0,0]=4 7399 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [0,2,0,0,0,0|2,0,0]=4 7400 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb19929880 [0,2,0,0,0,0|2,0,0]=4 7401 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,2,0,0,0,0|2,0,0]=4 7402 B12R1.17 C=CC[C@H](N)c1cccc(Cl)c1 Amb25775422 [0,2,0,0,0,0|2,0,0]=4 7403 B12R1.17 C=CC[C@H](N)c1cccc(I)c1 Amb25784765 [0,2,0,0,0,0|2,0,0]=4 7404 B12R1.17 C=CC[C@H](N)c1cccc(O)c1 Amb24487270 [0,2,0,0,0,0|2,0,0]=4 7405 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [0,2,0,0,0,0|2,0,0]=4 7406 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [0,2,0,0,0,0|2,0,0]=4 7407 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [0,2,0,0,0,0|2,0,0]=4 7408 B12R1.17 CC(CC#N)c1cccc(Br)c1 Amb24645330 [0,2,0,0,0,0|1,0,1]=4 7409 B12R1.17 CC(CC#N)c1cccc(F)c1 Amb24732112 [0,2,0,0,0,0|1,0,1]=4 7410 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [0,2,0,0,0,0|0,0,0]=2 7411 B12R1.17 CC(CCBr)c1cccc(Cl)c1 Amb25751472 [0,2,0,0,0,0|1,0,1]=4 7412 B12R1.17 CC(N=C=O)c1cccc(Br)c1 Amb25045945 [0,2,0,0,0,0|0,0,1]=3 7413 B12R1.17 CC(N=C=O)c1cccc(Cl)c1 Amb25189503 [0,2,0,0,0,0|0,0,1]=3 7414 B12R1.17 CC(N=C=O)c1cccc(F)c1 Amb25782325 [0,2,0,0,0,0|0,0,1]=3 7415 B12R1.17 CC(N=C=O)c1cccc(O)c1 Amb25253119 [0,2,0,0,0,0|0,0,1]=3 7416 B12R1.17 CC(N=C=S)c1cccc(Cl)c1 Amb18321565 [0,2,0,0,0,0|0,1,1]=4 7417 B12R1.17 CC(N=C=S)c1cccc(F)c1 Amb18796432 [0,2,0,0,0,0|0,1,1]=4 7418 B12R1.17 CC(N=[N+]=[N-])c1cccc(F)c1 Amb24414933 [0,2,0,0,0,0|2,0,0]=4 7419 B12R1.17 CC(NC#N)c1cccc(Br)c1 Amb24565626 [0,2,0,0,0,0|1,0,1]=4 7420 B12R1.17 CC(NC#N)c1cccc(Cl)c1 Amb18809455 [0,2,0,0,0,0|1,0,1]=4 7421 B12R1.17 CC(NC#N)c1cccc(F)c1 Amb18800783 [0,2,0,0,0,0|1,0,1]=4 7422 B12R1.17 CC(NC#N)c1cccc(O)c1 Amb24608412 [0,2,0,0,0,0|1,0,1]=4 7423 B12R1.17 CC(NC=O)c1cccc(Cl)c1 Amb25042206 [0,2,0,0,0,0|0,0,0]=2 7424 B12R1.17 CC(NC=O)c1cccc(F)c1 Amb24432563 [0,2,0,0,0,0|0,0,0]=2 7425 B12R1.17 CC(NC=O)c1cccc(O)c1 Amb24406138 [0,2,0,0,0,0|0,0,0]=2 7426 B12R1.17 CC(\C=N\N)c1cccc(Br)c1 Amb24473846 [0,2,0,0,0,0|1,0,0]=3 7427 B12R1.17 CC(\C=N\N)c1cccc(Cl)c1 Amb25285373 [0,2,0,0,0,0|1,0,0]=3 7428 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,2,0,0,0,0|1,0,1]=4 7429 B12R1.17 CCNC(C)c1cccc(I)c1 Amb25061694 [0,2,0,0,0,0|1,0,1]=4 7430 B12R1.17 CCNC(C)c1cccc(S)c1 Amb25798719 [0,2,0,0,0,0|1,0,1]=4 7431 B12R1.17 CCN[C@@H](C)c1cccc(Cl)c1 Amb25081589 [0,2,0,0,0,0|1,0,1]=4 7432 B12R1.17 CCN[C@H](C)c1cccc(Br)c1 Amb25075777 [0,2,0,0,0,0|1,0,1]=4 7433 B12R1.17 CCN[C@H](C)c1cccc(Cl)c1 Amb25067502 [0,2,0,0,0,0|1,0,1]=4 7434 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,2,0,0,0,0|1,0,1]=4 7435 B12R1.17 CCSC(C)c1cccc(Cl)c1 Amb25036538 [0,2,0,0,0,0|1,0,1]=4 7436 B12R1.17 CCSC(C)c1cccc(N)c1 Amb18973995 [0,2,0,0,0,0|1,0,1]=4 7437 B12R1.17 CN(CC=C)c1cccc(O)c1 Amb25723219 [0,2,0,0,0,0|2,0,0]=4 7438 B12R1.17 CN(CC=O)c1cccc(F)c1 Amb18788558 [0,2,0,0,0,0|1,0,0]=3 7439 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [0,2,0,0,0,0|1,0,1]=4 7440 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [0,2,0,0,0,0|1,0,1]=4 7441 B12R1.17 CONC(C)c1cccc(Br)c1 Amb25097009 [0,2,0,0,0,0|1,0,1]=4 7442 B12R1.17 CONC(C)c1cccc(F)c1 Amb24429508 [0,2,0,0,0,0|1,0,1]=4 7443 B12R1.17 CONC(C)c1cccc(O)c1 Amb24372902 [0,2,0,0,0,0|1,0,1]=4 7444 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [0,2,0,0,0,0|0,1,1]=4 7445 B12R1.17 C[C@@H](N=[N+]=[N-])c1cccc(Br)c1 Amb24671071 [0,2,0,0,0,0|2,0,0]=4 7446 B12R1.17 C[C@@H](NC#N)c1cccc(F)c1 Amb25834654 [0,2,0,0,0,0|1,0,1]=4 7447 B12R1.17 C[C@@H](NC=O)c1cccc(Br)c1 Amb24342087 [0,2,0,0,0,0|0,0,0]=2 7448 B12R1.17 C[C@@H](NC=O)c1cccc(Cl)c1 Amb25708277 [0,2,0,0,0,0|0,0,0]=2 7449 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [0,2,0,0,0,0|0,0,0]=2 7450 B12R1.17 C[C@H](NC#N)c1cccc(F)c1 Amb24712714 [0,2,0,0,0,0|1,0,1]=4 7451 B12R1.17 C[C@H](NC=O)c1cccc(Br)c1 Amb24525072 [0,2,0,0,0,0|0,0,0]=2 7452 B12R1.17 C[C@H](NC=O)c1cccc(F)c1 Amb25844630 [0,2,0,0,0,0|0,0,0]=2 7453 B12R1.17 C\C(=C/CCl)\c1cc(Cl)ccc1 Amb25039232 [0,2,0,0,0,0|1,0,1]=4 7454 B12R1.17 C\C(=C\C#N)\c1cccc(Br)c1 Amb24721889 [0,2,0,0,0,0|1,0,1]=4 7455 B12R1.17 C\C(=C\CN)\c1cccc(Cl)c1 Amb25723529 [0,2,0,0,0,0|1,0,1]=4 7456 B12R1.17 C\C(=C\CN)\c1cccc(F)c1 Amb24589057 [0,2,0,0,0,0|1,0,1]=4 7457 B12R1.17 C\C(=C\CO)\c1cccc(Br)c1 Amb25260939 [0,2,0,0,0,0|0,0,2]=4 7458 B12R1.17 Cc1cc(ccc1)C(=O)CC=O Amb18788116 [0,2,0,0,0,0|1,0,1]=4 7459 B12R1.17 Cc1cc(ccc1)C(N)CC=C Amb18977591 [0,2,0,0,0,0|2,0,0]=4 7460 B12R1.17 Cc1cc(ccc1)C(O)C=C=C Amb25356399 [0,2,0,0,0,0|2,0,0]=4 7461 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [0,2,0,0,0,0|2,0,0]=4 7462 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [0,2,0,0,0,0|1,0,0]=3 7463 B12R1.17 Cc1cc(ccc1)[C@@H](N)CC=C Amb25681927 [0,2,0,0,0,0|2,0,0]=4 7464 B12R1.17 Cc1cc(ccc1)[C@@H](O)C=C=C Amb25045732 [0,2,0,0,0,0|2,0,0]=4 7465 B12R1.17 Cc1cc(ccc1)[C@H](N)CC=C Amb24392927 [0,2,0,0,0,0|2,0,0]=4 7466 B12R1.17 Cc1cc(ccc1)[C@H](O)C=C=C Amb25846980 [0,2,0,0,0,0|2,0,0]=4 7467 B12R1.17 Cc1cc(ccc1)\C(\C)=C/C#N Amb25767209 [0,2,0,0,0,0|1,0,1]=4 7468 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [0,2,0,0,0,0|1,0,1]=4 7469 B12R1.17 Cc1cccc(c1)C(C)N=C=O Amb25160024 [0,2,0,0,0,0|0,0,1]=3 7470 B12R1.17 Cc1cccc(c1)C(C)NC=O Amb25274948 [0,2,0,0,0,0|0,0,0]=2 7471 B12R1.17 Cc1cccc(c1)C(C)SCC Amb25792019 [0,2,0,0,0,0|1,0,1]=4 7472 B12R1.17 Cc1cccc(c1)N(C)CC=O Amb18788187 [0,2,0,0,0,0|1,0,0]=3 7473 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,2,0,0,0,0|0,0,2]=4 7474 B12R1.17 Cc1cccc(c1)[C@@H](C)NCC Amb24448414 [0,2,0,0,0,0|1,0,1]=4 7475 B12R1.17 Cc1cccc(c1)[C@H](C)NC=O Amb25141298 [0,2,0,0,0,0|0,0,0]=2 7476 B12R1.17 Cc1cccc(c1)\C(\C)=C/C=O Amb24633639 [0,2,0,0,0,0|0,0,1]=3 7477 B12R1.17 Cc1cccc(c1)\C(\C)=C/CO Amb25852937 [0,2,0,0,0,0|0,0,2]=4 7478 B12R1.17 Cc1cccc(c1)\C(\C)=C\C=O Amb25087188 [0,2,0,0,0,0|0,0,1]=3 7479 B12R1.17 NCCC(c1cccc(c1)C)C Amb17232450 [0,2,0,0,0,0|1,0,1]=4 7480 B12R1.17 NCCC(c1cccc(c1)Cl)C Amb17234051 [0,2,0,0,0,0|1,0,1]=4 7481 B12R1.17 NCCC(c1cccc(c1)F)C Amb17232650 [0,2,0,0,0,0|1,0,1]=4 7482 B12R1.17 O=C=NC(Cl)c1cccc(Br)c1 Amb24721661 [0,2,0,0,0,0|1,0,1]=4 7483 B12R1.17 O=CCS(=O)c1cccc(Cl)c1 Amb24593348 [0,2,0,0,0,0|2,0,0]=4 7484 B12R1.17 O=C[CH-]C(=O)c1cccc(c1)Br Amb17610055 [0,2,0,0,0,0|1,0,1]=4 7485 B12R1.17 O=C\C=C(/Cl)\c1cccc(F)c1 Amb24465529 [0,2,0,0,0,0|1,0,1]=4 7486 B12R1.17 O=C\C=C(\Cl)/c1cc(Cl)ccc1 Amb25674312 [0,2,0,0,0,0|1,0,1]=4 7487 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [0,2,0,0,0,0|1,0,0]=3 7488 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,2,0,0,0,0|0,0,2]=4 7489 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,2,0,0,0,0|0,0,2]=4 7490 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,2,0,0,0,0|0,0,2]=4 7491 B12R1.30 BrCC\C=C(\c1ccccc1)/C Amb17246875 [0,2,0,0,0,0|1,0,1]=4 7492 B12R1.30 C#C\C=C\C(O)c1ccccc1 Amb24352319 [0,2,0,0,0,0|2,0,0]=4 7493 B12R1.30 C#C\C=C\[C@@H](O)c1ccccc1 Amb24354449 [0,2,0,0,0,0|2,0,0]=4 7494 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,2,0,0,0,0|2,0,0]=4 7495 B12R1.30 C=CC#CC(O)c1ccccc1 Amb24397445 [0,2,0,0,0,0|2,0,0]=4 7496 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,2,0,0,0,0|2,0,0]=4 7497 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,2,0,0,0,0|2,0,0]=4 7498 B12R1.30 C=C\C=C\C(O)c1ccccc1 Amb25816538 [0,2,0,0,0,0|2,0,0]=4 7499 B12R1.30 CC(=C=C=CCl)c1ccccc1 Amb24652425 [0,2,0,0,0,0|1,0,1]=4 7500 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,2,0,0,0,0|0,0,2]=4 7501 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [0,2,0,0,0,0|0,0,2]=4 7502 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,2,0,0,0,0|1,0,0]=3 7503 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,2,0,0,0,0|1,0,1]=4 7504 B12R1.30 CC(CN=C=O)c1c[n]ccc1 Amb25762873 [0,2,0,0,0,0|1,0,1]=4 7505 B12R1.30 CC(CN=C=O)c1cccc[n]1 Amb25045651 [0,2,0,0,0,0|1,0,1]=4 7506 B12R1.30 CC(CN=C=S)c1ccccc1 Amb25102676 [0,2,0,0,0,0|0,1,1]=4 7507 B12R1.30 CC(CNC#N)c1ccccc1 Amb24419584 [0,2,0,0,0,0|1,0,1]=4 7508 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,2,0,0,0,0|1,0,0]=3 7509 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,2,0,0,0,0|0,0,2]=4 7510 B12R1.30 CC(SCC#C)c1ccccc1 Amb25763673 [0,2,0,0,0,0|1,0,1]=4 7511 B12R1.30 CC(\C=C\C#N)c1ccccc1 Amb18644939 [0,2,0,0,0,0|1,0,0]=3 7512 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [0,2,0,0,0,0|0,0,0]=2 7513 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,2,0,0,0,0|1,0,0]=3 7514 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [0,2,0,0,0,0|1,0,0]=3 7515 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [0,2,0,0,0,0|1,0,0]=3 7516 B12R1.30 CC(c1ccccc1)SCC#N Amb17501742 [0,2,0,0,0,0|1,0,1]=4 7517 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [0,2,0,0,0,0|2,0,0]=4 7518 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [0,2,0,0,0,0|2,0,0]=4 7519 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,2,0,0,0,0|1,0,0]=3 7520 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,2,0,0,0,0|1,0,1]=4 7521 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,2,0,0,0,0|1,0,1]=4 7522 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,2,0,0,0,0|2,0,0]=4 7523 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [0,2,0,0,0,0|2,0,0]=4 7524 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,2,0,0,0,0|2,0,0]=4 7525 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [0,2,0,0,0,0|2,0,0]=4 7526 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [0,2,0,0,0,0|1,0,0]=3 7527 B12R1.30 CN(C=CC=C)c1ccccc1 Amb24092515 [0,2,0,0,0,0|2,0,0]=4 7528 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,2,0,0,0,0|2,0,0]=4 7529 B12R1.30 CN(\C=C/C=C)c1ccccc1 Amb25279309 [0,2,0,0,0,0|2,0,0]=4 7530 B12R1.30 CN(\C=C\C=O)c1cccc[n]1 Amb19889051 [0,2,0,0,0,0|2,0,0]=4 7531 B12R1.30 CN\C=N\N(C)c1ccccc1 Amb24443088 [0,2,0,0,0,0|2,0,0]=4 7532 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [0,2,0,0,0,0|1,0,0]=3 7533 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [0,2,0,0,0,0|1,0,1]=4 7534 B12R1.30 CO\N=C\C(C)c1ccccc1 Amb24403672 [0,2,0,0,0,0|0,0,1]=3 7535 B12R1.30 CO\N=C\C(O)c1ccccc1 Amb25788975 [0,2,0,0,0,0|1,0,1]=4 7536 B12R1.30 CO\N=C\[C@@H](O)c1ccccc1 Amb24592391 [0,2,0,0,0,0|1,0,1]=4 7537 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,2,0,0,0,0|0,1,1]=4 7538 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,2,0,0,0,0|0,0,0]=2 7539 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [0,2,0,0,0,0|1,0,0]=3 7540 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,2,0,0,0,0|0,1,1]=4 7541 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,2,0,0,0,0|1,0,1]=4 7542 B12R1.30 C\C(=C/C=C\Cl)\c1ccccc1 Amb24740702 [0,2,0,0,0,0|1,0,1]=4 7543 B12R1.30 C\C(=C/CC=O)\c1ccccc1 Amb18645375 [0,2,0,0,0,0|0,0,1]=3 7544 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [0,2,0,0,0,0|1,0,1]=4 7545 B12R1.30 C\C(=C/NC=O)\c1ccccc1 Amb24637832 [0,2,0,0,0,0|0,0,1]=3 7546 B12R1.30 C\C(=C\C=CCl)\c1ccccc1 Amb24627050 [0,2,0,0,0,0|1,0,1]=4 7547 B12R1.30 C\C(=C\CC=O)\c1ccccc1 Amb24757521 [0,2,0,0,0,0|0,0,1]=3 7548 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [0,2,0,0,0,0|1,0,1]=4 7549 B12R1.30 C\C(=C\N=C=O)\c1ccccc1 Amb24726981 [0,2,0,0,0,0|0,0,1]=3 7550 B12R1.30 C\C(=N/NC=O)\c1ccccc1 Amb25844967 [0,2,0,0,0,0|0,0,1]=3 7551 B12R1.30 C\C(=N\NC=O)\c1cc[n]cc1 Amb25115574 [0,2,0,0,0,0|1,0,1]=4 7552 B12R1.30 C\C(=N\NC=O)\c1ccccc1 Amb25091882 [0,2,0,0,0,0|0,0,1]=3 7553 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [0,2,0,0,0,0|1,0,0]=3 7554 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,2,0,0,0,0|2,0,0]=4 7555 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,2,0,0,0,0|2,0,0]=4 7556 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,2,0,0,0,0|1,0,1]=4 7557 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,2,0,0,0,0|1,0,1]=4 7558 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [0,2,0,0,0,0|1,0,1]=4 7559 B12R1.30 ClC\C=C\C(Cl)c1ccccc1 Amb24642037 [0,2,0,0,0,0|2,0,0]=4 7560 B12R1.30 N#C\C=C\C(O)c1ccccc1 Amb18645174 [0,2,0,0,0,0|2,0,0]=4 7561 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [0,2,0,0,0,0|1,0,1]=4 7562 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,2,0,0,0,0|1,0,1]=4 7563 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,2,0,0,0,0|1,0,1]=4 7564 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,2,0,0,0,0|1,0,1]=4 7565 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [0,2,0,0,0,0|1,0,1]=4 7566 B12R1.30 O=C(OCC=O)c1ccccc1 Amb18645965 [0,2,0,0,0,0|1,0,1]=4 7567 B12R1.30 O=C(\C=C/C=O)c1ccccc1 Amb25359189 [0,2,0,0,0,0|1,0,1]=4 7568 B12R1.30 O=C(\C=C\C=O)c1ccccc1 Amb18645282 [0,2,0,0,0,0|1,0,1]=4 7569 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [0,2,0,0,0,0|1,0,1]=4 7570 B12R1.30 O=C=N\C=C(\Cl)/c1ccccc1 Amb24375430 [0,2,0,0,0,0|1,0,1]=4 7571 B12R1.30 O=CCNC(=O)c1ccccc1 Amb17102065 [0,2,0,0,0,0|1,0,1]=4 7572 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [0,2,0,0,0,0|1,0,0]=3 7573 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,2,0,0,0,0|2,0,0]=4 7574 B12R1.30 OC(\C=C\C=O)c1ccccc1 Amb18645664 [0,2,0,0,0,0|1,0,0]=3 7575 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,2,0,0,0,0|0,0,2]=4 7576 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,2,0,0,0,0|1,0,1]=4 7577 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [0,2,0,0,0,0|1,0,1]=4 7578 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,2,0,0,0,0|2,0,0]=4 7579 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,2,0,0,0,0|1,0,1]=4 7580 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [0,2,0,0,0,0|1,0,1]=4 7581 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,2,0,0,0,0|0,0,2]=4 7582 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,2,0,0,0,0|0,0,2]=4 7583 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,2,0,0,0,0|2,0,0]=4 7584 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,2,0,0,0,0|2,0,0]=4 7585 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,2,0,0,0,0|2,0,0]=4 7586 B12R1.107 C=C(NC(N)=O)c1ccccc1 Amb25258325 [0,2,0,0,0,0|0,0,2]=4 7587 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,2,0,0,0,0|2,0,0]=4 7588 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,2,0,0,0,0|2,0,0]=4 7589 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,2,0,0,0,0|2,0,0]=4 7590 B12R1.107 CC(=N)NC(C)c1c[n]ccc1 Amb25054353 [0,2,0,0,0,0|2,0,0]=4 7591 B12R1.107 CC(=N)NC(C)c1cc[n]cc1 Amb25242908 [0,2,0,0,0,0|2,0,0]=4 7592 B12R1.107 CC(=N)NC(C)c1cccc[n]1 Amb25799324 [0,2,0,0,0,0|2,0,0]=4 7593 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [0,2,0,0,0,0|1,0,0]=3 7594 B12R1.107 CC(=O)CC(C)c1cc[n]c[n]1 Amb24580545 [0,2,0,0,0,0|2,0,0]=4 7595 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [0,2,0,0,0,0|1,0,0]=3 7596 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [0,2,0,0,0,0|2,0,0]=4 7597 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [0,2,0,0,0,0|2,0,0]=4 7598 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [0,2,0,0,0,0|1,0,0]=3 7599 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [0,2,0,0,0,0|1,0,1]=4 7600 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [0,2,0,0,0,0|1,0,1]=4 7601 B12R1.107 CC(=O)NC(C)c1cc[n]cc1 Amb25150955 [0,2,0,0,0,0|1,0,0]=3 7602 B12R1.107 CC(=O)NC(C)c1cccc[n]1 Amb25150956 [0,2,0,0,0,0|1,0,0]=3 7603 B12R1.107 CC(=O)N[C@@H](C)c1cccc[n]1 Amb25134946 [0,2,0,0,0,0|1,0,0]=3 7604 B12R1.107 CC(=O)N[C@H](C)c1cccc[n]1 Amb24659356 [0,2,0,0,0,0|1,0,0]=3 7605 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [0,2,0,0,0,0|0,0,2]=4 7606 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [0,2,0,0,0,0|1,0,1]=4 7607 B12R1.107 CC(=O)OC(C)c1c[n]ccc1 Amb25723772 [0,2,0,0,0,0|1,0,0]=3 7608 B12R1.107 CC(=O)O[C@@H](C)c1c[n]cc[n]1 Amb24676447 [0,2,0,0,0,0|2,0,0]=4 7609 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,2,0,0,0,0|0,0,0]=2 7610 B12R1.107 CC(=O)O[C@H](C)c1c[n]cc[n]1 Amb24473985 [0,2,0,0,0,0|2,0,0]=4 7611 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,2,0,0,0,0|0,0,0]=2 7612 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [0,2,0,0,0,0|1,0,1]=4 7613 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [0,2,0,0,0,0|1,0,1]=4 7614 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [0,2,0,0,0,0|1,0,1]=4 7615 B12R1.107 CC(=S)N[C@@H](C)c1ccccc1 Amb24532689 [0,2,0,0,0,0|0,1,0]=3 7616 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,2,0,0,0,0|2,0,0]=4 7617 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,2,0,0,0,0|1,0,1]=4 7618 B12R1.107 CC(C)SC(C)c1ccccc1 Amb24371858 [0,2,0,0,0,0|1,0,1]=4 7619 B12R1.107 CC(C)[NH2+][C@@H](C)c1ccccc1 Amb22049556 [0,2,0,0,0,0|1,0,1]=4 7620 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,2,0,0,0,0|0,0,2]=4 7621 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,2,0,0,0,0|1,0,1]=4 7622 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,2,0,0,0,0|1,0,0]=3 7623 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,2,0,0,0,0|0,1,0]=3 7624 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,2,0,0,0,0|1,0,1]=4 7625 B12R1.107 CC(CC(O)=O)c1[n]ccc[n]1 Amb25135402 [0,2,0,0,0,0|2,0,0]=4 7626 B12R1.107 CC(CC(O)=O)c1c[n]cc[n]1 Amb24487345 [0,2,0,0,0,0|2,0,0]=4 7627 B12R1.107 CC(CC(O)=O)c1cc[n]c[n]1 Amb24589784 [0,2,0,0,0,0|2,0,0]=4 7628 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,2,0,0,0,0|0,0,2]=4 7629 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,2,0,0,0,0|1,0,1]=4 7630 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,2,0,0,0,0|1,0,1]=4 7631 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,2,0,0,0,0|1,0,1]=4 7632 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,2,0,0,0,0|0,0,1]=3 7633 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,2,0,0,0,0|0,0,1]=3 7634 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,2,0,0,0,0|0,0,1]=3 7635 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [0,2,0,0,0,0|0,0,0]=2 7636 B12R1.107 CC(NC(N)=N)c1cc[n]cc1 Amb18798328 [0,2,0,0,0,0|2,0,0]=4 7637 B12R1.107 CC(NC(N)=N)c1ccc[n]c1 Amb18798329 [0,2,0,0,0,0|2,0,0]=4 7638 B12R1.107 CC(NC(N)=N)c1cccc[n]1 Amb18798330 [0,2,0,0,0,0|2,0,0]=4 7639 B12R1.107 CC(NC(N)=N)c1ccccc1 Amb22284229 [0,2,0,0,0,0|1,0,0]=3 7640 B12R1.107 CC(NN(C)C)c1ccccc1 Amb24608774 [0,2,0,0,0,0|2,0,0]=4 7641 B12R1.107 CC(OC(C)=O)c1ccccn1 Amb17912737 [0,2,0,0,0,0|1,0,0]=3 7642 B12R1.107 CC(OC(C)=O)c1ccncc1 Amb17689315 [0,2,0,0,0,0|1,0,0]=3 7643 B12R1.107 CC([SiH2]C(Cl)Cl)c1ccccc1 Amb25743475 [0,2,0,0,0,0|1,0,1]=4 7644 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,2,0,0,0,0|0,0,0]=2 7645 B12R1.107 CC(c1ccccc1)NC(=N)N Amb10669498 [0,2,0,0,0,0|1,0,0]=3 7646 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,2,0,0,0,0|0,0,0]=2 7647 B12R1.107 CC(c1ccccc1)NC(=S)N Amb1645582 [0,2,0,0,0,0|0,1,0]=3 7648 B12R1.107 CN(CC(N)=O)c1cccc[n]1 Amb25686738 [0,2,0,0,0,0|2,0,0]=4 7649 B12R1.107 CN(CC(O)=O)c1ccc[n]c1 Amb18268673 [0,2,0,0,0,0|2,0,0]=4 7650 B12R1.107 CN(CC(O)=O)c1cccc[n]1 Amb22275945 [0,2,0,0,0,0|2,0,0]=4 7651 B12R1.107 CN(NC(N)=O)c1cccc[n]1 Amb25151116 [0,2,0,0,0,0|2,0,0]=4 7652 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,2,0,0,0,0|2,0,0]=4 7653 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,2,0,0,0,0|1,0,0]=3 7654 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,2,0,0,0,0|1,0,0]=3 7655 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,2,0,0,0,0|1,0,0]=3 7656 B12R1.107 CS(=NC(N)=O)c1ccccc1 Amb24370272 [0,2,0,0,0,0|1,0,0]=3 7657 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,2,0,0,0,0|1,0,1]=4 7658 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,2,0,0,0,0|1,0,1]=4 7659 B12R1.107 C[C@@H](NC(N)=N)c1cc[n]cc1 Amb24703575 [0,2,0,0,0,0|2,0,0]=4 7660 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,2,0,0,0,0|0,0,0]=2 7661 B12R1.107 C[C@@H](SC(N)=N)c1ccccc1 Amb25807975 [0,2,0,0,0,0|1,0,0]=3 7662 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,2,0,0,0,0|0,0,0]=2 7663 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,2,0,0,0,0|0,0,2]=4 7664 B12R1.107 C[C@H](NC(N)=N)c1ccc[n]c1 Amb25369645 [0,2,0,0,0,0|2,0,0]=4 7665 B12R1.107 C[C@H](NC(N)=O)c1cccc[n]1 Amb24448704 [0,2,0,0,0,0|1,0,0]=3 7666 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,2,0,0,0,0|0,0,0]=2 7667 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,2,0,0,0,0|0,0,0]=2 7668 B12R1.107 C\C(=C/C(=O)Cl)\c1ccccc1 Amb25195673 [0,2,0,0,0,0|0,0,1]=3 7669 B12R1.107 C\C(=C/C(N)=O)\c1ccccc1 Amb24648875 [0,2,0,0,0,0|0,0,1]=3 7670 B12R1.107 C\C(=C/[N+]([O-])=O)\c1ccccc1 Amb21858900 [0,2,0,0,0,0|0,0,1]=3 7671 B12R1.107 C\C(=C\C(=O)Cl)\c1ccccc1 Amb25220154 [0,2,0,0,0,0|0,0,1]=3 7672 B12R1.107 C\C(=C\C(C)=O)\c1c[n]ccc1 Amb25308395 [0,2,0,0,0,0|1,0,1]=4 7673 B12R1.107 C\C(=C\C(C)=O)\c1cc[n]cc1 Amb25783222 [0,2,0,0,0,0|1,0,1]=4 7674 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,2,0,0,0,0|0,0,1]=3 7675 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,2,0,0,0,0|0,0,2]=4 7676 B12R1.107 C\C(=C\C(N)=O)\c1ccc[n]c1 Amb25296908 [0,2,0,0,0,0|1,0,1]=4 7677 B12R1.107 C\C(=C\C(O)=O)\c1cc[n]cc1 Amb20626499 [0,2,0,0,0,0|1,0,1]=4 7678 B12R1.107 C\C(=C\C(O)=O)\c1ccc[n]c1 Amb20626498 [0,2,0,0,0,0|1,0,1]=4 7679 B12R1.107 C\C(=C\C(O)=O)\c1cccc[n]1 Amb24393080 [0,2,0,0,0,0|1,0,1]=4 7680 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [0,2,0,0,0,0|0,0,1]=3 7681 B12R1.107 C\C(=C\N(C)C)\c1ccccc1 Amb25711045 [0,2,0,0,0,0|1,0,1]=4 7682 B12R1.107 C\C(=C\[N+]([O-])=O)\c1ccccc1 Amb25338387 [0,2,0,0,0,0|0,0,1]=3 7683 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,2,0,0,0,0|2,0,0]=4 7684 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,2,0,0,0,0|2,0,0]=4 7685 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [0,2,0,0,0,0|1,0,1]=4 7686 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,2,0,0,0,0|2,0,0]=4 7687 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [0,2,0,0,0,0|2,0,0]=4 7688 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,2,0,0,0,0|1,0,0]=3 7689 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,2,0,0,0,0|1,0,0]=3 7690 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [0,2,0,0,0,0|2,0,0]=4 7691 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [0,2,0,0,0,0|2,0,0]=4 7692 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,2,0,0,0,0|1,0,0]=3 7693 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,2,0,0,0,0|2,0,0]=4 7694 B12R1.107 NC(=O)NC(=N)c1ccccc1 Amb25337571 [0,2,0,0,0,0|1,0,1]=4 7695 B12R1.107 NC(=O)NC(=S)c1ccccc1 Amb24532795 [0,2,0,0,0,0|1,0,1]=4 7696 B12R1.107 NC(=O)\C=C(\O)/c1ccccc1 Amb24580412 [0,2,0,0,0,0|1,0,1]=4 7697 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,2,0,0,0,0|1,1,0]=4 7698 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [0,2,0,0,0,0|2,0,0]=4 7699 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,2,0,0,0,0|1,0,0]=3 7700 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,2,0,0,0,0|1,0,0]=3 7701 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,2,0,0,0,0|1,0,0]=3 7702 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,2,0,0,0,0|2,0,0]=4 7703 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [0,2,0,0,0,0|2,0,0]=4 7704 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [0,2,0,0,0,0|2,0,0]=4 7705 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [0,2,0,0,0,0|2,0,0]=4 7706 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [0,2,0,0,0,0|2,0,0]=4 7707 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [0,2,0,0,0,0|2,0,0]=4 7708 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [0,2,0,0,0,0|2,0,0]=4 7709 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [0,2,0,0,0,0|2,0,0]=4 7710 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [0,2,0,0,0,0|2,0,0]=4 7711 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [0,2,0,0,0,0|1,0,1]=4 7712 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [0,2,0,0,0,0|1,0,1]=4 7713 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,2,0,0,0,0|1,0,1]=4 7714 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,2,0,0,0,0|1,0,1]=4 7715 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [0,2,0,0,0,0|2,0,0]=4 7716 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [0,2,0,0,0,0|2,0,0]=4 7717 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [0,2,0,0,0,0|2,0,0]=4 7718 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,2,0,0,0,0|1,0,0]=3 7719 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [0,2,0,0,0,0|2,0,0]=4 7720 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,2,0,0,0,0|1,0,0]=3 7721 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [0,2,0,0,0,0|2,0,0]=4 7722 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [0,2,0,0,0,0|2,0,0]=4 7723 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,2,0,0,0,0|1,0,0]=3 7724 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [0,2,0,0,0,0|2,0,0]=4 7725 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [0,2,0,0,0,0|2,0,0]=4 7726 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,2,0,0,0,0|2,0,0]=4 7727 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [0,2,0,0,0,0|1,0,1]=4 7728 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,2,0,0,0,0|1,1,0]=4 7729 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,2,0,0,0,0|1,0,1]=4 7730 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,2,0,0,0,0|1,0,1]=4 7731 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,2,0,0,0,0|1,0,1]=4 7732 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [0,2,0,0,0,0|1,0,1]=4 7733 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [0,2,0,0,0,0|1,0,1]=4 7734 B12R1.308 C=C=CC(O)c1ccccc1O Amb25205882 [0,2,0,0,0,0|2,0,0]=4 7735 B12R1.308 C=CCC(N)c1ccccc1Br Amb18293502 [0,2,0,0,0,0|2,0,0]=4 7736 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,2,0,0,0,0|2,0,0]=4 7737 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,2,0,0,0,0|2,0,0]=4 7738 B12R1.308 C=CCC(N)c1ccccc1I Amb25377094 [0,2,0,0,0,0|2,0,0]=4 7739 B12R1.308 C=CCC(N)c1ccccc1O Amb25261429 [0,2,0,0,0,0|2,0,0]=4 7740 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,2,0,0,0,0|2,0,0]=4 7741 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,2,0,0,0,0|2,0,0]=4 7742 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,2,0,0,0,0|2,0,0]=4 7743 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [0,2,0,0,0,0|2,0,0]=4 7744 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [0,2,0,0,0,0|2,0,0]=4 7745 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb19889592 [0,2,0,0,0,0|2,0,0]=4 7746 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb22831179 [0,2,0,0,0,0|2,0,0]=4 7747 B12R1.308 C=CC[C@@H](N)c1ccccc1F Amb22831408 [0,2,0,0,0,0|2,0,0]=4 7748 B12R1.308 C=CC[C@@H](N)c1ccccc1N Amb25368389 [0,2,0,0,0,0|2,0,0]=4 7749 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [0,2,0,0,0,0|2,0,0]=4 7750 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb19889591 [0,2,0,0,0,0|2,0,0]=4 7751 B12R1.308 C=CC[C@H](N)c1ccccc1N Amb25138190 [0,2,0,0,0,0|2,0,0]=4 7752 B12R1.308 C=CC[C@H](N)c1ccccc1S Amb24460315 [0,2,0,0,0,0|2,0,0]=4 7753 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [0,2,0,0,0,0|2,0,0]=4 7754 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [0,2,0,0,0,0|2,0,0]=4 7755 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [0,2,0,0,0,0|2,0,0]=4 7756 B12R1.308 CC#CC(C)c1ccccc1O Amb24497018 [0,2,0,0,0,0|1,0,1]=4 7757 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,2,0,0,0,0|1,0,1]=4 7758 B12R1.308 CC(CC#N)c1ccccc1O Amb18645498 [0,2,0,0,0,0|1,0,1]=4 7759 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [0,2,0,0,0,0|0,0,0]=2 7760 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [0,2,0,0,0,0|0,0,0]=2 7761 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,2,0,0,0,0|1,0,1]=4 7762 B12R1.308 CC(N=C=O)c1ccccc1F Amb24483318 [0,2,0,0,0,0|0,0,1]=3 7763 B12R1.308 CC(N=C=O)c1ccccc1O Amb25178459 [0,2,0,0,0,0|0,0,1]=3 7764 B12R1.308 CC(N=C=S)c1ccccc1Cl Amb19054917 [0,2,0,0,0,0|0,1,1]=4 7765 B12R1.308 CC(N=C=S)c1ccccc1F Amb18796431 [0,2,0,0,0,0|0,1,1]=4 7766 B12R1.308 CC(N=[N+]=[N-])c1ccccc1Cl Amb25779276 [0,2,0,0,0,0|2,0,0]=4 7767 B12R1.308 CC(NC#N)c1ccccc1Cl Amb18809457 [0,2,0,0,0,0|1,0,1]=4 7768 B12R1.308 CC(NC#N)c1ccccc1F Amb18800782 [0,2,0,0,0,0|1,0,1]=4 7769 B12R1.308 CC(NC=O)c1ccccc1Cl Amb25717177 [0,2,0,0,0,0|0,0,0]=2 7770 B12R1.308 CC(NC=O)c1ccccc1F Amb25700735 [0,2,0,0,0,0|0,0,0]=2 7771 B12R1.308 CC(NC=O)c1ccccc1O Amb24485592 [0,2,0,0,0,0|0,0,0]=2 7772 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,2,0,0,0,0|1,0,1]=4 7773 B12R1.308 CCN[C@@H](C)c1ccccc1Br Amb25073112 [0,2,0,0,0,0|1,0,1]=4 7774 B12R1.308 CCN[C@@H](C)c1ccccc1Cl Amb25764966 [0,2,0,0,0,0|1,0,1]=4 7775 B12R1.308 CCN[C@H](C)c1ccccc1F Amb24665516 [0,2,0,0,0,0|1,0,1]=4 7776 B12R1.308 CCOC(C)c1ccccc1Cl Amb24061174 [0,2,0,0,0,0|1,0,1]=4 7777 B12R1.308 CCOC(C)c1ccccc1O Amb25667447 [0,2,0,0,0,0|1,0,1]=4 7778 B12R1.308 CCSC(C)c1ccccc1Br Amb24732685 [0,2,0,0,0,0|1,0,1]=4 7779 B12R1.308 CCSC(C)c1ccccc1O Amb18648671 [0,2,0,0,0,0|1,0,1]=4 7780 B12R1.308 CN(CC=C)c1ccccc1F Amb24474650 [0,2,0,0,0,0|2,0,0]=4 7781 B12R1.308 CN(CC=C)c1ccccc1O Amb25674265 [0,2,0,0,0,0|2,0,0]=4 7782 B12R1.308 CN(CC=O)c1ccccc1F Amb18788557 [0,2,0,0,0,0|1,0,0]=3 7783 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [0,2,0,0,0,0|1,0,1]=4 7784 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [0,2,0,0,0,0|1,0,1]=4 7785 B12R1.308 CONC(C)c1ccccc1O Amb24441195 [0,2,0,0,0,0|1,0,1]=4 7786 B12R1.308 C[C@@H](NC#N)c1ccccc1Br Amb25853589 [0,2,0,0,0,0|1,0,1]=4 7787 B12R1.308 C[C@@H](NC#N)c1ccccc1Cl Amb24432525 [0,2,0,0,0,0|1,0,1]=4 7788 B12R1.308 C[C@@H](NC=O)c1ccccc1Br Amb24406943 [0,2,0,0,0,0|0,0,0]=2 7789 B12R1.308 C[C@@H](NC=O)c1ccccc1Cl Amb24665517 [0,2,0,0,0,0|0,0,0]=2 7790 B12R1.308 C[C@@H](NC=O)c1ccccc1F Amb24756310 [0,2,0,0,0,0|0,0,0]=2 7791 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [0,2,0,0,0,0|0,0,0]=2 7792 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,2,0,0,0,0|0,0,2]=4 7793 B12R1.308 C[C@H](N=[N+]=[N-])c1ccccc1F Amb25824301 [0,2,0,0,0,0|2,0,0]=4 7794 B12R1.308 C[C@H](NC=O)c1ccccc1Br Amb25073668 [0,2,0,0,0,0|0,0,0]=2 7795 B12R1.308 C[C@H](NC=O)c1ccccc1Cl Amb25736127 [0,2,0,0,0,0|0,0,0]=2 7796 B12R1.308 C\C(=C/C#N)\c1ccccc1N Amb18645061 [0,2,0,0,0,0|1,0,1]=4 7797 B12R1.308 C\C(=C/C#N)\c1ccccc1O Amb18645165 [0,2,0,0,0,0|1,0,1]=4 7798 B12R1.308 C\C(=C/CC)\c1ccccc1N Amb24347670 [0,2,0,0,0,0|1,0,1]=4 7799 B12R1.308 C\C(=C/CO)\c1ccccc1Br Amb24438353 [0,2,0,0,0,0|0,0,2]=4 7800 B12R1.308 C\C(=C\C#N)\c1ccccc1Br Amb24689630 [0,2,0,0,0,0|1,0,1]=4 7801 B12R1.308 C\C(=C\C#N)\c1ccccc1C Amb24619357 [0,2,0,0,0,0|1,0,1]=4 7802 B12R1.308 C\C(=C\C#N)\c1ccccc1Cl Amb25712375 [0,2,0,0,0,0|1,0,1]=4 7803 B12R1.308 C\C(=C\C#N)\c1ccccc1N Amb25211046 [0,2,0,0,0,0|1,0,1]=4 7804 B12R1.308 C\C(=C\C=C)\c1ccccc1N Amb24379609 [0,2,0,0,0,0|1,0,1]=4 7805 B12R1.308 C\C(=C\C=O)\c1ccccc1Cl Amb25302195 [0,2,0,0,0,0|0,0,1]=3 7806 B12R1.308 C\C(=C\CC)\c1ccccc1N Amb25274437 [0,2,0,0,0,0|1,0,1]=4 7807 B12R1.308 C\C(=C\CN)\c1ccccc1Br Amb25346828 [0,2,0,0,0,0|1,0,1]=4 7808 B12R1.308 C\C(=C\CN)\c1ccccc1Cl Amb25713357 [0,2,0,0,0,0|1,0,1]=4 7809 B12R1.308 C\C(=C\CO)\c1ccccc1Br Amb24623710 [0,2,0,0,0,0|0,0,2]=4 7810 B12R1.308 C\C(=C\CO)\c1ccccc1Cl Amb25209579 [0,2,0,0,0,0|0,0,2]=4 7811 B12R1.308 C\C(=C\CO)\c1ccccc1F Amb24420735 [0,2,0,0,0,0|0,0,2]=4 7812 B12R1.308 C\C(=C\CO)\c1ccccc1O Amb18646033 [0,2,0,0,0,0|0,0,2]=4 7813 B12R1.308 C\C=C/C(C)c1ccccc1O Amb25059645 [0,2,0,0,0,0|1,0,0]=3 7814 B12R1.308 C\C=C\C(C)c1ccccc1N Amb18645537 [0,2,0,0,0,0|1,0,0]=3 7815 B12R1.308 C\C=C\C(C)c1ccccc1O Amb24608614 [0,2,0,0,0,0|1,0,0]=3 7816 B12R1.308 C\C=C\C(O)c1ccccc1O Amb24378436 [0,2,0,0,0,0|2,0,0]=4 7817 B12R1.308 Cc1c[n]ccc1C(O)CC=O Amb24662152 [0,2,0,0,0,0|2,0,0]=4 7818 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [0,2,0,0,0,0|1,0,1]=4 7819 B12R1.308 Cc1ccccc1C(C)CNN Amb24365526 [0,2,0,0,0,0|1,0,1]=4 7820 B12R1.308 Cc1ccccc1C(C)N=C=O Amb25189609 [0,2,0,0,0,0|0,0,1]=3 7821 B12R1.308 Cc1ccccc1C(C)N=C=S Amb18795944 [0,2,0,0,0,0|0,1,1]=4 7822 B12R1.308 Cc1ccccc1C(C)NC#N Amb18800411 [0,2,0,0,0,0|1,0,1]=4 7823 B12R1.308 Cc1ccccc1C(C)NC=O Amb24464016 [0,2,0,0,0,0|0,0,0]=2 7824 B12R1.308 Cc1ccccc1C(C)SCC Amb25157280 [0,2,0,0,0,0|1,0,1]=4 7825 B12R1.308 Cc1ccccc1C(Cl)CC=C Amb25044767 [0,2,0,0,0,0|2,0,0]=4 7826 B12R1.308 Cc1ccccc1C(N)CC=C Amb18292097 [0,2,0,0,0,0|2,0,0]=4 7827 B12R1.308 Cc1ccccc1C(O)C=C=C Amb25334725 [0,2,0,0,0,0|2,0,0]=4 7828 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [0,2,0,0,0,0|2,0,0]=4 7829 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [0,2,0,0,0,0|2,0,0]=4 7830 B12R1.308 Cc1ccccc1N(C)CC=O Amb18788186 [0,2,0,0,0,0|1,0,0]=3 7831 B12R1.308 Cc1ccccc1[C@@H](C)NC=O Amb24388804 [0,2,0,0,0,0|0,0,0]=2 7832 B12R1.308 Cc1ccccc1[C@@H](O)C=C=C Amb25156851 [0,2,0,0,0,0|2,0,0]=4 7833 B12R1.308 Cc1ccccc1[C@H](C)NC#N Amb25767191 [0,2,0,0,0,0|1,0,1]=4 7834 B12R1.308 Cc1ccccc1[C@H](C)NC=O Amb24448498 [0,2,0,0,0,0|0,0,0]=2 7835 B12R1.308 Cc1ccccc1[C@H](C)NCC Amb24361005 [0,2,0,0,0,0|1,0,1]=4 7836 B12R1.308 Cc1ccccc1\C(\Cl)=C\C=O Amb24435372 [0,2,0,0,0,0|1,0,1]=4 7837 B12R1.308 NCCC(c1ccccc1C)C Amb17232447 [0,2,0,0,0,0|1,0,1]=4 7838 B12R1.308 NCCC(c1ccccc1Cl)C Amb17234048 [0,2,0,0,0,0|1,0,1]=4 7839 B12R1.308 NCCC(c1ccccc1F)C Amb17232646 [0,2,0,0,0,0|1,0,1]=4 7840 B12R1.308 Nc1ccccc1C(=O)CC=O Amb25299151 [0,2,0,0,0,0|1,0,1]=4 7841 B12R1.308 O=C=NC(Cl)c1ccccc1F Amb24463049 [0,2,0,0,0,0|1,0,1]=4 7842 B12R1.308 O=CCS(=O)c1ccccc1F Amb25273429 [0,2,0,0,0,0|2,0,0]=4 7843 B12R1.308 O=CNC(=O)c1ccccc1O Amb17621622 [0,2,0,0,0,0|1,0,1]=4 7844 B12R1.308 O=C\C=C(/Cl)\c1ccccc1F Amb25674459 [0,2,0,0,0,0|1,0,1]=4 7845 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,2,0,0,0,0|0,0,2]=4 7846 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,2,0,0,0,0|0,0,2]=4 7847 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,2,0,0,0,0|0,0,2]=4 7848 B12R1.308 Oc1ccccc1C(=O)CC=O Amb18645953 [0,2,0,0,0,0|1,0,1]=4 7849 B12R1.5 BrCC(c1ccc(cc1)CC)C Amb17247628 [0,2,0,0,0,0|1,0,1]=4 7850 B12R1.5 BrCC(c1ccc(cc1)OC)C Amb17248427 [0,2,0,0,0,0|1,0,1]=4 7851 B12R1.5 C=CC(N)c1ccc(cc1)C#C Amb25275120 [0,2,0,0,0,0|2,0,0]=4 7852 B12R1.5 C=CC(O)c1ccc(C=O)cc1 Amb25735750 [0,2,0,0,0,0|2,0,0]=4 7853 B12R1.5 C=C[C@@H](N)c1ccc(cc1)C#C Amb24485482 [0,2,0,0,0,0|2,0,0]=4 7854 B12R1.5 C=C[C@@H](N)c1ccc(cc1)C=C Amb24667873 [0,2,0,0,0,0|2,0,0]=4 7855 B12R1.5 C=C[C@@H](O)c1ccc(cc1)C#N Amb24421602 [0,2,0,0,0,0|2,0,0]=4 7856 B12R1.5 C=C[C@H](N)c1ccc(CO)cc1 Amb24415369 [0,2,0,0,0,0|2,0,0]=4 7857 B12R1.5 C=C[C@H](N)c1ccc(cc1)C#C Amb25684198 [0,2,0,0,0,0|2,0,0]=4 7858 B12R1.5 C=C[C@H](N)c1ccc(cc1)C=C Amb24452672 [0,2,0,0,0,0|2,0,0]=4 7859 B12R1.5 CC(C#N)c1ccc(CO)cc1 Amb24613872 [0,2,0,0,0,0|1,0,1]=4 7860 B12R1.5 CC(C#N)c1ccc(cc1)C#C Amb25188171 [0,2,0,0,0,0|1,0,1]=4 7861 B12R1.5 CC(CC)c1ccc(CC)cc1 Amb24096906 [0,2,0,0,0,0|1,0,1]=4 7862 B12R1.5 CC(CN)c1ccc(CO)cc1 Amb25228167 [0,2,0,0,0,0|1,0,1]=4 7863 B12R1.5 CC(NC)c1ccc(cc1)NC Amb24419927 [0,2,0,0,0,0|2,0,0]=4 7864 B12R1.5 CC(NO)c1ccc(cc1)C#N Amb25808477 [0,2,0,0,0,0|1,0,1]=4 7865 B12R1.5 CCC(C)c1ccc(C=C)cc1 Amb25288447 [0,2,0,0,0,0|1,0,1]=4 7866 B12R1.5 CCC(C)c1ccc(C=O)cc1 Amb18563555 [0,2,0,0,0,0|1,0,1]=4 7867 B12R1.5 CCC(C)c1ccc(NN)cc1 Amb17949616 [0,2,0,0,0,0|1,0,1]=4 7868 B12R1.5 CCC(C)c1ccc(cc1)NC Amb18177793 [0,2,0,0,0,0|1,0,1]=4 7869 B12R1.5 CCC(C)c1ccc(cc1)OC Amb25707460 [0,2,0,0,0,0|1,0,1]=4 7870 B12R1.5 CCC(C)c1ccc(cc1)ON Amb24698716 [0,2,0,0,0,0|1,0,1]=4 7871 B12R1.5 CCC(c1ccc(cc1)C#N)C Amb17232304 [0,2,0,0,0,0|1,0,1]=4 7872 B12R1.5 CCC(c1ccc(cc1)CN)C Amb17232443 [0,2,0,0,0,0|1,0,1]=4 7873 B12R1.5 CCC(c1ccc(cc1)CO)C Amb17232497 [0,2,0,0,0,0|1,0,1]=4 7874 B12R1.5 CCC(c1ccc(cc1)NN)C Amb2234675 [0,2,0,0,0,0|1,0,1]=4 7875 B12R1.5 CC[C@@H](C)c1ccc(C=O)cc1 Amb24392252 [0,2,0,0,0,0|1,0,1]=4 7876 B12R1.5 CCc1cc[n+](cc1)C(C)C=C Amb25083951 [0,2,0,0,0,0|2,0,0]=4 7877 B12R1.5 CCc1ccc(cc1)C(=O)C=O Amb10069048 [0,2,0,0,0,0|1,0,1]=4 7878 B12R1.5 CCc1ccc(cc1)C(=O)C=O Amb17594031 [0,2,0,0,0,0|1,0,1]=4 7879 B12R1.5 CCc1ccc(cc1)C(C=O)C Amb17138537 [0,2,0,0,0,0|0,0,0]=2 7880 B12R1.5 CCc1ccc(cc1)C(NO)C Amb17089204 [0,2,0,0,0,0|1,0,1]=4 7881 B12R1.5 CCc1ccc(cc1)C(ON)C Amb17089187 [0,2,0,0,0,0|2,0,0]=4 7882 B12R1.5 CCc1ccc(cc1)N(C)C=O Amb25150901 [0,2,0,0,0,0|1,0,0]=3 7883 B12R1.5 CCc1ccc(cc1)[C@@H](N)C=C Amb24746733 [0,2,0,0,0,0|2,0,0]=4 7884 B12R1.5 CCc1ccc(cc1)[C@H](C)NC Amb25724427 [0,2,0,0,0,0|2,0,0]=4 7885 B12R1.5 CCc1ccc(cc1)[C@H](C)NO Amb24684872 [0,2,0,0,0,0|1,0,1]=4 7886 B12R1.5 CCc1ccc(cc1)[C@H](N)C=C Amb24401137 [0,2,0,0,0,0|2,0,0]=4 7887 B12R1.5 CN(C=O)c1ccc(cc1)C=O Amb24691560 [0,2,0,0,0,0|1,0,0]=3 7888 B12R1.5 CN(N=O)c1ccc(CO)cc1 Amb25155909 [0,2,0,0,0,0|2,0,0]=4 7889 B12R1.5 CN(N=O)c1ccc(cc1)N=O Amb24488583 [0,2,0,0,0,0|2,0,0]=4 7890 B12R1.5 CNC(C)c1ccc(CO)cc1 Amb25803560 [0,2,0,0,0,0|2,0,0]=4 7891 B12R1.5 CNC(C)c1ccc(cc1)OC Amb21955430 [0,2,0,0,0,0|2,0,0]=4 7892 B12R1.5 CNC(c1ccc(cc1)C#N)C Amb1124953 [0,2,0,0,0,0|2,0,0]=4 7893 B12R1.5 CNC(c1ccc(cc1)OC)C Amb1113211 [0,2,0,0,0,0|2,0,0]=4 7894 B12R1.5 CN[C@@H](C)c1ccc(C=C)cc1 Amb25807990 [0,2,0,0,0,0|2,0,0]=4 7895 B12R1.5 CN[C@@H](C)c1ccc(cc1)C#N Amb25257340 [0,2,0,0,0,0|2,0,0]=4 7896 B12R1.5 CN[C@@H](C)c1ccc(cc1)OC Amb22008513 [0,2,0,0,0,0|2,0,0]=4 7897 B12R1.5 CN[C@@H](c1ccc(cc1)OC)C Amb10070543 [0,2,0,0,0,0|2,0,0]=4 7898 B12R1.5 CNc1ccc(cc1)C(C)CN Amb25217118 [0,2,0,0,0,0|1,0,1]=4 7899 B12R1.5 CNc1ccc(cc1)[C@@H](N)C=C Amb24680925 [0,2,0,0,0,0|2,0,0]=4 7900 B12R1.5 CNc1ccc(cc1)[C@H](N)C=C Amb24378047 [0,2,0,0,0,0|2,0,0]=4 7901 B12R1.5 COC(C)c1ccc(C=O)cc1 Amb23443770 [0,2,0,0,0,0|2,0,0]=4 7902 B12R1.5 COC(C)c1ccc(CN)cc1 Amb23556380 [0,2,0,0,0,0|2,0,0]=4 7903 B12R1.5 COc1ccc(c[n]1)[C@H](C)C=O Amb24485676 [0,2,0,0,0,0|1,0,0]=3 7904 B12R1.5 COc1ccc(cc1)C(=O)C=O Amb10067936 [0,2,0,0,0,0|1,0,1]=4 7905 B12R1.5 COc1ccc(cc1)C(C=O)C Amb17138571 [0,2,0,0,0,0|0,0,0]=2 7906 B12R1.5 COc1ccc(cc1)C(F)C=O Amb24746381 [0,2,0,0,0,0|1,0,0]=3 7907 B12R1.5 COc1ccc(cc1)C(N)C=O Amb24340481 [0,2,0,0,0,0|1,0,0]=3 7908 B12R1.5 COc1ccc(cc1)C(O)C=C Amb22505306 [0,2,0,0,0,0|2,0,0]=4 7909 B12R1.5 COc1ccc(cc1)C(O)C=O Amb25150071 [0,2,0,0,0,0|1,0,0]=3 7910 B12R1.5 COc1ccc(cc1)N(C)C=O Amb24323386 [0,2,0,0,0,0|1,0,0]=3 7911 B12R1.5 COc1ccc(cc1)N(C)N=O Amb23497759 [0,2,0,0,0,0|2,0,0]=4 7912 B12R1.5 COc1ccc(cc1)[C@@H](C)C=O Amb25159562 [0,2,0,0,0,0|0,0,0]=2 7913 B12R1.5 COc1ccc(cc1)[C@@H](N)C=C Amb24746732 [0,2,0,0,0,0|2,0,0]=4 7914 B12R1.5 COc1ccc(cc1)[C@H](N)C=C Amb25791597 [0,2,0,0,0,0|2,0,0]=4 7915 B12R1.5 COc1ccc(cc1)[C@H](O)C=C Amb25739690 [0,2,0,0,0,0|2,0,0]=4 7916 B12R1.5 COc1ccc(cc1)[C@H](O)C=O Amb24444862 [0,2,0,0,0,0|1,0,0]=3 7917 B12R1.5 CSC(C)c1ccc(cc1)C#N Amb24369706 [0,2,0,0,0,0|2,0,0]=4 7918 B12R1.5 CSc1ccc(cc1)C(=O)C=O Amb21858435 [0,2,0,0,0,0|1,0,1]=4 7919 B12R1.5 CSc1ccc(cc1)C(=O)C=O Amb22059437 [0,2,0,0,0,0|1,0,1]=4 7920 B12R1.5 CSc1ccc(cc1)C(C)C=O Amb24682816 [0,2,0,0,0,0|0,0,0]=2 7921 B12R1.5 CSc1ccc(cc1)C(C)CN Amb18243818 [0,2,0,0,0,0|1,0,1]=4 7922 B12R1.5 CSc1ccc(cc1)C(C)CO Amb24564639 [0,2,0,0,0,0|0,0,2]=4 7923 B12R1.5 CSc1ccc(cc1)C(N)C=C Amb25113405 [0,2,0,0,0,0|2,0,0]=4 7924 B12R1.5 CSc1ccc(cc1)[C@H](N)C=C Amb25149811 [0,2,0,0,0,0|2,0,0]=4 7925 B12R1.5 C[C@@H](CO)c1ccc(CO)cc1 Amb24353098 [0,2,0,0,0,0|0,0,2]=4 7926 B12R1.5 C\C(=C/Cl)\c1ccc(cc1)OC Amb25322140 [0,2,0,0,0,0|1,0,1]=4 7927 B12R1.5 ClCC(c1ccc(cc1)CC)C Amb17233971 [0,2,0,0,0,0|1,0,1]=4 7928 B12R1.5 ClCC(c1ccc(cc1)OC)C Amb17234158 [0,2,0,0,0,0|1,0,1]=4 7929 B12R1.5 N#Cc1ccc(cc1)C(=O)C=O Amb20240831 [0,2,0,0,0,0|1,0,1]=4 7930 B12R1.5 NCc1ccc(cc1)C(=O)C=O Amb25040804 [0,2,0,0,0,0|1,0,1]=4 7931 B12R1.5 NOC(c1ccc(cc1)OC)C Amb17089196 [0,2,0,0,0,0|2,0,0]=4 7932 B12R1.5 O=C(C=O)c1ccc(CCl)cc1 Amb24635708 [0,2,0,0,0,0|1,0,1]=4 7933 B12R1.5 O=CC(=O)c1ccc(cc1)C#N Amb10067940 [0,2,0,0,0,0|1,0,1]=4 7934 B12R1.5 OCC(c1ccc(cc1)CC)C Amb17232491 [0,2,0,0,0,0|0,0,2]=4 7935 B12R1.5 OCC(c1ccc(cc1)OC)C Amb17232590 [0,2,0,0,0,0|0,0,2]=4 7936 B12R1.5 ONC(c1ccc(cc1)OC)C Amb17089213 [0,2,0,0,0,0|1,0,1]=4 7937 B12R1.20 BrC(c1ccc(cc1)F)C(=O)C Amb17142689 [0,2,0,0,0,0|1,0,0]=3 7938 B12R1.20 C=C(C(N)=O)c1ccc(Cl)cc1 Amb25829588 [0,2,0,0,0,0|0,0,2]=4 7939 B12R1.20 C=C(c1ccc(cc1)Br)C(=O)O Amb17322199 [0,2,0,0,0,0|0,0,2]=4 7940 B12R1.20 C=C(c1ccc(cc1)C)C(=O)O Amb17322163 [0,2,0,0,0,0|0,0,2]=4 7941 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O Amb17322176 [0,2,0,0,0,0|0,0,2]=4 7942 B12R1.20 C=C(c1ccc(cc1)F)C(=O)O Amb17322166 [0,2,0,0,0,0|0,0,2]=4 7943 B12R1.20 CC(=C)C(N)c1ccc(Br)cc1 Amb24355767 [0,2,0,0,0,0|2,0,0]=4 7944 B12R1.20 CC(=C)C(N)c1ccc(Cl)cc1 Amb25035155 [0,2,0,0,0,0|2,0,0]=4 7945 B12R1.20 CC(=C)C(N)c1ccc(F)cc1 Amb24365829 [0,2,0,0,0,0|2,0,0]=4 7946 B12R1.20 CC(=C)C(N)c1ccc(I)cc1 Amb25823888 [0,2,0,0,0,0|2,0,0]=4 7947 B12R1.20 CC(=O)C(Br)c1ccc(N)cc1 Amb25364338 [0,2,0,0,0,0|1,0,0]=3 7948 B12R1.20 CC(=O)C(Br)c1ccc(O)cc1 Amb20620488 [0,2,0,0,0,0|1,0,0]=3 7949 B12R1.20 CC(=O)C(Br)c1ccc(S)cc1 Amb25351848 [0,2,0,0,0,0|1,0,0]=3 7950 B12R1.20 CC(=O)C(C)c1ccc(Br)cc1 Amb25043063 [0,2,0,0,0,0|0,0,0]=2 7951 B12R1.20 CC(=O)C(C)c1ccc(F)cc1 Amb25802289 [0,2,0,0,0,0|0,0,0]=2 7952 B12R1.20 CC(=O)C(N)c1ccc(Br)c[n]1 Amb25716232 [0,2,0,0,0,0|2,0,0]=4 7953 B12R1.20 CC(=O)C(N)c1ccc(Cl)c[n]1 Amb24349800 [0,2,0,0,0,0|2,0,0]=4 7954 B12R1.20 CC(=O)C(N)c1ccc(Cl)cc1 Amb24376685 [0,2,0,0,0,0|1,0,0]=3 7955 B12R1.20 CC(=O)C(N)c1ccc(F)[n]c1 Amb24487166 [0,2,0,0,0,0|2,0,0]=4 7956 B12R1.20 CC(=O)C(N)c1ccc(F)c[n]1 Amb24428783 [0,2,0,0,0,0|2,0,0]=4 7957 B12R1.20 CC(=O)C(N)c1ccc(I)[n]c1 Amb24427622 [0,2,0,0,0,0|2,0,0]=4 7958 B12R1.20 CC(=O)C(N)c1ccc(I)c[n]1 Amb24360228 [0,2,0,0,0,0|2,0,0]=4 7959 B12R1.20 CC(=O)C(N)c1ccc(I)cc1 Amb24483646 [0,2,0,0,0,0|1,0,0]=3 7960 B12R1.20 CC(=O)C(N)c1ccc(N)c[n]1 Amb25836837 [0,2,0,0,0,0|2,0,0]=4 7961 B12R1.20 CC(=O)C(N)c1ccc(N)cc1 Amb24487126 [0,2,0,0,0,0|1,0,0]=3 7962 B12R1.20 CC(=O)C(N)c1ccc(O)[n]c1 Amb24560279 [0,2,0,0,0,0|2,0,0]=4 7963 B12R1.20 CC(=O)C(N)c1ccc(O)c[n]1 Amb25076757 [0,2,0,0,0,0|2,0,0]=4 7964 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [0,2,0,0,0,0|1,0,0]=3 7965 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [0,2,0,0,0,0|1,0,0]=3 7966 B12R1.20 CC(=O)C(O)c1ccc(O)cc1 Amb18646451 [0,2,0,0,0,0|1,0,0]=3 7967 B12R1.20 CC(=O)C(c1ccc(cc1)C)Br Amb17142262 [0,2,0,0,0,0|1,0,0]=3 7968 B12R1.20 CC(=O)C(c1ccc(cc1)C)Cl Amb17139039 [0,2,0,0,0,0|1,0,0]=3 7969 B12R1.20 CC(=O)N(C)c1ccc(Br)c[n]1 Amb24557089 [0,2,0,0,0,0|2,0,0]=4 7970 B12R1.20 CC(=O)N(C)c1ccc(Cl)[n]c1 Amb25255688 [0,2,0,0,0,0|2,0,0]=4 7971 B12R1.20 CC(=O)N(C)c1ccc(Cl)c[n]1 Amb25036537 [0,2,0,0,0,0|2,0,0]=4 7972 B12R1.20 CC(=O)N(N)c1ccc(Br)cc1 Amb18070169 [0,2,0,0,0,0|2,0,0]=4 7973 B12R1.20 CC(=O)N(N)c1ccc(Cl)cc1 Amb18564312 [0,2,0,0,0,0|2,0,0]=4 7974 B12R1.20 CC(=O)N(N)c1ccc(F)cc1 Amb18563834 [0,2,0,0,0,0|2,0,0]=4 7975 B12R1.20 CC(=O)N(O)c1ccc(O)cc1 Amb24567688 [0,2,0,0,0,0|2,0,0]=4 7976 B12R1.20 CC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25852918 [0,2,0,0,0,0|1,0,0]=3 7977 B12R1.20 CC(=O)[C@H](C)c1ccc(Br)cc1 Amb25848276 [0,2,0,0,0,0|0,0,0]=2 7978 B12R1.20 CC(=O)[C@H](O)c1ccc(Cl)cc1 Amb25371989 [0,2,0,0,0,0|1,0,0]=3 7979 B12R1.20 CC(=O)[C@H](O)c1ccc(O)cc1 Amb25807613 [0,2,0,0,0,0|1,0,0]=3 7980 B12R1.20 CC(C(=O)Cl)c1ccc(Br)cc1 Amb24483822 [0,2,0,0,0,0|0,0,0]=2 7981 B12R1.20 CC(C(C)Br)c1ccc(Br)cc1 Amb24362041 [0,2,0,0,0,0|1,0,1]=4 7982 B12R1.20 CC(C(C)Br)c1ccc(I)cc1 Amb25159817 [0,2,0,0,0,0|1,0,1]=4 7983 B12R1.20 CC(C(C)N)c1ccc(Br)cc1 Amb18161837 [0,2,0,0,0,0|1,0,1]=4 7984 B12R1.20 CC(C(C)N)c1ccc(Cl)cc1 Amb18823024 [0,2,0,0,0,0|1,0,1]=4 7985 B12R1.20 CC(C(C)N)c1ccc(F)cc1 Amb18646792 [0,2,0,0,0,0|1,0,1]=4 7986 B12R1.20 CC(C(C)N)c1ccc(I)cc1 Amb25045736 [0,2,0,0,0,0|1,0,1]=4 7987 B12R1.20 CC(C(C)O)c1ccc(I)cc1 Amb24353088 [0,2,0,0,0,0|0,0,2]=4 7988 B12R1.20 CC(C(F)F)c1ccc(O)cc1 Amb24422392 [0,2,0,0,0,0|1,0,1]=4 7989 B12R1.20 CC(C(N)=N)c1ccc(Br)cc1 Amb25799351 [0,2,0,0,0,0|1,0,0]=3 7990 B12R1.20 CC(C(N)=O)c1ccc(O)cc1 Amb24364677 [0,2,0,0,0,0|0,0,0]=2 7991 B12R1.20 CC(C(N)=S)c1ccc(Br)cc1 Amb24570080 [0,2,0,0,0,0|0,1,0]=3 7992 B12R1.20 CC(C(O)=O)N1C=CC(=O)C=C1 Amb18534254 [0,2,0,0,0,0|1,0,0]=3 7993 B12R1.20 CC(C(O)=O)c1[n]cc(Br)c[n]1 Amb24677163 [0,2,0,0,0,0|2,0,0]=4 7994 B12R1.20 CC(C(O)=O)c1[n]cc(Cl)c[n]1 Amb24687285 [0,2,0,0,0,0|2,0,0]=4 7995 B12R1.20 CC(C(O)=O)c1ccc(C)cc1 Amb17678847 [0,2,0,0,0,0|0,0,0]=2 7996 B12R1.20 CC(C(O)=O)c1ccc(Cl)[n]c1 Amb19944615 [0,2,0,0,0,0|1,0,0]=3 7997 B12R1.20 CC(C(O)=O)c1ccc(I)cc1 Amb20619418 [0,2,0,0,0,0|0,0,0]=2 7998 B12R1.20 CC(C(O)=O)c1ccc(N)cc1 Amb24113246 [0,2,0,0,0,0|0,0,0]=2 7999 B12R1.20 CC(c1ccc(N)cc1)C(N)=O Amb25806999 [0,2,0,0,0,0|0,0,0]=2 8000 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O Amb17087424 [0,2,0,0,0,0|0,0,0]=2 8001 B12R1.20 CC(c1ccc(cc1)N)C(=O)O Amb2438888 [0,2,0,0,0,0|0,0,0]=2 8002 B12R1.20 CC(c1ccc(cc1)N)N(C)C Amb17090400 [0,2,0,0,0,0|2,0,0]=4 8003 B12R1.20 CN(C(=O)Cl)c1ccc(F)cc1 Amb25718037 [0,2,0,0,0,0|1,0,0]=3 8004 B12R1.20 CN(C(C)=O)[n]1ccc(=S)cc1 Amb24096752 [0,2,0,0,0,0|2,0,0]=4 8005 B12R1.20 CN(C(N)=N)c1ccc(F)cc1 Amb18788567 [0,2,0,0,0,0|2,0,0]=4 8006 B12R1.20 CN(C(N)=N)c1ccc(O)cc1 Amb24429000 [0,2,0,0,0,0|2,0,0]=4 8007 B12R1.20 CN(C(N)=O)N1C=CC(=S)C=C1 Amb24407273 [0,2,0,0,0,0|2,0,0]=4 8008 B12R1.20 CN(C(N)=O)c1ccc(Br)c[n]1 Amb25143812 [0,2,0,0,0,0|2,0,0]=4 8009 B12R1.20 CN(C(N)=O)c1ccc(Cl)c[n]1 Amb25145217 [0,2,0,0,0,0|2,0,0]=4 8010 B12R1.20 CN(C(N)=O)c1ccc(F)cc1 Amb18793023 [0,2,0,0,0,0|1,0,0]=3 8011 B12R1.20 CN(C(N)=S)c1ccc(F)cc1 Amb19045413 [0,2,0,0,0,0|1,1,0]=4 8012 B12R1.20 CN(C)C(C)c1ccc(Br)cc1 Amb21955701 [0,2,0,0,0,0|2,0,0]=4 8013 B12R1.20 CN(C)C(C)c1ccc(Cl)cc1 Amb24747924 [0,2,0,0,0,0|2,0,0]=4 8014 B12R1.20 CN(C)C(C)c1ccc(O)cc1 Amb25223024 [0,2,0,0,0,0|2,0,0]=4 8015 B12R1.20 CN(C)[C@@H](C)c1ccc(O)cc1 Amb24715954 [0,2,0,0,0,0|2,0,0]=4 8016 B12R1.20 CN(c1cc[n+](cc1)[O-])C(=O)C Amb10553011 [0,2,0,0,0,0|2,0,0]=4 8017 B12R1.20 CN(c1ccc(O)cc1)S(C)=O Amb25177213 [0,2,0,0,0,0|2,0,0]=4 8018 B12R1.20 CN(c1ccc(cc1)O)C(=O)C Amb2575449 [0,2,0,0,0,0|1,0,0]=3 8019 B12R1.20 C[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb24182093 [0,2,0,0,0,0|0,0,0]=2 8020 B12R1.20 C[C@@H](c1ccc(N)cc1)C(N)=O Amb25141393 [0,2,0,0,0,0|0,0,0]=2 8021 B12R1.20 C[C@@H](c1ccc(O)cc1)C(O)=O Amb21855850 [0,2,0,0,0,0|0,0,0]=2 8022 B12R1.20 C[C@H](C(N)=O)c1ccc(Cl)cc1 Amb24723034 [0,2,0,0,0,0|0,0,0]=2 8023 B12R1.20 C[C@H](C(N)=O)c1ccc(F)cc1 Amb24401577 [0,2,0,0,0,0|0,0,0]=2 8024 B12R1.20 C[C@H](C(O)=O)c1ccc(Cl)cc1 Amb24740781 [0,2,0,0,0,0|0,0,0]=2 8025 B12R1.20 C[C@H](C(O)=O)c1ccc(N)cc1 Amb25708326 [0,2,0,0,0,0|0,0,0]=2 8026 B12R1.20 C[C@H](c1ccc(N)cc1)C(N)=O Amb24665804 [0,2,0,0,0,0|0,0,0]=2 8027 B12R1.20 C[C@H](c1ccc(cc1)F)C(=O)O Amb10843989 [0,2,0,0,0,0|0,0,0]=2 8028 B12R1.20 Cc1ccc([n]c1)[C@@H](N)C(O)=O Amb24485647 [0,2,0,0,0,0|2,0,0]=4 8029 B12R1.20 Cc1ccc([n]c1)[C@H](N)C(O)=O Amb24358612 [0,2,0,0,0,0|2,0,0]=4 8030 B12R1.20 Cc1ccc(c[n]1)C(C)C(O)=O Amb18828385 [0,2,0,0,0,0|1,0,0]=3 8031 B12R1.20 Cc1ccc(c[n]1)C(F)C([O-])=O Amb24117186 [0,2,0,0,0,0|2,0,0]=4 8032 B12R1.20 Cc1ccc(c[n]1)C(O)C(N)=O Amb25238036 [0,2,0,0,0,0|2,0,0]=4 8033 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)C Amb17400105 [0,2,0,0,0,0|1,0,1]=4 8034 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)Cl Amb24068590 [0,2,0,0,0,0|1,0,1]=4 8035 B12R1.20 Cc1ccc(cc1)C(=O)C(N)=O Amb24100697 [0,2,0,0,0,0|1,0,1]=4 8036 B12R1.20 Cc1ccc(cc1)C(C)C(=O)Cl Amb24425440 [0,2,0,0,0,0|0,0,0]=2 8037 B12R1.20 Cc1ccc(cc1)C(C)C(C)N Amb18829123 [0,2,0,0,0,0|1,0,1]=4 8038 B12R1.20 Cc1ccc(cc1)C(C)C(N)=N Amb25081542 [0,2,0,0,0,0|1,0,0]=3 8039 B12R1.20 Cc1ccc(cc1)C(C)C(N)=O Amb25288853 [0,2,0,0,0,0|0,0,0]=2 8040 B12R1.20 Cc1ccc(cc1)C(C)N(C)C Amb25271218 [0,2,0,0,0,0|2,0,0]=4 8041 B12R1.20 Cc1ccc(cc1)C(C)[N+]([O-])=O Amb24064769 [0,2,0,0,0,0|1,0,0]=3 8042 B12R1.20 Cc1ccc(cc1)C(Cl)C(N)=O Amb19074654 [0,2,0,0,0,0|1,0,0]=3 8043 B12R1.20 Cc1ccc(cc1)C(F)C(O)=O Amb25320951 [0,2,0,0,0,0|1,0,0]=3 8044 B12R1.20 Cc1ccc(cc1)C(N)C(C)=C Amb25375128 [0,2,0,0,0,0|2,0,0]=4 8045 B12R1.20 Cc1ccc(cc1)C(O)C(C)=C Amb25098914 [0,2,0,0,0,0|2,0,0]=4 8046 B12R1.20 Cc1ccc(cc1)C(O)C(N)=N Amb24084346 [0,2,0,0,0,0|2,0,0]=4 8047 B12R1.20 Cc1ccc(cc1)C(O)C(N)=O Amb18800898 [0,2,0,0,0,0|1,0,0]=3 8048 B12R1.20 Cc1ccc(cc1)N(C)C(C)=N Amb25148508 [0,2,0,0,0,0|2,0,0]=4 8049 B12R1.20 Cc1ccc(cc1)N(C)C(C)=O Amb25141388 [0,2,0,0,0,0|1,0,0]=3 8050 B12R1.20 Cc1ccc(cc1)N(C)C(C)=S Amb24096749 [0,2,0,0,0,0|1,1,0]=4 8051 B12R1.20 Cc1ccc(cc1)N(C)C(N)=N Amb18788212 [0,2,0,0,0,0|2,0,0]=4 8052 B12R1.20 Cc1ccc(cc1)N(C)C(N)=O Amb18788283 [0,2,0,0,0,0|1,0,0]=3 8053 B12R1.20 Cc1ccc(cc1)N(C)C(N)=S Amb18791184 [0,2,0,0,0,0|1,1,0]=4 8054 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb18563638 [0,2,0,0,0,0|2,0,0]=4 8055 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb24072440 [0,2,0,0,0,0|2,0,0]=4 8056 B12R1.20 Cc1ccc(cc1)[C@@H](C)C(O)=O Amb22736712 [0,2,0,0,0,0|0,0,0]=2 8057 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(N)=O Amb24341621 [0,2,0,0,0,0|1,0,0]=3 8058 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(O)=O Amb22747999 [0,2,0,0,0,0|1,0,0]=3 8059 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(N)=N Amb25331476 [0,2,0,0,0,0|2,0,0]=4 8060 B12R1.20 Cc1ccc(cc1)[C@H](C)C(O)=O Amb22736713 [0,2,0,0,0,0|0,0,0]=2 8061 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@@H](C)O Amb25343914 [0,2,0,0,0,0|0,0,2]=4 8062 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@H](C)O Amb24412147 [0,2,0,0,0,0|0,0,2]=4 8063 B12R1.20 Cc1ccc(cc1)[C@H](O)C(C)=O Amb25320143 [0,2,0,0,0,0|1,0,0]=3 8064 B12R1.20 Cc1ccc(cc1)[C@H](O)C(N)=N Amb24738424 [0,2,0,0,0,0|2,0,0]=4 8065 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)C Amb17477759 [0,2,0,0,0,0|1,0,0]=3 8066 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)N Amb1199712 [0,2,0,0,0,0|1,0,0]=3 8067 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)O Amb17261128 [0,2,0,0,0,0|1,0,0]=3 8068 B12R1.20 ClC(c1ccc(cc1)C)C(=O)Cl Amb17506249 [0,2,0,0,0,0|1,0,0]=3 8069 B12R1.20 ClC(c1ccc(cc1)C)C(=O)O Amb17234143 [0,2,0,0,0,0|1,0,0]=3 8070 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)C Amb17477762 [0,2,0,0,0,0|1,0,0]=3 8071 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)O Amb17238287 [0,2,0,0,0,0|1,0,0]=3 8072 B12R1.20 ClC(c1ccc(cc1)F)C(=O)C Amb17139154 [0,2,0,0,0,0|1,0,0]=3 8073 B12R1.20 ClC(c1ccc(cc1)F)C(=O)Cl Amb17098059 [0,2,0,0,0,0|1,0,0]=3 8074 B12R1.20 ClC(c1ccc(cc1)F)C(=O)O Amb17234610 [0,2,0,0,0,0|1,0,0]=3 8075 B12R1.20 NC(=N)C(O)c1ccc(Cl)cc1 Amb25667224 [0,2,0,0,0,0|2,0,0]=4 8076 B12R1.20 NC(=N)C(O)c1ccc(F)cc1 Amb25224827 [0,2,0,0,0,0|2,0,0]=4 8077 B12R1.20 NC(=O)C(=O)c1ccc(Br)cc1 Amb21963977 [0,2,0,0,0,0|1,0,1]=4 8078 B12R1.20 NC(=O)C(=O)c1ccc(F)cc1 Amb25856862 [0,2,0,0,0,0|1,0,1]=4 8079 B12R1.20 NC(=O)C(=O)c1ccc(O)cc1 Amb24485532 [0,2,0,0,0,0|1,0,1]=4 8080 B12R1.20 NC(=O)C(Br)c1ccc(Br)cc1 Amb23510123 [0,2,0,0,0,0|1,0,0]=3 8081 B12R1.20 NC(=O)C(Cl)c1ccc(F)cc1 Amb18329809 [0,2,0,0,0,0|1,0,0]=3 8082 B12R1.20 NC(=O)C(Cl)c1ccc(I)cc1 Amb24373016 [0,2,0,0,0,0|1,0,0]=3 8083 B12R1.20 NC(=O)C(N)c1ccc(Br)cc1 Amb22478994 [0,2,0,0,0,0|1,0,0]=3 8084 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb19400288 [0,2,0,0,0,0|1,0,0]=3 8085 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb22433459 [0,2,0,0,0,0|1,0,0]=3 8086 B12R1.20 NC(=O)C(N)c1ccc(F)cc1 Amb22469878 [0,2,0,0,0,0|1,0,0]=3 8087 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [0,2,0,0,0,0|1,0,0]=3 8088 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [0,2,0,0,0,0|1,0,0]=3 8089 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [0,2,0,0,0,0|1,0,0]=3 8090 B12R1.20 NC(=O)C(O)c1ccc(I)cc1 Amb25700495 [0,2,0,0,0,0|1,0,0]=3 8091 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [0,2,0,0,0,0|1,0,0]=3 8092 B12R1.20 NC(=O)N(O)c1ccc(Cl)cc1 Amb25201508 [0,2,0,0,0,0|2,0,0]=4 8093 B12R1.20 NC(=O)N(O)c1ccc(F)cc1 Amb25096455 [0,2,0,0,0,0|2,0,0]=4 8094 B12R1.20 NC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb25152633 [0,2,0,0,0,0|1,0,0]=3 8095 B12R1.20 NC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25346222 [0,2,0,0,0,0|1,0,0]=3 8096 B12R1.20 NC(=O)[C@H](N)c1ccc(Cl)cc1 Amb25724996 [0,2,0,0,0,0|1,0,0]=3 8097 B12R1.20 NC(=O)[C@H](O)c1ccc(Cl)cc1 Amb24398035 [0,2,0,0,0,0|1,0,0]=3 8098 B12R1.20 NC(=S)C(N)c1ccc(F)cc1 Amb19374912 [0,2,0,0,0,0|1,1,0]=4 8099 B12R1.20 NC(=S)C(O)c1ccc(O)cc1 Amb24487581 [0,2,0,0,0,0|1,1,0]=4 8100 B12R1.20 NC(C(=O)Cl)c1ccc(O)cc1 Amb25100939 [0,2,0,0,0,0|1,0,0]=3 8101 B12R1.20 NC(C(O)=O)c1ccc(Cl)c[n]1 Amb24081006 [0,2,0,0,0,0|2,0,0]=4 8102 B12R1.20 NC(C(O)=O)c1ccc(I)[n]c1 Amb24759938 [0,2,0,0,0,0|2,0,0]=4 8103 B12R1.20 NC(C(O)=O)c1ccc(I)cc1 Amb22899108 [0,2,0,0,0,0|1,0,0]=3 8104 B12R1.20 NC(C(O)=O)c1ccc(S)cc1 Amb24504681 [0,2,0,0,0,0|1,0,0]=3 8105 B12R1.20 NC(c1ccc(O)[n]c1)C(O)=O Amb24674057 [0,2,0,0,0,0|2,0,0]=4 8106 B12R1.20 NC(c1ccc(O)c[n]1)C(O)=O Amb24629017 [0,2,0,0,0,0|2,0,0]=4 8107 B12R1.20 NC(c1ccc(O)cc1)P(O)=O Amb25047232 [0,2,0,0,0,0|2,0,0]=4 8108 B12R1.20 NC(c1ccc(cc1)Br)C(=O)N Amb13951626 [0,2,0,0,0,0|1,0,0]=3 8109 B12R1.20 NC(c1ccc(cc1)Br)C(=O)O Amb1837854 [0,2,0,0,0,0|1,0,0]=3 8110 B12R1.20 NC(c1ccc(cc1)C)C(=O)N Amb17334619 [0,2,0,0,0,0|1,0,0]=3 8111 B12R1.20 NC(c1ccc(cc1)C)C(=O)O Amb2234620 [0,2,0,0,0,0|1,0,0]=3 8112 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)N Amb17335727 [0,2,0,0,0,0|1,0,0]=3 8113 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)O Amb1837642 [0,2,0,0,0,0|1,0,0]=3 8114 B12R1.20 NC(c1ccc(cc1)F)C(=O)N Amb17334711 [0,2,0,0,0,0|1,0,0]=3 8115 B12R1.20 NC(c1ccc(cc1)I)C(=O)O Amb2234604 [0,2,0,0,0,0|1,0,0]=3 8116 B12R1.20 NC(c1ccc(cc1)O)C(=O)N Amb17334665 [0,2,0,0,0,0|1,0,0]=3 8117 B12R1.20 N[C@@H](C(=O)Cl)c1ccc(O)cc1 Amb24595943 [0,2,0,0,0,0|1,0,0]=3 8118 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)[n]c1 Amb25309311 [0,2,0,0,0,0|2,0,0]=4 8119 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)c[n]1 Amb25824057 [0,2,0,0,0,0|2,0,0]=4 8120 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)cc1 Amb22745984 [0,2,0,0,0,0|1,0,0]=3 8121 B12R1.20 N[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb19889601 [0,2,0,0,0,0|1,0,0]=3 8122 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)[n]c1 Amb25272929 [0,2,0,0,0,0|2,0,0]=4 8123 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)c[n]1 Amb25765185 [0,2,0,0,0,0|2,0,0]=4 8124 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)cc1 Amb19889896 [0,2,0,0,0,0|1,0,0]=3 8125 B12R1.20 N[C@@H](C(O)=O)c1ccc(I)cc1 Amb22745451 [0,2,0,0,0,0|1,0,0]=3 8126 B12R1.20 N[C@@H](c1ccc(O)[n]c1)C(O)=O Amb24365264 [0,2,0,0,0,0|2,0,0]=4 8127 B12R1.20 N[C@@H](c1ccc(cc1)C)C(=O)O Amb17621414 [0,2,0,0,0,0|1,0,0]=3 8128 B12R1.20 N[C@H](C(=O)Cl)c1ccc(O)cc1 Amb25141079 [0,2,0,0,0,0|1,0,0]=3 8129 B12R1.20 N[C@H](C(O)=O)c1ccc(Br)c[n]1 Amb24451007 [0,2,0,0,0,0|2,0,0]=4 8130 B12R1.20 N[C@H](C(O)=O)c1ccc(Cl)[n]c1 Amb25299360 [0,2,0,0,0,0|2,0,0]=4 8131 B12R1.20 N[C@H](C(O)=O)c1ccc(F)[n]c1 Amb24691564 [0,2,0,0,0,0|2,0,0]=4 8132 B12R1.20 N[C@H](C(O)=O)c1ccc(F)c[n]1 Amb24665825 [0,2,0,0,0,0|2,0,0]=4 8133 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 Amb19889897 [0,2,0,0,0,0|1,0,0]=3 8134 B12R1.20 N[C@H](C(O)=O)c1ccc(I)cc1 Amb24653870 [0,2,0,0,0,0|1,0,0]=3 8135 B12R1.20 N[C@H](c1ccc(O)[n]c1)C(O)=O Amb24692602 [0,2,0,0,0,0|2,0,0]=4 8136 B12R1.20 N[C@H](c1ccc(cc1)O)C(=O)N Amb15741205 [0,2,0,0,0,0|1,0,0]=3 8137 B12R1.20 Nc1ccc([n]c1)C(N)C(O)=O Amb25289878 [0,2,0,0,0,0|2,0,0]=4 8138 B12R1.20 Nc1ccc([n]c1)[C@@H](N)C(O)=O Amb24341698 [0,2,0,0,0,0|2,0,0]=4 8139 B12R1.20 Nc1ccc(c[n]1)C(O)C(O)=O Amb24591814 [0,2,0,0,0,0|2,0,0]=4 8140 B12R1.20 Nc1ccc(cc1)C(F)C(O)=O Amb25376043 [0,2,0,0,0,0|1,0,0]=3 8141 B12R1.20 Nc1ccc(cc1)C(N)C(O)=O Amb18646484 [0,2,0,0,0,0|1,0,0]=3 8142 B12R1.20 Nc1ccc(cc1)C(O)C(N)=O Amb24100608 [0,2,0,0,0,0|1,0,0]=3 8143 B12R1.20 Nc1ccc(cc1)C(O)C(O)=O Amb20668152 [0,2,0,0,0,0|1,0,0]=3 8144 B12R1.20 Nc1ccc(cc1)C(S)C(O)=O Amb25299470 [0,2,0,0,0,0|1,0,0]=3 8145 B12R1.20 Nc1ccc(cc1)[C@@H](N)C(O)=O Amb22745344 [0,2,0,0,0,0|1,0,0]=3 8146 B12R1.20 Nc1ccc(cc1)[C@H](N)C(O)=O Amb24568498 [0,2,0,0,0,0|1,0,0]=3 8147 B12R1.20 O=C(Br)C(Br)c1ccc(Br)cc1 Amb23536400 [0,2,0,0,0,0|1,0,0]=3 8148 B12R1.20 O=C(Cl)C(=O)c1ccc(Cl)cc1 Amb24068531 [0,2,0,0,0,0|1,0,1]=4 8149 B12R1.20 O=C(Cl)C(=O)c1ccc(F)cc1 Amb24068567 [0,2,0,0,0,0|1,0,1]=4 8150 B12R1.20 O=C(c1ccc(cc1)C)C(=O)O Amb1220932 [0,2,0,0,0,0|1,0,1]=4 8151 B12R1.20 O=C(c1ccc(cc1)F)C(=O)C Amb17400192 [0,2,0,0,0,0|1,0,1]=4 8152 B12R1.20 OC(=O)C(Br)c1ccc(Br)cc1 Amb23510124 [0,2,0,0,0,0|1,0,0]=3 8153 B12R1.20 OC(=O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,2,0,0,0,0|1,0,0]=3 8154 B12R1.20 OC(=O)C(Br)c1ccc(F)c[n]1 Amb24420865 [0,2,0,0,0,0|2,0,0]=4 8155 B12R1.20 OC(=O)C(Br)c1ccc(F)cc1 Amb22337461 [0,2,0,0,0,0|1,0,0]=3 8156 B12R1.20 OC(=O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,2,0,0,0,0|1,0,0]=3 8157 B12R1.20 OC(=O)C(O)c1ccc(Br)c[n]1 Amb25083758 [0,2,0,0,0,0|2,0,0]=4 8158 B12R1.20 OC(=O)C(O)c1ccc(I)cc1 Amb25798219 [0,2,0,0,0,0|1,0,0]=3 8159 B12R1.20 OC(=O)C(S)c1ccc(Cl)cc1 Amb24668947 [0,2,0,0,0,0|1,0,0]=3 8160 B12R1.20 OC(=O)[C@@H](F)c1ccc(Br)cc1 Amb25112439 [0,2,0,0,0,0|1,0,0]=3 8161 B12R1.20 OC(=O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,2,0,0,0,0|1,0,0]=3 8162 B12R1.20 OC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,2,0,0,0,0|1,0,0]=3 8163 B12R1.20 OC(=O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,2,0,0,0,0|1,0,0]=3 8164 B12R1.20 OC(=O)[C@@H](S)c1ccc(Cl)cc1 Amb24497033 [0,2,0,0,0,0|1,0,0]=3 8165 B12R1.20 OC(=O)[C@@H](c1ccc(cc1)O)C Amb10843991 [0,2,0,0,0,0|0,0,0]=2 8166 B12R1.20 OC(=O)[C@H](F)c1ccc(Br)cc1 Amb25117435 [0,2,0,0,0,0|1,0,0]=3 8167 B12R1.20 OC(=O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,2,0,0,0,0|1,0,0]=3 8168 B12R1.20 OC(=O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,2,0,0,0,0|1,0,0]=3 8169 B12R1.20 OC(c1ccc(cc1)F)C(=O)O Amb1218322 [0,2,0,0,0,0|1,0,0]=3 8170 B12R1.20 O[C@H](c1ccc(cc1)C)C(=O)O Amb10808019 [0,2,0,0,0,0|1,0,0]=3 8171 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)Cl Amb24068578 [0,2,0,0,0,0|1,0,1]=4 8172 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)O Amb16231521 [0,2,0,0,0,0|1,0,1]=4 8173 B12R1.20 Oc1ccc(cc1)[C@@H](O)C(O)=O Amb22745764 [0,2,0,0,0,0|1,0,0]=3 8174 B12R1.20 [NH3+]C(C(=O)Cl)c1ccc(O)cc1 Amb24104191 [0,2,0,0,0,0|1,0,0]=3 8175 B12R1.20 [O-]C(=O)C(=O)c1ccc(O)cc1 Amb19929368 [0,2,0,0,0,0|1,0,1]=4 8176 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb21964739 [0,2,0,0,0,0|1,0,0]=3 8177 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb22899121 [0,2,0,0,0,0|1,0,0]=3 8178 B12R1.20 [O-]S(=O)C(O)c1ccc(O)cc1 Amb24492510 [0,2,0,0,0,0|2,0,0]=4 8179 B12R1.367 BrCC(c1ccc(c(c1)C)C)C Amb17247629 [0,2,0,0,0,0|1,0,1]=4 8180 B12R1.367 BrCC(c1ccc(c(c1)C)F)C Amb17249286 [0,2,0,0,0,0|1,0,1]=4 8181 B12R1.367 C=CC(N)c1cc(Cl)c(Cl)cc1 Amb25771162 [0,2,0,0,0,0|2,0,0]=4 8182 B12R1.367 C=CC(N)c1cc(F)c(F)cc1 Amb25076087 [0,2,0,0,0,0|2,0,0]=4 8183 B12R1.367 C=CC(N)c1cc(N)c(Cl)cc1 Amb24453379 [0,2,0,0,0,0|2,0,0]=4 8184 B12R1.367 C=CC(N)c1cc(O)c(O)cc1 Amb24523186 [0,2,0,0,0,0|2,0,0]=4 8185 B12R1.367 C=CC(N)c1ccc(Br)c(O)c1 Amb25817242 [0,2,0,0,0,0|2,0,0]=4 8186 B12R1.367 C=CC(N)c1ccc(Cl)c(Br)c1 Amb24367194 [0,2,0,0,0,0|2,0,0]=4 8187 B12R1.367 C=CC(N)c1ccc(Cl)c(I)c1 Amb25838049 [0,2,0,0,0,0|2,0,0]=4 8188 B12R1.367 C=CC(N)c1ccc(F)c(Br)c1 Amb25780672 [0,2,0,0,0,0|2,0,0]=4 8189 B12R1.367 C=CC(N)c1ccc(F)c(O)c1 Amb24377609 [0,2,0,0,0,0|2,0,0]=4 8190 B12R1.367 C=CC(N)c1ccc(I)c(Br)c1 Amb25156700 [0,2,0,0,0,0|2,0,0]=4 8191 B12R1.367 C=CC(N)c1ccc(I)c(Cl)c1 Amb25731152 [0,2,0,0,0,0|2,0,0]=4 8192 B12R1.367 C=CC(N)c1ccc(I)c(F)c1 Amb25040526 [0,2,0,0,0,0|2,0,0]=4 8193 B12R1.367 C=CC(N)c1ccc(N)c(Cl)c1 Amb25703130 [0,2,0,0,0,0|2,0,0]=4 8194 B12R1.367 C=CC(N)c1ccc(O)c(Br)c1 Amb25849028 [0,2,0,0,0,0|2,0,0]=4 8195 B12R1.367 C=CC(O)c1cc(O)c(O)cc1 Amb25830070 [0,2,0,0,0,0|2,0,0]=4 8196 B12R1.367 C=CC(O)c1ccc(Br)c(Cl)c1 Amb25344105 [0,2,0,0,0,0|2,0,0]=4 8197 B12R1.367 C=CC(O)c1ccc(Br)c(F)c1 Amb25130738 [0,2,0,0,0,0|2,0,0]=4 8198 B12R1.367 C=CC(O)c1ccc(Cl)c(Br)c1 Amb25679476 [0,2,0,0,0,0|2,0,0]=4 8199 B12R1.367 C=CC(O)c1ccc(F)c(Br)c1 Amb24627955 [0,2,0,0,0,0|2,0,0]=4 8200 B12R1.367 C=CC(O)c1ccc(I)c(Cl)c1 Amb24497512 [0,2,0,0,0,0|2,0,0]=4 8201 B12R1.367 C=C[C@@H](N)c1cc(Br)c(Br)cc1 Amb24483722 [0,2,0,0,0,0|2,0,0]=4 8202 B12R1.367 C=C[C@@H](N)c1cc(N)c(Br)cc1 Amb24410284 [0,2,0,0,0,0|2,0,0]=4 8203 B12R1.367 C=C[C@@H](N)c1cc(N)c(F)cc1 Amb24738343 [0,2,0,0,0,0|2,0,0]=4 8204 B12R1.367 C=C[C@@H](N)c1ccc(Cl)c(I)c1 Amb25150118 [0,2,0,0,0,0|2,0,0]=4 8205 B12R1.367 C=C[C@@H](N)c1ccc(I)c(Cl)c1 Amb25739873 [0,2,0,0,0,0|2,0,0]=4 8206 B12R1.367 C=C[C@@H](N)c1ccc(I)c(F)c1 Amb25114236 [0,2,0,0,0,0|2,0,0]=4 8207 B12R1.367 C=C[C@@H](N)c1ccc(N)c(F)c1 Amb25268978 [0,2,0,0,0,0|2,0,0]=4 8208 B12R1.367 C=C[C@@H](N)c1ccc(O)c(Br)c1 Amb24394510 [0,2,0,0,0,0|2,0,0]=4 8209 B12R1.367 C=C[C@H](N)c1cc(Cl)c(Cl)cc1 Amb25143946 [0,2,0,0,0,0|2,0,0]=4 8210 B12R1.367 C=C[C@H](N)c1cc(N)c(Br)cc1 Amb24437734 [0,2,0,0,0,0|2,0,0]=4 8211 B12R1.367 C=C[C@H](N)c1cc(N)c(Cl)cc1 Amb25856622 [0,2,0,0,0,0|2,0,0]=4 8212 B12R1.367 C=C[C@H](N)c1ccc(Br)c(F)c1 Amb25691463 [0,2,0,0,0,0|2,0,0]=4 8213 B12R1.367 C=C[C@H](N)c1ccc(Br)c(I)c1 Amb25776021 [0,2,0,0,0,0|2,0,0]=4 8214 B12R1.367 C=C[C@H](N)c1ccc(Cl)c(Br)c1 Amb25805313 [0,2,0,0,0,0|2,0,0]=4 8215 B12R1.367 C=C[C@H](N)c1ccc(Cl)c(I)c1 Amb25733581 [0,2,0,0,0,0|2,0,0]=4 8216 B12R1.367 C=C[C@H](N)c1ccc(F)c(Br)c1 Amb24627944 [0,2,0,0,0,0|2,0,0]=4 8217 B12R1.367 C=C[C@H](N)c1ccc(I)c(Br)c1 Amb25691857 [0,2,0,0,0,0|2,0,0]=4 8218 B12R1.367 C=C[C@H](N)c1ccc(I)c(Cl)c1 Amb24607868 [0,2,0,0,0,0|2,0,0]=4 8219 B12R1.367 C=C[C@H](N)c1ccc(O)c(Cl)c1 Amb24671666 [0,2,0,0,0,0|2,0,0]=4 8220 B12R1.367 C=C[C@H](N)c1ccc(O)c(I)c1 Amb24483766 [0,2,0,0,0,0|2,0,0]=4 8221 B12R1.367 C=C[C@H](O)c1ccc(O)c(F)c1 Amb24497367 [0,2,0,0,0,0|2,0,0]=4 8222 B12R1.367 CC(C#N)c1cc(Cl)c(Cl)cc1 Amb25046821 [0,2,0,0,0,0|1,0,1]=4 8223 B12R1.367 CC(C#N)c1cc(O)c(O)cc1 Amb24661389 [0,2,0,0,0,0|1,0,1]=4 8224 B12R1.367 CC(C#N)c1ccc(Cl)c(F)c1 Amb24721563 [0,2,0,0,0,0|1,0,1]=4 8225 B12R1.367 CC(C#N)c1ccc(F)c(O)c1 Amb24430027 [0,2,0,0,0,0|1,0,1]=4 8226 B12R1.367 CC(C#N)c1ccc(N)c(Br)c1 Amb18134499 [0,2,0,0,0,0|1,0,1]=4 8227 B12R1.367 CC(C#N)c1ccc(N)c(F)c1 Amb18126401 [0,2,0,0,0,0|1,0,1]=4 8228 B12R1.367 CC(C#N)c1ccc(O)c(Br)c1 Amb24459391 [0,2,0,0,0,0|1,0,1]=4 8229 B12R1.367 CC(C=O)c1cc(Cl)c(Cl)cc1 Amb24421735 [0,2,0,0,0,0|0,0,0]=2 8230 B12R1.367 CC(C=O)c1ccc(F)c(Br)c1 Amb25206840 [0,2,0,0,0,0|0,0,0]=2 8231 B12R1.367 CC(C=O)c1ccc(F)c(Cl)c1 Amb24416159 [0,2,0,0,0,0|0,0,0]=2 8232 B12R1.367 CC(CBr)c1cc(Br)c(F)cc1 Amb25092362 [0,2,0,0,0,0|1,0,1]=4 8233 B12R1.367 CC(CC)c1ccc(F)c(Cl)c1 Amb24558902 [0,2,0,0,0,0|1,0,1]=4 8234 B12R1.367 CC(CC)c1ccc(F)c(O)c1 Amb24071670 [0,2,0,0,0,0|1,0,1]=4 8235 B12R1.367 CC(CC)c1ccc(N)c(S)c1 Amb25077096 [0,2,0,0,0,0|1,0,1]=4 8236 B12R1.367 CC(CC)c1ccc(O)c(Cl)c1 Amb24497216 [0,2,0,0,0,0|1,0,1]=4 8237 B12R1.367 CC(CCl)c1cc(Cl)c(Cl)cc1 Amb25790745 [0,2,0,0,0,0|1,0,1]=4 8238 B12R1.367 CC(CCl)c1cc(Cl)c(F)cc1 Amb25708831 [0,2,0,0,0,0|1,0,1]=4 8239 B12R1.367 CC(CCl)c1cc(F)c(F)cc1 Amb24700297 [0,2,0,0,0,0|1,0,1]=4 8240 B12R1.367 CC(CN)c1cc(N)c(O)cc1 Amb24654151 [0,2,0,0,0,0|1,0,1]=4 8241 B12R1.367 CC(CN)c1cc(O)c(O)cc1 Amb25363361 [0,2,0,0,0,0|1,0,1]=4 8242 B12R1.367 CC(CN)c1ccc(Cl)c(F)c1 Amb18191121 [0,2,0,0,0,0|1,0,1]=4 8243 B12R1.367 CC(CN)c1ccc(Cl)c(O)c1 Amb24497404 [0,2,0,0,0,0|1,0,1]=4 8244 B12R1.367 CC(CN)c1ccc(F)c(Br)c1 Amb25679253 [0,2,0,0,0,0|1,0,1]=4 8245 B12R1.367 CC(CN)c1ccc(F)c(O)c1 Amb24555118 [0,2,0,0,0,0|1,0,1]=4 8246 B12R1.367 CC(CO)c1cc(F)c(F)cc1 Amb24431908 [0,2,0,0,0,0|0,0,2]=4 8247 B12R1.367 CC(CO)c1ccc(F)c(Cl)c1 Amb25802288 [0,2,0,0,0,0|0,0,2]=4 8248 B12R1.367 CC(NN)c1ccc(Br)c(F)c1 Amb25281241 [0,2,0,0,0,0|2,0,0]=4 8249 B12R1.367 CC(NN)c1ccc(F)c(Br)c1 Amb24422733 [0,2,0,0,0,0|2,0,0]=4 8250 B12R1.367 CC(NN)c1ccc(I)c(Cl)c1 Amb25744151 [0,2,0,0,0,0|2,0,0]=4 8251 B12R1.367 CC(NN)c1ccc(O)c(F)c1 Amb25078561 [0,2,0,0,0,0|2,0,0]=4 8252 B12R1.367 CC(NO)c1cc(F)c(F)cc1 Amb24649381 [0,2,0,0,0,0|1,0,1]=4 8253 B12R1.367 CC(NO)c1ccc(O)c(Cl)c1 Amb24525861 [0,2,0,0,0,0|1,0,1]=4 8254 B12R1.367 CC(NO)c1ccc(O)c(F)c1 Amb25825270 [0,2,0,0,0,0|1,0,1]=4 8255 B12R1.367 CC=1C=C\C(\SC1C)=C(/C)\C=O Amb25072629 [0,2,0,0,0,0|1,0,1]=4 8256 B12R1.367 CC=1C=C\C(\SC1C)=C(\C)/C=O Amb18648420 [0,2,0,0,0,0|1,0,1]=4 8257 B12R1.367 CCC(C)C1=CC(=O)C(=O)C=C1 Amb25735240 [0,2,0,0,0,0|1,0,1]=4 8258 B12R1.367 CCC(c1ccc(c(c1)Br)O)C Amb2189167 [0,2,0,0,0,0|1,0,1]=4 8259 B12R1.367 CCC(c1ccc(c(c1)N)O)C Amb1222808 [0,2,0,0,0,0|1,0,1]=4 8260 B12R1.367 CN(N=O)c1cc(O)c(O)cc1 Amb22362729 [0,2,0,0,0,0|2,0,0]=4 8261 B12R1.367 CNC(C)c1ccc(Br)c(Cl)c1 Amb25067901 [0,2,0,0,0,0|2,0,0]=4 8262 B12R1.367 CNC(C)c1ccc(Br)c(F)c1 Amb25757259 [0,2,0,0,0,0|2,0,0]=4 8263 B12R1.367 CNC(C)c1ccc(Cl)c(N)c1 Amb24391694 [0,2,0,0,0,0|2,0,0]=4 8264 B12R1.367 CNC(C)c1ccc(F)c(O)c1 Amb25804087 [0,2,0,0,0,0|2,0,0]=4 8265 B12R1.367 CNC(C)c1ccc(N)c(Cl)c1 Amb25137108 [0,2,0,0,0,0|2,0,0]=4 8266 B12R1.367 CNC(C)c1ccc(O)c(Br)c1 Amb18287830 [0,2,0,0,0,0|2,0,0]=4 8267 B12R1.367 CNC(C)c1ccc(O)c(Cl)c1 Amb18965647 [0,2,0,0,0,0|2,0,0]=4 8268 B12R1.367 CNC(c1ccc(c(c1)C)F)C Amb17061030 [0,2,0,0,0,0|2,0,0]=4 8269 B12R1.367 CN[C@@H](C)c1cc(Br)c(Br)cc1 Amb25770184 [0,2,0,0,0,0|2,0,0]=4 8270 B12R1.367 CN[C@@H](C)c1cc(C)c(C)cc1 Amb25073933 [0,2,0,0,0,0|2,0,0]=4 8271 B12R1.367 CN[C@@H](C)c1ccc(Br)c(Cl)c1 Amb24400240 [0,2,0,0,0,0|2,0,0]=4 8272 B12R1.367 CN[C@@H](C)c1ccc(Br)c(F)c1 Amb24712633 [0,2,0,0,0,0|2,0,0]=4 8273 B12R1.367 CN[C@@H](C)c1ccc(Cl)c(Br)c1 Amb25312174 [0,2,0,0,0,0|2,0,0]=4 8274 B12R1.367 CN[C@@H](C)c1ccc(Cl)c(F)c1 Amb24585715 [0,2,0,0,0,0|2,0,0]=4 8275 B12R1.367 CN[C@@H](C)c1ccc(Cl)c(I)c1 Amb24435488 [0,2,0,0,0,0|2,0,0]=4 8276 B12R1.367 CN[C@@H](C)c1ccc(F)c(Br)c1 Amb25828941 [0,2,0,0,0,0|2,0,0]=4 8277 B12R1.367 CN[C@@H](C)c1ccc(F)c(Cl)c1 Amb25368275 [0,2,0,0,0,0|2,0,0]=4 8278 B12R1.367 CN[C@@H](C)c1ccc(F)c(I)c1 Amb24713724 [0,2,0,0,0,0|2,0,0]=4 8279 B12R1.367 CN[C@@H](C)c1ccc(I)c(Cl)c1 Amb25844962 [0,2,0,0,0,0|2,0,0]=4 8280 B12R1.367 CN[C@@H](C)c1ccc(N)c(F)c1 Amb24415370 [0,2,0,0,0,0|2,0,0]=4 8281 B12R1.367 CN[C@@H](C)c1ccc(O)c(Br)c1 Amb24614892 [0,2,0,0,0,0|2,0,0]=4 8282 B12R1.367 CN[C@@H](C)c1ccc(O)c(Cl)c1 Amb24446973 [0,2,0,0,0,0|2,0,0]=4 8283 B12R1.367 CN[C@@H](C)c1ccc(O)c(N)c1 Amb24484160 [0,2,0,0,0,0|2,0,0]=4 8284 B12R1.367 CN[C@H](C)c1cc(Cl)c(Cl)cc1 Amb24400806 [0,2,0,0,0,0|2,0,0]=4 8285 B12R1.367 CN[C@H](C)c1ccc(Br)c(Cl)c1 Amb25799707 [0,2,0,0,0,0|2,0,0]=4 8286 B12R1.367 CN[C@H](C)c1ccc(Cl)c(Br)c1 Amb24420100 [0,2,0,0,0,0|2,0,0]=4 8287 B12R1.367 CN[C@H](C)c1ccc(Cl)c(I)c1 Amb25120372 [0,2,0,0,0,0|2,0,0]=4 8288 B12R1.367 CN[C@H](C)c1ccc(F)c(Cl)c1 Amb25836911 [0,2,0,0,0,0|2,0,0]=4 8289 B12R1.367 CN[C@H](C)c1ccc(F)c(I)c1 Amb25742875 [0,2,0,0,0,0|2,0,0]=4 8290 B12R1.367 CN[C@H](C)c1ccc(F)c(O)c1 Amb24525030 [0,2,0,0,0,0|2,0,0]=4 8291 B12R1.367 CN[C@H](C)c1ccc(I)c(Cl)c1 Amb25715013 [0,2,0,0,0,0|2,0,0]=4 8292 B12R1.367 CN[C@H](C)c1ccc(N)c(Cl)c1 Amb25138049 [0,2,0,0,0,0|2,0,0]=4 8293 B12R1.367 CN[C@H](C)c1ccc(O)c(F)c1 Amb24715872 [0,2,0,0,0,0|2,0,0]=4 8294 B12R1.367 CSC(C)c1cc(Cl)c(Cl)cc1 Amb25159186 [0,2,0,0,0,0|2,0,0]=4 8295 B12R1.367 CSC(C)c1cc(F)c(F)cc1 Amb25160259 [0,2,0,0,0,0|2,0,0]=4 8296 B12R1.367 CSC(C)c1ccc(F)c(Cl)c1 Amb24459024 [0,2,0,0,0,0|2,0,0]=4 8297 B12R1.367 C[C@@H](NO)c1cc(Cl)c(Cl)cc1 Amb25792491 [0,2,0,0,0,0|1,0,1]=4 8298 B12R1.367 C[C@@H](NO)c1cc(O)c(O)cc1 Amb24702667 [0,2,0,0,0,0|1,0,1]=4 8299 B12R1.367 C[C@@H](NO)c1ccc(Cl)c(F)c1 Amb24414080 [0,2,0,0,0,0|1,0,1]=4 8300 B12R1.367 C[C@@H](NO)c1ccc(F)c(Cl)c1 Amb24395370 [0,2,0,0,0,0|1,0,1]=4 8301 B12R1.367 C[C@@H](NO)c1ccc(O)c(Br)c1 Amb25121274 [0,2,0,0,0,0|1,0,1]=4 8302 B12R1.367 C[C@@H](NO)c1ccc(O)c(F)c1 Amb25682405 [0,2,0,0,0,0|1,0,1]=4 8303 B12R1.367 C[C@H](NO)c1cc(Cl)c(Cl)cc1 Amb24342128 [0,2,0,0,0,0|1,0,1]=4 8304 B12R1.367 C[C@H](NO)c1ccc(F)c(Br)c1 Amb25035063 [0,2,0,0,0,0|1,0,1]=4 8305 B12R1.367 C[C@H](NO)c1ccc(O)c(Br)c1 Amb25786419 [0,2,0,0,0,0|1,0,1]=4 8306 B12R1.367 Cc1cc(ccc1Br)C(C)NC Amb18227611 [0,2,0,0,0,0|2,0,0]=4 8307 B12R1.367 Cc1cc(ccc1Br)[C@@H](N)C=C Amb25096357 [0,2,0,0,0,0|2,0,0]=4 8308 B12R1.367 Cc1cc(ccc1C)C(=O)C=O Amb18645657 [0,2,0,0,0,0|1,0,1]=4 8309 B12R1.367 Cc1cc(ccc1C)C(N)C=C Amb25667258 [0,2,0,0,0,0|2,0,0]=4 8310 B12R1.367 Cc1cc(ccc1C)N(O)C=O Amb24072091 [0,2,0,0,0,0|2,0,0]=4 8311 B12R1.367 Cc1cc(ccc1C)[C@@H](N)C=C Amb25781272 [0,2,0,0,0,0|2,0,0]=4 8312 B12R1.367 Cc1cc(ccc1C)[C@H](N)C=C Amb25079563 [0,2,0,0,0,0|2,0,0]=4 8313 B12R1.367 Cc1cc(ccc1C)\C(\C)=C/Cl Amb25061269 [0,2,0,0,0,0|1,0,1]=4 8314 B12R1.367 Cc1cc(ccc1Cl)C(C)NC Amb25674438 [0,2,0,0,0,0|2,0,0]=4 8315 B12R1.367 Cc1cc(ccc1Cl)C(N)C=C Amb25340509 [0,2,0,0,0,0|2,0,0]=4 8316 B12R1.367 Cc1cc(ccc1Cl)[C@@H](N)C=C Amb24670252 [0,2,0,0,0,0|2,0,0]=4 8317 B12R1.367 Cc1cc(ccc1Cl)[C@H](C)NC Amb25741775 [0,2,0,0,0,0|2,0,0]=4 8318 B12R1.367 Cc1cc(ccc1F)C(=O)C=O Amb18646441 [0,2,0,0,0,0|1,0,1]=4 8319 B12R1.367 Cc1cc(ccc1F)C(C)NN Amb18862776 [0,2,0,0,0,0|2,0,0]=4 8320 B12R1.367 Cc1cc(ccc1F)[C@@H](C)NC Amb24745571 [0,2,0,0,0,0|2,0,0]=4 8321 B12R1.367 Cc1cc(ccc1F)[C@H](C)NO Amb25049352 [0,2,0,0,0,0|1,0,1]=4 8322 B12R1.367 Cc1cc(ccc1F)[C@H](N)C=C Amb25849247 [0,2,0,0,0,0|2,0,0]=4 8323 B12R1.367 Cc1cc(ccc1I)C(C)NC Amb25327250 [0,2,0,0,0,0|2,0,0]=4 8324 B12R1.367 Cc1cc(ccc1I)C(N)C=C Amb25052490 [0,2,0,0,0,0|2,0,0]=4 8325 B12R1.367 Cc1cc(ccc1I)[C@@H](C)NC Amb25314177 [0,2,0,0,0,0|2,0,0]=4 8326 B12R1.367 Cc1cc(ccc1I)[C@H](N)C=C Amb25148882 [0,2,0,0,0,0|2,0,0]=4 8327 B12R1.367 Cc1cc(ccc1N)C(C)C#N Amb25322692 [0,2,0,0,0,0|1,0,1]=4 8328 B12R1.367 Cc1cc(ccc1N)C(C)CC Amb24382168 [0,2,0,0,0,0|1,0,1]=4 8329 B12R1.367 Cc1cc(ccc1N)C(C)NC Amb25738015 [0,2,0,0,0,0|2,0,0]=4 8330 B12R1.367 Cc1cc(ccc1N)[C@@H](N)C=C Amb24590144 [0,2,0,0,0,0|2,0,0]=4 8331 B12R1.367 Cc1cc(ccc1O)C(C)NC Amb24443775 [0,2,0,0,0,0|2,0,0]=4 8332 B12R1.367 Cc1cc(ccc1O)C(C)NN Amb25152281 [0,2,0,0,0,0|2,0,0]=4 8333 B12R1.367 Cc1cc(ccc1O)[C@@H](C)NC Amb25340424 [0,2,0,0,0,0|2,0,0]=4 8334 B12R1.367 Cc1cc(ccc1O)[C@@H](N)C=C Amb25856468 [0,2,0,0,0,0|2,0,0]=4 8335 B12R1.367 Cc1cc(ccc1O)[C@H](C)NC Amb25849296 [0,2,0,0,0,0|2,0,0]=4 8336 B12R1.367 Cc1ccc(cc1Br)C(C)CN Amb24556030 [0,2,0,0,0,0|1,0,1]=4 8337 B12R1.367 Cc1ccc(cc1Br)C(C)NC Amb18867524 [0,2,0,0,0,0|2,0,0]=4 8338 B12R1.367 Cc1ccc(cc1Br)C(C)NN Amb25704902 [0,2,0,0,0,0|2,0,0]=4 8339 B12R1.367 Cc1ccc(cc1Br)C(O)C=C Amb24474505 [0,2,0,0,0,0|2,0,0]=4 8340 B12R1.367 Cc1ccc(cc1Cl)C(C)C#N Amb25134007 [0,2,0,0,0,0|1,0,1]=4 8341 B12R1.367 Cc1ccc(cc1Cl)C(C)NC Amb18863079 [0,2,0,0,0,0|2,0,0]=4 8342 B12R1.367 Cc1ccc(cc1Cl)C(N)C=C Amb25326910 [0,2,0,0,0,0|2,0,0]=4 8343 B12R1.367 Cc1ccc(cc1Cl)C(O)C=C Amb25135615 [0,2,0,0,0,0|2,0,0]=4 8344 B12R1.367 Cc1ccc(cc1Cl)[C@@H](C)NC Amb24488546 [0,2,0,0,0,0|2,0,0]=4 8345 B12R1.367 Cc1ccc(cc1Cl)[C@H](N)C=C Amb24691592 [0,2,0,0,0,0|2,0,0]=4 8346 B12R1.367 Cc1ccc(cc1F)C(C)CN Amb24429256 [0,2,0,0,0,0|1,0,1]=4 8347 B12R1.367 Cc1ccc(cc1F)C(C)NC Amb18949731 [0,2,0,0,0,0|2,0,0]=4 8348 B12R1.367 Cc1ccc(cc1F)C(C)NO Amb24702112 [0,2,0,0,0,0|1,0,1]=4 8349 B12R1.367 Cc1ccc(cc1F)C(N)C=C Amb25034711 [0,2,0,0,0,0|2,0,0]=4 8350 B12R1.367 Cc1ccc(cc1F)C(O)C=C Amb25804757 [0,2,0,0,0,0|2,0,0]=4 8351 B12R1.367 Cc1ccc(cc1F)[C@@H](C)NC Amb24377106 [0,2,0,0,0,0|2,0,0]=4 8352 B12R1.367 Cc1ccc(cc1F)[C@@H](C)NO Amb25026034 [0,2,0,0,0,0|1,0,1]=4 8353 B12R1.367 Cc1ccc(cc1F)[C@@H](N)C=C Amb25789927 [0,2,0,0,0,0|2,0,0]=4 8354 B12R1.367 Cc1ccc(cc1F)[C@H](C)NC Amb24377107 [0,2,0,0,0,0|2,0,0]=4 8355 B12R1.367 Cc1ccc(cc1I)[C@H](N)C=C Amb24637815 [0,2,0,0,0,0|2,0,0]=4 8356 B12R1.367 Cc1ccc(cc1N)C(C)NC Amb25095280 [0,2,0,0,0,0|2,0,0]=4 8357 B12R1.367 Cc1ccc(cc1N)C(C)OC Amb23541098 [0,2,0,0,0,0|2,0,0]=4 8358 B12R1.367 Cc1ccc(cc1N)C(N)C=C Amb25111498 [0,2,0,0,0,0|2,0,0]=4 8359 B12R1.367 Cc1ccc(cc1N)N(C)N=O Amb25684825 [0,2,0,0,0,0|2,0,0]=4 8360 B12R1.367 Cc1ccc(cc1N)[C@H](C)NC Amb24407288 [0,2,0,0,0,0|2,0,0]=4 8361 B12R1.367 Cc1ccc(cc1N)[C@H](N)C=C Amb25150898 [0,2,0,0,0,0|2,0,0]=4 8362 B12R1.367 Cc1ccc(cc1O)C(C)C#N Amb25318699 [0,2,0,0,0,0|1,0,1]=4 8363 B12R1.367 Cc1ccc(cc1O)C(C)CN Amb24497393 [0,2,0,0,0,0|1,0,1]=4 8364 B12R1.367 Cc1ccc(cc1O)C(N)C=C Amb25708766 [0,2,0,0,0,0|2,0,0]=4 8365 B12R1.367 Cc1ccc(cc1O)[C@@H](C)CO Amb25094343 [0,2,0,0,0,0|0,0,2]=4 8366 B12R1.367 Cc1ccc(cc1O)[C@H](C)NC Amb25765356 [0,2,0,0,0,0|2,0,0]=4 8367 B12R1.367 Cc1ccc(cc1O)[C@H](N)C=C Amb25808598 [0,2,0,0,0,0|2,0,0]=4 8368 B12R1.367 ClCC(c1ccc(c(c1)C)C)C Amb17233972 [0,2,0,0,0,0|1,0,1]=4 8369 B12R1.367 ClCC(c1ccc(c(c1)C)F)C Amb17234367 [0,2,0,0,0,0|1,0,1]=4 8370 B12R1.367 N#CC(c1ccc(c(c1)C)F)C Amb17089241 [0,2,0,0,0,0|1,0,1]=4 8371 B12R1.367 N#CC(c1ccc(c(c1)N)O)C Amb17594036 [0,2,0,0,0,0|1,0,1]=4 8372 B12R1.367 NCC(c1ccc(c(c1)C)F)C Amb17087285 [0,2,0,0,0,0|1,0,1]=4 8373 B12R1.367 NCC(c1ccc(c(c1)Cl)Cl)C Amb17087287 [0,2,0,0,0,0|1,0,1]=4 8374 B12R1.367 NCC(c1ccc(c(c1)Cl)F)C Amb17321743 [0,2,0,0,0,0|1,0,1]=4 8375 B12R1.367 NOC(c1ccc(c(c1)C)C)C Amb17089190 [0,2,0,0,0,0|2,0,0]=4 8376 B12R1.367 NOC(c1ccc(c(c1)C)F)C Amb17089197 [0,2,0,0,0,0|2,0,0]=4 8377 B12R1.367 O=C(C=O)c1cc(Cl)c(F)cc1 Amb18649453 [0,2,0,0,0,0|1,0,1]=4 8378 B12R1.367 O=CC(=O)c1ccc(c(c1)Cl)Cl Amb10067954 [0,2,0,0,0,0|1,0,1]=4 8379 B12R1.367 O=CC(=O)c1ccc(c(c1)F)F Amb10605626 [0,2,0,0,0,0|1,0,1]=4 8380 B12R1.367 O=CC(=O)c1ccc(c(c1)F)F Amb10807474 [0,2,0,0,0,0|1,0,1]=4 8381 B12R1.367 O=CC(c1ccc(c(c1)C)C)C Amb17138538 [0,2,0,0,0,0|0,0,0]=2 8382 B12R1.367 O=CC(c1ccc(c(c1)C)F)C Amb17138601 [0,2,0,0,0,0|0,0,0]=2 8383 B12R1.367 O=CC(c1ccc(c(c1)F)F)C Amb17194477 [0,2,0,0,0,0|0,0,0]=2 8384 B12R1.367 OC(C=O)c1cc(Cl)c(Cl)cc1 Amb24363884 [0,2,0,0,0,0|1,0,0]=3 8385 B12R1.367 OC(C=O)c1cc(O)c(O)cc1 Amb24089729 [0,2,0,0,0,0|1,0,0]=3 8386 B12R1.367 OCC(c1ccc(c(c1)C)C)C Amb17232492 [0,2,0,0,0,0|0,0,2]=4 8387 B12R1.367 OCC(c1ccc(c(c1)C)F)C Amb17232669 [0,2,0,0,0,0|0,0,2]=4 8388 B12R1.367 ONC(c1ccc(c(c1)C)C)C Amb17089207 [0,2,0,0,0,0|1,0,1]=4 8389 B12R1.367 ONC(c1ccc(c(c1)C)F)C Amb17089214 [0,2,0,0,0,0|1,0,1]=4 8390 B12R1.367 Oc1cc(ccc1O)C(=O)C=O Amb25667227 [0,2,0,0,0,0|1,0,1]=4 8391 B12R1.1703 BrCC(c1ccc(cc1C)C)C Amb17247631 [0,2,0,0,0,0|1,0,1]=4 8392 B12R1.1703 C=CC(N)c1ccc(Br)cc1F Amb25148693 [0,2,0,0,0,0|2,0,0]=4 8393 B12R1.1703 C=CC(N)c1ccc(Cl)cc1N Amb24502044 [0,2,0,0,0,0|2,0,0]=4 8394 B12R1.1703 C=CC(N)c1ccc(F)cc1Br Amb25726913 [0,2,0,0,0,0|2,0,0]=4 8395 B12R1.1703 C=CC(N)c1ccc(F)cc1I Amb24376133 [0,2,0,0,0,0|2,0,0]=4 8396 B12R1.1703 C=CC(N)c1ccc(F)cc1O Amb25824208 [0,2,0,0,0,0|2,0,0]=4 8397 B12R1.1703 C=CC(N)c1ccc(I)cc1F Amb24587213 [0,2,0,0,0,0|2,0,0]=4 8398 B12R1.1703 C=CC(N)c1ccc(N)cc1Br Amb24436822 [0,2,0,0,0,0|2,0,0]=4 8399 B12R1.1703 C=CC(N)c1ccc(N)cc1Cl Amb25669566 [0,2,0,0,0,0|2,0,0]=4 8400 B12R1.1703 C=CC(N)c1ccc(O)cc1Br Amb25061959 [0,2,0,0,0,0|2,0,0]=4 8401 B12R1.1703 C=CC(N)c1ccc(O)cc1I Amb24427562 [0,2,0,0,0,0|2,0,0]=4 8402 B12R1.1703 C=CC(N)c1ccc(O)cc1N Amb24558637 [0,2,0,0,0,0|2,0,0]=4 8403 B12R1.1703 C=CC(N)c1ccc(S)cc1O Amb25276337 [0,2,0,0,0,0|2,0,0]=4 8404 B12R1.1703 C=CC(O)c1ccc(Br)cc1Br Amb25351054 [0,2,0,0,0,0|2,0,0]=4 8405 B12R1.1703 C=CC(O)c1ccc(Br)cc1F Amb25375931 [0,2,0,0,0,0|2,0,0]=4 8406 B12R1.1703 C=CC(O)c1ccc(Cl)cc1Cl Amb25691025 [0,2,0,0,0,0|2,0,0]=4 8407 B12R1.1703 C=CC(O)c1ccc(F)cc1Cl Amb24674421 [0,2,0,0,0,0|2,0,0]=4 8408 B12R1.1703 C=CC(O)c1ccc(O)cc1O Amb24497212 [0,2,0,0,0,0|2,0,0]=4 8409 B12R1.1703 C=C[C@@H](N)c1ccc(Br)cc1N Amb24702637 [0,2,0,0,0,0|2,0,0]=4 8410 B12R1.1703 C=C[C@@H](N)c1ccc(Br)cc1O Amb24615736 [0,2,0,0,0,0|2,0,0]=4 8411 B12R1.1703 C=C[C@@H](N)c1ccc(Cl)cc1Cl Amb25773765 [0,2,0,0,0,0|2,0,0]=4 8412 B12R1.1703 C=C[C@@H](N)c1ccc(Cl)cc1F Amb25713802 [0,2,0,0,0,0|2,0,0]=4 8413 B12R1.1703 C=C[C@@H](N)c1ccc(F)cc1Br Amb24637926 [0,2,0,0,0,0|2,0,0]=4 8414 B12R1.1703 C=C[C@@H](N)c1ccc(F)cc1Cl Amb25084892 [0,2,0,0,0,0|2,0,0]=4 8415 B12R1.1703 C=C[C@@H](N)c1ccc(F)cc1I Amb24594325 [0,2,0,0,0,0|2,0,0]=4 8416 B12R1.1703 C=C[C@@H](N)c1ccc(F)cc1O Amb24421794 [0,2,0,0,0,0|2,0,0]=4 8417 B12R1.1703 C=C[C@@H](N)c1ccc(I)cc1O Amb24435944 [0,2,0,0,0,0|2,0,0]=4 8418 B12R1.1703 C=C[C@@H](N)c1ccc(N)cc1Cl Amb25064650 [0,2,0,0,0,0|2,0,0]=4 8419 B12R1.1703 C=C[C@@H](N)c1ccc(N)cc1O Amb24484300 [0,2,0,0,0,0|2,0,0]=4 8420 B12R1.1703 C=C[C@@H](N)c1ccc(O)cc1Br Amb24468898 [0,2,0,0,0,0|2,0,0]=4 8421 B12R1.1703 C=C[C@@H](N)c1ccc(O)cc1F Amb25130726 [0,2,0,0,0,0|2,0,0]=4 8422 B12R1.1703 C=C[C@@H](N)c1ccc(O)cc1I Amb25827455 [0,2,0,0,0,0|2,0,0]=4 8423 B12R1.1703 C=C[C@@H](N)c1ccc(O)cc1N Amb24437361 [0,2,0,0,0,0|2,0,0]=4 8424 B12R1.1703 C=C[C@@H](N)c1ccc(S)cc1O Amb24388779 [0,2,0,0,0,0|2,0,0]=4 8425 B12R1.1703 C=C[C@H](N)c1ccc(Br)cc1F Amb25150058 [0,2,0,0,0,0|2,0,0]=4 8426 B12R1.1703 C=C[C@H](N)c1ccc(Br)cc1O Amb24342199 [0,2,0,0,0,0|2,0,0]=4 8427 B12R1.1703 C=C[C@H](N)c1ccc(Cl)cc1N Amb25724848 [0,2,0,0,0,0|2,0,0]=4 8428 B12R1.1703 C=C[C@H](N)c1ccc(F)cc1F Amb24409965 [0,2,0,0,0,0|2,0,0]=4 8429 B12R1.1703 C=C[C@H](N)c1ccc(F)cc1I Amb24483878 [0,2,0,0,0,0|2,0,0]=4 8430 B12R1.1703 C=C[C@H](N)c1ccc(I)cc1F Amb25063356 [0,2,0,0,0,0|2,0,0]=4 8431 B12R1.1703 C=C[C@H](N)c1ccc(I)cc1O Amb25047281 [0,2,0,0,0,0|2,0,0]=4 8432 B12R1.1703 C=C[C@H](N)c1ccc(N)cc1Br Amb24403129 [0,2,0,0,0,0|2,0,0]=4 8433 B12R1.1703 C=C[C@H](N)c1ccc(O)cc1Br Amb25793690 [0,2,0,0,0,0|2,0,0]=4 8434 B12R1.1703 C=C[C@H](N)c1ccc(O)cc1F Amb25128332 [0,2,0,0,0,0|2,0,0]=4 8435 B12R1.1703 C=C[C@H](N)c1ccc(O)cc1I Amb25118688 [0,2,0,0,0,0|2,0,0]=4 8436 B12R1.1703 C=C[C@H](O)c1ccc(F)cc1Br Amb24591788 [0,2,0,0,0,0|2,0,0]=4 8437 B12R1.1703 CC(C#N)c1ccc(Br)cc1Cl Amb24564954 [0,2,0,0,0,0|1,0,1]=4 8438 B12R1.1703 CC(C#N)c1ccc(Cl)cc1Br Amb24370090 [0,2,0,0,0,0|1,0,1]=4 8439 B12R1.1703 CC(C#N)c1ccc(Cl)cc1Cl Amb22451091 [0,2,0,0,0,0|1,0,1]=4 8440 B12R1.1703 CC(C#N)c1ccc(Cl)cc1N Amb25145449 [0,2,0,0,0,0|1,0,1]=4 8441 B12R1.1703 CC(C#N)c1ccc(F)cc1Cl Amb25314404 [0,2,0,0,0,0|1,0,1]=4 8442 B12R1.1703 CC(C#N)c1ccc(F)cc1O Amb25829982 [0,2,0,0,0,0|1,0,1]=4 8443 B12R1.1703 CC(C#N)c1ccc(N)cc1Cl Amb24676658 [0,2,0,0,0,0|1,0,1]=4 8444 B12R1.1703 CC(C#N)c1ccc(O)cc1Cl Amb25144509 [0,2,0,0,0,0|1,0,1]=4 8445 B12R1.1703 CC(C#N)c1ccc(O)cc1F Amb25188170 [0,2,0,0,0,0|1,0,1]=4 8446 B12R1.1703 CC(C=C)c1ccc(O)cc1O Amb18646049 [0,2,0,0,0,0|1,0,0]=3 8447 B12R1.1703 CC(C=O)c1ccc(Br)cc1F Amb25756333 [0,2,0,0,0,0|0,0,0]=2 8448 B12R1.1703 CC(C=O)c1ccc(Cl)cc1Cl Amb25369752 [0,2,0,0,0,0|0,0,0]=2 8449 B12R1.1703 CC(C=O)c1ccc(F)cc1F Amb24483800 [0,2,0,0,0,0|0,0,0]=2 8450 B12R1.1703 CC(CBr)c1ccc(Cl)cc1Cl Amb25043908 [0,2,0,0,0,0|1,0,1]=4 8451 B12R1.1703 CC(CBr)c1ccc(F)cc1Br Amb25179942 [0,2,0,0,0,0|1,0,1]=4 8452 B12R1.1703 CC(CCl)c1ccc(Br)cc1Cl Amb25824995 [0,2,0,0,0,0|1,0,1]=4 8453 B12R1.1703 CC(CCl)c1ccc(Cl)cc1Cl Amb24654238 [0,2,0,0,0,0|1,0,1]=4 8454 B12R1.1703 CC(CCl)c1ccc(F)cc1Br Amb25761773 [0,2,0,0,0,0|1,0,1]=4 8455 B12R1.1703 CC(CN)c1ccc(Br)cc1Cl Amb25121037 [0,2,0,0,0,0|1,0,1]=4 8456 B12R1.1703 CC(CN)c1ccc(Br)cc1F Amb25770356 [0,2,0,0,0,0|1,0,1]=4 8457 B12R1.1703 CC(CN)c1ccc(Cl)cc1Br Amb24365487 [0,2,0,0,0,0|1,0,1]=4 8458 B12R1.1703 CC(CN)c1ccc(Cl)cc1Cl Amb18654410 [0,2,0,0,0,0|1,0,1]=4 8459 B12R1.1703 CC(CN)c1ccc(F)cc1Br Amb24687890 [0,2,0,0,0,0|1,0,1]=4 8460 B12R1.1703 CC(CN)c1ccc(O)cc1O Amb25377927 [0,2,0,0,0,0|1,0,1]=4 8461 B12R1.1703 CC(CO)c1ccc(Cl)cc1Cl Amb25794913 [0,2,0,0,0,0|0,0,2]=4 8462 B12R1.1703 CC(NN)c1ccc(Br)cc1Cl Amb25797265 [0,2,0,0,0,0|2,0,0]=4 8463 B12R1.1703 CC(NN)c1ccc(Br)cc1O Amb24443933 [0,2,0,0,0,0|2,0,0]=4 8464 B12R1.1703 CC(NN)c1ccc(Cl)cc1F Amb25330363 [0,2,0,0,0,0|2,0,0]=4 8465 B12R1.1703 CC(NN)c1ccc(Cl)cc1N Amb24724086 [0,2,0,0,0,0|2,0,0]=4 8466 B12R1.1703 CC(NN)c1ccc(F)cc1Cl Amb25307866 [0,2,0,0,0,0|2,0,0]=4 8467 B12R1.1703 CC(NN)c1ccc(F)cc1O Amb18177925 [0,2,0,0,0,0|2,0,0]=4 8468 B12R1.1703 CC(NN)c1ccc(O)cc1O Amb25688404 [0,2,0,0,0,0|2,0,0]=4 8469 B12R1.1703 CC(NO)c1ccc(F)cc1Br Amb24741386 [0,2,0,0,0,0|1,0,1]=4 8470 B12R1.1703 CC(NO)c1ccc(F)cc1Cl Amb24493160 [0,2,0,0,0,0|1,0,1]=4 8471 B12R1.1703 CCC(C)c1ccc(C)cc1C Amb24596162 [0,2,0,0,0,0|1,0,1]=4 8472 B12R1.1703 CCC(C)c1ccc(Cl)cc1F Amb25376069 [0,2,0,0,0,0|1,0,1]=4 8473 B12R1.1703 CCC(C)c1ccc(F)cc1Cl Amb25176010 [0,2,0,0,0,0|1,0,1]=4 8474 B12R1.1703 CCC(C)c1ccc(N)cc1F Amb24401588 [0,2,0,0,0,0|1,0,1]=4 8475 B12R1.1703 CCC(C)c1ccc(O)cc1O Amb24614735 [0,2,0,0,0,0|1,0,1]=4 8476 B12R1.1703 CN(C=O)c1ccc(N)[n]c1N Amb25196128 [0,2,0,0,0,0|2,0,0]=4 8477 B12R1.1703 CN(N=O)c1ccc(O)cc1O Amb25320038 [0,2,0,0,0,0|2,0,0]=4 8478 B12R1.1703 CNC(C)c1ccc(Br)cc1Cl Amb25786173 [0,2,0,0,0,0|2,0,0]=4 8479 B12R1.1703 CNC(C)c1ccc(Br)cc1F Amb24435936 [0,2,0,0,0,0|2,0,0]=4 8480 B12R1.1703 CNC(C)c1ccc(Cl)cc1F Amb18967489 [0,2,0,0,0,0|2,0,0]=4 8481 B12R1.1703 CNC(C)c1ccc(Cl)cc1I Amb25117864 [0,2,0,0,0,0|2,0,0]=4 8482 B12R1.1703 CNC(C)c1ccc(Cl)cc1N Amb25222554 [0,2,0,0,0,0|2,0,0]=4 8483 B12R1.1703 CNC(C)c1ccc(F)cc1O Amb18967357 [0,2,0,0,0,0|2,0,0]=4 8484 B12R1.1703 CNC(C)c1ccc(I)cc1Cl Amb24641489 [0,2,0,0,0,0|2,0,0]=4 8485 B12R1.1703 CNC(C)c1ccc(N)cc1Cl Amb25751594 [0,2,0,0,0,0|2,0,0]=4 8486 B12R1.1703 CNC(C)c1ccc(N)cc1F Amb25046195 [0,2,0,0,0,0|2,0,0]=4 8487 B12R1.1703 CNC(C)c1ccc(O)cc1F Amb24537590 [0,2,0,0,0,0|2,0,0]=4 8488 B12R1.1703 CNC(c1ccc(cc1C)C)C Amb1119766 [0,2,0,0,0,0|2,0,0]=4 8489 B12R1.1703 CNC(c1ccc(cc1Cl)Cl)C Amb1131820 [0,2,0,0,0,0|2,0,0]=4 8490 B12R1.1703 CNC(c1ccc(cc1F)F)C Amb1115466 [0,2,0,0,0,0|2,0,0]=4 8491 B12R1.1703 CNC(c1ccc(cc1O)O)C Amb1115799 [0,2,0,0,0,0|2,0,0]=4 8492 B12R1.1703 CN[C@@H](C)c1ccc(Br)cc1O Amb25785049 [0,2,0,0,0,0|2,0,0]=4 8493 B12R1.1703 CN[C@@H](C)c1ccc(Cl)cc1Br Amb25364907 [0,2,0,0,0,0|2,0,0]=4 8494 B12R1.1703 CN[C@@H](C)c1ccc(Cl)cc1N Amb25751368 [0,2,0,0,0,0|2,0,0]=4 8495 B12R1.1703 CN[C@@H](C)c1ccc(Cl)cc1O Amb24436505 [0,2,0,0,0,0|2,0,0]=4 8496 B12R1.1703 CN[C@@H](C)c1ccc(F)cc1Cl Amb24487296 [0,2,0,0,0,0|2,0,0]=4 8497 B12R1.1703 CN[C@@H](C)c1ccc(I)cc1Cl Amb24444333 [0,2,0,0,0,0|2,0,0]=4 8498 B12R1.1703 CN[C@@H](C)c1ccc(N)cc1Cl Amb24488602 [0,2,0,0,0,0|2,0,0]=4 8499 B12R1.1703 CN[C@H](C)c1ccc(Cl)cc1F Amb25791657 [0,2,0,0,0,0|2,0,0]=4 8500 B12R1.1703 CN[C@H](C)c1ccc(Cl)cc1I Amb25696437 [0,2,0,0,0,0|2,0,0]=4 8501 B12R1.1703 CN[C@H](C)c1ccc(Cl)cc1O Amb25843324 [0,2,0,0,0,0|2,0,0]=4 8502 B12R1.1703 CN[C@H](C)c1ccc(F)cc1Br Amb25195372 [0,2,0,0,0,0|2,0,0]=4 8503 B12R1.1703 CN[C@H](C)c1ccc(F)cc1Cl Amb25317868 [0,2,0,0,0,0|2,0,0]=4 8504 B12R1.1703 CN[C@H](C)c1ccc(F)cc1I Amb25835800 [0,2,0,0,0,0|2,0,0]=4 8505 B12R1.1703 CN[C@H](C)c1ccc(I)cc1F Amb24756459 [0,2,0,0,0,0|2,0,0]=4 8506 B12R1.1703 CN[C@H](C)c1ccc(N)cc1F Amb25376604 [0,2,0,0,0,0|2,0,0]=4 8507 B12R1.1703 CN[C@H](C)c1ccc(O)cc1Cl Amb25111973 [0,2,0,0,0,0|2,0,0]=4 8508 B12R1.1703 CN[C@H](C)c1ccc(O)cc1F Amb24702973 [0,2,0,0,0,0|2,0,0]=4 8509 B12R1.1703 COC(C)c1ccc(N)cc1N Amb25702119 [0,2,0,0,0,0|2,0,0]=4 8510 B12R1.1703 CSC(C)c1ccc(Cl)cc1Cl Amb25669923 [0,2,0,0,0,0|2,0,0]=4 8511 B12R1.1703 CSC(C)c1ccc(F)cc1F Amb24343660 [0,2,0,0,0,0|2,0,0]=4 8512 B12R1.1703 C[C@@H](NO)c1ccc(Cl)cc1Cl Amb25352361 [0,2,0,0,0,0|1,0,1]=4 8513 B12R1.1703 C[C@@H](NO)c1ccc(F)cc1Cl Amb24659550 [0,2,0,0,0,0|1,0,1]=4 8514 B12R1.1703 C[C@@H](NO)c1ccc(F)cc1F Amb24437624 [0,2,0,0,0,0|1,0,1]=4 8515 B12R1.1703 C[C@@H](NO)c1ccc(O)cc1O Amb25797536 [0,2,0,0,0,0|1,0,1]=4 8516 B12R1.1703 C[C@H](NO)c1ccc(Br)cc1F Amb24554172 [0,2,0,0,0,0|1,0,1]=4 8517 B12R1.1703 C[C@H](NO)c1ccc(F)cc1Cl Amb25715229 [0,2,0,0,0,0|1,0,1]=4 8518 B12R1.1703 C[C@H](NO)c1ccc(F)cc1F Amb24585682 [0,2,0,0,0,0|1,0,1]=4 8519 B12R1.1703 C\C=C(/C)\c1ccc(C)cc1O Amb24722980 [0,2,0,0,0,0|1,0,1]=4 8520 B12R1.1703 C\C=C(\C)/c1ccc(C)cc1O Amb25834444 [0,2,0,0,0,0|1,0,1]=4 8521 B12R1.1703 Cc1cc(Br)ccc1C(C)C#N Amb24632631 [0,2,0,0,0,0|1,0,1]=4 8522 B12R1.1703 Cc1cc(Br)ccc1C(C)NC Amb18867560 [0,2,0,0,0,0|2,0,0]=4 8523 B12R1.1703 Cc1cc(Br)ccc1C(N)C=C Amb24483668 [0,2,0,0,0,0|2,0,0]=4 8524 B12R1.1703 Cc1cc(Br)ccc1C(O)C=C Amb24352328 [0,2,0,0,0,0|2,0,0]=4 8525 B12R1.1703 Cc1cc(C)c(cc1)C(O)C=C Amb25040535 [0,2,0,0,0,0|2,0,0]=4 8526 B12R1.1703 Cc1cc(C)c(cc1)N(C)C=O Amb24364474 [0,2,0,0,0,0|1,0,0]=3 8527 B12R1.1703 Cc1cc(C)c(cc1)[C@@H](C)NO Amb25782941 [0,2,0,0,0,0|1,0,1]=4 8528 B12R1.1703 Cc1cc(C)c(cc1)[C@H](C)NO Amb25035041 [0,2,0,0,0,0|1,0,1]=4 8529 B12R1.1703 Cc1cc(C)c(cc1)[C@H](N)C=C Amb24341532 [0,2,0,0,0,0|2,0,0]=4 8530 B12R1.1703 Cc1cc(C)c(cc1)\C(\C)=C/Cl Amb25108679 [0,2,0,0,0,0|1,0,1]=4 8531 B12R1.1703 Cc1cc(Cl)c(cc1)C(=O)C=O Amb24724561 [0,2,0,0,0,0|1,0,1]=4 8532 B12R1.1703 Cc1cc(Cl)ccc1C(=O)C=O Amb18648696 [0,2,0,0,0,0|1,0,1]=4 8533 B12R1.1703 Cc1cc(Cl)ccc1C(C)NC Amb18863078 [0,2,0,0,0,0|2,0,0]=4 8534 B12R1.1703 Cc1cc(Cl)ccc1C(O)C=C Amb24573757 [0,2,0,0,0,0|2,0,0]=4 8535 B12R1.1703 Cc1cc(Cl)ccc1[C@@H](C)NC Amb24487297 [0,2,0,0,0,0|2,0,0]=4 8536 B12R1.1703 Cc1cc(F)ccc1C(=O)C=O Amb18646442 [0,2,0,0,0,0|1,0,1]=4 8537 B12R1.1703 Cc1cc(F)ccc1C(C)CN Amb18251915 [0,2,0,0,0,0|1,0,1]=4 8538 B12R1.1703 Cc1cc(F)ccc1C(C)NC Amb18964729 [0,2,0,0,0,0|2,0,0]=4 8539 B12R1.1703 Cc1cc(F)ccc1C(O)C=C Amb25374878 [0,2,0,0,0,0|2,0,0]=4 8540 B12R1.1703 Cc1cc(F)ccc1C(O)C=O Amb25317912 [0,2,0,0,0,0|1,0,0]=3 8541 B12R1.1703 Cc1cc(F)ccc1[C@@H](N)C=C Amb24411482 [0,2,0,0,0,0|2,0,0]=4 8542 B12R1.1703 Cc1cc(F)ccc1[C@H](C)NC Amb24487295 [0,2,0,0,0,0|2,0,0]=4 8543 B12R1.1703 Cc1cc(I)ccc1C(C)NC Amb25159316 [0,2,0,0,0,0|2,0,0]=4 8544 B12R1.1703 Cc1cc(I)ccc1C(N)C=C Amb25843548 [0,2,0,0,0,0|2,0,0]=4 8545 B12R1.1703 Cc1cc(I)ccc1[C@H](C)NC Amb25148743 [0,2,0,0,0,0|2,0,0]=4 8546 B12R1.1703 Cc1cc(O)c(cc1)C(O)C=C Amb25087137 [0,2,0,0,0,0|2,0,0]=4 8547 B12R1.1703 Cc1cc(O)ccc1C(C)NC Amb25350311 [0,2,0,0,0,0|2,0,0]=4 8548 B12R1.1703 Cc1cc(O)ccc1C(C)NN Amb25359910 [0,2,0,0,0,0|2,0,0]=4 8549 B12R1.1703 Cc1cc(O)ccc1C(N)C=C Amb24488558 [0,2,0,0,0,0|2,0,0]=4 8550 B12R1.1703 Cc1cc(O)ccc1[C@H](C)NC Amb25796714 [0,2,0,0,0,0|2,0,0]=4 8551 B12R1.1703 Cc1cc(O)ccc1[C@H](N)C=C Amb25131700 [0,2,0,0,0,0|2,0,0]=4 8552 B12R1.1703 Cc1ccc(C(C)C#N)c(Br)c1 Amb25236328 [0,2,0,0,0,0|1,0,1]=4 8553 B12R1.1703 Cc1ccc(C(C)C#N)c(Cl)c1 Amb25823194 [0,2,0,0,0,0|1,0,1]=4 8554 B12R1.1703 Cc1ccc(C(C)C#N)c(F)c1 Amb25044200 [0,2,0,0,0,0|1,0,1]=4 8555 B12R1.1703 Cc1ccc(C(C)C#N)c(O)c1 Amb24421650 [0,2,0,0,0,0|1,0,1]=4 8556 B12R1.1703 Cc1ccc(C(C)CN)c(Cl)c1 Amb25851446 [0,2,0,0,0,0|1,0,1]=4 8557 B12R1.1703 Cc1ccc(C(C)CN)c(F)c1 Amb25678404 [0,2,0,0,0,0|1,0,1]=4 8558 B12R1.1703 Cc1ccc(C(C)NN)c(F)c1 Amb24502051 [0,2,0,0,0,0|2,0,0]=4 8559 B12R1.1703 Cc1ccc(C(O)C=C)c(Br)c1 Amb25069953 [0,2,0,0,0,0|2,0,0]=4 8560 B12R1.1703 Cc1ccc([C@@H](C)CO)c(O)c1 Amb25373213 [0,2,0,0,0,0|0,0,2]=4 8561 B12R1.1703 Cc1ccc([C@@H](C)NC)c(Cl)c1 Amb25088887 [0,2,0,0,0,0|2,0,0]=4 8562 B12R1.1703 Cc1ccc([C@@H](C)NC)c(F)c1 Amb25349322 [0,2,0,0,0,0|2,0,0]=4 8563 B12R1.1703 Cc1ccc([C@@H](C)NC)c(O)c1 Amb24715745 [0,2,0,0,0,0|2,0,0]=4 8564 B12R1.1703 Cc1ccc([C@@H](C)NO)c(O)c1 Amb24702386 [0,2,0,0,0,0|1,0,1]=4 8565 B12R1.1703 Cc1ccc([C@@H](N)C=C)c(Cl)c1 Amb25108030 [0,2,0,0,0,0|2,0,0]=4 8566 B12R1.1703 Cc1ccc([C@@H](O)C=C)c(Br)c1 Amb25140886 [0,2,0,0,0,0|2,0,0]=4 8567 B12R1.1703 Cc1ccc([C@H](C)CO)c(O)c1 Amb25674232 [0,2,0,0,0,0|0,0,2]=4 8568 B12R1.1703 Cc1ccc([C@H](C)NC)c(N)c1 Amb25689931 [0,2,0,0,0,0|2,0,0]=4 8569 B12R1.1703 Cc1ccc([C@H](N)C=C)c(Br)c1 Amb25312204 [0,2,0,0,0,0|2,0,0]=4 8570 B12R1.1703 Cc1ccc([C@H](O)C=C)c(Br)c1 Amb25213125 [0,2,0,0,0,0|2,0,0]=4 8571 B12R1.1703 ClCC(c1ccc(cc1C)C)C Amb17233974 [0,2,0,0,0,0|1,0,1]=4 8572 B12R1.1703 O=C(C=O)c1ccc(Br)cc1Cl Amb25077496 [0,2,0,0,0,0|1,0,1]=4 8573 B12R1.1703 O=C(C=O)c1ccc(Cl)cc1Cl Amb24644625 [0,2,0,0,0,0|1,0,1]=4 8574 B12R1.1703 O=C(C=O)c1ccc(F)cc1Cl Amb18649452 [0,2,0,0,0,0|1,0,1]=4 8575 B12R1.1703 O=CC(=O)c1ccc(cc1C)C Amb1014546 [0,2,0,0,0,0|1,0,1]=4 8576 B12R1.1703 O=CC(F)c1ccc(F)cc1Cl Amb24680501 [0,2,0,0,0,0|1,0,0]=3 8577 B12R1.1703 O=CC(c1ccc(cc1C)C)C Amb17194468 [0,2,0,0,0,0|0,0,0]=2 8578 B12R1.1703 OCC(c1ccc(cc1C)C)C Amb17232494 [0,2,0,0,0,0|0,0,2]=4 8579 B12R1.1703 ONC(c1ccc(cc1Cl)Cl)C Amb10606962 [0,2,0,0,0,0|1,0,1]=4 8580 B12R1.24 C=CC(N)c1cccc(Br)c1Cl Amb25699044 [0,2,0,0,0,0|2,0,0]=4 8581 B12R1.24 C=CC(N)c1cccc(Cl)c1Br Amb25142144 [0,2,0,0,0,0|2,0,0]=4 8582 B12R1.24 C=CC(N)c1cccc(Cl)c1Cl Amb24700363 [0,2,0,0,0,0|2,0,0]=4 8583 B12R1.24 C=CC(N)c1cccc(Cl)c1N Amb25717060 [0,2,0,0,0,0|2,0,0]=4 8584 B12R1.24 C=CC(N)c1cccc(F)c1Cl Amb24410589 [0,2,0,0,0,0|2,0,0]=4 8585 B12R1.24 C=CC(N)c1cccc(I)c1Cl Amb25049461 [0,2,0,0,0,0|2,0,0]=4 8586 B12R1.24 C=CC(N)c1cccc(N)c1F Amb25350524 [0,2,0,0,0,0|2,0,0]=4 8587 B12R1.24 C=CC(N)c1cccc(N)c1O Amb25054050 [0,2,0,0,0,0|2,0,0]=4 8588 B12R1.24 C=CC(N)c1cccc(O)c1Br Amb25095262 [0,2,0,0,0,0|2,0,0]=4 8589 B12R1.24 C=CC(N)c1cccc(O)c1Cl Amb25082871 [0,2,0,0,0,0|2,0,0]=4 8590 B12R1.24 C=CC(N)c1cccc(O)c1F Amb25276146 [0,2,0,0,0,0|2,0,0]=4 8591 B12R1.24 C=CC(N)c1cccc(O)c1O Amb24711528 [0,2,0,0,0,0|2,0,0]=4 8592 B12R1.24 C=CC(N)c1cccc(S)c1O Amb25804013 [0,2,0,0,0,0|2,0,0]=4 8593 B12R1.24 C=CC(O)c1cccc(Br)c1Cl Amb24674528 [0,2,0,0,0,0|2,0,0]=4 8594 B12R1.24 C=C[C@@H](N)c1cccc(Br)c1F Amb24679961 [0,2,0,0,0,0|2,0,0]=4 8595 B12R1.24 C=C[C@@H](N)c1cccc(Cl)c1N Amb24436711 [0,2,0,0,0,0|2,0,0]=4 8596 B12R1.24 C=C[C@@H](N)c1cccc(Cl)c1O Amb25798382 [0,2,0,0,0,0|2,0,0]=4 8597 B12R1.24 C=C[C@@H](N)c1cccc(F)c1Br Amb25726343 [0,2,0,0,0,0|2,0,0]=4 8598 B12R1.24 C=C[C@@H](N)c1cccc(F)c1F Amb25149812 [0,2,0,0,0,0|2,0,0]=4 8599 B12R1.24 C=C[C@@H](N)c1cccc(F)c1N Amb24648753 [0,2,0,0,0,0|2,0,0]=4 8600 B12R1.24 C=C[C@@H](N)c1cccc(F)c1O Amb24717696 [0,2,0,0,0,0|2,0,0]=4 8601 B12R1.24 C=C[C@@H](N)c1cccc(I)c1Br Amb24493177 [0,2,0,0,0,0|2,0,0]=4 8602 B12R1.24 C=C[C@@H](N)c1cccc(I)c1O Amb25058032 [0,2,0,0,0,0|2,0,0]=4 8603 B12R1.24 C=C[C@@H](N)c1cccc(O)c1Br Amb24760054 [0,2,0,0,0,0|2,0,0]=4 8604 B12R1.24 C=C[C@@H](N)c1cccc(S)c1O Amb24632711 [0,2,0,0,0,0|2,0,0]=4 8605 B12R1.24 C=C[C@H](N)c1cccc(Br)c1Cl Amb25352560 [0,2,0,0,0,0|2,0,0]=4 8606 B12R1.24 C=C[C@H](N)c1cccc(Cl)c1Br Amb25142142 [0,2,0,0,0,0|2,0,0]=4 8607 B12R1.24 C=C[C@H](N)c1cccc(Cl)c1N Amb24493121 [0,2,0,0,0,0|2,0,0]=4 8608 B12R1.24 C=C[C@H](N)c1cccc(Cl)c1O Amb25064600 [0,2,0,0,0,0|2,0,0]=4 8609 B12R1.24 C=C[C@H](N)c1cccc(F)c1Br Amb25669652 [0,2,0,0,0,0|2,0,0]=4 8610 B12R1.24 C=C[C@H](N)c1cccc(F)c1F Amb25151110 [0,2,0,0,0,0|2,0,0]=4 8611 B12R1.24 C=C[C@H](N)c1cccc(F)c1I Amb25755467 [0,2,0,0,0,0|2,0,0]=4 8612 B12R1.24 C=C[C@H](N)c1cccc(I)c1Cl Amb25850059 [0,2,0,0,0,0|2,0,0]=4 8613 B12R1.24 C=C[C@H](N)c1cccc(I)c1O Amb25742511 [0,2,0,0,0,0|2,0,0]=4 8614 B12R1.24 C=C[C@H](N)c1cccc(N)c1F Amb25736877 [0,2,0,0,0,0|2,0,0]=4 8615 B12R1.24 C=C[C@H](N)c1cccc(N)c1N Amb24406672 [0,2,0,0,0,0|2,0,0]=4 8616 B12R1.24 C=C[C@H](N)c1cccc(O)c1Br Amb24418944 [0,2,0,0,0,0|2,0,0]=4 8617 B12R1.24 C=C[C@H](N)c1cccc(O)c1F Amb24376168 [0,2,0,0,0,0|2,0,0]=4 8618 B12R1.24 C=C[C@H](N)c1cccc(O)c1O Amb25063236 [0,2,0,0,0,0|2,0,0]=4 8619 B12R1.24 C=C[C@H](N)c1cccc(S)c1O Amb25820837 [0,2,0,0,0,0|2,0,0]=4 8620 B12R1.24 CC(C#N)c1cccc(Br)c1O Amb24520574 [0,2,0,0,0,0|1,0,1]=4 8621 B12R1.24 CC(C#N)c1cccc(Cl)c1F Amb24573662 [0,2,0,0,0,0|1,0,1]=4 8622 B12R1.24 CC(C#N)c1cccc(N)c1N Amb25138131 [0,2,0,0,0,0|1,0,1]=4 8623 B12R1.24 CC(C=C)c1cccc(N)c1O Amb18645871 [0,2,0,0,0,0|1,0,0]=3 8624 B12R1.24 CC(C=O)c1cccc(Cl)c1Cl Amb24407679 [0,2,0,0,0,0|0,0,0]=2 8625 B12R1.24 CC(C=O)c1cccc(F)c1F Amb24361624 [0,2,0,0,0,0|0,0,0]=2 8626 B12R1.24 CC(CN)c1cccc(Br)c1Cl Amb25755201 [0,2,0,0,0,0|1,0,1]=4 8627 B12R1.24 CC(CN)c1cccc(Cl)c1Br Amb24407097 [0,2,0,0,0,0|1,0,1]=4 8628 B12R1.24 CC(CN)c1cccc(F)c1Br Amb25711434 [0,2,0,0,0,0|1,0,1]=4 8629 B12R1.24 CC(CN)c1cccc(F)c1Cl Amb25080045 [0,2,0,0,0,0|1,0,1]=4 8630 B12R1.24 CC(CN)c1cccc(O)c1Br Amb24405878 [0,2,0,0,0,0|1,0,1]=4 8631 B12R1.24 CC(CN)c1cccc(O)c1Cl Amb24450194 [0,2,0,0,0,0|1,0,1]=4 8632 B12R1.24 CC(CN)c1cccc(O)c1F Amb25266085 [0,2,0,0,0,0|1,0,1]=4 8633 B12R1.24 CC(NN)c1cccc(Br)c1Cl Amb24701916 [0,2,0,0,0,0|2,0,0]=4 8634 B12R1.24 CC(NN)c1cccc(Cl)c1F Amb24502052 [0,2,0,0,0,0|2,0,0]=4 8635 B12R1.24 CC(NN)c1cccc(F)c1F Amb25077493 [0,2,0,0,0,0|2,0,0]=4 8636 B12R1.24 CC(NO)c1cccc(Cl)c1Cl Amb25704223 [0,2,0,0,0,0|1,0,1]=4 8637 B12R1.24 CC(c1cccc(c1Cl)Cl)CN Amb17321747 [0,2,0,0,0,0|1,0,1]=4 8638 B12R1.24 CCC(C)c1cccc(F)c1F Amb25247361 [0,2,0,0,0,0|1,0,1]=4 8639 B12R1.24 CNC(C)c1cccc(Cl)c1Cl Amb24670008 [0,2,0,0,0,0|2,0,0]=4 8640 B12R1.24 CNC(C)c1cccc(Cl)c1O Amb25695396 [0,2,0,0,0,0|2,0,0]=4 8641 B12R1.24 CNC(C)c1cccc(F)c1Cl Amb24453332 [0,2,0,0,0,0|2,0,0]=4 8642 B12R1.24 CNC(C)c1cccc(F)c1N Amb25803573 [0,2,0,0,0,0|2,0,0]=4 8643 B12R1.24 CNC(C)c1cccc(N)c1N Amb24374684 [0,2,0,0,0,0|2,0,0]=4 8644 B12R1.24 CN[C@@H](C)c1cccc(Cl)c1Cl Amb25195350 [0,2,0,0,0,0|2,0,0]=4 8645 B12R1.24 CN[C@@H](C)c1cccc(F)c1Br Amb24399883 [0,2,0,0,0,0|2,0,0]=4 8646 B12R1.24 CN[C@@H](C)c1cccc(F)c1Cl Amb24484201 [0,2,0,0,0,0|2,0,0]=4 8647 B12R1.24 CN[C@@H](C)c1cccc(F)c1F Amb25836910 [0,2,0,0,0,0|2,0,0]=4 8648 B12R1.24 CN[C@@H](C)c1cccc(N)c1N Amb25100830 [0,2,0,0,0,0|2,0,0]=4 8649 B12R1.24 CN[C@@H](C)c1cccc(O)c1O Amb25849267 [0,2,0,0,0,0|2,0,0]=4 8650 B12R1.24 CN[C@H](C)c1cccc(Cl)c1Cl Amb24655761 [0,2,0,0,0,0|2,0,0]=4 8651 B12R1.24 CN[C@H](C)c1cccc(F)c1Br Amb25721643 [0,2,0,0,0,0|2,0,0]=4 8652 B12R1.24 CN[C@H](C)c1cccc(F)c1Cl Amb25689844 [0,2,0,0,0,0|2,0,0]=4 8653 B12R1.24 CN[C@H](C)c1cccc(F)c1O Amb24416102 [0,2,0,0,0,0|2,0,0]=4 8654 B12R1.24 CN[C@H](C)c1cccc(O)c1O Amb24488507 [0,2,0,0,0,0|2,0,0]=4 8655 B12R1.24 COC(C)c1cccc(Br)c1F Amb22896509 [0,2,0,0,0,0|2,0,0]=4 8656 B12R1.24 C[C@@H](NO)c1cccc(F)c1F Amb25132803 [0,2,0,0,0,0|1,0,1]=4 8657 B12R1.24 C[C@H](NO)c1cccc(F)c1F Amb24535478 [0,2,0,0,0,0|1,0,1]=4 8658 B12R1.24 Cc1c(Br)cccc1C(C)CN Amb25700595 [0,2,0,0,0,0|1,0,1]=4 8659 B12R1.24 Cc1c(Br)cccc1C(C)NN Amb24643599 [0,2,0,0,0,0|2,0,0]=4 8660 B12R1.24 Cc1c(Br)cccc1C(N)C=C Amb25826641 [0,2,0,0,0,0|2,0,0]=4 8661 B12R1.24 Cc1c(Br)cccc1[C@@H](C)NC Amb24664378 [0,2,0,0,0,0|2,0,0]=4 8662 B12R1.24 Cc1c(Br)cccc1[C@H](N)C=C Amb25377003 [0,2,0,0,0,0|2,0,0]=4 8663 B12R1.24 Cc1c(Cl)cccc1C(C)C#N Amb25236610 [0,2,0,0,0,0|1,0,1]=4 8664 B12R1.24 Cc1c(Cl)cccc1C(C)NC Amb18863076 [0,2,0,0,0,0|2,0,0]=4 8665 B12R1.24 Cc1c(Cl)cccc1[C@@H](C)NC Amb24469983 [0,2,0,0,0,0|2,0,0]=4 8666 B12R1.24 Cc1c(Cl)cccc1[C@@H](N)C=C Amb24485600 [0,2,0,0,0,0|2,0,0]=4 8667 B12R1.24 Cc1c(Cl)cccc1[C@H](C)NC Amb25837373 [0,2,0,0,0,0|2,0,0]=4 8668 B12R1.24 Cc1c(F)cccc1C(C)C#N Amb24719840 [0,2,0,0,0,0|1,0,1]=4 8669 B12R1.24 Cc1c(F)cccc1[C@@H](C)NC Amb24562852 [0,2,0,0,0,0|2,0,0]=4 8670 B12R1.24 Cc1c(F)cccc1[C@@H](N)C=C Amb25073487 [0,2,0,0,0,0|2,0,0]=4 8671 B12R1.24 Cc1c(F)cccc1[C@H](C)NC Amb25113931 [0,2,0,0,0,0|2,0,0]=4 8672 B12R1.24 Cc1c(I)cccc1[C@@H](C)NC Amb24427628 [0,2,0,0,0,0|2,0,0]=4 8673 B12R1.24 Cc1c(I)cccc1[C@@H](N)C=C Amb25150011 [0,2,0,0,0,0|2,0,0]=4 8674 B12R1.24 Cc1c(I)cccc1[C@H](C)NC Amb25148639 [0,2,0,0,0,0|2,0,0]=4 8675 B12R1.24 Cc1c(I)cccc1[C@H](N)C=C Amb24696586 [0,2,0,0,0,0|2,0,0]=4 8676 B12R1.24 Cc1c(N)cccc1[C@H](C)NC Amb25087893 [0,2,0,0,0,0|2,0,0]=4 8677 B12R1.24 Cc1c(O)cccc1C(C)CN Amb25786513 [0,2,0,0,0,0|1,0,1]=4 8678 B12R1.24 Cc1c(O)cccc1C(N)C=C Amb25187672 [0,2,0,0,0,0|2,0,0]=4 8679 B12R1.24 Cc1c(O)cccc1[C@H](C)NC Amb25373960 [0,2,0,0,0,0|2,0,0]=4 8680 B12R1.24 Cc1c(O)cccc1[C@H](N)C=C Amb24657245 [0,2,0,0,0,0|2,0,0]=4 8681 B12R1.24 Cc1c(cccc1N)C(N)C=C Amb25667122 [0,2,0,0,0,0|2,0,0]=4 8682 B12R1.24 Cc1cccc(C(C)C#N)c1Br Amb24721565 [0,2,0,0,0,0|1,0,1]=4 8683 B12R1.24 Cc1cccc(C(C)C#N)c1C Amb18645225 [0,2,0,0,0,0|1,0,1]=4 8684 B12R1.24 Cc1cccc(C(C)C#N)c1F Amb24576358 [0,2,0,0,0,0|1,0,1]=4 8685 B12R1.24 Cc1cccc(C(C)C=O)c1C Amb24666800 [0,2,0,0,0,0|0,0,0]=2 8686 B12R1.24 Cc1cccc(C(C)CC)c1N Amb24085059 [0,2,0,0,0,0|1,0,1]=4 8687 B12R1.24 Cc1cccc(C(C)CN)c1Br Amb25700596 [0,2,0,0,0,0|1,0,1]=4 8688 B12R1.24 Cc1cccc(C(C)CN)c1Cl Amb24361808 [0,2,0,0,0,0|1,0,1]=4 8689 B12R1.24 Cc1cccc(C(C)CN)c1F Amb25218789 [0,2,0,0,0,0|1,0,1]=4 8690 B12R1.24 Cc1cccc(C(C)CO)c1C Amb25369429 [0,2,0,0,0,0|0,0,2]=4 8691 B12R1.24 Cc1cccc(C(C)NC)c1Br Amb25039227 [0,2,0,0,0,0|2,0,0]=4 8692 B12R1.24 Cc1cccc(C(C)NC)c1C Amb18962504 [0,2,0,0,0,0|2,0,0]=4 8693 B12R1.24 Cc1cccc(C(C)NC)c1Cl Amb24566175 [0,2,0,0,0,0|2,0,0]=4 8694 B12R1.24 Cc1cccc(C(C)NC)c1I Amb25159619 [0,2,0,0,0,0|2,0,0]=4 8695 B12R1.24 Cc1cccc(C(C)NC)c1N Amb25054613 [0,2,0,0,0,0|2,0,0]=4 8696 B12R1.24 Cc1cccc(C(C)NC)c1O Amb24558627 [0,2,0,0,0,0|2,0,0]=4 8697 B12R1.24 Cc1cccc(C(C)NN)c1Br Amb25304762 [0,2,0,0,0,0|2,0,0]=4 8698 B12R1.24 Cc1cccc(C(C)NN)c1C Amb25307691 [0,2,0,0,0,0|2,0,0]=4 8699 B12R1.24 Cc1cccc(C(C)SC)c1O Amb25759522 [0,2,0,0,0,0|2,0,0]=4 8700 B12R1.24 Cc1cccc(C(N)C=C)c1Cl Amb24443806 [0,2,0,0,0,0|2,0,0]=4 8701 B12R1.24 Cc1cccc(C(N)C=C)c1I Amb25255389 [0,2,0,0,0,0|2,0,0]=4 8702 B12R1.24 Cc1cccc(C(O)C=C)c1C Amb25751750 [0,2,0,0,0,0|2,0,0]=4 8703 B12R1.24 Cc1cccc(C(O)C=C)c1O Amb24497318 [0,2,0,0,0,0|2,0,0]=4 8704 B12R1.24 Cc1cccc(C(O)C=O)c1C Amb24341994 [0,2,0,0,0,0|1,0,0]=3 8705 B12R1.24 Cc1cccc([C@@H](C)NC)c1C Amb25036128 [0,2,0,0,0,0|2,0,0]=4 8706 B12R1.24 Cc1cccc([C@@H](C)NC)c1F Amb25764330 [0,2,0,0,0,0|2,0,0]=4 8707 B12R1.24 Cc1cccc([C@@H](C)NC)c1N Amb25066954 [0,2,0,0,0,0|2,0,0]=4 8708 B12R1.24 Cc1cccc([C@@H](C)NC)c1O Amb25189384 [0,2,0,0,0,0|2,0,0]=4 8709 B12R1.24 Cc1cccc([C@@H](N)C=C)c1Cl Amb25247683 [0,2,0,0,0,0|2,0,0]=4 8710 B12R1.24 Cc1cccc([C@@H](N)C=C)c1I Amb25809026 [0,2,0,0,0,0|2,0,0]=4 8711 B12R1.24 Cc1cccc([C@@H](N)C=C)c1O Amb25121498 [0,2,0,0,0,0|2,0,0]=4 8712 B12R1.24 Cc1cccc([C@H](C)NC)c1Br Amb24399363 [0,2,0,0,0,0|2,0,0]=4 8713 B12R1.24 Cc1cccc([C@H](C)NC)c1C Amb24487202 [0,2,0,0,0,0|2,0,0]=4 8714 B12R1.24 Cc1cccc([C@H](C)NC)c1O Amb25259202 [0,2,0,0,0,0|2,0,0]=4 8715 B12R1.24 Cc1cccc([C@H](N)C=C)c1F Amb25064741 [0,2,0,0,0,0|2,0,0]=4 8716 B12R1.24 Cc1cccc([C@H](N)C=C)c1I Amb24446557 [0,2,0,0,0,0|2,0,0]=4 8717 B12R1.24 NCC(c1cccc(c1C)C)C Amb17232454 [0,2,0,0,0,0|1,0,1]=4 8718 B12R1.24 NCC(c1cccc(c1C)Cl)C Amb17321741 [0,2,0,0,0,0|1,0,1]=4 8719 B12R1.24 O=C(C=O)c1cccc(Cl)c1Cl Amb25740996 [0,2,0,0,0,0|1,0,1]=4 8720 B12R1.24 OC(C=O)c1cccc(Br)c1F Amb25743176 [0,2,0,0,0,0|1,0,0]=3 8721 B12R1.24 OC(C=O)c1cccc(F)c1F Amb25141276 [0,2,0,0,0,0|1,0,0]=3 8722 B12R1.225 Brc1cccc(c1)C(=O)C(=O)C Amb17406920 [0,2,0,0,0,0|1,0,1]=4 8723 B12R1.225 CC(=C)C(N)c1cccc(Cl)c1 Amb25150098 [0,2,0,0,0,0|2,0,0]=4 8724 B12R1.225 CC(=C)C(N)c1cccc(F)c1 Amb25241405 [0,2,0,0,0,0|2,0,0]=4 8725 B12R1.225 CC(=C)C(N)c1cccc(I)c1 Amb24354516 [0,2,0,0,0,0|2,0,0]=4 8726 B12R1.225 CC(=C)C(O)c1cccc(I)c1 Amb24660150 [0,2,0,0,0,0|2,0,0]=4 8727 B12R1.225 CC(=N)N(C)c1cccc(F)c1 Amb24343123 [0,2,0,0,0,0|2,0,0]=4 8728 B12R1.225 CC(=O)C(Br)c1cc(Br)[n]cc1 Amb25717635 [0,2,0,0,0,0|2,0,0]=4 8729 B12R1.225 CC(=O)C(Br)c1cccc(F)c1 Amb24537119 [0,2,0,0,0,0|1,0,0]=3 8730 B12R1.225 CC(=O)C(Br)c1cccc(O)c1 Amb25253266 [0,2,0,0,0,0|1,0,0]=3 8731 B12R1.225 CC(=O)C(C)c1cccc(Br)c1 Amb22753504 [0,2,0,0,0,0|0,0,0]=2 8732 B12R1.225 CC(=O)C(C)c1cccc(Cl)c1 Amb22753502 [0,2,0,0,0,0|0,0,0]=2 8733 B12R1.225 CC(=O)C(C)c1cccc(F)c1 Amb24430167 [0,2,0,0,0,0|0,0,0]=2 8734 B12R1.225 CC(=O)C(C)c1cccc(I)c1 Amb22753511 [0,2,0,0,0,0|0,0,0]=2 8735 B12R1.225 CC(=O)C(C)c1cccc(O)c1 Amb24537925 [0,2,0,0,0,0|0,0,0]=2 8736 B12R1.225 CC(=O)C(Cl)c1cccc(F)c1 Amb24541089 [0,2,0,0,0,0|1,0,0]=3 8737 B12R1.225 CC(=O)C(N)c1c[n]cc(Br)c1 Amb25375793 [0,2,0,0,0,0|2,0,0]=4 8738 B12R1.225 CC(=O)C(N)c1cc(Br)cc[n]1 Amb25111783 [0,2,0,0,0,0|2,0,0]=4 8739 B12R1.225 CC(=O)C(N)c1cc(N)ccc1 Amb24504677 [0,2,0,0,0,0|1,0,0]=3 8740 B12R1.225 CC(=O)C(N)c1cc[n]c(O)c1 Amb24460340 [0,2,0,0,0,0|2,0,0]=4 8741 B12R1.225 CC(=O)C(N)c1cccc(Cl)[n]1 Amb25259198 [0,2,0,0,0,0|2,0,0]=4 8742 B12R1.225 CC(=O)C(N)c1cccc(F)[n]1 Amb25843808 [0,2,0,0,0,0|2,0,0]=4 8743 B12R1.225 CC(=O)C(N)c1cccc(F)c1 Amb25076722 [0,2,0,0,0,0|1,0,0]=3 8744 B12R1.225 CC(=O)C(N)c1cccc(N)[n]1 Amb25709600 [0,2,0,0,0,0|2,0,0]=4 8745 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [0,2,0,0,0,0|1,0,0]=3 8746 B12R1.225 CC(=O)C(c1cccc(c1)Br)Cl Amb17477760 [0,2,0,0,0,0|1,0,0]=3 8747 B12R1.225 CC(=O)C(c1cccc(c1)C)Cl Amb17477625 [0,2,0,0,0,0|1,0,0]=3 8748 B12R1.225 CC(=O)C(c1cccc(c1)Cl)Cl Amb17477763 [0,2,0,0,0,0|1,0,0]=3 8749 B12R1.225 CC(=O)C(c1cccc(c1)Cl)O Amb17611032 [0,2,0,0,0,0|1,0,0]=3 8750 B12R1.225 CC(=O)C(c1cccc(c1)O)O Amb17594122 [0,2,0,0,0,0|1,0,0]=3 8751 B12R1.225 CC(=O)N(C)c1cc[n]c(Cl)c1 Amb24096486 [0,2,0,0,0,0|2,0,0]=4 8752 B12R1.225 CC(=O)N(C)c1cccc(Br)[n]1 Amb19959594 [0,2,0,0,0,0|2,0,0]=4 8753 B12R1.225 CC(=O)N(C)c1cccc(F)c1 Amb24607920 [0,2,0,0,0,0|1,0,0]=3 8754 B12R1.225 CC(=O)N(C)c1cccc(O)c1 Amb24432229 [0,2,0,0,0,0|1,0,0]=3 8755 B12R1.225 CC(=O)N(N)c1cccc(Br)c1 Amb18070415 [0,2,0,0,0,0|2,0,0]=4 8756 B12R1.225 CC(=O)N(N)c1cccc(Cl)c1 Amb18564311 [0,2,0,0,0,0|2,0,0]=4 8757 B12R1.225 CC(=O)N(N)c1cccc(F)c1 Amb18563835 [0,2,0,0,0,0|2,0,0]=4 8758 B12R1.225 CC(=O)[C@H](O)c1cc(O)ccc1 Amb25855760 [0,2,0,0,0,0|1,0,0]=3 8759 B12R1.225 CC(=O)[C@H](O)c1cccc(Cl)c1 Amb25832686 [0,2,0,0,0,0|1,0,0]=3 8760 B12R1.225 CC(Br)C(C)c1cccc(Cl)c1 Amb25071912 [0,2,0,0,0,0|1,0,1]=4 8761 B12R1.225 CC(C(=O)Cl)c1cccc(Br)c1 Amb25150116 [0,2,0,0,0,0|0,0,0]=2 8762 B12R1.225 CC(C(=O)Cl)c1cccc(F)c1 Amb25125145 [0,2,0,0,0,0|0,0,0]=2 8763 B12R1.225 CC(C(C)N)c1cc(Br)ccc1 Amb18161825 [0,2,0,0,0,0|1,0,1]=4 8764 B12R1.225 CC(C(C)N)c1cc(F)ccc1 Amb18199472 [0,2,0,0,0,0|1,0,1]=4 8765 B12R1.225 CC(C(C)N)c1cc(I)ccc1 Amb24581687 [0,2,0,0,0,0|1,0,1]=4 8766 B12R1.225 CC(C(C)O)c1cc(Cl)ccc1 Amb24363903 [0,2,0,0,0,0|0,0,2]=4 8767 B12R1.225 CC(C(C)O)c1cc(O)ccc1 Amb25674463 [0,2,0,0,0,0|0,0,2]=4 8768 B12R1.225 CC(C(N)=O)c1cccc(Br)c1 Amb25333205 [0,2,0,0,0,0|0,0,0]=2 8769 B12R1.225 CC(C(N)=O)c1cccc(F)c1 Amb25760785 [0,2,0,0,0,0|0,0,0]=2 8770 B12R1.225 CC(C(N)=O)c1cccc(O)c1 Amb24743243 [0,2,0,0,0,0|0,0,0]=2 8771 B12R1.225 CC(C(O)=O)c1c[n]cc(F)c1 Amb18961443 [0,2,0,0,0,0|1,0,0]=3 8772 B12R1.225 CC(C(O)=O)c1cc[n]c(Cl)c1 Amb25322122 [0,2,0,0,0,0|1,0,0]=3 8773 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb22265668 [0,2,0,0,0,0|0,0,0]=2 8774 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb24061864 [0,2,0,0,0,0|0,0,0]=2 8775 B12R1.225 CC(C)C(C)c1cccc(Br)c1 Amb25091718 [0,2,0,0,0,0|1,0,1]=4 8776 B12R1.225 CC(c1cc(O)[n]c[n]1)C(O)=O Amb25234290 [0,2,0,0,0,0|2,0,0]=4 8777 B12R1.225 CC(c1cc(O)ccc1)C(O)=O Amb18646445 [0,2,0,0,0,0|0,0,0]=2 8778 B12R1.225 CN(C(=O)Cl)c1cccc(F)c1 Amb25735378 [0,2,0,0,0,0|1,0,0]=3 8779 B12R1.225 CN(C(N)=N)c1cccc(Cl)c1 Amb25217619 [0,2,0,0,0,0|2,0,0]=4 8780 B12R1.225 CN(C(N)=N)c1cccc(F)c1 Amb18177851 [0,2,0,0,0,0|2,0,0]=4 8781 B12R1.225 CN(C(N)=O)c1cccc(F)c1 Amb18788753 [0,2,0,0,0,0|1,0,0]=3 8782 B12R1.225 CN(C(N)=O)c1cccc(O)c1 Amb24356761 [0,2,0,0,0,0|1,0,0]=3 8783 B12R1.225 CN(C(N)=S)c1cccc(F)c1 Amb19045415 [0,2,0,0,0,0|1,1,0]=4 8784 B12R1.225 CN(C(c1cccc(c1)N)C)C Amb17090316 [0,2,0,0,0,0|2,0,0]=4 8785 B12R1.225 CN(C)C(C)c1cccc(Br)c1 Amb25257843 [0,2,0,0,0,0|2,0,0]=4 8786 B12R1.225 CN(C)C(C)c1cccc(F)c1 Amb25792131 [0,2,0,0,0,0|2,0,0]=4 8787 B12R1.225 CN(c1cc(N)ccc1)C(N)=O Amb18944888 [0,2,0,0,0,0|1,0,0]=3 8788 B12R1.225 CN(c1cccc(O)c1)S(C)=O Amb25177212 [0,2,0,0,0,0|2,0,0]=4 8789 B12R1.225 C[C@@H](C(O)=O)c1cccc(F)c1 Amb25108167 [0,2,0,0,0,0|0,0,0]=2 8790 B12R1.225 C[C@@H](C(O)=O)c1cccc(N)c1 Amb24182071 [0,2,0,0,0,0|0,0,0]=2 8791 B12R1.225 C[C@@H]([C@H](C)N)c1cc(O)ccc1 Amb25804222 [0,2,0,0,0,0|1,0,1]=4 8792 B12R1.225 C[C@H](C(N)=O)c1cccc(Cl)c1 Amb25730493 [0,2,0,0,0,0|0,0,0]=2 8793 B12R1.225 C[C@H](C(O)=O)c1cccc(Cl)c1 Amb25124032 [0,2,0,0,0,0|0,0,0]=2 8794 B12R1.225 C[C@H]([C@@H](C)O)c1cc(Cl)ccc1 Amb25803016 [0,2,0,0,0,0|0,0,2]=4 8795 B12R1.225 C[C@H](c1cc(O)ccc1)C(O)=O Amb24677825 [0,2,0,0,0,0|0,0,0]=2 8796 B12R1.225 Cc1[n]c(cc[n]1)C(C)C(O)=O Amb18827827 [0,2,0,0,0,0|2,0,0]=4 8797 B12R1.225 Cc1c[n]cc(c1)C(N)C(C)=O Amb25189486 [0,2,0,0,0,0|2,0,0]=4 8798 B12R1.225 Cc1cc([n]c[n]1)C(C)C(O)=O Amb25034886 [0,2,0,0,0,0|2,0,0]=4 8799 B12R1.225 Cc1cc([n]cc1)C(O)C(O)=O Amb20246917 [0,2,0,0,0,0|2,0,0]=4 8800 B12R1.225 Cc1cc([n]cc1)[C@@H](N)C(O)=O Amb24462152 [0,2,0,0,0,0|2,0,0]=4 8801 B12R1.225 Cc1cc(c[n]c1)C(N)C(O)=O Amb24488617 [0,2,0,0,0,0|2,0,0]=4 8802 B12R1.225 Cc1cc(c[n]c1)[C@H](N)C(O)=O Amb24485701 [0,2,0,0,0,0|2,0,0]=4 8803 B12R1.225 Cc1cc(cc[n]1)C(C)C(O)=O Amb24584555 [0,2,0,0,0,0|1,0,0]=3 8804 B12R1.225 Cc1cc(cc[n]1)C(N)C(O)=O Amb18827868 [0,2,0,0,0,0|2,0,0]=4 8805 B12R1.225 Cc1cc(ccc1)C(=O)C(O)=O Amb18645964 [0,2,0,0,0,0|1,0,1]=4 8806 B12R1.225 Cc1cc(ccc1)C(Br)C(O)=O Amb25136874 [0,2,0,0,0,0|1,0,0]=3 8807 B12R1.225 Cc1cc(ccc1)C(C)C(=O)Cl Amb25152463 [0,2,0,0,0,0|0,0,0]=2 8808 B12R1.225 Cc1cc(ccc1)C(Cl)C(N)=O Amb19074652 [0,2,0,0,0,0|1,0,0]=3 8809 B12R1.225 Cc1cc(ccc1)C(Cl)C(O)=O Amb18564302 [0,2,0,0,0,0|1,0,0]=3 8810 B12R1.225 Cc1cc(ccc1)C(F)C(N)=O Amb25117936 [0,2,0,0,0,0|1,0,0]=3 8811 B12R1.225 Cc1cc(ccc1)C(O)C(=O)Cl Amb24095714 [0,2,0,0,0,0|1,0,0]=3 8812 B12R1.225 Cc1cc(ccc1)C(O)C(N)=O Amb18800895 [0,2,0,0,0,0|1,0,0]=3 8813 B12R1.225 Cc1cc(ccc1)N(C)C(N)=N Amb18788211 [0,2,0,0,0,0|2,0,0]=4 8814 B12R1.225 Cc1cc(ccc1)N(C)C(N)=O Amb18788282 [0,2,0,0,0,0|1,0,0]=3 8815 B12R1.225 Cc1cc(ccc1)N(C)C(N)=S Amb18791183 [0,2,0,0,0,0|1,1,0]=4 8816 B12R1.225 Cc1cc(ccc1)N(N)C(N)=O Amb25152377 [0,2,0,0,0,0|2,0,0]=4 8817 B12R1.225 Cc1cc(ccc1)[C@@H](C)C(O)=O Amb25065324 [0,2,0,0,0,0|0,0,0]=2 8818 B12R1.225 Cc1cc(ccc1)[C@@H](F)C(N)=O Amb24399357 [0,2,0,0,0,0|1,0,0]=3 8819 B12R1.225 Cc1cc(ccc1)[C@@H](N)C(O)=O Amb24182070 [0,2,0,0,0,0|1,0,0]=3 8820 B12R1.225 Cc1cc(ccc1)[C@H]([NH3+])C([O-])=O Amb24068288 [0,2,0,0,0,0|1,0,0]=3 8821 B12R1.225 Cc1cc[n]c([n]1)C(C)C(O)=O Amb24732375 [0,2,0,0,0,0|2,0,0]=4 8822 B12R1.225 Cc1cc[n]c(c1)N(C)C(=O)Cl Amb25051804 [0,2,0,0,0,0|2,0,0]=4 8823 B12R1.225 Cc1cc[n]c(c1)N(C)C(C)=O Amb24096748 [0,2,0,0,0,0|2,0,0]=4 8824 B12R1.225 Cc1cccc([n]1)C(O)C(O)=O Amb20246916 [0,2,0,0,0,0|2,0,0]=4 8825 B12R1.225 Cc1cccc([n]1)N(C)C(N)=O Amb24525636 [0,2,0,0,0,0|2,0,0]=4 8826 B12R1.225 Cc1cccc(c1)C(=C)C(=O)O Amb17322165 [0,2,0,0,0,0|0,0,2]=4 8827 B12R1.225 Cc1cccc(c1)C(=O)C(=O)C Amb17400104 [0,2,0,0,0,0|1,0,1]=4 8828 B12R1.225 Cc1cccc(c1)C(C)C(C)Cl Amb25316621 [0,2,0,0,0,0|1,0,1]=4 8829 B12R1.225 Cc1cccc(c1)C(O)C(C)=O Amb25801127 [0,2,0,0,0,0|1,0,0]=3 8830 B12R1.225 Cc1cccc(c1)N(C)C(C)=O Amb24413264 [0,2,0,0,0,0|1,0,0]=3 8831 B12R1.225 Cc1cccc(c1)N(N)C(C)=O Amb18563637 [0,2,0,0,0,0|2,0,0]=4 8832 B12R1.225 Cc1cccc(c1)[C@@H](C)C(C)=O Amb25707020 [0,2,0,0,0,0|0,0,0]=2 8833 B12R1.225 Cc1cccc(c1)[C@@H](C)[C@@H](C)O Amb25357646 [0,2,0,0,0,0|0,0,2]=4 8834 B12R1.225 Cc1cccc(c1)[C@H](C)C(C)=O Amb25143362 [0,2,0,0,0,0|0,0,0]=2 8835 B12R1.225 Clc1cccc(c1)C(=C)C(=O)O Amb17322175 [0,2,0,0,0,0|0,0,2]=4 8836 B12R1.225 Clc1cccc(c1)C(=O)C(=O)C Amb17400962 [0,2,0,0,0,0|1,0,1]=4 8837 B12R1.225 Fc1cccc(c1)C(=C)C(=O)O Amb17322168 [0,2,0,0,0,0|0,0,2]=4 8838 B12R1.225 Fc1cccc(c1)C(=O)C(=O)C Amb17400193 [0,2,0,0,0,0|1,0,1]=4 8839 B12R1.225 NC(=N)C(O)c1cccc(Cl)c1 Amb25144070 [0,2,0,0,0,0|2,0,0]=4 8840 B12R1.225 NC(=O)C(=O)c1cc(Cl)ccc1 Amb24696640 [0,2,0,0,0,0|1,0,1]=4 8841 B12R1.225 NC(=O)C(Cl)c1cc(Cl)ccc1 Amb25089760 [0,2,0,0,0,0|1,0,0]=3 8842 B12R1.225 NC(=O)C(Cl)c1cccc(Br)c1 Amb22059075 [0,2,0,0,0,0|1,0,0]=3 8843 B12R1.225 NC(=O)C(Cl)c1cccc(F)c1 Amb18329808 [0,2,0,0,0,0|1,0,0]=3 8844 B12R1.225 NC(=O)C(N)c1cccc(Cl)c1 Amb22487627 [0,2,0,0,0,0|1,0,0]=3 8845 B12R1.225 NC(=O)C(N)c1cccc(F)c1 Amb18949669 [0,2,0,0,0,0|1,0,0]=3 8846 B12R1.225 NC(=O)C(O)c1cc(O)ccc1 Amb18805579 [0,2,0,0,0,0|1,0,0]=3 8847 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [0,2,0,0,0,0|1,0,0]=3 8848 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [0,2,0,0,0,0|1,0,0]=3 8849 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [0,2,0,0,0,0|1,0,0]=3 8850 B12R1.225 NC(=O)C(O)c1cccc(I)c1 Amb24554086 [0,2,0,0,0,0|1,0,0]=3 8851 B12R1.225 NC(=O)C(c1cccc(c1)Br)N Amb13951644 [0,2,0,0,0,0|1,0,0]=3 8852 B12R1.225 NC(=O)C(c1cccc(c1)C)N Amb17334618 [0,2,0,0,0,0|1,0,0]=3 8853 B12R1.225 NC(=O)C(c1cccc(c1)Cl)N Amb17335726 [0,2,0,0,0,0|1,0,0]=3 8854 B12R1.225 NC(=O)C(c1cccc(c1)O)N Amb17334666 [0,2,0,0,0,0|1,0,0]=3 8855 B12R1.225 NC(=O)[C@H](O)c1cccc(Cl)c1 Amb24443861 [0,2,0,0,0,0|1,0,0]=3 8856 B12R1.225 NC(=S)C(O)c1cccc(Cl)c1 Amb25041787 [0,2,0,0,0,0|1,1,0]=4 8857 B12R1.225 NC(C(=O)Cl)c1cc(Cl)ccc1 Amb25764846 [0,2,0,0,0,0|1,0,0]=3 8858 B12R1.225 NC(C(O)=O)c1c[n]cc(Cl)c1 Amb25149922 [0,2,0,0,0,0|2,0,0]=4 8859 B12R1.225 NC(C(O)=O)c1c[n]cc(F)c1 Amb25751298 [0,2,0,0,0,0|2,0,0]=4 8860 B12R1.225 NC(C(O)=O)c1cc[n]c(F)c1 Amb24599975 [0,2,0,0,0,0|2,0,0]=4 8861 B12R1.225 NC(C(O)=O)c1cccc(Br)[n]1 Amb25828657 [0,2,0,0,0,0|2,0,0]=4 8862 B12R1.225 NC(C(O)=O)c1cccc(Cl)[n]1 Amb24531519 [0,2,0,0,0,0|2,0,0]=4 8863 B12R1.225 NC(C(O)=O)c1cccc(F)[n]1 Amb24487122 [0,2,0,0,0,0|2,0,0]=4 8864 B12R1.225 NC(c1cc(O)cc[n]1)C(O)=O Amb24410976 [0,2,0,0,0,0|2,0,0]=4 8865 B12R1.225 NC(c1cc(O)ccc1)C(O)=O Amb21959949 [0,2,0,0,0,0|1,0,0]=3 8866 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Br)c1 Amb24532664 [0,2,0,0,0,0|2,0,0]=4 8867 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(Cl)c1 Amb25736271 [0,2,0,0,0,0|2,0,0]=4 8868 B12R1.225 N[C@@H](C(O)=O)c1c[n]cc(F)c1 Amb25299280 [0,2,0,0,0,0|2,0,0]=4 8869 B12R1.225 N[C@@H](C(O)=O)c1cc(Br)cc[n]1 Amb25270715 [0,2,0,0,0,0|2,0,0]=4 8870 B12R1.225 N[C@@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24417076 [0,2,0,0,0,0|2,0,0]=4 8871 B12R1.225 N[C@@H](C(O)=O)c1cc[n]c(Br)c1 Amb25082617 [0,2,0,0,0,0|2,0,0]=4 8872 B12R1.225 N[C@@H](C(O)=O)c1cccc(Br)c1 Amb25122869 [0,2,0,0,0,0|1,0,0]=3 8873 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)[n]1 Amb25046108 [0,2,0,0,0,0|2,0,0]=4 8874 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb22899025 [0,2,0,0,0,0|1,0,0]=3 8875 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb23399639 [0,2,0,0,0,0|1,0,0]=3 8876 B12R1.225 N[C@@H](C(O)=O)c1cccc(I)c1 Amb24342192 [0,2,0,0,0,0|1,0,0]=3 8877 B12R1.225 N[C@@H](C(O)=O)c1cccc(S)c1 Amb25361957 [0,2,0,0,0,0|1,0,0]=3 8878 B12R1.225 N[C@@H](c1cc(O)c[n]c1)C(O)=O Amb25724341 [0,2,0,0,0,0|2,0,0]=4 8879 B12R1.225 N[C@@H](c1cc(O)ccc1)C(O)=O Amb25294728 [0,2,0,0,0,0|1,0,0]=3 8880 B12R1.225 N[C@@H](c1cccc(O)[n]1)C(O)=O Amb24406730 [0,2,0,0,0,0|2,0,0]=4 8881 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Br)c1 Amb24461604 [0,2,0,0,0,0|2,0,0]=4 8882 B12R1.225 N[C@H](C(O)=O)c1c[n]cc(Cl)c1 Amb24583875 [0,2,0,0,0,0|2,0,0]=4 8883 B12R1.225 N[C@H](C(O)=O)c1cc(Br)cc[n]1 Amb24756460 [0,2,0,0,0,0|2,0,0]=4 8884 B12R1.225 N[C@H](C(O)=O)c1cc(Cl)cc[n]1 Amb24707713 [0,2,0,0,0,0|2,0,0]=4 8885 B12R1.225 N[C@H](C(O)=O)c1cc[n]c(Br)c1 Amb24695338 [0,2,0,0,0,0|2,0,0]=4 8886 B12R1.225 N[C@H](C(O)=O)c1cccc(Br)c1 Amb25150059 [0,2,0,0,0,0|1,0,0]=3 8887 B12R1.225 N[C@H](C(O)=O)c1cccc(Cl)c1 Amb19889600 [0,2,0,0,0,0|1,0,0]=3 8888 B12R1.225 Nc1c[n]cc(c1)C(N)C(O)=O Amb25152306 [0,2,0,0,0,0|2,0,0]=4 8889 B12R1.225 Nc1c[n]cc(c1)[C@@H](N)C(O)=O Amb24485432 [0,2,0,0,0,0|2,0,0]=4 8890 B12R1.225 Nc1c[n]cc(c1)[C@H](N)C(O)=O Amb24422889 [0,2,0,0,0,0|2,0,0]=4 8891 B12R1.225 Nc1cc(cc[n]1)[C@@H](N)C(O)=O Amb25667081 [0,2,0,0,0,0|2,0,0]=4 8892 B12R1.225 Nc1cc(cc[n]1)[C@H](N)C(O)=O Amb24452048 [0,2,0,0,0,0|2,0,0]=4 8893 B12R1.225 Nc1cc(ccc1)C(N)C(O)=O Amb18646483 [0,2,0,0,0,0|1,0,0]=3 8894 B12R1.225 Nc1cc(ccc1)C(O)C(O)=O Amb18646668 [0,2,0,0,0,0|1,0,0]=3 8895 B12R1.225 Nc1cc[n]c(c1)[C@@H](N)C(O)=O Amb24364737 [0,2,0,0,0,0|2,0,0]=4 8896 B12R1.225 Nc1cc[n]c(c1)[C@H](N)C(O)=O Amb25106778 [0,2,0,0,0,0|2,0,0]=4 8897 B12R1.225 Nc1cccc(c1)N(C(=O)C)C Amb10975760 [0,2,0,0,0,0|1,0,0]=3 8898 B12R1.225 O=C(Cl)C(F)c1cc(F)ccc1 Amb25689085 [0,2,0,0,0,0|1,0,0]=3 8899 B12R1.225 OC(=O)C(=O)c1cc(Br)ccc1 Amb18135081 [0,2,0,0,0,0|1,0,1]=4 8900 B12R1.225 OC(=O)C(=O)c1cc(Cl)ccc1 Amb18649007 [0,2,0,0,0,0|1,0,1]=4 8901 B12R1.225 OC(=O)C(=O)c1cc(F)ccc1 Amb18646830 [0,2,0,0,0,0|1,0,1]=4 8902 B12R1.225 OC(=O)C(Br)c1cc(Br)ccc1 Amb25053820 [0,2,0,0,0,0|1,0,0]=3 8903 B12R1.225 OC(=O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,2,0,0,0,0|1,0,0]=3 8904 B12R1.225 OC(=O)C(Cl)c1cc(Cl)ccc1 Amb18066588 [0,2,0,0,0,0|1,0,0]=3 8905 B12R1.225 OC(=O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,2,0,0,0,0|1,0,0]=3 8906 B12R1.225 OC(=O)C(O)c1c[n]cc(Br)c1 Amb25829664 [0,2,0,0,0,0|2,0,0]=4 8907 B12R1.225 OC(=O)C(O)c1c[n]cc(F)c1 Amb25131443 [0,2,0,0,0,0|2,0,0]=4 8908 B12R1.225 OC(=O)C(O)c1cccc(I)c1 Amb25223767 [0,2,0,0,0,0|1,0,0]=3 8909 B12R1.225 OC(=O)C(c1cccc(c1)Br)C Amb10602488 [0,2,0,0,0,0|0,0,0]=2 8910 B12R1.225 OC(=O)C(c1cccc(c1)Br)N Amb2431609 [0,2,0,0,0,0|1,0,0]=3 8911 B12R1.225 OC(=O)C(c1cccc(c1)C)C Amb17232469 [0,2,0,0,0,0|0,0,0]=2 8912 B12R1.225 OC(=O)C(c1cccc(c1)C)N Amb1840070 [0,2,0,0,0,0|1,0,0]=3 8913 B12R1.225 OC(=O)C(c1cccc(c1)Cl)N Amb1840776 [0,2,0,0,0,0|1,0,0]=3 8914 B12R1.225 OC(=O)C(c1cccc(c1)F)C Amb17232662 [0,2,0,0,0,0|0,0,0]=2 8915 B12R1.225 OC(=O)C(c1cccc(c1)F)N Amb2431604 [0,2,0,0,0,0|1,0,0]=3 8916 B12R1.225 OC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,2,0,0,0,0|1,0,0]=3 8917 B12R1.225 OC(=O)[C@@H](O)c1cccc(F)c1 Amb24429173 [0,2,0,0,0,0|1,0,0]=3 8918 B12R1.225 OC(=O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,2,0,0,0,0|1,0,0]=3 8919 B12R1.225 OC(=O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,2,0,0,0,0|1,0,0]=3 8920 B12R1.225 OC(C(=O)Cl)c1cccc(F)c1 Amb24068439 [0,2,0,0,0,0|1,0,0]=3 8921 B12R1.225 Oc1cccc(c1)C(S)C(O)=O Amb25295477 [0,2,0,0,0,0|1,0,0]=3 8922 B12R1.225 Oc1cccc(c1)[C@@H](O)C(O)=O Amb25036246 [0,2,0,0,0,0|1,0,0]=3 8923 B12R1.354 BrCC(c1cc(C)ccc1C)C Amb17247630 [0,2,0,0,0,0|1,0,1]=4 8924 B12R1.354 C=CC(N)c1cc(Br)ccc1Cl Amb24399740 [0,2,0,0,0,0|2,0,0]=4 8925 B12R1.354 C=CC(N)c1cc(Br)ccc1I Amb25701859 [0,2,0,0,0,0|2,0,0]=4 8926 B12R1.354 C=CC(N)c1cc(Br)ccc1N Amb24553980 [0,2,0,0,0,0|2,0,0]=4 8927 B12R1.354 C=CC(N)c1cc(Cl)ccc1Cl Amb25689593 [0,2,0,0,0,0|2,0,0]=4 8928 B12R1.354 C=CC(N)c1cc(Cl)ccc1I Amb25327233 [0,2,0,0,0,0|2,0,0]=4 8929 B12R1.354 C=CC(N)c1cc(F)ccc1Br Amb25035164 [0,2,0,0,0,0|2,0,0]=4 8930 B12R1.354 C=CC(N)c1cc(F)ccc1F Amb24488666 [0,2,0,0,0,0|2,0,0]=4 8931 B12R1.354 C=CC(N)c1cc(F)ccc1I Amb24543558 [0,2,0,0,0,0|2,0,0]=4 8932 B12R1.354 C=CC(N)c1cc(F)ccc1O Amb25187575 [0,2,0,0,0,0|2,0,0]=4 8933 B12R1.354 C=CC(N)c1cc(I)ccc1Br Amb25300369 [0,2,0,0,0,0|2,0,0]=4 8934 B12R1.354 C=CC(N)c1cc(I)ccc1Cl Amb25364961 [0,2,0,0,0,0|2,0,0]=4 8935 B12R1.354 C=CC(N)c1cc(N)ccc1F Amb25076669 [0,2,0,0,0,0|2,0,0]=4 8936 B12R1.354 C=CC(N)c1cc(N)ccc1N Amb25159637 [0,2,0,0,0,0|2,0,0]=4 8937 B12R1.354 C=CC(N)c1cc(N)ccc1O Amb24488559 [0,2,0,0,0,0|2,0,0]=4 8938 B12R1.354 C=CC(N)c1cc(O)ccc1Cl Amb25159580 [0,2,0,0,0,0|2,0,0]=4 8939 B12R1.354 C=CC(N)c1cc(O)ccc1F Amb24393334 [0,2,0,0,0,0|2,0,0]=4 8940 B12R1.354 C=CC(O)c1cc(Br)ccc1Br Amb25080471 [0,2,0,0,0,0|2,0,0]=4 8941 B12R1.354 C=CC(O)c1cc(Br)ccc1Cl Amb24674422 [0,2,0,0,0,0|2,0,0]=4 8942 B12R1.354 C=CC(O)c1cc(Br)ccc1F Amb24399375 [0,2,0,0,0,0|2,0,0]=4 8943 B12R1.354 C=CC(O)c1cc(Br)ccc1N Amb24523933 [0,2,0,0,0,0|2,0,0]=4 8944 B12R1.354 C=CC(O)c1cc(Cl)ccc1Br Amb24380046 [0,2,0,0,0,0|2,0,0]=4 8945 B12R1.354 C=CC(O)c1cc(F)ccc1Br Amb25229595 [0,2,0,0,0,0|2,0,0]=4 8946 B12R1.354 C=CC(O)c1cc(F)ccc1N Amb24523920 [0,2,0,0,0,0|2,0,0]=4 8947 B12R1.354 C=C[C@@H](N)c1cc(Br)ccc1F Amb24483775 [0,2,0,0,0,0|2,0,0]=4 8948 B12R1.354 C=C[C@@H](N)c1cc(Br)ccc1N Amb24364812 [0,2,0,0,0,0|2,0,0]=4 8949 B12R1.354 C=C[C@@H](N)c1cc(Cl)ccc1Cl Amb24533950 [0,2,0,0,0,0|2,0,0]=4 8950 B12R1.354 C=C[C@@H](N)c1cc(Cl)ccc1I Amb24428105 [0,2,0,0,0,0|2,0,0]=4 8951 B12R1.354 C=C[C@@H](N)c1cc(Cl)ccc1N Amb25127149 [0,2,0,0,0,0|2,0,0]=4 8952 B12R1.354 C=C[C@@H](N)c1cc(F)ccc1Cl Amb24488598 [0,2,0,0,0,0|2,0,0]=4 8953 B12R1.354 C=C[C@@H](N)c1cc(F)ccc1F Amb25694425 [0,2,0,0,0,0|2,0,0]=4 8954 B12R1.354 C=C[C@@H](N)c1cc(F)ccc1N Amb25760118 [0,2,0,0,0,0|2,0,0]=4 8955 B12R1.354 C=C[C@@H](N)c1cc(F)ccc1O Amb24761439 [0,2,0,0,0,0|2,0,0]=4 8956 B12R1.354 C=C[C@@H](N)c1cc(I)ccc1Cl Amb25826728 [0,2,0,0,0,0|2,0,0]=4 8957 B12R1.354 C=C[C@@H](N)c1cc(I)ccc1F Amb24483804 [0,2,0,0,0,0|2,0,0]=4 8958 B12R1.354 C=C[C@@H](N)c1cc(I)ccc1O Amb25148704 [0,2,0,0,0,0|2,0,0]=4 8959 B12R1.354 C=C[C@@H](N)c1cc(N)ccc1Cl Amb25072776 [0,2,0,0,0,0|2,0,0]=4 8960 B12R1.354 C=C[C@@H](N)c1cc(N)ccc1N Amb25844988 [0,2,0,0,0,0|2,0,0]=4 8961 B12R1.354 C=C[C@@H](N)c1cc(O)ccc1Br Amb24637925 [0,2,0,0,0,0|2,0,0]=4 8962 B12R1.354 C=C[C@@H](N)c1cc(O)ccc1F Amb24487319 [0,2,0,0,0,0|2,0,0]=4 8963 B12R1.354 C=C[C@@H](N)c1cc(O)ccc1O Amb24411496 [0,2,0,0,0,0|2,0,0]=4 8964 B12R1.354 C=C[C@@H](N)c1cc(S)ccc1O Amb24584179 [0,2,0,0,0,0|2,0,0]=4 8965 B12R1.354 C=C[C@@H](O)c1cc(Cl)ccc1Br Amb25214269 [0,2,0,0,0,0|2,0,0]=4 8966 B12R1.354 C=C[C@H](N)c1cc(Br)ccc1Br Amb25330823 [0,2,0,0,0,0|2,0,0]=4 8967 B12R1.354 C=C[C@H](N)c1cc(Br)ccc1F Amb25830670 [0,2,0,0,0,0|2,0,0]=4 8968 B12R1.354 C=C[C@H](N)c1cc(Br)ccc1O Amb25040928 [0,2,0,0,0,0|2,0,0]=4 8969 B12R1.354 C=C[C@H](N)c1cc(Cl)ccc1Cl Amb24382142 [0,2,0,0,0,0|2,0,0]=4 8970 B12R1.354 C=C[C@H](N)c1cc(Cl)ccc1I Amb25062023 [0,2,0,0,0,0|2,0,0]=4 8971 B12R1.354 C=C[C@H](N)c1cc(F)ccc1Br Amb24663190 [0,2,0,0,0,0|2,0,0]=4 8972 B12R1.354 C=C[C@H](N)c1cc(F)ccc1I Amb25118780 [0,2,0,0,0,0|2,0,0]=4 8973 B12R1.354 C=C[C@H](N)c1cc(F)ccc1N Amb25684149 [0,2,0,0,0,0|2,0,0]=4 8974 B12R1.354 C=C[C@H](N)c1cc(I)ccc1O Amb25148949 [0,2,0,0,0,0|2,0,0]=4 8975 B12R1.354 C=C[C@H](N)c1cc(N)ccc1N Amb24428621 [0,2,0,0,0,0|2,0,0]=4 8976 B12R1.354 C=C[C@H](N)c1cc(O)ccc1Br Amb25727025 [0,2,0,0,0,0|2,0,0]=4 8977 B12R1.354 C=C[C@H](N)c1cc(O)ccc1N Amb25708306 [0,2,0,0,0,0|2,0,0]=4 8978 B12R1.354 C=C[C@H](O)c1cc(O)ccc1Br Amb24410203 [0,2,0,0,0,0|2,0,0]=4 8979 B12R1.354 CC(C#N)c1cc(Br)ccc1F Amb25776954 [0,2,0,0,0,0|1,0,1]=4 8980 B12R1.354 CC(C#N)c1cc(Cl)ccc1Br Amb25823131 [0,2,0,0,0,0|1,0,1]=4 8981 B12R1.354 CC(C#N)c1cc(Cl)ccc1F Amb24487208 [0,2,0,0,0,0|1,0,1]=4 8982 B12R1.354 CC(C#N)c1cc(Cl)ccc1N Amb24380680 [0,2,0,0,0,0|1,0,1]=4 8983 B12R1.354 CC(C#N)c1cc(Cl)ccc1O Amb25345919 [0,2,0,0,0,0|1,0,1]=4 8984 B12R1.354 CC(C#N)c1cc(F)ccc1O Amb25712139 [0,2,0,0,0,0|1,0,1]=4 8985 B12R1.354 CC(C#N)c1cc(O)ccc1O Amb24736378 [0,2,0,0,0,0|1,0,1]=4 8986 B12R1.354 CC(C=C)c1cc(F)ccc1O Amb25838685 [0,2,0,0,0,0|1,0,0]=3 8987 B12R1.354 CC(C=O)c1cc(Br)ccc1F Amb25305214 [0,2,0,0,0,0|0,0,0]=2 8988 B12R1.354 CC(C=O)c1cc(Cl)ccc1F Amb24742741 [0,2,0,0,0,0|0,0,0]=2 8989 B12R1.354 CC(CBr)c1cc(Cl)ccc1Cl Amb25853159 [0,2,0,0,0,0|1,0,1]=4 8990 B12R1.354 CC(CCl)c1cc(Br)ccc1F Amb24454069 [0,2,0,0,0,0|1,0,1]=4 8991 B12R1.354 CC(CN)c1cc(Br)ccc1Cl Amb24385330 [0,2,0,0,0,0|1,0,1]=4 8992 B12R1.354 CC(CN)c1cc(Cl)ccc1Br Amb25793994 [0,2,0,0,0,0|1,0,1]=4 8993 B12R1.354 CC(CN)c1cc(Cl)ccc1F Amb18243885 [0,2,0,0,0,0|1,0,1]=4 8994 B12R1.354 CC(CN)c1cc(F)ccc1Cl Amb25822558 [0,2,0,0,0,0|1,0,1]=4 8995 B12R1.354 CC(CN)c1cc(O)ccc1Cl Amb25710884 [0,2,0,0,0,0|1,0,1]=4 8996 B12R1.354 CC(CN)c1cc(O)ccc1O Amb24406562 [0,2,0,0,0,0|1,0,1]=4 8997 B12R1.354 CC(CO)c1cc(Cl)ccc1F Amb25350926 [0,2,0,0,0,0|0,0,2]=4 8998 B12R1.354 CC(CO)c1cc(F)ccc1F Amb24448098 [0,2,0,0,0,0|0,0,2]=4 8999 B12R1.354 CC(NN)c1cc(Br)ccc1Br Amb24427175 [0,2,0,0,0,0|2,0,0]=4 9000 B12R1.354 CC(NN)c1cc(Cl)ccc1Br Amb25336999 [0,2,0,0,0,0|2,0,0]=4 9001 B12R1.354 CC(NN)c1cc(Cl)ccc1F Amb18863385 [0,2,0,0,0,0|2,0,0]=4 9002 B12R1.354 CC(NN)c1cc(Cl)ccc1I Amb24598762 [0,2,0,0,0,0|2,0,0]=4 9003 B12R1.354 CC(NN)c1cc(F)ccc1Br Amb25341040 [0,2,0,0,0,0|2,0,0]=4 9004 B12R1.354 CC(NN)c1cc(F)ccc1F Amb18224423 [0,2,0,0,0,0|2,0,0]=4 9005 B12R1.354 CC(NN)c1cc(F)ccc1O Amb25259216 [0,2,0,0,0,0|2,0,0]=4 9006 B12R1.354 CC(NN)c1cc(I)ccc1Br Amb24373280 [0,2,0,0,0,0|2,0,0]=4 9007 B12R1.354 CC(NO)c1cc(Br)ccc1O Amb25353749 [0,2,0,0,0,0|1,0,1]=4 9008 B12R1.354 CC(NO)c1cc(Cl)ccc1Cl Amb24346555 [0,2,0,0,0,0|1,0,1]=4 9009 B12R1.354 CC(NO)c1cc(O)ccc1O Amb24493162 [0,2,0,0,0,0|1,0,1]=4 9010 B12R1.354 CC(c1cc(Cl)ccc1Cl)CN Amb17321745 [0,2,0,0,0,0|1,0,1]=4 9011 B12R1.354 CC(c1cc(Cl)ccc1Cl)NC Amb1131264 [0,2,0,0,0,0|2,0,0]=4 9012 B12R1.354 CC(c1cc(F)ccc1F)C=O Amb17194479 [0,2,0,0,0,0|0,0,0]=2 9013 B12R1.354 CC(c1cc(F)ccc1F)NC Amb1115201 [0,2,0,0,0,0|2,0,0]=4 9014 B12R1.354 CC(c1cc(O)ccc1O)NC Amb1116164 [0,2,0,0,0,0|2,0,0]=4 9015 B12R1.354 CCC(C)c1cc(Br)ccc1O Amb24357504 [0,2,0,0,0,0|1,0,1]=4 9016 B12R1.354 CCC(C)c1cc(F)ccc1F Amb25276730 [0,2,0,0,0,0|1,0,1]=4 9017 B12R1.354 CCC(C)c1cc(S)ccc1O Amb25767898 [0,2,0,0,0,0|1,0,1]=4 9018 B12R1.354 CN(N=O)c1cc(O)ccc1O Amb22353567 [0,2,0,0,0,0|2,0,0]=4 9019 B12R1.354 CNC(C)c1cc(Br)ccc1Cl Amb24376886 [0,2,0,0,0,0|2,0,0]=4 9020 B12R1.354 CNC(C)c1cc(Br)ccc1O Amb18961161 [0,2,0,0,0,0|2,0,0]=4 9021 B12R1.354 CNC(C)c1cc(Cl)ccc1F Amb18893774 [0,2,0,0,0,0|2,0,0]=4 9022 B12R1.354 CNC(C)c1cc(Cl)ccc1I Amb25771640 [0,2,0,0,0,0|2,0,0]=4 9023 B12R1.354 CNC(C)c1cc(Cl)ccc1O Amb18958314 [0,2,0,0,0,0|2,0,0]=4 9024 B12R1.354 CNC(C)c1cc(F)ccc1Br Amb24394413 [0,2,0,0,0,0|2,0,0]=4 9025 B12R1.354 CNC(C)c1cc(F)ccc1I Amb24394999 [0,2,0,0,0,0|2,0,0]=4 9026 B12R1.354 CNC(C)c1cc(I)ccc1I Amb24411127 [0,2,0,0,0,0|2,0,0]=4 9027 B12R1.354 CNC(C)c1cc(I)ccc1N Amb24641416 [0,2,0,0,0,0|2,0,0]=4 9028 B12R1.354 CNC(C)c1cc(N)ccc1Cl Amb25223094 [0,2,0,0,0,0|2,0,0]=4 9029 B12R1.354 CNC(C)c1cc(N)ccc1F Amb25161221 [0,2,0,0,0,0|2,0,0]=4 9030 B12R1.354 CNC(C)c1cc(N)ccc1N Amb25299429 [0,2,0,0,0,0|2,0,0]=4 9031 B12R1.354 CNC(C)c1cc(O)ccc1Br Amb24419044 [0,2,0,0,0,0|2,0,0]=4 9032 B12R1.354 CNC(c1cc(C)ccc1C)C Amb1120067 [0,2,0,0,0,0|2,0,0]=4 9033 B12R1.354 CN[C@@H](C)c1cc(Br)ccc1N Amb25041014 [0,2,0,0,0,0|2,0,0]=4 9034 B12R1.354 CN[C@@H](C)c1cc(Br)ccc1O Amb25076150 [0,2,0,0,0,0|2,0,0]=4 9035 B12R1.354 CN[C@@H](C)c1cc(Cl)ccc1Br Amb25351537 [0,2,0,0,0,0|2,0,0]=4 9036 B12R1.354 CN[C@@H](C)c1cc(Cl)ccc1Cl Amb25778276 [0,2,0,0,0,0|2,0,0]=4 9037 B12R1.354 CN[C@@H](C)c1cc(Cl)ccc1I Amb24451088 [0,2,0,0,0,0|2,0,0]=4 9038 B12R1.354 CN[C@@H](C)c1cc(Cl)ccc1O Amb25309152 [0,2,0,0,0,0|2,0,0]=4 9039 B12R1.354 CN[C@@H](C)c1cc(F)ccc1F Amb24484130 [0,2,0,0,0,0|2,0,0]=4 9040 B12R1.354 CN[C@@H](C)c1cc(F)ccc1N Amb24484159 [0,2,0,0,0,0|2,0,0]=4 9041 B12R1.354 CN[C@@H](C)c1cc(F)ccc1O Amb24487203 [0,2,0,0,0,0|2,0,0]=4 9042 B12R1.354 CN[C@@H](C)c1cc(I)ccc1Br Amb25096278 [0,2,0,0,0,0|2,0,0]=4 9043 B12R1.354 CN[C@@H](C)c1cc(N)ccc1O Amb24485492 [0,2,0,0,0,0|2,0,0]=4 9044 B12R1.354 CN[C@@H](C)c1cc(O)ccc1O Amb25828889 [0,2,0,0,0,0|2,0,0]=4 9045 B12R1.354 CN[C@H](C)c1cc(Br)ccc1Cl Amb24728145 [0,2,0,0,0,0|2,0,0]=4 9046 B12R1.354 CN[C@H](C)c1cc(Br)ccc1I Amb25095899 [0,2,0,0,0,0|2,0,0]=4 9047 B12R1.354 CN[C@H](C)c1cc(Br)ccc1O Amb25704043 [0,2,0,0,0,0|2,0,0]=4 9048 B12R1.354 CN[C@H](C)c1cc(Cl)ccc1Cl Amb25315894 [0,2,0,0,0,0|2,0,0]=4 9049 B12R1.354 CN[C@H](C)c1cc(Cl)ccc1F Amb25317869 [0,2,0,0,0,0|2,0,0]=4 9050 B12R1.354 CN[C@H](C)c1cc(Cl)ccc1I Amb24382018 [0,2,0,0,0,0|2,0,0]=4 9051 B12R1.354 CN[C@H](C)c1cc(F)ccc1Cl Amb25821515 [0,2,0,0,0,0|2,0,0]=4 9052 B12R1.354 CN[C@H](C)c1cc(I)ccc1F Amb25667570 [0,2,0,0,0,0|2,0,0]=4 9053 B12R1.354 CN[C@H](C)c1cc(I)ccc1I Amb25067695 [0,2,0,0,0,0|2,0,0]=4 9054 B12R1.354 CN[C@H](C)c1cc(N)ccc1F Amb24470014 [0,2,0,0,0,0|2,0,0]=4 9055 B12R1.354 CN[C@H](C)c1cc(N)ccc1O Amb24484203 [0,2,0,0,0,0|2,0,0]=4 9056 B12R1.354 CN[C@H](C)c1cc(O)ccc1O Amb25798064 [0,2,0,0,0,0|2,0,0]=4 9057 B12R1.354 CSC(C)c1cc(Cl)ccc1O Amb25717759 [0,2,0,0,0,0|2,0,0]=4 9058 B12R1.354 CSC(C)c1cc(F)ccc1F Amb24355063 [0,2,0,0,0,0|2,0,0]=4 9059 B12R1.354 C[C@@H](NO)c1cc(Br)ccc1F Amb24436833 [0,2,0,0,0,0|1,0,1]=4 9060 B12R1.354 C[C@@H](NO)c1cc(Cl)ccc1O Amb25085129 [0,2,0,0,0,0|1,0,1]=4 9061 B12R1.354 C[C@@H](NO)c1cc(F)ccc1Cl Amb25720163 [0,2,0,0,0,0|1,0,1]=4 9062 B12R1.354 C[C@@H](NO)c1cc(F)ccc1F Amb24385021 [0,2,0,0,0,0|1,0,1]=4 9063 B12R1.354 C[C@@H](NO)c1cc(F)ccc1O Amb25721043 [0,2,0,0,0,0|1,0,1]=4 9064 B12R1.354 C[C@H](NO)c1cc(Br)ccc1F Amb24427194 [0,2,0,0,0,0|1,0,1]=4 9065 B12R1.354 C[C@H](NO)c1cc(F)ccc1O Amb25850095 [0,2,0,0,0,0|1,0,1]=4 9066 B12R1.354 Cc1cc(C(C)NC)c(C)cc1 Amb19374607 [0,2,0,0,0,0|2,0,0]=4 9067 B12R1.354 Cc1cc(C(F)C=O)c(C)cc1 Amb25131521 [0,2,0,0,0,0|1,0,0]=3 9068 B12R1.354 Cc1cc(C(N)C=C)c(Br)cc1 Amb25366934 [0,2,0,0,0,0|2,0,0]=4 9069 B12R1.354 Cc1cc(C(N)C=C)c(Cl)cc1 Amb25159665 [0,2,0,0,0,0|2,0,0]=4 9070 B12R1.354 Cc1cc(C(N)C=C)c(O)cc1 Amb25791660 [0,2,0,0,0,0|2,0,0]=4 9071 B12R1.354 Cc1cc(C(O)C=C)c(Br)cc1 Amb25355371 [0,2,0,0,0,0|2,0,0]=4 9072 B12R1.354 Cc1cc(C(O)C=C)c(C)cc1 Amb25778129 [0,2,0,0,0,0|2,0,0]=4 9073 B12R1.354 Cc1cc(C(O)C=C)c(F)cc1 Amb25355433 [0,2,0,0,0,0|2,0,0]=4 9074 B12R1.354 Cc1cc(C(O)C=O)c(C)cc1 Amb25150122 [0,2,0,0,0,0|1,0,0]=3 9075 B12R1.354 Cc1cc([C@@H](N)C=C)c(Br)cc1 Amb25734761 [0,2,0,0,0,0|2,0,0]=4 9076 B12R1.354 Cc1cc([C@@H](N)C=C)c(C)cc1 Amb25113486 [0,2,0,0,0,0|2,0,0]=4 9077 B12R1.354 Cc1cc([C@@H](N)C=C)c(F)cc1 Amb24745658 [0,2,0,0,0,0|2,0,0]=4 9078 B12R1.354 Cc1cc([C@H](C)CO)c(C)cc1 Amb25369413 [0,2,0,0,0,0|0,0,2]=4 9079 B12R1.354 Cc1cc([C@H](C)NC)c(C)cc1 Amb24738339 [0,2,0,0,0,0|2,0,0]=4 9080 B12R1.354 Cc1cc([C@H](C)NO)c(C)cc1 Amb24730879 [0,2,0,0,0,0|1,0,1]=4 9081 B12R1.354 Cc1cc([C@H](N)C=C)c(Br)cc1 Amb25712380 [0,2,0,0,0,0|2,0,0]=4 9082 B12R1.354 Cc1cc([C@H](N)C=C)c(I)cc1 Amb25669663 [0,2,0,0,0,0|2,0,0]=4 9083 B12R1.354 Cc1ccc(Br)cc1C(=O)C=O Amb25761177 [0,2,0,0,0,0|1,0,1]=4 9084 B12R1.354 Cc1ccc(Br)cc1C(C)NC Amb25844996 [0,2,0,0,0,0|2,0,0]=4 9085 B12R1.354 Cc1ccc(Br)cc1C(C)NN Amb25064200 [0,2,0,0,0,0|2,0,0]=4 9086 B12R1.354 Cc1ccc(Br)cc1C(O)C=C Amb24525550 [0,2,0,0,0,0|2,0,0]=4 9087 B12R1.354 Cc1ccc(Br)cc1[C@@H](C)NC Amb24696548 [0,2,0,0,0,0|2,0,0]=4 9088 B12R1.354 Cc1ccc(Br)cc1[C@@H](N)C=C Amb24666546 [0,2,0,0,0,0|2,0,0]=4 9089 B12R1.354 Cc1ccc(Cl)cc1C(C)C#N Amb25188303 [0,2,0,0,0,0|1,0,1]=4 9090 B12R1.354 Cc1ccc(Cl)cc1C(C)NC Amb18863077 [0,2,0,0,0,0|2,0,0]=4 9091 B12R1.354 Cc1ccc(Cl)cc1C(C)NN Amb25715177 [0,2,0,0,0,0|2,0,0]=4 9092 B12R1.354 Cc1ccc(Cl)cc1C(N)C=C Amb25113887 [0,2,0,0,0,0|2,0,0]=4 9093 B12R1.354 Cc1ccc(Cl)cc1[C@@H](C)NC Amb24726061 [0,2,0,0,0,0|2,0,0]=4 9094 B12R1.354 Cc1ccc(F)c(c1)C(=O)C=O Amb18646443 [0,2,0,0,0,0|1,0,1]=4 9095 B12R1.354 Cc1ccc(F)c(c1)C(C)CN Amb18908716 [0,2,0,0,0,0|1,0,1]=4 9096 B12R1.354 Cc1ccc(F)c(c1)C(C)NC Amb18964749 [0,2,0,0,0,0|2,0,0]=4 9097 B12R1.354 Cc1ccc(F)c(c1)C(C)NN Amb24401975 [0,2,0,0,0,0|2,0,0]=4 9098 B12R1.354 Cc1ccc(F)c(c1)[C@@H](C)NC Amb25751437 [0,2,0,0,0,0|2,0,0]=4 9099 B12R1.354 Cc1ccc(F)cc1C(C)CN Amb18251914 [0,2,0,0,0,0|1,0,1]=4 9100 B12R1.354 Cc1ccc(F)cc1C(C)NC Amb18964431 [0,2,0,0,0,0|2,0,0]=4 9101 B12R1.354 Cc1ccc(F)cc1C(N)C=C Amb25185322 [0,2,0,0,0,0|2,0,0]=4 9102 B12R1.354 Cc1ccc(F)cc1C(O)C=C Amb25787610 [0,2,0,0,0,0|2,0,0]=4 9103 B12R1.354 Cc1ccc(F)cc1[C@@H](C)NO Amb25035096 [0,2,0,0,0,0|1,0,1]=4 9104 B12R1.354 Cc1ccc(F)cc1[C@@H](N)C=C Amb24426866 [0,2,0,0,0,0|2,0,0]=4 9105 B12R1.354 Cc1ccc(F)cc1[C@H](N)C=C Amb24351583 [0,2,0,0,0,0|2,0,0]=4 9106 B12R1.354 Cc1ccc(I)c(c1)[C@H](C)NC Amb25305671 [0,2,0,0,0,0|2,0,0]=4 9107 B12R1.354 Cc1ccc(I)cc1[C@@H](N)C=C Amb25132958 [0,2,0,0,0,0|2,0,0]=4 9108 B12R1.354 Cc1ccc(N)c(c1)C(C)CC Amb24739754 [0,2,0,0,0,0|1,0,1]=4 9109 B12R1.354 Cc1ccc(N)c(c1)C(C)NC Amb25095787 [0,2,0,0,0,0|2,0,0]=4 9110 B12R1.354 Cc1ccc(N)c(c1)C(N)C=C Amb25698317 [0,2,0,0,0,0|2,0,0]=4 9111 B12R1.354 Cc1ccc(N)cc1C(C)CN Amb25247285 [0,2,0,0,0,0|1,0,1]=4 9112 B12R1.354 Cc1ccc(N)cc1[C@H](N)C=C Amb24394956 [0,2,0,0,0,0|2,0,0]=4 9113 B12R1.354 Cc1ccc(O)c(c1)C(C)C#N Amb25182952 [0,2,0,0,0,0|1,0,1]=4 9114 B12R1.354 Cc1ccc(O)c(c1)C(C)C=C Amb24721745 [0,2,0,0,0,0|1,0,0]=3 9115 B12R1.354 Cc1ccc(O)c(c1)C(C)CC Amb24497314 [0,2,0,0,0,0|1,0,1]=4 9116 B12R1.354 Cc1ccc(O)c(c1)C(C)NO Amb24726021 [0,2,0,0,0,0|1,0,1]=4 9117 B12R1.354 Cc1ccc(O)c(c1)C(C)SC Amb25128914 [0,2,0,0,0,0|2,0,0]=4 9118 B12R1.354 Cc1ccc(O)cc1C(C)CC Amb25322786 [0,2,0,0,0,0|1,0,1]=4 9119 B12R1.354 ClCC(c1cc(C)ccc1C)C Amb17233973 [0,2,0,0,0,0|1,0,1]=4 9120 B12R1.354 Fc1ccc(cc1C(=O)C=O)F Amb10838620 [0,2,0,0,0,0|1,0,1]=4 9121 B12R1.354 NCC(c1cc(Cl)ccc1C)C Amb17321742 [0,2,0,0,0,0|1,0,1]=4 9122 B12R1.354 NOC(c1cc(C)ccc1C)C Amb17089191 [0,2,0,0,0,0|2,0,0]=4 9123 B12R1.354 O=C(C=O)c1cc(Br)ccc1F Amb25121361 [0,2,0,0,0,0|1,0,1]=4 9124 B12R1.354 O=C(C=O)c1cc(Cl)ccc1Cl Amb24359455 [0,2,0,0,0,0|1,0,1]=4 9125 B12R1.354 O=C(C=O)c1cc(F)ccc1F Amb18647240 [0,2,0,0,0,0|1,0,1]=4 9126 B12R1.354 O=CC(F)c1cc(F)ccc1F Amb25809292 [0,2,0,0,0,0|1,0,0]=3 9127 B12R1.354 O=CC(c1cc(C)ccc1C)C Amb17138539 [0,2,0,0,0,0|0,0,0]=2 9128 B12R1.354 OC(C=O)c1cc(Cl)ccc1Cl Amb25823383 [0,2,0,0,0,0|1,0,0]=3 9129 B12R1.354 OC(C=O)c1cc(F)ccc1F Amb25802177 [0,2,0,0,0,0|1,0,0]=3 9130 B12R1.354 OCC(c1cc(C)ccc1C)C Amb17232493 [0,2,0,0,0,0|0,0,2]=4 9131 B12R1.354 ONC(c1cc(C)ccc1C)C Amb17089208 [0,2,0,0,0,0|1,0,1]=4 9132 B12R1.354 Oc1ccc(Cl)c(c1)C(=O)C=O Amb18649005 [0,2,0,0,0,0|1,0,1]=4 9133 B12R1.358 C=CC(N)c1cc(Br)cc(Br)c1 Amb25669657 [0,2,0,0,0,0|2,0,0]=4 9134 B12R1.358 C=CC(N)c1cc(Cl)cc(Br)c1 Amb25687316 [0,2,0,0,0,0|2,0,0]=4 9135 B12R1.358 C=CC(N)c1cc(F)cc(Br)c1 Amb24696588 [0,2,0,0,0,0|2,0,0]=4 9136 B12R1.358 C=CC(N)c1cc(N)cc(F)c1 Amb24743294 [0,2,0,0,0,0|2,0,0]=4 9137 B12R1.358 C=CC(O)c1cc(Br)cc(Br)c1 Amb25851740 [0,2,0,0,0,0|2,0,0]=4 9138 B12R1.358 C=CC(O)c1cc(Cl)cc(Cl)c1 Amb25853590 [0,2,0,0,0,0|2,0,0]=4 9139 B12R1.358 C=CC(O)c1cc(F)cc(Br)c1 Amb25057890 [0,2,0,0,0,0|2,0,0]=4 9140 B12R1.358 C=C[C@@H](N)c1cc(Br)cc(Br)c1 Amb25835274 [0,2,0,0,0,0|2,0,0]=4 9141 B12R1.358 C=C[C@@H](N)c1cc(F)cc(Cl)c1 Amb25149858 [0,2,0,0,0,0|2,0,0]=4 9142 B12R1.358 C=C[C@@H](N)c1cc(O)cc(F)c1 Amb25806977 [0,2,0,0,0,0|2,0,0]=4 9143 B12R1.358 C=C[C@@H](N)c1cc(O)cc(O)c1 Amb25072773 [0,2,0,0,0,0|2,0,0]=4 9144 B12R1.358 C=C[C@H](N)c1cc(F)cc(Cl)c1 Amb25131713 [0,2,0,0,0,0|2,0,0]=4 9145 B12R1.358 CC(C#N)c1cc(Cl)cc(Cl)c1 Amb25829986 [0,2,0,0,0,0|1,0,1]=4 9146 B12R1.358 CC(C=O)c1cc(C)cc(C)c1 Amb24690725 [0,2,0,0,0,0|0,0,0]=2 9147 B12R1.358 CC(C=O)c1cc(Cl)cc(Cl)c1 Amb25300737 [0,2,0,0,0,0|0,0,0]=2 9148 B12R1.358 CC(CBr)c1cc(C)cc(C)c1 Amb25198667 [0,2,0,0,0,0|1,0,1]=4 9149 B12R1.358 CC(CCl)c1cc(C)cc(C)c1 Amb25674411 [0,2,0,0,0,0|1,0,1]=4 9150 B12R1.358 CC(CN)c1cc(Cl)cc(Br)c1 Amb25722979 [0,2,0,0,0,0|1,0,1]=4 9151 B12R1.358 CC(CN)c1cc(F)cc(Cl)c1 Amb24423440 [0,2,0,0,0,0|1,0,1]=4 9152 B12R1.358 CC(CN)c1cc(O)cc(O)c1 Amb25373902 [0,2,0,0,0,0|1,0,1]=4 9153 B12R1.358 CC(CO)c1cc(Cl)cc(Cl)c1 Amb25249362 [0,2,0,0,0,0|0,0,2]=4 9154 B12R1.358 CC(NN)c1cc(C)cc(C)c1 Amb24716701 [0,2,0,0,0,0|2,0,0]=4 9155 B12R1.358 CC(NN)c1cc(Cl)cc(Br)c1 Amb24419712 [0,2,0,0,0,0|2,0,0]=4 9156 B12R1.358 CC(NN)c1cc(F)cc(F)c1 Amb25789968 [0,2,0,0,0,0|2,0,0]=4 9157 B12R1.358 CC(NO)c1cc(Cl)cc(Cl)c1 Amb25672183 [0,2,0,0,0,0|1,0,1]=4 9158 B12R1.358 CCC(C)c1cc(C)cc(C)c1 Amb24558918 [0,2,0,0,0,0|1,0,1]=4 9159 B12R1.358 CCC(C)c1cc(O)cc(O)c1 Amb18646526 [0,2,0,0,0,0|1,0,1]=4 9160 B12R1.358 CNC(C)c1cc(C)cc(C)c1 Amb18950400 [0,2,0,0,0,0|2,0,0]=4 9161 B12R1.358 CNC(C)c1cc(Cl)cc(Br)c1 Amb24370369 [0,2,0,0,0,0|2,0,0]=4 9162 B12R1.358 CNC(C)c1cc(Cl)cc(Cl)c1 Amb18864205 [0,2,0,0,0,0|2,0,0]=4 9163 B12R1.358 CNC(C)c1cc(Cl)cc(I)c1 Amb24712399 [0,2,0,0,0,0|2,0,0]=4 9164 B12R1.358 CNC(C)c1cc(F)cc(F)c1 Amb18955938 [0,2,0,0,0,0|2,0,0]=4 9165 B12R1.358 CN[C@@H](C)c1cc(F)cc(Br)c1 Amb24675822 [0,2,0,0,0,0|2,0,0]=4 9166 B12R1.358 CN[C@@H](C)c1cc(F)cc(F)c1 Amb25064277 [0,2,0,0,0,0|2,0,0]=4 9167 B12R1.358 CN[C@@H](C)c1cc(O)cc(O)c1 Amb24372155 [0,2,0,0,0,0|2,0,0]=4 9168 B12R1.358 CN[C@H](C)c1cc(C)cc(C)c1 Amb25315049 [0,2,0,0,0,0|2,0,0]=4 9169 B12R1.358 CN[C@H](C)c1cc(Cl)cc(I)c1 Amb25123410 [0,2,0,0,0,0|2,0,0]=4 9170 B12R1.358 CN[C@H](C)c1cc(F)cc(Br)c1 Amb24532662 [0,2,0,0,0,0|2,0,0]=4 9171 B12R1.358 CN[C@H](C)c1cc(O)cc(F)c1 Amb24635589 [0,2,0,0,0,0|2,0,0]=4 9172 B12R1.358 C[C@@H](NO)c1cc(F)cc(F)c1 Amb24404988 [0,2,0,0,0,0|1,0,1]=4 9173 B12R1.358 C[C@H](CO)c1cc(C)cc(C)c1 Amb24363662 [0,2,0,0,0,0|0,0,2]=4 9174 B12R1.358 C[C@H](NO)c1cc(Cl)cc(Cl)c1 Amb24604451 [0,2,0,0,0,0|1,0,1]=4 9175 B12R1.358 Cc1cc(Br)cc(c1)C(C)CN Amb25036221 [0,2,0,0,0,0|1,0,1]=4 9176 B12R1.358 Cc1cc(Cl)cc(c1)C(C)C#N Amb25820358 [0,2,0,0,0,0|1,0,1]=4 9177 B12R1.358 Cc1cc(N)cc(c1)C(N)C=C Amb25159636 [0,2,0,0,0,0|2,0,0]=4 9178 B12R1.358 Cc1cc(O)cc(c1)C(C)C#N Amb24708110 [0,2,0,0,0,0|1,0,1]=4 9179 B12R1.358 Cc1cc(O)cc(c1)C(C)CC Amb24342061 [0,2,0,0,0,0|1,0,1]=4 9180 B12R1.358 Cc1cc(O)cc(c1)C(C)CN Amb24385329 [0,2,0,0,0,0|1,0,1]=4 9181 B12R1.358 Cc1cc(cc(Br)c1)C(C)NC Amb25049949 [0,2,0,0,0,0|2,0,0]=4 9182 B12R1.358 Cc1cc(cc(Br)c1)C(N)C=C Amb24539973 [0,2,0,0,0,0|2,0,0]=4 9183 B12R1.358 Cc1cc(cc(Br)c1)C(O)C=C Amb24525551 [0,2,0,0,0,0|2,0,0]=4 9184 B12R1.358 Cc1cc(cc(Br)c1)[C@H](N)C=C Amb24399368 [0,2,0,0,0,0|2,0,0]=4 9185 B12R1.358 Cc1cc(cc(C)c1)C(=O)C=O Amb22059618 [0,2,0,0,0,0|1,0,1]=4 9186 B12R1.358 Cc1cc(cc(C)c1)C(=O)C=O Amb24053010 [0,2,0,0,0,0|1,0,1]=4 9187 B12R1.358 Cc1cc(cc(C)c1)C(O)C=C Amb24382070 [0,2,0,0,0,0|2,0,0]=4 9188 B12R1.358 Cc1cc(cc(Cl)c1)C(C)NC Amb25276454 [0,2,0,0,0,0|2,0,0]=4 9189 B12R1.358 Cc1cc(cc(Cl)c1)C(N)C=C Amb25247202 [0,2,0,0,0,0|2,0,0]=4 9190 B12R1.358 Cc1cc(cc(Cl)c1)C(O)C=C Amb24706041 [0,2,0,0,0,0|2,0,0]=4 9191 B12R1.358 Cc1cc(cc(Cl)c1)[C@H](C)NC Amb24406596 [0,2,0,0,0,0|2,0,0]=4 9192 B12R1.358 Cc1cc(cc(Cl)c1)[C@H](N)C=C Amb24377661 [0,2,0,0,0,0|2,0,0]=4 9193 B12R1.358 Cc1cc(cc(F)c1)C(C)NC Amb24702861 [0,2,0,0,0,0|2,0,0]=4 9194 B12R1.358 Cc1cc(cc(F)c1)C(N)C=C Amb25757829 [0,2,0,0,0,0|2,0,0]=4 9195 B12R1.358 Cc1cc(cc(F)c1)C(O)C=C Amb24525552 [0,2,0,0,0,0|2,0,0]=4 9196 B12R1.358 Cc1cc(cc(F)c1)[C@@H](N)C=C Amb25709549 [0,2,0,0,0,0|2,0,0]=4 9197 B12R1.358 Cc1cc(cc(F)c1)[C@H](C)NC Amb25794027 [0,2,0,0,0,0|2,0,0]=4 9198 B12R1.358 Cc1cc(cc(O)c1)[C@@H](N)C=C Amb24677520 [0,2,0,0,0,0|2,0,0]=4 9199 B12R1.358 NCC(c1cc(C)cc(c1)C)C Amb17232451 [0,2,0,0,0,0|1,0,1]=4 9200 B12R1.358 NCC(c1cc(Cl)cc(c1)Cl)C Amb17321746 [0,2,0,0,0,0|1,0,1]=4 9201 B12R1.358 NCC(c1cc(F)cc(c1)F)C Amb17232801 [0,2,0,0,0,0|1,0,1]=4 9202 B12R1.358 O=C(C=O)c1cc(Cl)cc(Cl)c1 Amb24053013 [0,2,0,0,0,0|1,0,1]=4 9203 B12R1.358 OC(C=O)c1cc(O)cc(O)c1 Amb25667641 [0,2,0,0,0,0|1,0,0]=3 9204 B12R1.358 OC(C=S)c1cc(Cl)cc(Cl)c1 Amb22167504 [0,2,0,0,0,0|1,1,0]=4 9205 B12R1.435 BrCC(c1cccc(c1)OC)C Amb17248429 [0,2,0,0,0,0|1,0,1]=4 9206 B12R1.435 C=CC(N)c1cc(ccc1)C#C Amb25159354 [0,2,0,0,0,0|2,0,0]=4 9207 B12R1.435 C=CC(N)c1cc(ccc1)C#N Amb24487114 [0,2,0,0,0,0|2,0,0]=4 9208 B12R1.435 C=CC(N)c1cc(ccc1)C=C Amb24426740 [0,2,0,0,0,0|2,0,0]=4 9209 B12R1.435 C=CC(N)c1cccc(CO)c1 Amb25368279 [0,2,0,0,0,0|2,0,0]=4 9210 B12R1.435 C=CC(O)c1cccc(C=O)c1 Amb25271015 [0,2,0,0,0,0|2,0,0]=4 9211 B12R1.435 CC(C#N)c1cccc(CO)c1 Amb25356095 [0,2,0,0,0,0|1,0,1]=4 9212 B12R1.435 CC(CC)c1cc(CC)ccc1 Amb24086012 [0,2,0,0,0,0|1,0,1]=4 9213 B12R1.435 CC(NN)c1cc(ccc1)C#N Amb25233867 [0,2,0,0,0,0|2,0,0]=4 9214 B12R1.435 CCC(C)c1cc(ccc1)OC Amb25269697 [0,2,0,0,0,0|1,0,1]=4 9215 B12R1.435 CCC(C)c1cccc(CCl)c1 Amb25061322 [0,2,0,0,0,0|1,0,1]=4 9216 B12R1.435 CCc1cc(ccc1)C(C)CN Amb25335915 [0,2,0,0,0,0|1,0,1]=4 9217 B12R1.435 CCc1cc(ccc1)[C@@H](N)C=C Amb24763788 [0,2,0,0,0,0|2,0,0]=4 9218 B12R1.435 CCc1cc(ccc1)[C@H](C)NC Amb24484161 [0,2,0,0,0,0|2,0,0]=4 9219 B12R1.435 CCc1cc(ccc1)[C@H](N)C=C Amb25702297 [0,2,0,0,0,0|2,0,0]=4 9220 B12R1.435 CNC(C)c1cc(ccc1)SC Amb25151113 [0,2,0,0,0,0|2,0,0]=4 9221 B12R1.435 CNC(C)c1cccc(C=C)c1 Amb24729645 [0,2,0,0,0,0|2,0,0]=4 9222 B12R1.435 CNC(C)c1cccc(CF)c1 Amb25202395 [0,2,0,0,0,0|2,0,0]=4 9223 B12R1.435 CNC(c1cccc(c1)OC)C Amb1115403 [0,2,0,0,0,0|2,0,0]=4 9224 B12R1.435 CN[C@@H](C)c1cc(ccc1)C#N Amb24668643 [0,2,0,0,0,0|2,0,0]=4 9225 B12R1.435 CN[C@@H](C)c1cccc(C=C)c1 Amb25189383 [0,2,0,0,0,0|2,0,0]=4 9226 B12R1.435 CN[C@H](C)c1cc(ccc1)C#N Amb24382420 [0,2,0,0,0,0|2,0,0]=4 9227 B12R1.435 CN[C@H](C)c1cc(ccc1)SC Amb25335284 [0,2,0,0,0,0|2,0,0]=4 9228 B12R1.435 CN[C@H](C)c1cccc(C=C)c1 Amb25751436 [0,2,0,0,0,0|2,0,0]=4 9229 B12R1.435 CN[C@H](C)c1cccc(CO)c1 Amb25074073 [0,2,0,0,0,0|2,0,0]=4 9230 B12R1.435 CNc1cc(ccc1)C(C)OC Amb25787977 [0,2,0,0,0,0|2,0,0]=4 9231 B12R1.435 COc1cc(ccc1)C(C)NO Amb25336010 [0,2,0,0,0,0|1,0,1]=4 9232 B12R1.435 COc1cc(ccc1)C(C)SC Amb25271177 [0,2,0,0,0,0|2,0,0]=4 9233 B12R1.435 COc1cc(ccc1)C(O)C=O Amb24488539 [0,2,0,0,0,0|1,0,0]=3 9234 B12R1.435 COc1cc(ccc1)N(C)C=O Amb25150900 [0,2,0,0,0,0|1,0,0]=3 9235 B12R1.435 COc1cc(ccc1)[C@@H](C)CO Amb25129765 [0,2,0,0,0,0|0,0,2]=4 9236 B12R1.435 COc1cc(ccc1)[C@@H](C)NO Amb25710531 [0,2,0,0,0,0|1,0,1]=4 9237 B12R1.435 COc1cc(ccc1)[C@H](N)C=C Amb24401482 [0,2,0,0,0,0|2,0,0]=4 9238 B12R1.435 CSC(C)c1cc(ccc1)C#N Amb25160289 [0,2,0,0,0,0|2,0,0]=4 9239 B12R1.435 CSc1cc(ccc1)[C@@H](N)C=C Amb25724339 [0,2,0,0,0,0|2,0,0]=4 9240 B12R1.435 ClCC(c1cccc(c1)OC)C Amb17234160 [0,2,0,0,0,0|1,0,1]=4 9241 B12R1.435 O=CC(=O)c1cccc(c1)OC Amb10067953 [0,2,0,0,0,0|1,0,1]=4 9242 B12R1.435 O=CC(c1cccc(c1)OC)C Amb17232468 [0,2,0,0,0,0|0,0,0]=2 9243 B12R1.435 OCC(c1cccc(c1)OC)C Amb17232594 [0,2,0,0,0,0|0,0,2]=4 9244 B12R1.124 CC(=C)C(O)c1ccccc1Cl Amb25333923 [0,2,0,0,0,0|2,0,0]=4 9245 B12R1.124 CC(=C)C(O)c1ccccc1F Amb25136591 [0,2,0,0,0,0|2,0,0]=4 9246 B12R1.124 CC(=C)C(O)c1ccccc1O Amb24497319 [0,2,0,0,0,0|2,0,0]=4 9247 B12R1.124 CC(=O)C(=C)c1ccccc1O Amb24408394 [0,2,0,0,0,0|0,0,2]=4 9248 B12R1.124 CC(=O)C(=O)c1ccccc1Br Amb17406919 [0,2,0,0,0,0|1,0,1]=4 9249 B12R1.124 CC(=O)C(=O)c1ccccc1C Amb17400103 [0,2,0,0,0,0|1,0,1]=4 9250 B12R1.124 CC(=O)C(=O)c1ccccc1Cl Amb17400961 [0,2,0,0,0,0|1,0,1]=4 9251 B12R1.124 CC(=O)C(=O)c1ccccc1F Amb17400191 [0,2,0,0,0,0|1,0,1]=4 9252 B12R1.124 CC(=O)C(=O)c1ccccc1O Amb18645956 [0,2,0,0,0,0|1,0,1]=4 9253 B12R1.124 CC(=O)C(Br)c1ccccc1Br Amb24664641 [0,2,0,0,0,0|1,0,0]=3 9254 B12R1.124 CC(=O)C(C)c1ccccc1Br Amb25686339 [0,2,0,0,0,0|0,0,0]=2 9255 B12R1.124 CC(=O)C(C)c1ccccc1Cl Amb22753501 [0,2,0,0,0,0|0,0,0]=2 9256 B12R1.124 CC(=O)C(Cl)c1ccccc1N Amb25253259 [0,2,0,0,0,0|1,0,0]=3 9257 B12R1.124 CC(=O)C(N)c1[n]cccc1N Amb25189598 [0,2,0,0,0,0|2,0,0]=4 9258 B12R1.124 CC(=O)C(N)c1c[n]ccc1Cl Amb24715705 [0,2,0,0,0,0|2,0,0]=4 9259 B12R1.124 CC(=O)C(N)c1cc[n]cc1Br Amb25805508 [0,2,0,0,0,0|2,0,0]=4 9260 B12R1.124 CC(=O)C(N)c1ccc[n]c1Cl Amb25292250 [0,2,0,0,0,0|2,0,0]=4 9261 B12R1.124 CC(=O)C(N)c1ccc[n]c1S Amb25328674 [0,2,0,0,0,0|2,0,0]=4 9262 B12R1.124 CC(=O)C(N)c1ccccc1Cl Amb25265226 [0,2,0,0,0,0|1,0,0]=3 9263 B12R1.124 CC(=O)C(N)c1ccccc1S Amb24487128 [0,2,0,0,0,0|1,0,0]=3 9264 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [0,2,0,0,0,0|1,0,0]=3 9265 B12R1.124 CC(=O)C(c1ccccc1C)Cl Amb17477626 [0,2,0,0,0,0|1,0,0]=3 9266 B12R1.124 CC(=O)C(c1ccccc1Cl)Cl Amb17477761 [0,2,0,0,0,0|1,0,0]=3 9267 B12R1.124 CC(=O)C(c1ccccc1F)Br Amb17142690 [0,2,0,0,0,0|1,0,0]=3 9268 B12R1.124 CC(=O)C(c1ccccc1F)Cl Amb17139155 [0,2,0,0,0,0|1,0,0]=3 9269 B12R1.124 CC(=O)N(C)c1[n]cccc1Br Amb25078870 [0,2,0,0,0,0|2,0,0]=4 9270 B12R1.124 CC(=O)N(C)c1[n]cccc1F Amb25043592 [0,2,0,0,0,0|2,0,0]=4 9271 B12R1.124 CC(=O)N(C)c1cc[n]cc1N Amb18278939 [0,2,0,0,0,0|2,0,0]=4 9272 B12R1.124 CC(=O)N(C)c1ccc[n]c1Cl Amb23024680 [0,2,0,0,0,0|2,0,0]=4 9273 B12R1.124 CC(=O)N(C)c1ccccc1Br Amb24462353 [0,2,0,0,0,0|1,0,0]=3 9274 B12R1.124 CC(=O)N(C)c1ccccc1F Amb25151063 [0,2,0,0,0,0|1,0,0]=3 9275 B12R1.124 CC(=O)N(C)c1ccccc1O Amb18646273 [0,2,0,0,0,0|1,0,0]=3 9276 B12R1.124 CC(=O)N(N)c1ccccc1Br Amb18571906 [0,2,0,0,0,0|2,0,0]=4 9277 B12R1.124 CC(=O)N(N)c1ccccc1Cl Amb18564310 [0,2,0,0,0,0|2,0,0]=4 9278 B12R1.124 CC(=O)N(N)c1ccccc1F Amb18563833 [0,2,0,0,0,0|2,0,0]=4 9279 B12R1.124 CC(=O)N(c1ccccc1N)C Amb2444993 [0,2,0,0,0,0|1,0,0]=3 9280 B12R1.124 CC(=O)[C@@H](O)c1ccccc1F Amb25306551 [0,2,0,0,0,0|1,0,0]=3 9281 B12R1.124 CC(C(=O)Cl)c1ccccc1Br Amb24605624 [0,2,0,0,0,0|0,0,0]=2 9282 B12R1.124 CC(C(=O)Cl)c1ccccc1Cl Amb24699169 [0,2,0,0,0,0|0,0,0]=2 9283 B12R1.124 CC(C(C)N)c1ccccc1Br Amb18161843 [0,2,0,0,0,0|1,0,1]=4 9284 B12R1.124 CC(C(C)N)c1ccccc1Cl Amb18191712 [0,2,0,0,0,0|1,0,1]=4 9285 B12R1.124 CC(C(C)N)c1ccccc1F Amb18199473 [0,2,0,0,0,0|1,0,1]=4 9286 B12R1.124 CC(C(C)O)c1ccccc1Br Amb25725772 [0,2,0,0,0,0|0,0,2]=4 9287 B12R1.124 CC(C(C)O)c1ccccc1Cl Amb25787409 [0,2,0,0,0,0|0,0,2]=4 9288 B12R1.124 CC(C(C)O)c1ccccc1O Amb24357145 [0,2,0,0,0,0|0,0,2]=4 9289 B12R1.124 CC(C(N)=O)c1ccccc1F Amb25285412 [0,2,0,0,0,0|0,0,0]=2 9290 B12R1.124 CC(C(O)=O)N1C=CC=CC1=O Amb18040083 [0,2,0,0,0,0|1,0,0]=3 9291 B12R1.124 CC(C(O)=O)N1N=CC=CC1=O Amb21937507 [0,2,0,0,0,0|2,0,0]=4 9292 B12R1.124 CC(C(O)=O)c1[n]c[n]cc1F Amb24756995 [0,2,0,0,0,0|2,0,0]=4 9293 B12R1.124 CC(C(O)=O)c1[n]cccc1Br Amb25751488 [0,2,0,0,0,0|1,0,0]=3 9294 B12R1.124 CC(C(O)=O)c1[n]cccc1Cl Amb18822248 [0,2,0,0,0,0|1,0,0]=3 9295 B12R1.124 CC(C(O)=O)c1[n]cccc1F Amb25824753 [0,2,0,0,0,0|1,0,0]=3 9296 B12R1.124 CC(C(O)=O)c1cc[n]cc1Cl Amb25850310 [0,2,0,0,0,0|1,0,0]=3 9297 B12R1.124 CC(C(O)=O)c1cc[n]cc1F Amb25682826 [0,2,0,0,0,0|1,0,0]=3 9298 B12R1.124 CC(C)=C(C)c1ccccc1O Amb25767128 [0,2,0,0,0,0|1,0,1]=4 9299 B12R1.124 CC(Cl)C(C)c1ccccc1F Amb24474326 [0,2,0,0,0,0|1,0,1]=4 9300 B12R1.124 CC(c1ccccc1Br)[N+]([O-])=O Amb18753221 [0,2,0,0,0,0|1,0,0]=3 9301 B12R1.124 CC(c1ccccc1N)=C(Cl)Cl Amb25218862 [0,2,0,0,0,0|1,0,1]=4 9302 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [0,2,0,0,0,0|0,0,0]=2 9303 B12R1.124 CC(n1cccnc1=O)C(=O)O Amb1124559 [0,2,0,0,0,0|2,0,0]=4 9304 B12R1.124 CN(C(=O)Cl)c1c[n]ccc1Cl Amb24727536 [0,2,0,0,0,0|2,0,0]=4 9305 B12R1.124 CN(C(C)=O)[n]1ccccc1=S Amb24096743 [0,2,0,0,0,0|2,0,0]=4 9306 B12R1.124 CN(C(N)=N)c1ccccc1F Amb18177852 [0,2,0,0,0,0|2,0,0]=4 9307 B12R1.124 CN(C(N)=O)c1ccccc1F Amb18788752 [0,2,0,0,0,0|1,0,0]=3 9308 B12R1.124 CN(C(N)=O)c1ccccc1O Amb18646492 [0,2,0,0,0,0|1,0,0]=3 9309 B12R1.124 CN(C(N)=O)c1ccccc1S Amb25095886 [0,2,0,0,0,0|1,0,0]=3 9310 B12R1.124 CN(C(N)=S)c1ccccc1Cl Amb25063186 [0,2,0,0,0,0|1,1,0]=4 9311 B12R1.124 CN(C(N)=S)c1ccccc1F Amb19045414 [0,2,0,0,0,0|1,1,0]=4 9312 B12R1.124 CN(C)C(C)c1ccccc1Br Amb25154604 [0,2,0,0,0,0|2,0,0]=4 9313 B12R1.124 CN(C)C(C)c1ccccc1S Amb24694175 [0,2,0,0,0,0|2,0,0]=4 9314 B12R1.124 CN(C)[C@@H](C)c1ccccc1O Amb25094366 [0,2,0,0,0,0|2,0,0]=4 9315 B12R1.124 CN(c1cc[n]cc1N)C(N)=O Amb18278974 [0,2,0,0,0,0|2,0,0]=4 9316 B12R1.124 CN(c1ccccc1N)C(N)=O Amb18279536 [0,2,0,0,0,0|1,0,0]=3 9317 B12R1.124 CN(c1ccccc1N)S(C)=O Amb24551837 [0,2,0,0,0,0|2,0,0]=4 9318 B12R1.124 CS(=O)C(C)c1ccccc1Cl Amb25188412 [0,2,0,0,0,0|1,0,0]=3 9319 B12R1.124 C[C@@H](O)[C@@H](C)c1ccccc1N Amb24695229 [0,2,0,0,0,0|0,0,2]=4 9320 B12R1.124 C[C@H](C(O)=O)c1ccccc1Cl Amb25222036 [0,2,0,0,0,0|0,0,0]=2 9321 B12R1.124 C[C@H](O)[C@@H](C)c1ccccc1N Amb24636832 [0,2,0,0,0,0|0,0,2]=4 9322 B12R1.124 Cc1[n]cc[n]c1C(C)C(O)=O Amb18827787 [0,2,0,0,0,0|2,0,0]=4 9323 B12R1.124 Cc1[n]cccc1[C@@H](N)C(O)=O Amb25097107 [0,2,0,0,0,0|2,0,0]=4 9324 B12R1.124 Cc1[n]cccc1[C@H](N)C(O)=O Amb24485602 [0,2,0,0,0,0|2,0,0]=4 9325 B12R1.124 Cc1c[n]ccc1C(N)C(C)=O Amb25128027 [0,2,0,0,0,0|2,0,0]=4 9326 B12R1.124 Cc1c[n]ccc1[C@@H](N)C(O)=O Amb25121088 [0,2,0,0,0,0|2,0,0]=4 9327 B12R1.124 Cc1c[n]ccc1[C@H](N)C(O)=O Amb24487133 [0,2,0,0,0,0|2,0,0]=4 9328 B12R1.124 Cc1cc[n]cc1C(C)C(O)=O Amb25759366 [0,2,0,0,0,0|1,0,0]=3 9329 B12R1.124 Cc1cc[n]cc1C(N)C(O)=O Amb18827789 [0,2,0,0,0,0|2,0,0]=4 9330 B12R1.124 Cc1cc[n]cc1C(O)C(O)=O Amb25035168 [0,2,0,0,0,0|2,0,0]=4 9331 B12R1.124 Cc1ccc[n]c1C(C)C(O)=O Amb25710871 [0,2,0,0,0,0|1,0,0]=3 9332 B12R1.124 Cc1ccc[n]c1C(N)C(C)=O Amb24428767 [0,2,0,0,0,0|2,0,0]=4 9333 B12R1.124 Cc1ccc[n]c1[C@@H](N)C(O)=O Amb24546429 [0,2,0,0,0,0|2,0,0]=4 9334 B12R1.124 Cc1ccccc1C(=O)C(=O)Cl Amb24100489 [0,2,0,0,0,0|1,0,1]=4 9335 B12R1.124 Cc1ccccc1C(Br)C(O)=O Amb25136873 [0,2,0,0,0,0|1,0,0]=3 9336 B12R1.124 Cc1ccccc1C(C)C(=O)Cl Amb25152464 [0,2,0,0,0,0|0,0,0]=2 9337 B12R1.124 Cc1ccccc1C(C)C(C)=O Amb25204377 [0,2,0,0,0,0|0,0,0]=2 9338 B12R1.124 Cc1ccccc1C(C)C(C)N Amb24619318 [0,2,0,0,0,0|1,0,1]=4 9339 B12R1.124 Cc1ccccc1C(Cl)C(N)=O Amb19074653 [0,2,0,0,0,0|1,0,0]=3 9340 B12R1.124 Cc1ccccc1C(Cl)C(O)=O Amb18564301 [0,2,0,0,0,0|1,0,0]=3 9341 B12R1.124 Cc1ccccc1C(N)C(C)=O Amb25131697 [0,2,0,0,0,0|1,0,0]=3 9342 B12R1.124 Cc1ccccc1C(N)P(O)=O Amb24433887 [0,2,0,0,0,0|2,0,0]=4 9343 B12R1.124 Cc1ccccc1C(O)C(C)=O Amb25712931 [0,2,0,0,0,0|1,0,0]=3 9344 B12R1.124 Cc1ccccc1C(O)C(N)=N Amb25159647 [0,2,0,0,0,0|2,0,0]=4 9345 B12R1.124 Cc1ccccc1C(O)C(N)=O Amb18800897 [0,2,0,0,0,0|1,0,0]=3 9346 B12R1.124 Cc1ccccc1N(C)C(=O)Cl Amb25034673 [0,2,0,0,0,0|1,0,0]=3 9347 B12R1.124 Cc1ccccc1N(C)C(C)=O Amb24085648 [0,2,0,0,0,0|1,0,0]=3 9348 B12R1.124 Cc1ccccc1N(C)C(N)=N Amb18788213 [0,2,0,0,0,0|2,0,0]=4 9349 B12R1.124 Cc1ccccc1N(C)C(N)=O Amb18788281 [0,2,0,0,0,0|1,0,0]=3 9350 B12R1.124 Cc1ccccc1N(C)C(N)=S Amb18791182 [0,2,0,0,0,0|1,1,0]=4 9351 B12R1.124 Cc1ccccc1N(N)C(C)=O Amb18563636 [0,2,0,0,0,0|2,0,0]=4 9352 B12R1.124 Cc1ccccc1N(O)C(N)=O Amb25808551 [0,2,0,0,0,0|2,0,0]=4 9353 B12R1.124 Cc1ccccc1[C@@H](C)C(O)=O Amb24426211 [0,2,0,0,0,0|0,0,0]=2 9354 B12R1.124 Cc1ccccc1[C@@H](N)C(O)=O Amb17933183 [0,2,0,0,0,0|1,0,0]=3 9355 B12R1.124 Cc1ccccc1[C@@H](O)C(=O)Cl Amb24608093 [0,2,0,0,0,0|1,0,0]=3 9356 B12R1.124 Cc1ccccc1[C@@H](O)C(C)=O Amb24722864 [0,2,0,0,0,0|1,0,0]=3 9357 B12R1.124 Cc1ccccc1[C@H](C)C(O)=O Amb25798862 [0,2,0,0,0,0|0,0,0]=2 9358 B12R1.124 Cc1ccccc1[C@H](N)C(N)=O Amb24483792 [0,2,0,0,0,0|1,0,0]=3 9359 B12R1.124 NC(=N)C(O)c1ccccc1Br Amb24100285 [0,2,0,0,0,0|2,0,0]=4 9360 B12R1.124 NC(=N)C(O)c1ccccc1Cl Amb24070108 [0,2,0,0,0,0|2,0,0]=4 9361 B12R1.124 NC(=O)C(=O)c1ccccc1Cl Amb25805251 [0,2,0,0,0,0|1,0,1]=4 9362 B12R1.124 NC(=O)C(Br)c1ccccc1Cl Amb25089052 [0,2,0,0,0,0|1,0,0]=3 9363 B12R1.124 NC(=O)C(Cl)c1ccccc1F Amb18329810 [0,2,0,0,0,0|1,0,0]=3 9364 B12R1.124 NC(=O)C(N)c1ccccc1Br Amb18282827 [0,2,0,0,0,0|1,0,0]=3 9365 B12R1.124 NC(=O)C(N)c1ccccc1F Amb19374457 [0,2,0,0,0,0|1,0,0]=3 9366 B12R1.124 NC(=O)C(N)c1ccccc1O Amb24391892 [0,2,0,0,0,0|1,0,0]=3 9367 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [0,2,0,0,0,0|1,0,0]=3 9368 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [0,2,0,0,0,0|1,0,0]=3 9369 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [0,2,0,0,0,0|1,0,0]=3 9370 B12R1.124 NC(=O)C(c1ccccc1C)N Amb17334617 [0,2,0,0,0,0|1,0,0]=3 9371 B12R1.124 NC(=O)C(c1ccccc1Cl)N Amb17335725 [0,2,0,0,0,0|1,0,0]=3 9372 B12R1.124 NC(=O)C(c1ccccc1F)N Amb17334710 [0,2,0,0,0,0|1,0,0]=3 9373 B12R1.124 NC(=O)[C@@H](N)c1ccccc1Cl Amb24483835 [0,2,0,0,0,0|1,0,0]=3 9374 B12R1.124 NC(=O)[C@@H](O)c1ccccc1Cl Amb22799808 [0,2,0,0,0,0|1,0,0]=3 9375 B12R1.124 NC(=O)[C@H](N)c1ccccc1O Amb25056722 [0,2,0,0,0,0|1,0,0]=3 9376 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl Amb24355348 [0,2,0,0,0,0|1,0,0]=3 9377 B12R1.124 NC(=S)C(O)c1ccccc1Cl Amb25159696 [0,2,0,0,0,0|1,1,0]=4 9378 B12R1.124 NC(=S)C(O)c1ccccc1F Amb25159483 [0,2,0,0,0,0|1,1,0]=4 9379 B12R1.124 NC(C(O)=O)C1=CC=CNC1=O Amb25854713 [0,2,0,0,0,0|2,0,0]=4 9380 B12R1.124 NC(C(O)=O)c1[n]cccc1Br Amb24695377 [0,2,0,0,0,0|2,0,0]=4 9381 B12R1.124 NC(C(O)=O)c1[n]cccc1Cl Amb25835423 [0,2,0,0,0,0|2,0,0]=4 9382 B12R1.124 NC(C(O)=O)c1cc[n]cc1Br Amb25327473 [0,2,0,0,0,0|2,0,0]=4 9383 B12R1.124 NC(C(O)=O)c1ccc[n]c1Br Amb24420309 [0,2,0,0,0,0|2,0,0]=4 9384 B12R1.124 NC(C(O)=O)c1ccc[n]c1Cl Amb24427947 [0,2,0,0,0,0|2,0,0]=4 9385 B12R1.124 NC(C(O)=O)c1ccc[n]c1F Amb24697660 [0,2,0,0,0,0|2,0,0]=4 9386 B12R1.124 NC(C(O)=O)c1ccc[n]c1S Amb25151059 [0,2,0,0,0,0|2,0,0]=4 9387 B12R1.124 NC(C(O)=O)c1ccccc1F Amb24331712 [0,2,0,0,0,0|1,0,0]=3 9388 B12R1.124 NC(c1[n]cccc1O)C(O)=O Amb24670280 [0,2,0,0,0,0|2,0,0]=4 9389 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1Br Amb25149962 [0,2,0,0,0,0|2,0,0]=4 9390 B12R1.124 N[C@@H](C(O)=O)c1[n]cccc1F Amb24484150 [0,2,0,0,0,0|2,0,0]=4 9391 B12R1.124 N[C@@H](C(O)=O)c1cc[n]cc1Cl Amb24648834 [0,2,0,0,0,0|2,0,0]=4 9392 B12R1.124 N[C@@H](C(O)=O)c1ccc[n]c1F Amb25295392 [0,2,0,0,0,0|2,0,0]=4 9393 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb23440362 [0,2,0,0,0,0|1,0,0]=3 9394 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb25270086 [0,2,0,0,0,0|1,0,0]=3 9395 B12R1.124 N[C@@H](C(O)=O)c1ccccc1F Amb22747759 [0,2,0,0,0,0|1,0,0]=3 9396 B12R1.124 N[C@@H](C(O)=O)c1ccccc1I Amb25055265 [0,2,0,0,0,0|1,0,0]=3 9397 B12R1.124 N[C@@H](C(O)=O)c1ccccc1S Amb24649945 [0,2,0,0,0,0|1,0,0]=3 9398 B12R1.124 N[C@@H](c1[n]cccc1O)C(O)=O Amb24635276 [0,2,0,0,0,0|2,0,0]=4 9399 B12R1.124 N[C@@H](c1c[n]ccc1O)C(O)=O Amb25751540 [0,2,0,0,0,0|2,0,0]=4 9400 B12R1.124 N[C@@H](c1ccc[n]c1O)C(O)=O Amb25087908 [0,2,0,0,0,0|2,0,0]=4 9401 B12R1.124 N[C@@H](c1ccccc1O)C(O)=O Amb22748113 [0,2,0,0,0,0|1,0,0]=3 9402 B12R1.124 N[C@H](C(O)=O)c1[n]cccc1Cl Amb25774361 [0,2,0,0,0,0|2,0,0]=4 9403 B12R1.124 N[C@H](C(O)=O)c1cc[n]cc1F Amb25150860 [0,2,0,0,0,0|2,0,0]=4 9404 B12R1.124 N[C@H](C(O)=O)c1ccccc1I Amb24637866 [0,2,0,0,0,0|1,0,0]=3 9405 B12R1.124 N[C@H](c1ccccc1O)C(O)=O Amb25134608 [0,2,0,0,0,0|1,0,0]=3 9406 B12R1.124 Nc1c[n]ccc1C(N)C(O)=O Amb24351686 [0,2,0,0,0,0|2,0,0]=4 9407 B12R1.124 Nc1c[n]ccc1[C@@H](N)C(O)=O Amb25349329 [0,2,0,0,0,0|2,0,0]=4 9408 B12R1.124 Nc1c[n]ccc1[C@H](N)C(O)=O Amb24341560 [0,2,0,0,0,0|2,0,0]=4 9409 B12R1.124 Nc1cc[n]cc1[C@@H](N)C(O)=O Amb24748647 [0,2,0,0,0,0|2,0,0]=4 9410 B12R1.124 Nc1ccc[n]c1C(N)C(O)=O Amb25727218 [0,2,0,0,0,0|2,0,0]=4 9411 B12R1.124 Nc1ccccc1C(=O)C([O-])=O Amb21963722 [0,2,0,0,0,0|1,0,1]=4 9412 B12R1.124 Nc1ccccc1C(O)C(O)=O Amb18646669 [0,2,0,0,0,0|1,0,0]=3 9413 B12R1.124 Nc1ccccc1C(O)C([O-])=O Amb21963741 [0,2,0,0,0,0|1,0,0]=3 9414 B12R1.124 Nc1ccccc1[C@@H](N)C(O)=O Amb25700852 [0,2,0,0,0,0|1,0,0]=3 9415 B12R1.124 Nc1ccccc1[C@H](O)C(O)=O Amb24373910 [0,2,0,0,0,0|1,0,0]=3 9416 B12R1.124 O=C(Cl)C(Br)c1ccccc1Cl Amb24641573 [0,2,0,0,0,0|1,0,0]=3 9417 B12R1.124 OC(=O)C(=C)c1ccccc1C Amb17322164 [0,2,0,0,0,0|0,0,2]=4 9418 B12R1.124 OC(=O)C(=C)c1ccccc1Cl Amb17322174 [0,2,0,0,0,0|0,0,2]=4 9419 B12R1.124 OC(=O)C(=C)c1ccccc1F Amb17322167 [0,2,0,0,0,0|0,0,2]=4 9420 B12R1.124 OC(=O)C(=O)c1ccccc1Br Amb13883630 [0,2,0,0,0,0|1,0,1]=4 9421 B12R1.124 OC(=O)C(=O)c1ccccc1C Amb16231619 [0,2,0,0,0,0|1,0,1]=4 9422 B12R1.124 OC(=O)C(=O)c1ccccc1F Amb13883629 [0,2,0,0,0,0|1,0,1]=4 9423 B12R1.124 OC(=O)C(=O)c1ccccc1N Amb17594093 [0,2,0,0,0,0|1,0,1]=4 9424 B12R1.124 OC(=O)C(=O)c1ccccc1O Amb18646415 [0,2,0,0,0,0|1,0,1]=4 9425 B12R1.124 OC(=O)C(Cl)c1ccccc1Br Amb24060809 [0,2,0,0,0,0|1,0,0]=3 9426 B12R1.124 OC(=O)C(Cl)c1ccccc1Cl Amb18066587 [0,2,0,0,0,0|1,0,0]=3 9427 B12R1.124 OC(=O)C(Cl)c1ccccc1F Amb18564556 [0,2,0,0,0,0|1,0,0]=3 9428 B12R1.124 OC(=O)C(O)c1[n]cccc1F Amb25820427 [0,2,0,0,0,0|2,0,0]=4 9429 B12R1.124 OC(=O)C(O)c1ccccc1I Amb25117434 [0,2,0,0,0,0|1,0,0]=3 9430 B12R1.124 OC(=O)C(c1ccccc1Br)C Amb10844025 [0,2,0,0,0,0|0,0,0]=2 9431 B12R1.124 OC(=O)C(c1ccccc1Br)N Amb2234623 [0,2,0,0,0,0|1,0,0]=3 9432 B12R1.124 OC(=O)C(c1ccccc1C)N Amb1837192 [0,2,0,0,0,0|1,0,0]=3 9433 B12R1.124 OC(=O)C(c1ccccc1Cl)N Amb1841983 [0,2,0,0,0,0|1,0,0]=3 9434 B12R1.124 OC(=O)C(c1ccccc1F)C Amb10843985 [0,2,0,0,0,0|0,0,0]=2 9435 B12R1.124 OC(=O)C(c1ccccc1F)N Amb1837738 [0,2,0,0,0,0|1,0,0]=3 9436 B12R1.124 OC(=O)[C@@H](O)c1ccccc1F Amb22745223 [0,2,0,0,0,0|1,0,0]=3 9437 B12R1.124 OC(=O)[C@H](O)c1ccccc1F Amb24428765 [0,2,0,0,0,0|1,0,0]=3 9438 B12R1.124 Oc1ccccc1C(O)P(O)=O Amb24497278 [0,2,0,0,0,0|2,0,0]=4 9439 B12R1.124 [O-]C(=O)C(O)c1ccccc1F Amb22455226 [0,2,0,0,0,0|1,0,0]=3 9440 B12R1.124 [O-]S(=O)C(O)c1ccccc1O Amb25833584 [0,2,0,0,0,0|2,0,0]=4 9441 B12R1.564 CC(C(N)(C)C)c1ccccc1 Amb17594058 [0,2,0,0,0,0|1,0,1]=4 9442 B12R1.564 CC(P(=O)(O)O)c1ccccc1 Amb10975962 [0,2,0,0,0,0|1,0,0]=3 9443 B12R1.564 CC(c1c[n]ccc1)S(C)(=O)=O Amb24380360 [0,2,0,0,0,0|2,0,0]=4 9444 B12R1.564 CC(c1cccc[n]1)S(=O)(=O)Cl Amb22267286 [0,2,0,0,0,0|2,0,0]=4 9445 B12R1.564 CC(c1cccc[n]1)S(N)(=O)=O Amb19075746 [0,2,0,0,0,0|2,0,0]=4 9446 B12R1.564 CC(c1cccc[n]1)S(O)(=O)=O Amb22267287 [0,2,0,0,0,0|2,0,0]=4 9447 B12R1.564 CC(c1ccccc1)C(C)(C)C Amb24579473 [0,2,0,0,0,0|1,0,1]=4 9448 B12R1.564 CC(c1ccccc1)C(C)(C)N Amb22057442 [0,2,0,0,0,0|1,0,1]=4 9449 B12R1.564 CC(c1ccccc1)C(F)(F)F Amb20669783 [0,2,0,0,0,0|1,0,1]=4 9450 B12R1.564 CC(c1ccccc1)S(=O)(=O)Cl Amb22752088 [0,2,0,0,0,0|1,0,0]=3 9451 B12R1.564 CC(c1ccccc1)S(=O)(=O)F Amb24761366 [0,2,0,0,0,0|1,0,0]=3 9452 B12R1.564 CC(c1ccccc1)S(N)(=O)=O Amb19075244 [0,2,0,0,0,0|1,0,0]=3 9453 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22359327 [0,2,0,0,0,0|2,0,0]=4 9454 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22360591 [0,2,0,0,0,0|2,0,0]=4 9455 B12R1.564 CC(c1ccccc1)[Si](Cl)(Cl)Cl Amb24323687 [0,2,0,0,0,0|1,1,0]=4 9456 B12R1.564 CC(c1ccccc1)[Si](Cl)(Cl)Cl Amb25327805 [0,2,0,0,0,0|1,1,0]=4 9457 B12R1.564 CN(S(=O)(=O)Cl)c1ccccc1 Amb1142209 [0,2,0,0,0,0|2,0,0]=4 9458 B12R1.564 CP(O)(=O)C(N)c1ccccc1 Amb25772757 [0,2,0,0,0,0|2,0,0]=4 9459 B12R1.564 C[C@@H](c1ccccc1)C(F)(F)F Amb20669785 [0,2,0,0,0,0|1,0,1]=4 9460 B12R1.564 C[C@H](c1ccccc1)C(C)(C)N Amb24678916 [0,2,0,0,0,0|1,0,1]=4 9461 B12R1.564 C[C@H](c1ccccc1)C(F)(F)F Amb20669784 [0,2,0,0,0,0|1,0,1]=4 9462 B12R1.564 NC(P(=O)(O)O)c1ccccc1 Amb1148498 [0,2,0,0,0,0|2,0,0]=4 9463 B12R1.564 NC(c1ccccc1)S(O)(=O)=O Amb22472999 [0,2,0,0,0,0|2,0,0]=4 9464 B12R1.564 O=S(=O)(Cl)C(Cl)c1ccccc1 Amb25335421 [0,2,0,0,0,0|2,0,0]=4 9465 B12R1.564 O=S(=O)(Cl)C(F)c1ccccc1 Amb25349761 [0,2,0,0,0,0|2,0,0]=4 9466 B12R1.564 OC(S(=O)(=O)O)c1ccccc1 Amb17594875 [0,2,0,0,0,0|2,0,0]=4 9467 B12R1.564 [O-]S(=O)(=O)C(Cl)c1ccccc1 Amb22364808 [0,2,0,0,0,0|2,0,0]=4 9468 B12R1.2206 CC(C(O)=O)C1(O)CC=CC=C1 Amb25122114 [0,2,0,0,0,0|0,0,2]=4 9469 B12R1.77 BrCC(c1ccccc1OC)C Amb17248428 [0,2,0,0,0,0|1,0,1]=4 9470 B12R1.77 C=C(C=O)c1ccccc1C=O Amb24100569 [0,2,0,0,0,0|0,0,2]=4 9471 B12R1.77 C=CC(N)c1ccccc1C=C Amb24745623 [0,2,0,0,0,0|2,0,0]=4 9472 B12R1.77 C=CC(O)c1ccccc1C#C Amb25792378 [0,2,0,0,0,0|2,0,0]=4 9473 B12R1.77 C=CC(O)c1ccccc1C=C Amb24661301 [0,2,0,0,0,0|2,0,0]=4 9474 B12R1.77 C=CC(O)c1ccccc1CO Amb24557147 [0,2,0,0,0,0|2,0,0]=4 9475 B12R1.77 C=C[C@H](N)c1ccccc1CO Amb25241948 [0,2,0,0,0,0|2,0,0]=4 9476 B12R1.77 CC(C=C)c1ccccc1CO Amb24719510 [0,2,0,0,0,0|1,0,0]=3 9477 B12R1.77 CC(CN)c1ccccc1CF Amb24564770 [0,2,0,0,0,0|1,0,1]=4 9478 B12R1.77 CC(CO)c1ccccc1CO Amb25741410 [0,2,0,0,0,0|0,0,2]=4 9479 B12R1.77 CC(NC)c1ccccc1NC Amb24537591 [0,2,0,0,0,0|2,0,0]=4 9480 B12R1.77 CCC(C)c1ccccc1C=O Amb24085061 [0,2,0,0,0,0|1,0,1]=4 9481 B12R1.77 CCC(C)c1ccccc1CO Amb25158130 [0,2,0,0,0,0|1,0,1]=4 9482 B12R1.77 CCC(C)c1ccccc1ON Amb25816759 [0,2,0,0,0,0|1,0,1]=4 9483 B12R1.77 CCC(c1ccccc1[N+]#[C-])C Amb2235816 [0,2,0,0,0,0|1,0,1]=4 9484 B12R1.77 CC[C@H](C)c1ccccc1NC Amb25364172 [0,2,0,0,0,0|1,0,1]=4 9485 B12R1.77 CCc1ccccc1C(C)C#N Amb24613113 [0,2,0,0,0,0|1,0,1]=4 9486 B12R1.77 CCc1ccccc1C(N)C=C Amb24341731 [0,2,0,0,0,0|2,0,0]=4 9487 B12R1.77 CCc1ccccc1C(O)C=C Amb24532684 [0,2,0,0,0,0|2,0,0]=4 9488 B12R1.77 CCc1ccccc1C(O)C=O Amb25341843 [0,2,0,0,0,0|1,0,0]=3 9489 B12R1.77 CCc1ccccc1[C@@H](C)CO Amb25057871 [0,2,0,0,0,0|0,0,2]=4 9490 B12R1.77 CCc1ccccc1[C@@H](C)NC Amb24377607 [0,2,0,0,0,0|2,0,0]=4 9491 B12R1.77 CN(C=O)c1ccccc1C=O Amb24084249 [0,2,0,0,0,0|1,0,0]=3 9492 B12R1.77 CN(N=O)c1ccccc1C#N Amb22524569 [0,2,0,0,0,0|2,0,0]=4 9493 B12R1.77 CNC(C)c1ccccc1C=C Amb24694177 [0,2,0,0,0,0|2,0,0]=4 9494 B12R1.77 CNC(C)c1ccccc1CF Amb25276837 [0,2,0,0,0,0|2,0,0]=4 9495 B12R1.77 CNC(C)c1ccccc1CO Amb25731814 [0,2,0,0,0,0|2,0,0]=4 9496 B12R1.77 CNC(C)c1ccccc1SC Amb18290087 [0,2,0,0,0,0|2,0,0]=4 9497 B12R1.77 CNC(c1ccccc1OC)C Amb1119115 [0,2,0,0,0,0|2,0,0]=4 9498 B12R1.77 CNC(c1ccccc1OC)C Amb13949026 [0,2,0,0,0,0|2,0,0]=4 9499 B12R1.77 CN[C@@H](C)c1ccccc1C=C Amb25132659 [0,2,0,0,0,0|2,0,0]=4 9500 B12R1.77 CN[C@@H](C)c1ccccc1CO Amb24341700 [0,2,0,0,0,0|2,0,0]=4 9501 B12R1.77 CN[C@H](C)c1ccccc1OC Amb24611100 [0,2,0,0,0,0|2,0,0]=4 9502 B12R1.77 CN[C@H](C)c1ccccc1SC Amb24744534 [0,2,0,0,0,0|2,0,0]=4 9503 B12R1.77 CNc1ccccc1C(C)C#N Amb25780006 [0,2,0,0,0,0|1,0,1]=4 9504 B12R1.77 CNc1ccccc1C(C)C=C Amb25667051 [0,2,0,0,0,0|1,0,0]=3 9505 B12R1.77 CNc1ccccc1N(C)C=O Amb25375772 [0,2,0,0,0,0|1,0,0]=3 9506 B12R1.77 COc1[n]cccc1C(C)C=O Amb24497119 [0,2,0,0,0,0|1,0,0]=3 9507 B12R1.77 COc1cc[n]cc1C(O)C=O Amb24685466 [0,2,0,0,0,0|2,0,0]=4 9508 B12R1.77 COc1ccccc1C(=O)C=O Amb22228874 [0,2,0,0,0,0|1,0,1]=4 9509 B12R1.77 COc1ccccc1C(C)NO Amb24417492 [0,2,0,0,0,0|1,0,1]=4 9510 B12R1.77 COc1ccccc1C(Cl)C=O Amb25050296 [0,2,0,0,0,0|1,0,0]=3 9511 B12R1.77 COc1ccccc1C(N)C=C Amb25360914 [0,2,0,0,0,0|2,0,0]=4 9512 B12R1.77 COc1ccccc1C(O)C=O Amb25107227 [0,2,0,0,0,0|1,0,0]=3 9513 B12R1.77 COc1ccccc1N(C)C=O Amb25736171 [0,2,0,0,0,0|1,0,0]=3 9514 B12R1.77 COc1ccccc1[C@@H](N)C=C Amb25694428 [0,2,0,0,0,0|2,0,0]=4 9515 B12R1.77 COc1ccccc1[C@H](C)NO Amb24437309 [0,2,0,0,0,0|1,0,1]=4 9516 B12R1.77 COc1ccccc1[C@H](N)C=C Amb24351634 [0,2,0,0,0,0|2,0,0]=4 9517 B12R1.77 CSc1ccccc1C(O)C=C Amb25787609 [0,2,0,0,0,0|2,0,0]=4 9518 B12R1.77 CSc1ccccc1[C@H](N)C=C Amb25060112 [0,2,0,0,0,0|2,0,0]=4 9519 B12R1.77 C[C@@H](NC)c1ccccc1NC Amb24407314 [0,2,0,0,0,0|2,0,0]=4 9520 B12R1.77 C\C(=C/C)\c1ccccc1CO Amb24069146 [0,2,0,0,0,0|1,0,1]=4 9521 B12R1.77 ClCC(c1ccccc1OC)C Amb17234159 [0,2,0,0,0,0|1,0,1]=4 9522 B12R1.77 O=CC(c1ccccc1OC)C Amb17138572 [0,2,0,0,0,0|0,0,0]=2 9523 B12R1.77 O=NN(c1ccccc1OC)C Amb2234119 [0,2,0,0,0,0|2,0,0]=4 9524 B12R1.77 OCC(c1ccccc1OC)C Amb17232593 [0,2,0,0,0,0|0,0,2]=4 9525 B12R1.3441 C=CC(N)c1c(Br)cccc1Br Amb25159578 [0,2,0,0,0,0|2,0,0]=4 9526 B12R1.3441 C=CC(N)c1c(Cl)cccc1Br Amb25835024 [0,2,0,0,0,0|2,0,0]=4 9527 B12R1.3441 C=CC(N)c1c(Cl)cccc1N Amb25214294 [0,2,0,0,0,0|2,0,0]=4 9528 B12R1.3441 C=CC(N)c1c(F)cccc1Cl Amb25244597 [0,2,0,0,0,0|2,0,0]=4 9529 B12R1.3441 C=CC(N)c1c(F)cccc1N Amb24487330 [0,2,0,0,0,0|2,0,0]=4 9530 B12R1.3441 C=CC(N)c1c(O)cccc1Br Amb24424068 [0,2,0,0,0,0|2,0,0]=4 9531 B12R1.3441 C=CC(N)c1c(O)cccc1F Amb25082679 [0,2,0,0,0,0|2,0,0]=4 9532 B12R1.3441 C=CC(N)c1c(O)cccc1O Amb25311081 [0,2,0,0,0,0|2,0,0]=4 9533 B12R1.3441 C=CC(O)c1c(F)cccc1Cl Amb25344029 [0,2,0,0,0,0|2,0,0]=4 9534 B12R1.3441 C=C[C@@H](N)c1c(Cl)cccc1Cl Amb24409070 [0,2,0,0,0,0|2,0,0]=4 9535 B12R1.3441 C=C[C@@H](N)c1c(O)cccc1Cl Amb25113408 [0,2,0,0,0,0|2,0,0]=4 9536 B12R1.3441 C=C[C@@H](N)c1c(O)cccc1F Amb25149835 [0,2,0,0,0,0|2,0,0]=4 9537 B12R1.3441 C=C[C@@H](N)c1c(O)cccc1O Amb25047110 [0,2,0,0,0,0|2,0,0]=4 9538 B12R1.3441 C=C[C@@H](O)c1c(F)cccc1Br Amb25085940 [0,2,0,0,0,0|2,0,0]=4 9539 B12R1.3441 C=C[C@H](N)c1c(Br)cccc1Br Amb24760052 [0,2,0,0,0,0|2,0,0]=4 9540 B12R1.3441 C=C[C@H](N)c1c(Br)cccc1N Amb24346562 [0,2,0,0,0,0|2,0,0]=4 9541 B12R1.3441 C=C[C@H](N)c1c(F)cccc1Br Amb24682557 [0,2,0,0,0,0|2,0,0]=4 9542 B12R1.3441 C=C[C@H](N)c1c(F)cccc1F Amb25703519 [0,2,0,0,0,0|2,0,0]=4 9543 B12R1.3441 C=C[C@H](N)c1c(F)cccc1I Amb24670046 [0,2,0,0,0,0|2,0,0]=4 9544 B12R1.3441 CC(C#N)c1c(Br)cccc1Br Amb23402721 [0,2,0,0,0,0|1,0,1]=4 9545 B12R1.3441 CC(C#N)c1c(F)cccc1F Amb22499558 [0,2,0,0,0,0|1,0,1]=4 9546 B12R1.3441 CC(C#N)c1c(N)cccc1F Amb24370074 [0,2,0,0,0,0|1,0,1]=4 9547 B12R1.3441 CC(C#N)c1c(O)cccc1F Amb24372093 [0,2,0,0,0,0|1,0,1]=4 9548 B12R1.3441 CC(C=O)c1c(Cl)cccc1Cl Amb25034858 [0,2,0,0,0,0|0,0,0]=2 9549 B12R1.3441 CC(CCl)c1c(F)cccc1Cl Amb25282152 [0,2,0,0,0,0|1,0,1]=4 9550 B12R1.3441 CC(CCl)c1c(F)cccc1F Amb25808830 [0,2,0,0,0,0|1,0,1]=4 9551 B12R1.3441 CC(CN)c1c(Cl)cccc1Br Amb24343749 [0,2,0,0,0,0|1,0,1]=4 9552 B12R1.3441 CC(CN)c1c(F)cccc1Cl Amb25049175 [0,2,0,0,0,0|1,0,1]=4 9553 B12R1.3441 CC(CN)c1c(F)cccc1F Amb22396195 [0,2,0,0,0,0|1,0,1]=4 9554 B12R1.3441 CC(CO)c1c(C)cccc1C Amb25058548 [0,2,0,0,0,0|0,0,2]=4 9555 B12R1.3441 CC(CO)c1c(F)cccc1Cl Amb24591598 [0,2,0,0,0,0|0,0,2]=4 9556 B12R1.3441 CC(CO)c1c(F)cccc1F Amb24671851 [0,2,0,0,0,0|0,0,2]=4 9557 B12R1.3441 CC(NN)c1c(Cl)cccc1Br Amb25348966 [0,2,0,0,0,0|2,0,0]=4 9558 B12R1.3441 CC(NN)c1c(F)cccc1Cl Amb25353235 [0,2,0,0,0,0|2,0,0]=4 9559 B12R1.3441 CC(NN)c1c(O)cccc1O Amb24585119 [0,2,0,0,0,0|2,0,0]=4 9560 B12R1.3441 CC(NO)c1c(Cl)cccc1Cl Amb25289738 [0,2,0,0,0,0|1,0,1]=4 9561 B12R1.3441 CC(NO)c1c(F)cccc1Br Amb25235608 [0,2,0,0,0,0|1,0,1]=4 9562 B12R1.3441 CC(NO)c1c(F)cccc1F Amb25688768 [0,2,0,0,0,0|1,0,1]=4 9563 B12R1.3441 CNC(C)c1c(Br)cccc1Br Amb25338270 [0,2,0,0,0,0|2,0,0]=4 9564 B12R1.3441 CNC(C)c1c(C)cccc1C Amb25159440 [0,2,0,0,0,0|2,0,0]=4 9565 B12R1.3441 CNC(C)c1c(Cl)cccc1Br Amb25744019 [0,2,0,0,0,0|2,0,0]=4 9566 B12R1.3441 CNC(C)c1c(F)cccc1Br Amb25035028 [0,2,0,0,0,0|2,0,0]=4 9567 B12R1.3441 CNC(C)c1c(F)cccc1I Amb25041434 [0,2,0,0,0,0|2,0,0]=4 9568 B12R1.3441 CNC(C)c1c(N)cccc1F Amb25233468 [0,2,0,0,0,0|2,0,0]=4 9569 B12R1.3441 CNC(C)c1c(O)cccc1Cl Amb25159498 [0,2,0,0,0,0|2,0,0]=4 9570 B12R1.3441 CNC(C)c1c(O)cccc1O Amb24424440 [0,2,0,0,0,0|2,0,0]=4 9571 B12R1.3441 CNC(c1c(F)cccc1F)C Amb1114577 [0,2,0,0,0,0|2,0,0]=4 9572 B12R1.3441 CN[C@@H](C)c1c(Br)cccc1Br Amb24717688 [0,2,0,0,0,0|2,0,0]=4 9573 B12R1.3441 CN[C@@H](C)c1c(Cl)cccc1Br Amb25247276 [0,2,0,0,0,0|2,0,0]=4 9574 B12R1.3441 CN[C@@H](C)c1c(F)cccc1I Amb25826471 [0,2,0,0,0,0|2,0,0]=4 9575 B12R1.3441 CN[C@@H](C)c1c(N)cccc1F Amb24532601 [0,2,0,0,0,0|2,0,0]=4 9576 B12R1.3441 CN[C@@H](C)c1c(O)cccc1F Amb24655873 [0,2,0,0,0,0|2,0,0]=4 9577 B12R1.3441 CN[C@@H](C)c1c(O)cccc1O Amb25667082 [0,2,0,0,0,0|2,0,0]=4 9578 B12R1.3441 CN[C@H](C)c1c(Br)cccc1Br Amb25301202 [0,2,0,0,0,0|2,0,0]=4 9579 B12R1.3441 CN[C@H](C)c1c(Cl)cccc1Br Amb25047255 [0,2,0,0,0,0|2,0,0]=4 9580 B12R1.3441 CN[C@H](C)c1c(Cl)cccc1Cl Amb24483626 [0,2,0,0,0,0|2,0,0]=4 9581 B12R1.3441 CN[C@H](C)c1c(F)cccc1Cl Amb24504672 [0,2,0,0,0,0|2,0,0]=4 9582 B12R1.3441 CN[C@H](C)c1c(F)cccc1I Amb25708947 [0,2,0,0,0,0|2,0,0]=4 9583 B12R1.3441 CN[C@H](C)c1c(N)cccc1F Amb24484168 [0,2,0,0,0,0|2,0,0]=4 9584 B12R1.3441 CN[C@H](C)c1c(O)cccc1F Amb25113377 [0,2,0,0,0,0|2,0,0]=4 9585 B12R1.3441 CN[C@H](C)c1c(O)cccc1O Amb24485448 [0,2,0,0,0,0|2,0,0]=4 9586 B12R1.3441 C[C@@H](NO)c1c(F)cccc1Br Amb24492889 [0,2,0,0,0,0|1,0,1]=4 9587 B12R1.3441 C[C@H](NO)c1c(F)cccc1Cl Amb25091701 [0,2,0,0,0,0|1,0,1]=4 9588 B12R1.3441 C[C@H](NO)c1c(F)cccc1F Amb24369556 [0,2,0,0,0,0|1,0,1]=4 9589 B12R1.3441 Cc1cc[n]c(N)c1C(O)C=O Amb24703674 [0,2,0,0,0,0|2,0,0]=4 9590 B12R1.3441 Cc1cccc(Br)c1C(C)NC Amb24611784 [0,2,0,0,0,0|2,0,0]=4 9591 B12R1.3441 Cc1cccc(Br)c1C(O)C=C Amb25669741 [0,2,0,0,0,0|2,0,0]=4 9592 B12R1.3441 Cc1cccc(Br)c1[C@H](C)NC Amb24341998 [0,2,0,0,0,0|2,0,0]=4 9593 B12R1.3441 Cc1cccc(C)c1C(=O)C=O Amb24485694 [0,2,0,0,0,0|1,0,1]=4 9594 B12R1.3441 Cc1cccc(C)c1C(N)C=C Amb25187458 [0,2,0,0,0,0|2,0,0]=4 9595 B12R1.3441 Cc1cccc(C)c1C(O)C=C Amb25135038 [0,2,0,0,0,0|2,0,0]=4 9596 B12R1.3441 Cc1cccc(C)c1[C@H](N)C=C Amb25320726 [0,2,0,0,0,0|2,0,0]=4 9597 B12R1.3441 Cc1cccc(Cl)c1C(C)C#N Amb25317690 [0,2,0,0,0,0|1,0,1]=4 9598 B12R1.3441 Cc1cccc(Cl)c1C(C)NC Amb25124718 [0,2,0,0,0,0|2,0,0]=4 9599 B12R1.3441 Cc1cccc(Cl)c1C(N)C=C Amb25230596 [0,2,0,0,0,0|2,0,0]=4 9600 B12R1.3441 Cc1cccc(Cl)c1[C@H](C)NC Amb24476049 [0,2,0,0,0,0|2,0,0]=4 9601 B12R1.3441 Cc1cccc(Cl)c1[C@H](N)C=C Amb24658233 [0,2,0,0,0,0|2,0,0]=4 9602 B12R1.3441 Cc1cccc(F)c1C(C)NC Amb24636965 [0,2,0,0,0,0|2,0,0]=4 9603 B12R1.3441 Cc1cccc(F)c1C(N)C=C Amb24621862 [0,2,0,0,0,0|2,0,0]=4 9604 B12R1.3441 Cc1cccc(N)c1[C@@H](N)C=C Amb25087862 [0,2,0,0,0,0|2,0,0]=4 9605 B12R1.3441 Cc1cccc(O)c1C(C)CC Amb25143406 [0,2,0,0,0,0|1,0,1]=4 9606 B12R1.3441 Cc1cccc(O)c1C(C)NC Amb25202451 [0,2,0,0,0,0|2,0,0]=4 9607 B12R1.3441 Cc1cccc(O)c1C(O)C=C Amb24537612 [0,2,0,0,0,0|2,0,0]=4 9608 B12R1.3441 Cc1cccc(O)c1[C@@H](N)C=C Amb25338173 [0,2,0,0,0,0|2,0,0]=4 9609 B12R1.3441 NCC(c1c(C)cccc1C)C Amb17321738 [0,2,0,0,0,0|1,0,1]=4 9610 B12R1.3441 NCC(c1c(Cl)cccc1Cl)C Amb13952579 [0,2,0,0,0,0|1,0,1]=4 9611 B12R1.3441 O=C(C=O)c1c(F)cccc1Cl Amb25198126 [0,2,0,0,0,0|1,0,1]=4 9612 B12R1.3441 O=CC(=O)c1c(F)cccc1F Amb10838621 [0,2,0,0,0,0|1,0,1]=4 9613 B12R1.3441 O=CC(F)c1c(Cl)cccc1F Amb25131547 [0,2,0,0,0,0|1,0,0]=3 9614 B12R1.3441 OC(C=O)c1c(F)cccc1Cl Amb24493474 [0,2,0,0,0,0|1,0,0]=3 9615 B12R1.3441 OC(C=O)c1c(F)cccc1F Amb24537875 [0,2,0,0,0,0|1,0,0]=3 9616 B10R1.30 C=C1C=C(C=O)C(=C)C=C1 Amb25262252 [0,0,1,1,0,0|0,0,2]=4 9617 B10R1.230 CC1(C=O)C=CC=CC1=C Amb24698869 [0,0,1,1,0,0|0,0,0]=2 9618 B10R1.275 CC=1C=CC=CC(=O)C1C Amb25146868 [0,0,1,1,0,0|0,0,2]=4 9619 B10R1.2 CN1C(=CC=CC1=O)C=O Amb18643132 [0,0,1,1,0,0|2,0,0]=4 9620 B10R1.2 Cc1c(Cl)cccc1C=C Amb24077534 [0,0,1,1,0,0|1,0,1]=4 9621 B10R1.2 Cc1c(N)cccc1C=C Amb25292377 [0,0,1,1,0,0|1,0,1]=4 9622 B10R1.20 C=CC1CC=CCC1C=O Amb18643093 [0,0,1,1,0,0|0,0,2]=4 9623 B10R1.20 C=C[C@@H]1CC=CC[C@@H]1C=O Amb25339501 [0,0,1,1,0,0|0,0,2]=4 9624 B10R1.20 C=Cc1ccccc1C=O Amb18124354 [0,0,1,1,0,0|0,0,2]=4 9625 B10R1.27 CC(C[n]1cccc1)C=O Amb25337670 [0,0,1,1,0,0|1,0,1]=4 9626 B10R1.27 CC(Cc1c[s]cc1)C=O Amb18644680 [0,0,1,1,0,0|1,0,1]=4 9627 B10R1.27 CC(Cc1ccc[s]1)C=O Amb18644678 [0,0,1,1,0,0|1,0,1]=4 9628 B10R1.27 CC(Cc1ccco1)C=O Amb18643240 [0,0,1,1,0,0|1,0,1]=4 9629 B10R1.27 CC(Cc1cocc1)C=O Amb24715294 [0,0,1,1,0,0|1,0,1]=4 9630 B10R1.27 C\C(=C/c1cc[s]c1)\C=O Amb18644530 [0,0,1,1,0,0|1,0,1]=4 9631 B10R1.27 C\C(=C/c1ccc[nH]1)\C=O Amb18642995 [0,0,1,1,0,0|1,0,1]=4 9632 B10R1.27 C\C(=C\c1ccc[nH]1)\C=O Amb25785603 [0,0,1,1,0,0|1,0,1]=4 9633 B10R1.27 C\C(=C\c1ccc[s]1)\C=O Amb24433434 [0,0,1,1,0,0|1,0,1]=4 9634 B10R1.27 O=C\C(=C\c1cccs1)\C Amb17334333 [0,0,1,1,0,0|1,0,1]=4 9635 B10R1.161 O=CC1CC=CCC=CC1 Amb25187258 [0,0,1,1,0,0|0,0,2]=4 9636 B10R1.161 O=CC=1C=CC=CC=CC1 Amb25139496 [0,0,1,1,0,0|0,0,2]=4 9637 B10R1.172 C=Cc1cccc(c1)C=O Amb17593386 [0,0,1,1,0,0|0,0,2]=4 9638 B10R1.232 CC1(CO)C=CC=CC=C1 Amb24463964 [0,0,1,1,0,0|0,0,2]=4 9639 B10R2.6 C1CC1c2c[n]ccc2 Amb22235730 [1,0,0,1,0,0|1,0,1]=4 9640 B10R2.6 C1NC1c2c[n]ccc2 Amb18221862 [1,0,0,1,0,0|2,0,0]=4 9641 B10R2.6 C1NC1c2cc[n]cc2 Amb18221868 [1,0,0,1,0,0|2,0,0]=4 9642 B10R2.6 C1NC1c2cccc[n]2 Amb18860383 [1,0,0,1,0,0|2,0,0]=4 9643 B10R2.6 C1NC1c2ccccc2 Amb25082886 [1,0,0,1,0,0|1,0,0]=3 9644 B10R2.6 C1O[C@@H]1c2c[n]ccc2 Amb25758556 [1,0,0,1,0,0|1,0,1]=4 9645 B10R2.6 C1O[C@@H]1c2cc[n]cc2 Amb24103202 [1,0,0,1,0,0|1,0,1]=4 9646 B10R2.6 C1O[C@@H]1c2cccc[n]2 Amb24481607 [1,0,0,1,0,0|1,0,1]=4 9647 B10R2.6 C1O[C@H]1c2cc[n]cc2 Amb24103149 [1,0,0,1,0,0|1,0,1]=4 9648 B10R2.6 C1O[C@H]1c2cccc[n]2 Amb24101968 [1,0,0,1,0,0|1,0,1]=4 9649 B10R2.6 C1SC1c2ccccc2 Amb17666888 [1,0,0,1,0,0|0,1,0]=3 9650 B10R2.6 C=1NC1c2ccccc2 Amb25848069 [1,0,0,1,0,0|1,0,1]=4 9651 B10R2.6 O1CC1c2ccncc2 Amb17090250 [1,0,0,1,0,0|1,0,1]=4 9652 B10R2.6 c1ccc(cn1)C2CO2 Amb17090249 [1,0,0,1,0,0|1,0,1]=4 9653 B10R2.6 c1ccc(nc1)C2CO2 Amb17090248 [1,0,0,1,0,0|1,0,1]=4 9654 B10R2.196 ClC1(Cl)c2ccccc12 Amb25347359 [1,0,0,1,0,0|2,0,0]=4 9655 B10R2.196 FC1(F)c2ccccc12 Amb25305708 [1,0,0,1,0,0|2,0,0]=4 9656 B10R2.320 BrC1=Cc2ccccc21 Amb20248944 [1,0,0,1,0,0|1,0,1]=4 9657 B10R2.320 CC1Cc2ccccc12 Amb17778870 [1,0,0,1,0,0|0,0,1]=3 9658 B10R2.320 ClC1=Cc2ccccc21 Amb24402931 [1,0,0,1,0,0|1,0,1]=4 9659 B10R2.320 ClC1Cc2ccccc12 Amb17778800 [1,0,0,1,0,0|1,0,0]=3 9660 B10R2.320 O=C1Cc2[n]cccc21 Amb24061107 [1,0,0,1,0,0|1,0,1]=4 9661 B10R2.320 O=C1Cc2c[n]ccc21 Amb24587705 [1,0,0,1,0,0|1,0,1]=4 9662 B10R2.320 O=C1Cc2ccc[n]c21 Amb24479915 [1,0,0,1,0,0|1,0,1]=4 9663 B10R2.320 OC1=Cc2ccccc21 Amb22002555 [1,0,0,1,0,0|1,0,1]=4 9664 B10R2.320 OC1Cc2c[n]ccc21 Amb24478648 [1,0,0,1,0,0|1,0,1]=4 9665 B10R2.320 OC1Cc2ccccc12 Amb17778676 [1,0,0,1,0,0|0,0,1]=3 9666 B10R2.320 O[C@@H]1Cc2ccccc21 Amb25676494 [1,0,0,1,0,0|0,0,1]=3 9667 B10R2.320 O[C@H]1Cc2ccccc21 Amb24704470 [1,0,0,1,0,0|0,0,1]=3 9668 B10R2.320 [NH3+]C1Cc2ccccc12 Amb17778877 [1,0,0,1,0,0|1,0,0]=3 9669 B10R2.7 C1C=Cc2[n]cccc21 Amb22496284 [1,0,0,1,0,0|2,0,0]=4 9670 B10R2.7 C1C=Cc2ccc[n]c21 Amb21963524 [1,0,0,1,0,0|2,0,0]=4 9671 B10R2.7 C1C=Nc2[n]cccc21 Amb21927360 [1,0,0,1,0,0|2,0,0]=4 9672 B10R2.7 C1C=Nc2ccc[n]c21 Amb24099986 [1,0,0,1,0,0|2,0,0]=4 9673 B10R2.7 C1CPc2ccccc21 Amb24477880 [1,0,0,1,0,0|1,0,1]=4 9674 B10R2.7 C1CSc2ccccc21 Amb24101549 [1,0,0,1,0,0|0,1,1]=4 9675 B10R2.7 C1N=Cc2ccccc21 Amb20241766 [1,0,0,1,0,0|2,0,0]=4 9676 B10R2.7 C1NCc2ccccc12 Amb17739945 [1,0,0,1,0,0|2,0,0]=4 9677 B10R2.7 C1OSc2ccccc21 Amb25250664 [1,0,0,1,0,0|1,1,0]=4 9678 B10R2.7 C1SCc2ccccc21 Amb21962922 [1,0,0,1,0,0|2,0,0]=4 9679 B10R2.7 c1[nH]c2ccccc2[p]1 Amb24340147 [1,0,0,1,0,0|2,0,0]=4 9680 B10R2.7 c1[n]c2ccccc2[se]1 Amb22346204 [1,0,0,1,0,0|1,1,0]=4 9681 B10R2.7 c1ccc2c(c1)C=CC2 Amb2383760 [1,0,0,1,0,0|1,0,0]=3 9682 B10R2.7 c1ccc2c(c1)NCC2 Amb1869493 [1,0,0,1,0,0|1,0,1]=4 9683 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205278 [1,0,0,1,0,0|1,1,0]=4 9684 B10R2.7 c1ccc2c(c1)[nH+]cs2 Amb16205847 [1,0,0,1,0,0|1,1,0]=4 9685 B12R2.11 Br[C@@H]1C[C@@H]1Cc2ccccc2 Amb25280103 [0,0,0,1,0,1|1,0,1]=4 9686 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [0,0,0,1,0,1|1,0,1]=4 9687 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [0,0,0,1,0,1|1,0,1]=4 9688 B12R2.11 ClC1CC1Oc2ccccc2 Amb25799021 [0,0,0,1,0,1|1,0,1]=4 9689 B12R2.11 Cl[C@@H]1C[C@@H]1Oc2ccccc2 Amb24652641 [0,0,0,1,0,1|1,0,1]=4 9690 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [0,0,0,1,0,1|1,0,1]=4 9691 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [0,0,0,1,0,1|1,0,1]=4 9692 B12R2.11 NC1CC1Oc2ccccc2 Amb24761155 [0,0,0,1,0,1|1,0,1]=4 9693 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [0,0,0,1,0,1|0,0,2]=4 9694 B12R2.11 OC1CC1Sc2ccccc2 Amb25788139 [0,0,0,1,0,1|0,0,2]=4 9695 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [0,0,0,1,0,1|0,0,2]=4 9696 B12R2.11 O[C@H]1C[C@@H]1Sc2ccccc2 Amb24745857 [0,0,0,1,0,1|0,0,2]=4 9697 B12R2.18 BN1C(C)Sc2ccccc12 Amb24085866 [0,0,0,1,0,1|2,0,0]=4 9698 B12R2.18 Brc1c(C)sc2c1cccc2 Amb10975969 [0,0,0,1,0,1|1,0,1]=4 9699 B12R2.18 C=C1C(O)Cc2ccccc21 Amb24576594 [0,0,0,1,0,1|2,0,0]=4 9700 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [0,0,0,1,0,1|0,0,2]=4 9701 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [0,0,0,1,0,1|1,0,1]=4 9702 B12R2.18 CC1Cc2ccccc2C1Br Amb25106421 [0,0,0,1,0,1|1,0,1]=4 9703 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [0,0,0,1,0,1|1,0,1]=4 9704 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [0,0,0,1,0,1|1,0,1]=4 9705 B12R2.18 CC1Cc2ccccc2N1N Amb24065299 [0,0,0,1,0,1|2,0,0]=4 9706 B12R2.18 CC1Nc2ccccc2N1Cl Amb25095932 [0,0,0,1,0,1|2,0,0]=4 9707 B12R2.18 CC1Oc2[n]cccc2C1=O Amb24084833 [0,0,0,1,0,1|1,0,0]=3 9708 B12R2.18 CC1Oc2c[n]ccc2C1=O Amb24084859 [0,0,0,1,0,1|1,0,0]=3 9709 B12R2.18 CC1Oc2ccc[n]c2C1=O Amb21963700 [0,0,0,1,0,1|1,0,0]=3 9710 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [0,0,0,1,0,1|1,0,1]=4 9711 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [0,0,0,1,0,1|0,0,2]=4 9712 B12R2.18 CC1Sc2ccccc2C1=O Amb25032373 [0,0,0,1,0,1|0,0,0]=2 9713 B12R2.18 CC1Sc2ccccc2C1N Amb18278067 [0,0,0,1,0,1|1,0,1]=4 9714 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,0,0,1,0,1|1,0,1]=4 9715 B12R2.18 CN1Cc2[n]cccc2C1=O Amb21963104 [0,0,0,1,0,1|2,0,0]=4 9716 B12R2.18 CN1N=C2C=CC=CN2C1=O Amb24509650 [0,0,0,1,0,1|2,0,0]=4 9717 B12R2.18 CN1Sc2ccccc2C1=S Amb22347590 [0,0,0,1,0,1|1,1,0]=4 9718 B12R2.18 CN1[C@H](C)Cc2ccccc12 Amb24068204 [0,0,0,1,0,1|2,0,0]=4 9719 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [0,0,0,1,0,1|0,0,0]=2 9720 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1N Amb24578752 [0,0,0,1,0,1|1,0,1]=4 9721 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [0,0,0,1,0,1|0,0,2]=4 9722 B12R2.18 C[C@H]1Nc2ccccc2[C@@H]1O Amb24629727 [0,0,0,1,0,1|0,0,2]=4 9723 B12R2.18 C[n]1[nH]c2ccccc2c1=O Amb24102205 [0,0,0,1,0,1|1,0,0]=3 9724 B12R2.18 C[n]1[n]c2ccccc2c1I Amb22494609 [0,0,0,1,0,1|2,0,0]=4 9725 B12R2.18 C[n]1[n]c2ccccc2c1N Amb24084319 [0,0,0,1,0,1|2,0,0]=4 9726 B12R2.18 Cc1[nH]c2c(c1C)cccc2 Amb1205252 [0,0,0,1,0,1|1,0,1]=4 9727 B12R2.18 Cc1[nH]c2c(c1I)cccc2 Amb17134452 [0,0,0,1,0,1|1,0,1]=4 9728 B12R2.18 Cc1[nH]c2ccccc2c1Cl Amb17673944 [0,0,0,1,0,1|1,0,1]=4 9729 B12R2.18 Cc1[nH]c2ccccc2c1F Amb24120604 [0,0,0,1,0,1|1,0,1]=4 9730 B12R2.18 Cc1[nH]c2ccccc2c1S Amb25119252 [0,0,0,1,0,1|0,1,1]=4 9731 B12R2.18 Cc1[s]c2ccccc2c1Cl Amb25376923 [0,0,0,1,0,1|1,0,1]=4 9732 B12R2.18 Cc1[s]c2ccccc2c1F Amb24697086 [0,0,0,1,0,1|1,0,1]=4 9733 B12R2.18 Cc1[s]c2ccccc2c1I Amb25247275 [0,0,0,1,0,1|1,0,1]=4 9734 B12R2.18 Cc1[s]c2ccccc2c1S Amb24679291 [0,0,0,1,0,1|0,1,1]=4 9735 B12R2.18 Cc1c2ccccc2[n][n]1C Amb23437154 [0,0,0,1,0,1|2,0,0]=4 9736 B12R2.18 Cc1c2ccccc2[s]c1C Amb22057362 [0,0,0,1,0,1|1,0,1]=4 9737 B12R2.18 Cc1oc2ccccc2c1Br Amb18773210 [0,0,0,1,0,1|1,0,1]=4 9738 B12R2.18 NC1=Nc2ccccc2C1=O Amb24078927 [0,0,0,1,0,1|1,0,1]=4 9739 B12R2.18 NC1C(C)Cc2c1cccc2 Amb17232033 [0,0,0,1,0,1|1,0,1]=4 9740 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [0,0,0,1,0,1|1,0,0]=3 9741 B12R2.18 NC1Oc2ccccc2C1=O Amb24349623 [0,0,0,1,0,1|1,0,0]=3 9742 B12R2.18 NN1Sc2ccccc2C1=O Amb25376699 [0,0,0,1,0,1|2,0,0]=4 9743 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [0,0,0,1,0,1|1,0,0]=3 9744 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [0,0,0,1,0,1|1,0,0]=3 9745 B12R2.18 O=C1C(=Nc2c1cccc2)Cl Amb17594117 [0,0,0,1,0,1|1,0,1]=4 9746 B12R2.18 O=C1C(=S)Nc2c1cccc2 Amb17594053 [0,0,0,1,0,1|1,0,1]=4 9747 B12R2.18 O=C1C(Br)Oc2ccccc21 Amb25835380 [0,0,0,1,0,1|1,0,0]=3 9748 B12R2.18 O=C1C(C)Nc2c1cccc2 Amb17593674 [0,0,0,1,0,1|0,0,0]=2 9749 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [0,0,0,1,0,1|1,0,1]=4 9750 B12R2.18 O=C1C(Cl)Nc2ccccc21 Amb25059201 [0,0,0,1,0,1|1,0,0]=3 9751 B12R2.18 O=C1C(Cl)Oc2ccccc21 Amb24061516 [0,0,0,1,0,1|1,0,0]=3 9752 B12R2.18 O=C1C(Cl)Sc2ccccc21 Amb24533113 [0,0,0,1,0,1|1,0,0]=3 9753 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [0,0,0,1,0,1|1,0,0]=3 9754 B12R2.18 O=C1C(F)Sc2ccccc21 Amb24690556 [0,0,0,1,0,1|1,0,0]=3 9755 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [0,0,0,1,0,1|1,0,0]=3 9756 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [0,0,0,1,0,1|1,0,0]=3 9757 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [0,0,0,1,0,1|1,0,0]=3 9758 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [0,0,0,1,0,1|1,0,0]=3 9759 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [0,0,0,1,0,1|1,0,0]=3 9760 B12R2.18 OC1Oc2ccccc2C1=O Amb24061518 [0,0,0,1,0,1|1,0,0]=3 9761 B12R2.18 ON1Nc2ccccc2C1=O Amb24078896 [0,0,0,1,0,1|2,0,0]=4 9762 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [0,0,0,1,0,1|1,0,0]=3 9763 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [0,0,0,1,0,1|1,0,1]=4 9764 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,0,0,1,0,1|2,0,0]=4 9765 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,0,0,1,0,1|2,0,0]=4 9766 B12R2.24 CC1C=Cc2[n]cccc2O1 Amb25700391 [0,0,0,1,0,1|2,0,0]=4 9767 B12R2.24 CC1C=Cc2c(N1)cccc2 Amb17593644 [0,0,0,1,0,1|1,0,0]=3 9768 B12R2.24 CC1C=Cc2ccccc2O1 Amb24715788 [0,0,0,1,0,1|1,0,0]=3 9769 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [0,0,0,1,0,1|1,0,1]=4 9770 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [0,0,0,1,0,1|1,0,1]=4 9771 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [0,0,0,1,0,1|1,0,1]=4 9772 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [0,0,0,1,0,1|1,0,1]=4 9773 B12R2.24 CC1CNc2c(O1)cccc2 Amb17097653 [0,0,0,1,0,1|1,0,1]=4 9774 B12R2.24 CC1CSc2ccccc2N1 Amb20622496 [0,0,0,1,0,1|0,1,1]=4 9775 B12R2.24 CC1Cc2ccccc2CN1 Amb22755434 [0,0,0,1,0,1|2,0,0]=4 9776 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [0,0,0,1,0,1|1,0,0]=3 9777 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [0,0,0,1,0,1|1,0,1]=4 9778 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [0,0,0,1,0,1|0,0,2]=4 9779 B12R2.24 CC1Nc2ccccc2CS1 Amb24373918 [0,0,0,1,0,1|2,0,0]=4 9780 B12R2.24 CC1Nc2ccccc2N=N1 Amb24671082 [0,0,0,1,0,1|2,0,0]=4 9781 B12R2.24 CN1C=Nc2ccccc2N1 Amb24623403 [0,0,0,1,0,1|2,0,0]=4 9782 B12R2.24 CN1Cc2ccccc2N=C1 Amb24597104 [0,0,0,1,0,1|2,0,0]=4 9783 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [0,0,0,1,0,1|1,0,1]=4 9784 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [0,0,0,1,0,1|2,0,0]=4 9785 B12R2.24 C[C@@H]1Cc2ccccc2CN1 Amb22751934 [0,0,0,1,0,1|2,0,0]=4 9786 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [0,0,0,1,0,1|1,0,1]=4 9787 B12R2.24 C[C@H]1CNc2ccccc2N1 Amb25348686 [0,0,0,1,0,1|1,0,1]=4 9788 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [0,0,0,1,0,1|2,0,0]=4 9789 B12R2.24 C[C@H]1Cc2ccccc2CN1 Amb24087372 [0,0,0,1,0,1|2,0,0]=4 9790 B12R2.24 C[n+]1ccc2c(c1)cccc2 Amb1147460 [0,0,0,1,0,1|2,0,0]=4 9791 B12R2.24 Cc1ccc2c(n1)cccc2 Amb1151967 [0,0,0,1,0,1|1,0,1]=4 9792 B12R2.24 Cc1ccc2ccccc2[n]1 Amb24097096 [0,0,0,1,0,1|1,0,1]=4 9793 B12R2.24 Cc1cnc2c(c1)cccc2 Amb2447051 [0,0,0,1,0,1|1,0,1]=4 9794 B12R2.24 NC1C=Cc2c(C1)cccc2 Amb17470378 [0,0,0,1,0,1|2,0,0]=4 9795 B12R2.24 NC1C=Cc2ccccc2O1 Amb24618074 [0,0,0,1,0,1|2,0,0]=4 9796 B12R2.24 N[C@H]1Cc2ccccc2C=C1 Amb24699393 [0,0,0,1,0,1|2,0,0]=4 9797 B12R2.24 OC1C=Cc2ccccc2O1 Amb21964141 [0,0,0,1,0,1|2,0,0]=4 9798 B12R2.24 O[C@H]1Cc2ccccc2C=C1 Amb25792328 [0,0,0,1,0,1|2,0,0]=4 9799 B12R2.24 [13CH3][13c]1[13cH][13cH][13c]2[13c]([13cH]1)[13cH][13cH][13cH][13cH]2 Amb17617622 [0,0,0,1,0,1|1,0,1]=4 9800 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,0,0,1,0,1|1,0,1]=4 9801 B12R2.27 C#CC1CC1c2ccccc2 Amb22002424 [0,0,0,1,0,1|1,0,1]=4 9802 B12R2.27 C=CC1CC1c2cc[n]cc2 Amb24102778 [0,0,0,1,0,1|2,0,0]=4 9803 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,0,0,1,0,1|2,0,0]=4 9804 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,0,0,1,0,1|2,0,0]=4 9805 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,0,0,1,0,1|2,0,0]=4 9806 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,0,0,1,0,1|2,0,0]=4 9807 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,0,0,1,0,1|1,0,1]=4 9808 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,0,0,1,0,1|1,0,1]=4 9809 B12R2.27 N#C[C@H]1CC1c2ccccc2 Amb24544864 [0,0,0,1,0,1|1,0,1]=4 9810 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,0,0,1,0,1|1,0,1]=4 9811 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,0,0,1,0,1|1,0,1]=4 9812 B12R2.27 NC[C@@H]1CC1c2ccccc2 Amb17605571 [0,0,0,1,0,1|1,0,1]=4 9813 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,0,0,1,0,1|1,0,1]=4 9814 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,0,0,1,0,1|1,0,1]=4 9815 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [0,0,0,1,0,1|2,0,0]=4 9816 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,0,0,1,0,1|0,0,0]=2 9817 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,0,0,1,0,1|0,0,0]=2 9818 B12R2.27 O=CC1N=C1c2ccccc2 Amb16233228 [0,0,0,1,0,1|1,0,0]=3 9819 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,0,0,1,0,1|1,0,0]=3 9820 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,0,0,1,0,1|0,0,0]=2 9821 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [0,0,0,1,0,1|1,0,0]=3 9822 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,0,0,1,0,1|0,0,0]=2 9823 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,0,0,1,0,1|0,0,0]=2 9824 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,0,0,1,0,1|0,0,2]=4 9825 B12R2.32 BrCC1Cc2c(O1)cccc2 Amb17040446 [0,0,0,1,0,1|1,0,1]=4 9826 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [0,0,0,1,0,1|1,0,1]=4 9827 B12R2.32 BrC[C@H]1Cc2ccccc2O1 Amb25695955 [0,0,0,1,0,1|1,0,1]=4 9828 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [0,0,0,1,0,1|1,0,1]=4 9829 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [0,0,0,1,0,1|2,0,0]=4 9830 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [0,0,0,1,0,1|2,0,0]=4 9831 B12R2.32 CSC1Cc2ccccc2C1 Amb25712718 [0,0,0,1,0,1|2,0,0]=4 9832 B12R2.32 ClCC1Cc2ccccc2S1 Amb24688554 [0,0,0,1,0,1|1,0,1]=4 9833 B12R2.32 FCC1Cc2ccccc2N1 Amb25276456 [0,0,0,1,0,1|1,0,1]=4 9834 B12R2.32 FC[C@@H]1Cc2ccccc2N1 Amb25041577 [0,0,0,1,0,1|1,0,1]=4 9835 B12R2.32 ICC1Cc2ccccc2N1 Amb24061262 [0,0,0,1,0,1|1,0,1]=4 9836 B12R2.32 ICC1Cc2ccccc2O1 Amb23513694 [0,0,0,1,0,1|1,0,1]=4 9837 B12R2.32 N#CC1Cc2ccccc2O1 Amb24384661 [0,0,0,1,0,1|1,0,1]=4 9838 B12R2.32 N#CC1Cc2ccccc2S1 Amb24465725 [0,0,0,1,0,1|1,0,1]=4 9839 B12R2.32 NCC1Cc2c(O1)cccc2 Amb1088943 [0,0,0,1,0,1|1,0,1]=4 9840 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [0,0,0,1,0,1|1,0,1]=4 9841 B12R2.32 NNC1Cc2c(C1)cccc2 Amb10071076 [0,0,0,1,0,1|2,0,0]=4 9842 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [0,0,0,1,0,1|2,0,0]=4 9843 B12R2.32 NNC1Cc2ccccc2C1 Amb21954062 [0,0,0,1,0,1|2,0,0]=4 9844 B12R2.32 O=CC1C=C2C=CC=CN2N1 Amb24486973 [0,0,0,1,0,1|1,0,1]=4 9845 B12R2.32 O=CC1C=c2ccccc2=C1 Amb24100778 [0,0,0,1,0,1|0,0,1]=3 9846 B12R2.32 O=CC1Cc2c[n]ccc2C1 Amb24509571 [0,0,0,1,0,1|1,0,0]=3 9847 B12R2.32 O=CC1Cc2ccc[n]c2C1 Amb25851252 [0,0,0,1,0,1|1,0,0]=3 9848 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [0,0,0,1,0,1|0,0,0]=2 9849 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [0,0,0,1,0,1|0,0,1]=3 9850 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [0,0,0,1,0,1|0,0,1]=3 9851 B12R2.32 O=Cc1cc2c(o1)cccc2 Amb1156936 [0,0,0,1,0,1|0,0,2]=4 9852 B12R2.32 O=Cc1cc2c(s1)cccc2 Amb2447439 [0,0,0,1,0,1|0,0,2]=4 9853 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [0,0,0,1,0,1|0,0,2]=4 9854 B12R2.32 OCC1Cc2ccccc2S1 Amb24513744 [0,0,0,1,0,1|0,0,2]=4 9855 B12R2.32 OC[C@@H]1Cc2ccccc2N1 Amb22336386 [0,0,0,1,0,1|0,0,2]=4 9856 B12R2.32 OC[C@H]1Cc2ccccc2N1 Amb24746775 [0,0,0,1,0,1|0,0,2]=4 9857 B12R2.32 SCC1Cc2ccccc2S1 Amb25149129 [0,0,0,1,0,1|0,1,1]=4 9858 B12R2.37 CC1=C(C1=O)c2ccccc2 Amb1914070 [0,0,0,1,0,1|0,0,1]=3 9859 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [0,0,0,1,0,1|0,0,2]=4 9860 B12R2.37 C[C@@H]1C(c2ccccc2)[N@@]1C Amb23513697 [0,0,0,1,0,1|2,0,0]=4 9861 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [0,0,0,1,0,1|1,0,1]=4 9862 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [0,0,0,1,0,1|1,0,1]=4 9863 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [0,0,0,1,0,1|1,0,1]=4 9864 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [0,0,0,1,0,1|1,0,1]=4 9865 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [0,0,0,1,0,1|0,0,1]=3 9866 B12R2.37 NC=1C(=O)C1c2ccccc2 Amb24509252 [0,0,0,1,0,1|1,0,1]=4 9867 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [0,0,0,1,0,1|1,0,1]=4 9868 B12R2.37 OC=1C(=O)C1c2ccccc2 Amb24631580 [0,0,0,1,0,1|1,0,1]=4 9869 B12R2.94 CC1(Cc2ccccc2)NN1 Amb24672487 [0,0,0,1,0,1|2,0,0]=4 9870 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [0,0,0,1,0,1|1,0,0]=3 9871 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [0,0,0,1,0,1|1,0,1]=4 9872 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [0,0,0,1,0,1|2,0,0]=4 9873 B12R2.2058 C1CC(C1)Sc2ccccc2 Amb10976023 [0,0,0,1,0,1|1,0,1]=4 9874 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [0,0,0,1,0,1|1,0,1]=4 9875 B12R2.2058 C1N=CN1Cc2ccccc2 Amb25709568 [0,0,0,1,0,1|2,0,0]=4 9876 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [0,0,0,1,0,1|1,0,1]=4 9877 B12R2.2058 C1NCC1Oc2ccccc2 Amb19312256 [0,0,0,1,0,1|1,0,1]=4 9878 B12R2.2058 C1NCC1Sc2ccccc2 Amb18798478 [0,0,0,1,0,1|1,0,1]=4 9879 B12R2.2058 C1OCC1Nc2ccccc2 Amb22737358 [0,0,0,1,0,1|0,0,2]=4 9880 B12R2.2058 C1OCC1Sc2ccccc2 Amb25145934 [0,0,0,1,0,1|0,0,2]=4 9881 B12R2.2058 C1SCC1Nc2ccccc2 Amb25362257 [0,0,0,1,0,1|0,1,1]=4 9882 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [0,0,0,1,0,1|1,0,1]=4 9883 B12R2.2058 N1CC(C1)Oc2ccccc2 Amb15701497 [0,0,0,1,0,1|1,0,1]=4 9884 B12R2.504 CC1C2CC(C=CC=C2)C1=O Amb24378377 [0,0,0,1,0,1|0,0,2]=4 9885 B12R2.48 BrCC1(CC1)c2ccccc2 Amb17240828 [0,1,0,1,0,0|1,0,1]=4 9886 B12R2.48 C#CC1(CC1)c2ccccc2 Amb10067569 [0,1,0,1,0,0|1,0,1]=4 9887 B12R2.48 CCC1(CO1)c2ccccc2 Amb25063378 [0,1,0,1,0,0|0,0,2]=4 9888 B12R2.48 CNC1(CC1)c2ccccc2 Amb25063013 [0,1,0,1,0,0|1,0,1]=4 9889 B12R2.48 COC1(CC1)c2ccccc2 Amb24434857 [0,1,0,1,0,0|1,0,1]=4 9890 B12R2.48 ClCC1(CC1)c2ccccc2 Amb17232627 [0,1,0,1,0,0|1,0,1]=4 9891 B12R2.48 N#CC1(CC1)c2ccccc2 Amb2099443 [0,1,0,1,0,0|1,0,1]=4 9892 B12R2.48 NCC1(CC1)c2ccccc2 Amb10603193 [0,1,0,1,0,0|1,0,1]=4 9893 B12R2.48 NCC1(CC1)c2ccccc2 Amb2099519 [0,1,0,1,0,0|1,0,1]=4 9894 B12R2.48 O=CC1(CC1)c2ccccc2 Amb17399901 [0,1,0,1,0,0|0,0,0]=2 9895 B12R2.48 O=CC1(CO1)c2ccccc2 Amb24486157 [0,1,0,1,0,0|0,0,0]=2 9896 B12R2.48 OCC1(CC1)c2ccccc2 Amb20240525 [0,1,0,1,0,0|0,0,2]=4 9897 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,1,0,1,0,0|0,0,2]=4 9898 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [0,1,0,1,0,0|1,0,1]=4 9899 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [0,1,0,1,0,0|1,0,1]=4 9900 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [0,1,0,1,0,0|0,0,2]=4 9901 B12R2.116 FC1(COC1)c2ccccc2 Amb22738854 [0,1,0,1,0,0|0,0,2]=4 9902 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,1,0,1,0,0|1,0,1]=4 9903 B12R2.116 NC1(CNC1)c2ccccc2 Amb24120649 [0,1,0,1,0,0|1,0,1]=4 9904 B12R2.116 NC1(COC1)c2ccccc2 Amb19892665 [0,1,0,1,0,0|0,0,2]=4 9905 B12R2.116 NC1(COC1)c2ccccc2 Amb22386882 [0,1,0,1,0,0|0,0,2]=4 9906 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,1,0,1,0,0|1,0,1]=4 9907 B12R2.116 OC1(CNC1)c2ccccc2 Amb22406135 [0,1,0,1,0,0|1,0,1]=4 9908 B12R2.116 OC1(CNC1)c2ccccc2 Amb22496452 [0,1,0,1,0,0|1,0,1]=4 9909 B12R2.116 OC1(COC1)c2ccccc2 Amb21960821 [0,1,0,1,0,0|0,0,2]=4 9910 B12R2.116 OC1(CSC1)c2ccccc2 Amb22386890 [0,1,0,1,0,0|0,1,1]=4 9911 B12R2.235 CC1(CC1Cl)c2ccccc2 Amb25275063 [0,1,0,1,0,0|1,0,1]=4 9912 B12R2.235 CC1(CC1N)c2ccccc2 Amb18947391 [0,1,0,1,0,0|1,0,1]=4 9913 B12R2.235 CC1(CC1N)c2ccccc2 Amb19148136 [0,1,0,1,0,0|1,0,1]=4 9914 B12R2.235 C[C@@]1(C[C@@H]1Br)c2ccccc2 Amb25176508 [0,1,0,1,0,0|1,0,1]=4 9915 B12R2.235 C[C@]1(C[C@@H]1Cl)c2ccccc2 Amb24557815 [0,1,0,1,0,0|1,0,1]=4 9916 B12R2.235 NC1(CC1F)c2ccccc2 Amb25194668 [0,1,0,1,0,0|1,0,1]=4 9917 B12R2.235 N[C@@H]1C[C@@]1(F)c2ccccc2 Amb24100224 [0,1,0,1,0,0|1,0,1]=4 9918 B12R2.235 N[C@@H]1C[C@]1(F)c2ccccc2 Amb24100239 [0,1,0,1,0,0|1,0,1]=4 9919 B12R2.235 N[C@@]1(C[C@H]1F)c2ccccc2 Amb24655079 [0,1,0,1,0,0|1,0,1]=4 9920 B12R2.235 N[C@H]1C[C@]1(F)c2ccccc2 Amb24539890 [0,1,0,1,0,0|1,0,1]=4 9921 B12R2.235 N[C@]1(C[C@@H]1F)c2ccccc2 Amb24100238 [0,1,0,1,0,0|1,0,1]=4 9922 B12R2.235 N[C@]1(C[C@H]1F)c2ccccc2 Amb24744741 [0,1,0,1,0,0|1,0,1]=4 9923 B12R2.2403 CC1(C)C=Cc2ccccc12 Amb17844051 [0,1,0,1,0,0|1,0,0]=3 9924 B12R2.2403 CC1(C)C=Nc2ccccc12 Amb17778640 [0,1,0,1,0,0|1,0,0]=3 9925 B12R2.2403 CC1(C)CCc2ccccc12 Amb24657207 [0,1,0,1,0,0|1,0,1]=4 9926 B12R2.2403 CC1(C)CNc2c1cccc2 Amb17232031 [0,1,0,1,0,0|1,0,1]=4 9927 B12R2.2403 CC1(C)CNc2ccccc12 Amb20630653 [0,1,0,1,0,0|1,0,1]=4 9928 B12R2.2403 CC1(C)NCc2ccccc12 Amb23439228 [0,1,0,1,0,0|2,0,0]=4 9929 B12R2.2403 CC1(C)NNc2ccccc12 Amb25089466 [0,1,0,1,0,0|2,0,0]=4 9930 B12R2.2403 CC1(C)OCc2ccccc12 Amb23558274 [0,1,0,1,0,0|2,0,0]=4 9931 B12R2.2403 FC1(F)C=Cc2ccccc12 Amb24726039 [0,1,0,1,0,0|2,0,0]=4 9932 B12R2.1 BrCC1C=Cc2ccccc21 Amb25095724 [0,1,0,1,0,0|1,0,0]=3 9933 B12R2.1 BrCC1CCc2ccccc21 Amb22500999 [0,1,0,1,0,0|1,0,1]=4 9934 B12R2.1 BrCC1COc2ccccc21 Amb25063018 [0,1,0,1,0,0|0,0,2]=4 9935 B12R2.1 BrCC1CSc2ccccc21 Amb25720096 [0,1,0,1,0,0|0,1,1]=4 9936 B12R2.1 BrC[C@@H]1COc2ccccc21 Amb25694007 [0,1,0,1,0,0|0,0,2]=4 9937 B12R2.1 BrC[C@H]1COc2ccccc21 Amb24368636 [0,1,0,1,0,0|0,0,2]=4 9938 B12R2.1 BrCc1c[nH]c2ccccc12 Amb17689304 [0,1,0,1,0,0|1,0,1]=4 9939 B12R2.1 BrCc1coc2ccccc21 Amb23401826 [0,1,0,1,0,0|0,0,2]=4 9940 B12R2.1 BrCc1csc2c1cccc2 Amb10609548 [0,1,0,1,0,0|0,1,1]=4 9941 B12R2.1 C=CC1CNc2ccccc21 Amb24486031 [0,1,0,1,0,0|1,0,0]=3 9942 B12R2.1 CCC1CCc2ccccc21 Amb20248519 [0,1,0,1,0,0|1,0,1]=4 9943 B12R2.1 CCC1NCc2ccccc21 Amb24377125 [0,1,0,1,0,0|1,0,1]=4 9944 B12R2.1 CCC1SCc2ccccc21 Amb24092839 [0,1,0,1,0,0|1,0,1]=4 9945 B12R2.1 CC[n+]1c[s]c2ccccc12 Amb24414503 [0,1,0,1,0,0|1,1,0]=4 9946 B12R2.1 CC[n+]1csc2c1cccc2 Amb16205277 [0,1,0,1,0,0|1,1,0]=4 9947 B12R2.1 CC[n]1c[n]c2ccccc12 Amb19114164 [0,1,0,1,0,0|2,0,0]=4 9948 B12R2.1 CCc1csc2ccccc12 Amb17939293 [0,1,0,1,0,0|0,1,1]=4 9949 B12R2.1 CCn1cnc2c1cccc2 Amb1104116 [0,1,0,1,0,0|2,0,0]=4 9950 B12R2.1 CNC1CCc2c1cccc2 Amb1117068 [0,1,0,1,0,0|1,0,1]=4 9951 B12R2.1 CNC1CCc2ccccc21 Amb22757336 [0,1,0,1,0,0|1,0,1]=4 9952 B12R2.1 CN[C@@H]1CCc2ccccc21 Amb25808104 [0,1,0,1,0,0|1,0,1]=4 9953 B12R2.1 CNc1c[nH]c2ccccc12 Amb18553874 [0,1,0,1,0,0|1,0,1]=4 9954 B12R2.1 CNc1c[s]c2ccccc21 Amb23403655 [0,1,0,1,0,0|0,1,1]=4 9955 B12R2.1 COC1=CCc2ccccc12 Amb17778910 [0,1,0,1,0,0|1,0,1]=4 9956 B12R2.1 COC1COc2ccccc21 Amb24102318 [0,1,0,1,0,0|0,0,2]=4 9957 B12R2.1 COC1OCc2ccccc21 Amb24323529 [0,1,0,1,0,0|2,0,0]=4 9958 B12R2.1 CO[n]1ccc2ccccc12 Amb24117866 [0,1,0,1,0,0|2,0,0]=4 9959 B12R2.1 COc1c[nH]c2ccccc12 Amb22489959 [0,1,0,1,0,0|1,0,1]=4 9960 B12R2.1 CSC1CCc2ccccc21 Amb24684843 [0,1,0,1,0,0|1,0,1]=4 9961 B12R2.1 CSc1coc2ccccc12 Amb24085388 [0,1,0,1,0,0|0,0,2]=4 9962 B12R2.1 C\C=C/1\C=Cc2ccccc21 Amb25322411 [0,1,0,1,0,0|1,0,1]=4 9963 B12R2.1 C\C=C\1/CNc2ccccc21 Amb25858232 [0,1,0,1,0,0|1,0,1]=4 9964 B12R2.1 ClCC1C=Cc2ccccc21 Amb24556989 [0,1,0,1,0,0|1,0,0]=3 9965 B12R2.1 ClCC1CCc2ccccc21 Amb22500998 [0,1,0,1,0,0|1,0,1]=4 9966 B12R2.1 ClC[n]1c[n]c2ccccc12 Amb25790050 [0,1,0,1,0,0|2,0,0]=4 9967 B12R2.1 ClCc1c[nH]c2ccccc21 Amb18862655 [0,1,0,1,0,0|1,0,1]=4 9968 B12R2.1 Cl\C=C/1\CCc2ccccc21 Amb24519209 [0,1,0,1,0,0|1,0,1]=4 9969 B12R2.1 FCC1CNc2ccccc21 Amb25178926 [0,1,0,1,0,0|1,0,1]=4 9970 B12R2.1 FCc1c[nH]c2ccccc21 Amb24574383 [0,1,0,1,0,0|1,0,1]=4 9971 B12R2.1 ICC1CCc2ccccc21 Amb24721376 [0,1,0,1,0,0|1,0,1]=4 9972 B12R2.1 ICC1COc2ccccc21 Amb24060947 [0,1,0,1,0,0|0,0,2]=4 9973 B12R2.1 ICC1CSc2ccccc21 Amb24513745 [0,1,0,1,0,0|0,1,1]=4 9974 B12R2.1 ICc1c[s]c2ccccc21 Amb24750093 [0,1,0,1,0,0|0,1,1]=4 9975 B12R2.1 N#CC1CNc2ccccc21 Amb18063484 [0,1,0,1,0,0|1,0,1]=4 9976 B12R2.1 N#CC1COc2ccccc21 Amb23586274 [0,1,0,1,0,0|1,0,1]=4 9977 B12R2.1 N#CC1CSc2ccccc21 Amb18126297 [0,1,0,1,0,0|1,0,1]=4 9978 B12R2.1 NCC1=CCc2ccccc12 Amb18560208 [0,1,0,1,0,0|1,0,1]=4 9979 B12R2.1 NCC1C=Cc2c1cccc2 Amb17470375 [0,1,0,1,0,0|1,0,0]=3 9980 B12R2.1 NCC1CCc2ccccc21 Amb22500956 [0,1,0,1,0,0|1,0,1]=4 9981 B12R2.1 NCC1CNc2ccccc21 Amb18063038 [0,1,0,1,0,0|1,0,1]=4 9982 B12R2.1 NCC1COc2ccccc21 Amb18644395 [0,1,0,1,0,0|0,0,2]=4 9983 B12R2.1 NCC1COc2ccccc21 Amb20668243 [0,1,0,1,0,0|0,0,2]=4 9984 B12R2.1 NC[n]1c[n]c2ccccc12 Amb24078485 [0,1,0,1,0,0|2,0,0]=4 9985 B12R2.1 NC[n]1ccc2ccccc12 Amb24089082 [0,1,0,1,0,0|2,0,0]=4 9986 B12R2.1 NCc1c[nH]c2c1cccc2 Amb17603142 [0,1,0,1,0,0|1,0,1]=4 9987 B12R2.1 NCc1c[nH]c2ccccc12 Amb17760648 [0,1,0,1,0,0|1,0,1]=4 9988 B12R2.1 NCc1c[nH]c2ccccc12 Amb17844951 [0,1,0,1,0,0|1,0,1]=4 9989 B12R2.1 NCc1coc2ccccc21 Amb19373967 [0,1,0,1,0,0|0,0,2]=4 9990 B12R2.1 NCc1coc2ccccc21 Amb19649824 [0,1,0,1,0,0|0,0,2]=4 9991 B12R2.1 NOC1CCc2ccccc21 Amb25808729 [0,1,0,1,0,0|2,0,0]=4 9992 B12R2.1 O=CC1=CCc2ccccc12 Amb18644151 [0,1,0,1,0,0|0,0,1]=3 9993 B12R2.1 O=CC1C=Cc2ccccc21 Amb18644152 [0,1,0,1,0,0|0,0,1]=3 9994 B12R2.1 O=CC1C=Nc2ccccc21 Amb21952746 [0,1,0,1,0,0|0,0,1]=3 9995 B12R2.1 O=CC1CCc2ccccc21 Amb18644272 [0,1,0,1,0,0|0,0,0]=2 9996 B12R2.1 O=CC1CNc2ccccc21 Amb23590098 [0,1,0,1,0,0|0,0,0]=2 9997 B12R2.1 O=CC1COc2ccccc21 Amb23586276 [0,1,0,1,0,0|0,0,0]=2 9998 B12R2.1 O=C[C@H]1C=Cc2ccccc21 Amb25289156 [0,1,0,1,0,0|0,0,1]=3 9999 B12R2.1 O=C[n]1[n]cc2ccccc12 Amb25209304 [0,1,0,1,0,0|1,0,1]=4 10000 B12R2.1 O=C[n]1c[n]c2ccccc12 Amb24078339 [0,1,0,1,0,0|1,0,1]=4 10001 B12R2.1 O=Cc1[n][s]c2ccccc21 Amb18645862 [0,1,0,1,0,0|1,0,1]=4 10002 B12R2.1 O=Cc1[n]oc2ccccc21 Amb18124808 [0,1,0,1,0,0|1,0,1]=4 10003 B12R2.1 O=Cc1[s]cc2ccccc21 Amb25134071 [0,1,0,1,0,0|0,0,2]=4 10004 B12R2.1 O=Cc1c[n-]c2ccccc21 Amb22751036 [0,1,0,1,0,0|0,0,2]=4 10005 B12R2.1 O=Cc1c[nH]c2c1cccc2 Amb1147114 [0,1,0,1,0,0|0,0,2]=4 10006 B12R2.1 O=Cc1coc2c1cccc2 Amb10844786 [0,1,0,1,0,0|0,0,2]=4 10007 B12R2.1 O=Cc1csc2c1cccc2 Amb1157901 [0,1,0,1,0,0|0,0,2]=4 10008 B12R2.1 O=Cc1n[nH]c2ccccc12 Amb17739794 [0,1,0,1,0,0|1,0,1]=4 10009 B12R2.1 O=Cc1o[n]c2ccccc21 Amb18831437 [0,1,0,1,0,0|1,0,1]=4 10010 B12R2.1 O=Cn1ccc2ccccc12 Amb17673943 [0,1,0,1,0,0|1,0,1]=4 10011 B12R2.1 O=NN1CCc2ccccc12 Amb17689298 [0,1,0,1,0,0|2,0,0]=4 10012 B12R2.1 O=[13CH]c1c[nH]c2c1cccc2 Amb17616072 [0,1,0,1,0,0|0,0,2]=4 10013 B12R2.1 OCC1=CCc2ccccc12 Amb25797665 [0,1,0,1,0,0|1,0,1]=4 10014 B12R2.1 OCC1CCc2ccccc21 Amb19329220 [0,1,0,1,0,0|0,0,2]=4 10015 B12R2.1 OCC1CNc2ccccc21 Amb18063448 [0,1,0,1,0,0|0,0,2]=4 10016 B12R2.1 OCC1COc2ccccc21 Amb22224879 [0,1,0,1,0,0|0,0,2]=4 10017 B12R2.1 OCC1CSc2ccccc21 Amb24615579 [0,1,0,1,0,0|0,0,2]=4 10018 B12R2.1 OCC1NCc2ccccc21 Amb25736151 [0,1,0,1,0,0|0,0,2]=4 10019 B12R2.1 OC[C@@H]1COc2ccccc21 Amb24487044 [0,1,0,1,0,0|0,0,2]=4 10020 B12R2.1 OC[C@H]1OCc2ccccc21 Amb24412216 [0,1,0,1,0,0|0,0,2]=4 10021 B12R2.1 OC[n]1ccc2ccccc12 Amb25374111 [0,1,0,1,0,0|2,0,0]=4 10022 B12R2.1 OCc1c[nH]c2c1cccc2 Amb1153804 [0,1,0,1,0,0|1,0,1]=4 10023 B12R2.1 OCc1c[nH]c2c1cccc2 Amb16231311 [0,1,0,1,0,0|1,0,1]=4 10024 B12R2.1 OCc1coc2c1cccc2 Amb10572402 [0,1,0,1,0,0|0,0,2]=4 10025 B12R2.1 OCn1cnc2c1cccc2 Amb1151978 [0,1,0,1,0,0|2,0,0]=4 10026 B12R2.1 SC[n]1c[n]c2ccccc12 Amb24078486 [0,1,0,1,0,0|2,0,0]=4 10027 B12R2.1 SCc1coc2ccccc21 Amb24405838 [0,1,0,1,0,0|0,0,2]=4 10028 B12R2.2 C1=NC(CC1)c2cccnc2 Amb17616205 [0,1,0,1,0,0|2,0,0]=4 10029 B12R2.2 C1C=CC(N1)c2c[n]ccc2 Amb25076492 [0,1,0,1,0,0|2,0,0]=4 10030 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,1,0,1,0,0|1,0,0]=3 10031 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [0,1,0,1,0,0|2,0,0]=4 10032 B12R2.2 C1C=CNC1c2c[n]ccc2 Amb24085149 [0,1,0,1,0,0|2,0,0]=4 10033 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,1,0,1,0,0|1,0,0]=3 10034 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,1,0,1,0,0|2,0,0]=4 10035 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,1,0,1,0,0|2,0,0]=4 10036 B12R2.2 C1CC=C(N1)c2ccccc2 Amb17938860 [0,1,0,1,0,0|1,0,1]=4 10037 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,1,0,1,0,0|1,0,1]=4 10038 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,1,0,1,0,0|1,0,1]=4 10039 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,1,0,1,0,0|1,0,1]=4 10040 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,1,0,1,0,0|2,0,0]=4 10041 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,1,0,1,0,0|1,0,1]=4 10042 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,1,0,1,0,0|1,0,1]=4 10043 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,1,0,1,0,0|1,0,1]=4 10044 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,1,0,1,0,0|2,0,0]=4 10045 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,1,0,1,0,0|2,0,0]=4 10046 B12R2.2 C1N=CNC1c2c[n]ccc2 Amb24085256 [0,1,0,1,0,0|2,0,0]=4 10047 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,1,0,1,0,0|0,0,2]=4 10048 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,1,0,1,0,0|0,1,1]=4 10049 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,1,0,1,0,0|1,0,1]=4 10050 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,1,0,1,0,0|1,0,1]=4 10051 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,1,0,1,0,0|1,0,1]=4 10052 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,1,0,1,0,0|1,0,1]=4 10053 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,1,0,1,0,0|1,0,1]=4 10054 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,1,0,1,0,0|1,0,1]=4 10055 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,1,0,1,0,0|1,0,1]=4 10056 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,1,0,1,0,0|0,0,1]=3 10057 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,1,0,1,0,0|0,0,2]=4 10058 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,1,0,1,0,0|0,0,2]=4 10059 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,1,0,1,0,0|2,0,0]=4 10060 B12R2.2 c1ccccc1C2C=CC=C2 Amb24351108 [0,1,0,1,0,0|1,0,1]=4 10061 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [0,1,0,1,0,0|2,0,0]=4 10062 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,1,0,1,0,0|0,0,2]=4 10063 B12R2.2047 N#CC1C(Cl)c2ccccc21 Amb25257929 [0,1,0,1,0,0|1,0,1]=4 10064 B12R2.2047 O=C1C(=C=O)c2ccccc12 Amb25707004 [0,1,0,1,0,0|0,0,2]=4 10065 B12R2.22 BrC1CC(=C1)c2ccccc2 Amb24669104 [0,1,0,1,0,0|1,0,1]=4 10066 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,1,0,1,0,0|1,0,1]=4 10067 B12R2.22 C=C1CC(C1)c2cc[n]cc2 Amb24102821 [0,1,0,1,0,0|2,0,0]=4 10068 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,1,0,1,0,0|1,0,1]=4 10069 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,1,0,1,0,0|1,0,1]=4 10070 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,1,0,1,0,0|1,0,1]=4 10071 B12R2.22 O=C1CC(C1)c2c[n]cc[n]2 Amb24606497 [0,1,0,1,0,0|2,0,0]=4 10072 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [0,1,0,1,0,0|1,0,0]=3 10073 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [0,1,0,1,0,0|1,0,0]=3 10074 B12R2.22 O=C1CC(N1)c2cc[n]c[n]2 Amb25169482 [0,1,0,1,0,0|2,0,0]=4 10075 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [0,1,0,1,0,0|1,0,0]=3 10076 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,1,0,1,0,0|0,0,0]=2 10077 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,1,0,1,0,0|0,0,0]=2 10078 B12R2.22 OC1CC(=C1)c2ccccc2 Amb25198298 [0,1,0,1,0,0|0,0,2]=4 10079 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,1,0,1,0,0|0,0,2]=4 10080 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,1,0,1,0,0|0,0,2]=4 10081 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,1,0,1,0,0|0,1,1]=4 10082 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [0,1,0,1,0,0|1,0,1]=4 10083 B12R2.931 NCCC1Cc2ccccc21 Amb24600610 [0,1,0,1,0,0|1,0,1]=4 10084 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [0,1,0,1,0,0|1,0,1]=4 10085 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,1,0,1,0,0|0,0,2]=4 10086 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [0,1,0,1,0,0|0,0,1]=3 10087 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,1,0,1,0,0|0,0,0]=2 10088 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,1,0,1,0,0|1,0,1]=4 10089 B12R2.1081 CC1=CCOc2ccccc21 Amb25694360 [0,1,0,1,0,0|0,0,2]=4 10090 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [0,1,0,1,0,0|0,0,2]=4 10091 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,1,0,1,0,0|1,0,1]=4 10092 B12R2.1081 CC1CCSc2ccccc21 Amb24104681 [0,1,0,1,0,0|0,1,1]=4 10093 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,1,0,1,0,0|1,0,1]=4 10094 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,1,0,1,0,0|1,0,1]=4 10095 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,1,0,1,0,0|0,0,2]=4 10096 B12R2.1081 CC1N=CNc2c[n]ccc21 Amb24070480 [0,1,0,1,0,0|2,0,0]=4 10097 B12R2.1081 CC1NC=Nc2ccccc21 Amb24582943 [0,1,0,1,0,0|1,0,0]=3 10098 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,1,0,1,0,0|1,0,1]=4 10099 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,1,0,1,0,0|0,0,2]=4 10100 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,1,0,1,0,0|1,0,1]=4 10101 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,1,0,1,0,0|0,0,2]=4 10102 B12R2.1081 CC1SC=Cc2ccccc21 Amb24485795 [0,1,0,1,0,0|1,0,0]=3 10103 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,1,0,1,0,0|1,0,1]=4 10104 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,1,0,1,0,0|1,0,1]=4 10105 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,1,0,1,0,0|1,0,1]=4 10106 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,1,0,1,0,0|1,0,1]=4 10107 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,1,0,1,0,0|1,0,1]=4 10108 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,1,0,1,0,0|1,0,1]=4 10109 B12R2.1081 C[n+]1cccc2c1cccc2 Amb10553831 [0,1,0,1,0,0|2,0,0]=4 10110 B12R2.1081 C[n+]1cccc2c1cccc2 Amb2540187 [0,1,0,1,0,0|2,0,0]=4 10111 B12R2.1081 C[n+]1cccc2ccccc12 Amb22360002 [0,1,0,1,0,0|2,0,0]=4 10112 B12R2.1081 C[n+]1ccnc2c1cccc2 Amb2229303 [0,1,0,1,0,0|2,0,0]=4 10113 B12R2.1081 C[n+]1ccnc2c1cccc2 Amb2519210 [0,1,0,1,0,0|2,0,0]=4 10114 B12R2.1081 Cc1[n]ccc2ccccc21 Amb24074119 [0,1,0,1,0,0|1,0,1]=4 10115 B12R2.1081 Cc1c[n][n]c2ccccc21 Amb21964128 [0,1,0,1,0,0|1,0,1]=4 10116 B12R2.1081 Cc1cncc2c1cccc2 Amb15691609 [0,1,0,1,0,0|1,0,1]=4 10117 B12R2.1081 Cc1nccc2ccccc12 Amb17672018 [0,1,0,1,0,0|1,0,1]=4 10118 B12R2.1081 Cc1ncnc2c1cccc2 Amb10573340 [0,1,0,1,0,0|1,0,1]=4 10119 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [0,1,0,1,0,0|2,0,0]=4 10120 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,1,0,1,0,0|2,0,0]=4 10121 B12R2.1081 OC1C=COc2ccccc21 Amb25758786 [0,1,0,1,0,0|1,0,1]=4 10122 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,1,0,1,0,0|2,0,0]=4 10123 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [0,1,0,1,0,0|2,0,0]=4 10124 B12R2.1081 O[C@@H]1C=COc2ccccc21 Amb25108504 [0,1,0,1,0,0|1,0,1]=4 10125 B12R2.1313 O=C1NC(=O)c2ccc1cc2 Amb24441648 [0,1,0,1,0,0|1,0,1]=4 10126 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,1,0,1,0,0|2,0,0]=4 10127 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,1,0,1,0,0|2,0,0]=4 10128 B12R2.2028 C=C1NC(=O)c2ccccc21 Amb20671447 [0,1,0,1,0,0|0,0,2]=4 10129 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [0,1,0,1,0,0|0,0,2]=4 10130 B12R2.2028 CC1=CC(C)c2ccccc12 Amb24641446 [0,1,0,1,0,0|1,0,0]=3 10131 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,1,0,1,0,0|0,0,2]=4 10132 B12R2.2028 CC1=C[C@@H](Br)c2ccccc21 Amb25827191 [0,1,0,1,0,0|1,0,1]=4 10133 B12R2.2028 CC1=NC(C)c2ccccc12 Amb25223537 [0,1,0,1,0,0|1,0,0]=3 10134 B12R2.2028 CC1C=C(Cl)c2ccccc12 Amb17778911 [0,1,0,1,0,0|1,0,0]=3 10135 B12R2.2028 CC1C=C(O)c2cc[n]cc21 Amb24092212 [0,1,0,1,0,0|1,0,1]=4 10136 B12R2.2028 CC1CC(=O)c2cc[n]cc21 Amb24071420 [0,1,0,1,0,0|1,0,0]=3 10137 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,1,0,1,0,0|1,0,1]=4 10138 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,1,0,1,0,0|1,0,1]=4 10139 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,1,0,1,0,0|0,0,2]=4 10140 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,1,0,1,0,0|0,1,1]=4 10141 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,1,0,1,0,0|1,0,1]=4 10142 B12R2.2028 CC1N=C(N)c2ccccc21 Amb24426364 [0,1,0,1,0,0|1,0,0]=3 10143 B12R2.2028 CC1NC(=O)c2ccc[n]c21 Amb23536271 [0,1,0,1,0,0|1,0,0]=3 10144 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,1,0,1,0,0|0,0,0]=2 10145 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,1,0,1,0,0|1,0,1]=4 10146 B12R2.2028 CC1OC(=O)c2[n]cccc21 Amb24071603 [0,1,0,1,0,0|1,0,0]=3 10147 B12R2.2028 CC1OC(=O)c2cc[n]cc21 Amb25373921 [0,1,0,1,0,0|1,0,0]=3 10148 B12R2.2028 CC1OC(=O)c2ccccc21 Amb24060113 [0,1,0,1,0,0|0,0,0]=2 10149 B12R2.2028 CC1OC(=S)c2ccccc21 Amb25115999 [0,1,0,1,0,0|0,1,0]=3 10150 B12R2.2028 CC=1NC(=O)N2C=CC=CC21 Amb24436390 [0,1,0,1,0,0|1,0,1]=4 10151 B12R2.2028 CN1NC(=O)c2ccc[n]c12 Amb19314984 [0,1,0,1,0,0|2,0,0]=4 10152 B12R2.2028 CN1NC(=O)c2ccccc12 Amb22372319 [0,1,0,1,0,0|1,0,0]=3 10153 B12R2.2028 CN1OC(=O)c2ccccc12 Amb24528970 [0,1,0,1,0,0|1,0,0]=3 10154 B12R2.2028 CN1SC(=O)c2ccccc12 Amb19664923 [0,1,0,1,0,0|1,0,0]=3 10155 B12R2.2028 CN1SC(=S)c2ccccc12 Amb20661436 [0,1,0,1,0,0|1,1,0]=4 10156 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,1,0,1,0,0|0,0,0]=2 10157 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,1,0,1,0,0|0,0,2]=4 10158 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,1,0,1,0,0|1,0,1]=4 10159 B12R2.2028 C[C@@H]1NC(=O)c2ccccc21 Amb22754730 [0,1,0,1,0,0|0,0,0]=2 10160 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,1,0,1,0,0|0,0,0]=2 10161 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,1,0,1,0,0|0,0,2]=4 10162 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,1,0,1,0,0|0,0,2]=4 10163 B12R2.2028 C[C@H]1OC(=O)c2ccccc21 Amb24060118 [0,1,0,1,0,0|0,0,0]=2 10164 B12R2.2028 C[n]1[nH]c(=O)c2c[n]ccc12 Amb24082889 [0,1,0,1,0,0|2,0,0]=4 10165 B12R2.2028 C[n]1[n]c(Cl)c2ccccc12 Amb25327391 [0,1,0,1,0,0|2,0,0]=4 10166 B12R2.2028 C[n]1c[n+](C)c2ccccc12 Amb19895221 [0,1,0,1,0,0|2,0,0]=4 10167 B12R2.2028 C[n]1cc(I)c2ccccc12 Amb24067581 [0,1,0,1,0,0|2,0,0]=4 10168 B12R2.2028 C[n]1cc(N)c2ccccc12 Amb18064415 [0,1,0,1,0,0|2,0,0]=4 10169 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [0,1,0,1,0,0|1,0,1]=4 10170 B12R2.2028 C[n]1cc(S)c2ccccc12 Amb25721189 [0,1,0,1,0,0|1,1,0]=4 10171 B12R2.2028 Cc1[n][n](C)c2ccccc12 Amb22491231 [0,1,0,1,0,0|2,0,0]=4 10172 B12R2.2028 Cc1c[n](N)c2ccccc21 Amb24608862 [0,1,0,1,0,0|1,0,1]=4 10173 B12R2.2028 Cc1oc(C)c2ccccc12 Amb25702226 [0,1,0,1,0,0|1,0,1]=4 10174 B12R2.2028 Cn1nc(c2c1cccc2)Br Amb10604243 [0,1,0,1,0,0|2,0,0]=4 10175 B12R2.2028 Cn1nc(c2c1cccc2)I Amb10608014 [0,1,0,1,0,0|2,0,0]=4 10176 B12R2.2028 N=C1NC(=O)c2ccccc21 Amb21811514 [0,1,0,1,0,0|1,0,1]=4 10177 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,1,0,1,0,0|1,0,0]=3 10178 B12R2.2028 NC1NC(=N)c2ccccc21 Amb24351491 [0,1,0,1,0,0|2,0,0]=4 10179 B12R2.2028 NC1NC(=O)c2ccc[n]c21 Amb24091953 [0,1,0,1,0,0|2,0,0]=4 10180 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [0,1,0,1,0,0|1,0,0]=3 10181 B12R2.2028 O=C1CC(=O)c2c1cccc2 Amb1883008 [0,1,0,1,0,0|1,0,1]=4 10182 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,1,0,1,0,0|1,0,0]=3 10183 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,1,0,1,0,0|1,0,0]=3 10184 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb10604058 [0,1,0,1,0,0|1,0,1]=4 10185 B12R2.2028 O=C1NC(=O)c2c1cccc2 Amb1934252 [0,1,0,1,0,0|1,0,1]=4 10186 B12R2.2028 O=C1NC(=O)c2ccccc12 Amb19944694 [0,1,0,1,0,0|1,0,1]=4 10187 B12R2.2028 O=C1NC(=S)c2ccccc21 Amb25277268 [0,1,0,1,0,0|1,0,1]=4 10188 B12R2.2028 O=C1NC(Br)c2ccccc21 Amb24728224 [0,1,0,1,0,0|1,0,0]=3 10189 B12R2.2028 O=C1NC(Cl)c2ccccc21 Amb25700425 [0,1,0,1,0,0|1,0,0]=3 10190 B12R2.2028 O=C1NC(I)c2ccccc21 Amb25149062 [0,1,0,1,0,0|1,0,0]=3 10191 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [0,1,0,1,0,0|1,0,0]=3 10192 B12R2.2028 O=C1OC(=O)[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22339015 [0,1,0,1,0,0|1,0,1]=4 10193 B12R2.2028 O=C1OC(=O)c2ccccc12 Amb17748796 [0,1,0,1,0,0|1,0,1]=4 10194 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [0,1,0,1,0,0|1,0,0]=3 10195 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [0,1,0,1,0,0|1,0,0]=3 10196 B12R2.2028 O=C1[15N-]C(=O)c2ccccc12 Amb22732113 [0,1,0,1,0,0|1,0,1]=4 10197 B12R2.2028 O=C1[15NH]C(=O)c2ccccc12 Amb22338958 [0,1,0,1,0,0|1,0,1]=4 10198 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22411655 [0,1,0,1,0,0|1,0,1]=4 10199 B12R2.2028 O=C1[N-]C(=O)c2ccccc12 Amb22524346 [0,1,0,1,0,0|1,0,1]=4 10200 B12R2.2028 O=[13C]1O[13C](=O)c2ccccc12 Amb22056066 [0,1,0,1,0,0|1,0,1]=4 10201 B12R2.2028 OC1CC(=O)c2[n]cccc21 Amb22750353 [0,1,0,1,0,0|2,0,0]=4 10202 B12R2.2028 OC1CC(=O)c2c[n]ccc21 Amb24071455 [0,1,0,1,0,0|2,0,0]=4 10203 B12R2.2028 OC1NC(=O)c2[n]cccc21 Amb24081300 [0,1,0,1,0,0|2,0,0]=4 10204 B12R2.2028 OC1NC(=O)c2ccc[n]c21 Amb22436854 [0,1,0,1,0,0|2,0,0]=4 10205 B12R2.2028 OC1OC(=O)c2[n]cccc21 Amb25222317 [0,1,0,1,0,0|2,0,0]=4 10206 B12R2.2028 OC1OC(=O)c2cc[n]cc21 Amb24426049 [0,1,0,1,0,0|2,0,0]=4 10207 B12R2.2028 OC1OC(=O)c2ccc[n]c21 Amb24092124 [0,1,0,1,0,0|2,0,0]=4 10208 B12R2.2028 OC1OS(=O)c2ccccc21 Amb25234822 [0,1,0,1,0,0|2,0,0]=4 10209 B12R2.2028 OI1OC(=O)c2ccccc12 Amb19958248 [0,1,0,1,0,0|2,0,0]=4 10210 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,1,0,1,0,0|2,0,0]=4 10211 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,1,0,1,0,0|1,0,0]=3 10212 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,1,0,1,0,0|1,0,0]=3 10213 B12R2.2028 [O-][N+]1=CC(=O)c2ccccc12 Amb17843025 [0,1,0,1,0,0|2,0,0]=4 10214 B12R2.2028 [O-][n+]1cn(c2c1cccc2)C Amb10552961 [0,1,0,1,0,0|1,0,1]=4 10215 B12R2.2028 [O-][n+]1cn(c2c1cccc2)C Amb10552964 [0,1,0,1,0,0|1,0,1]=4 10216 B12R2.79 Br[C@@H]1C[C@H]1c2ccc(I)cc2 Amb25113713 [0,1,0,1,0,0|1,0,1]=4 10217 B12R2.79 Brc1ccc(cc1)C2CC2Br Amb23454932 [0,1,0,1,0,0|1,0,1]=4 10218 B12R2.79 CC1CC1c2ccc(Br)cc2 Amb23247702 [0,1,0,1,0,0|1,0,1]=4 10219 B12R2.79 CC1CC1c2ccc(F)cc2 Amb24662198 [0,1,0,1,0,0|1,0,1]=4 10220 B12R2.79 CC1CC1c2ccc(N)cc2 Amb23247694 [0,1,0,1,0,0|1,0,1]=4 10221 B12R2.79 Cc1ccc(cc1)C2CC2O Amb24527656 [0,1,0,1,0,0|0,0,2]=4 10222 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@@H]2Cl Amb25179016 [0,1,0,1,0,0|1,0,1]=4 10223 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2Cl Amb25210810 [0,1,0,1,0,0|1,0,1]=4 10224 B12R2.79 Cc1ccc(cc1)[C@@H]2C[C@H]2N Amb24100233 [0,1,0,1,0,0|1,0,1]=4 10225 B12R2.79 Clc1ccc(cc1)C2CC2Br Amb23454925 [0,1,0,1,0,0|1,0,1]=4 10226 B12R2.79 Fc1ccc(cc1)C2CC2Br Amb23454928 [0,1,0,1,0,0|1,0,1]=4 10227 B12R2.79 NC1CC1c2ccc(Br)cc2 Amb19346488 [0,1,0,1,0,0|1,0,1]=4 10228 B12R2.79 NC1CC1c2ccc(Cl)cc2 Amb19373427 [0,1,0,1,0,0|1,0,1]=4 10229 B12R2.79 NC1CC1c2ccc(F)cc2 Amb19514916 [0,1,0,1,0,0|1,0,1]=4 10230 B12R2.79 NC1CC1c2ccc(cc2)O Amb17568133 [0,1,0,1,0,0|1,0,1]=4 10231 B12R2.79 N[C@@H]1C[C@@H]1c2ccc(Br)cc2 Amb24763920 [0,1,0,1,0,0|1,0,1]=4 10232 B12R2.79 N[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24655057 [0,1,0,1,0,0|1,0,1]=4 10233 B12R2.79 N[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24100231 [0,1,0,1,0,0|1,0,1]=4 10234 B12R2.79 N[C@H]1CC1c2ccc(Cl)cc2 Amb25690946 [0,1,0,1,0,0|1,0,1]=4 10235 B12R2.79 N[C@H]1C[C@@H]1c2ccc(Cl)cc2 Amb24512288 [0,1,0,1,0,0|1,0,1]=4 10236 B12R2.79 N[C@H]1C[C@@H]1c2ccc(F)cc2 Amb25168877 [0,1,0,1,0,0|1,0,1]=4 10237 B12R2.79 N[C@H]1C[C@H]1c2ccc(Br)cc2 Amb25365231 [0,1,0,1,0,0|1,0,1]=4 10238 B12R2.79 N[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb25326697 [0,1,0,1,0,0|1,0,1]=4 10239 B12R2.79 OC1CC1c2ccc(F)cc2 Amb24639281 [0,1,0,1,0,0|0,0,2]=4 10240 B12R2.290 CC1(CC1)c2ccc(Br)cc2 Amb24064681 [0,1,0,1,0,0|1,0,1]=4 10241 B12R2.290 CC1(CC1)c2ccc(O)cc2 Amb24102688 [0,1,0,1,0,0|1,0,1]=4 10242 B12R2.290 CC1(CN1)c2ccc(Br)cc2 Amb18224964 [0,1,0,1,0,0|1,0,1]=4 10243 B12R2.290 CC1(CN1)c2ccc(Cl)cc2 Amb18862737 [0,1,0,1,0,0|1,0,1]=4 10244 B12R2.290 CC1(CN1)c2ccc(F)cc2 Amb18224288 [0,1,0,1,0,0|1,0,1]=4 10245 B12R2.290 CC1(CO1)c2ccc(I)cc2 Amb25725581 [0,1,0,1,0,0|0,0,2]=4 10246 B12R2.290 CC1(CO1)c2ccc(N)cc2 Amb25178693 [0,1,0,1,0,0|0,0,2]=4 10247 B12R2.290 CC1(CO1)c2ccc(O)cc2 Amb24486463 [0,1,0,1,0,0|0,0,2]=4 10248 B12R2.290 CC1(OC1)c2ccc(cc2)Br Amb17089389 [0,1,0,1,0,0|0,0,2]=4 10249 B12R2.290 CC1(OC1)c2ccc(cc2)Cl Amb17089388 [0,1,0,1,0,0|0,0,2]=4 10250 B12R2.290 CC1(OC1)c2ccc(cc2)F Amb17089387 [0,1,0,1,0,0|0,0,2]=4 10251 B12R2.290 C[C@@]1(CO1)c2ccc(F)cc2 Amb25028066 [0,1,0,1,0,0|0,0,2]=4 10252 B12R2.290 C[C@]1(CO1)c2ccc(F)cc2 Amb24486025 [0,1,0,1,0,0|0,0,2]=4 10253 B12R2.290 Cc1ccc(cc1)C2(C)CC2 Amb24559410 [0,1,0,1,0,0|1,0,1]=4 10254 B12R2.290 Cc1ccc(cc1)C2(C)CN2 Amb18862482 [0,1,0,1,0,0|1,0,1]=4 10255 B12R2.290 Cc1ccc(cc1)C2(C)CO2 Amb18024289 [0,1,0,1,0,0|0,0,2]=4 10256 B12R2.600 Cc1cc2c(cc1)C(=O)C2=O Amb25143566 [0,1,0,1,0,0|1,0,1]=4 10257 B12R2.600 O=C1c2ccc(Cl)cc2C1=O Amb24584429 [0,1,0,1,0,0|1,0,1]=4 10258 B12R2.600 Oc1cc2c(cc1)C(=O)C2=O Amb24584427 [0,1,0,1,0,0|1,0,1]=4 10259 B12R2.612 Brc1ccc2c(c1)ccn2C Amb2092066 [0,1,0,1,0,0|2,0,0]=4 10260 B12R2.612 CC1CCc2cc(N)ccc21 Amb25150570 [0,1,0,1,0,0|1,0,1]=4 10261 B12R2.612 CC1CCc2cc(O)ccc21 Amb24099163 [0,1,0,1,0,0|1,0,1]=4 10262 B12R2.612 CC1CNc2cc(Br)ccc21 Amb25103823 [0,1,0,1,0,0|1,0,1]=4 10263 B12R2.612 CC1CNc2cc(O)ccc21 Amb24401085 [0,1,0,1,0,0|1,0,1]=4 10264 B12R2.612 CC1COc2cc(F)ccc21 Amb24438567 [0,1,0,1,0,0|0,0,2]=4 10265 B12R2.612 CC1COc2cc(O)ccc21 Amb18125119 [0,1,0,1,0,0|0,0,2]=4 10266 B12R2.612 CC1NCc2cc(Br)ccc21 Amb19516198 [0,1,0,1,0,0|2,0,0]=4 10267 B12R2.612 CC1NCc2cc(Br)ccc21 Amb20242991 [0,1,0,1,0,0|2,0,0]=4 10268 B12R2.612 CC1NCc2cc(Cl)ccc21 Amb24683804 [0,1,0,1,0,0|2,0,0]=4 10269 B12R2.612 CC1NCc2cc(N)ccc21 Amb25842482 [0,1,0,1,0,0|2,0,0]=4 10270 B12R2.612 CC1NCc2cc(O)ccc21 Amb24730776 [0,1,0,1,0,0|2,0,0]=4 10271 B12R2.612 CC1OCc2cc(O)ccc21 Amb24486465 [0,1,0,1,0,0|2,0,0]=4 10272 B12R2.612 C[C@@H]1C=Cc2cc(F)ccc21 Amb24533053 [0,1,0,1,0,0|1,0,0]=3 10273 B12R2.612 C[C@@H]1NCc2cc(Br)ccc21 Amb24561131 [0,1,0,1,0,0|2,0,0]=4 10274 B12R2.612 C[C@H]1C=Cc2cc(F)ccc21 Amb25106906 [0,1,0,1,0,0|1,0,0]=3 10275 B12R2.612 C[C@H]1NCc2cc(Br)ccc21 Amb20242968 [0,1,0,1,0,0|2,0,0]=4 10276 B12R2.612 C[C@H]1NCc2cc(F)ccc21 Amb24403085 [0,1,0,1,0,0|2,0,0]=4 10277 B12R2.612 C[C@H]1NCc2cc(N)ccc21 Amb24642600 [0,1,0,1,0,0|2,0,0]=4 10278 B12R2.612 C[n]1c[n]c2cc(Br)ccc12 Amb18896211 [0,1,0,1,0,0|2,0,0]=4 10279 B12R2.612 C[n]1c[n]c2cc(F)ccc12 Amb24433299 [0,1,0,1,0,0|2,0,0]=4 10280 B12R2.612 C[n]1c[n]c2cc(I)ccc12 Amb24668748 [0,1,0,1,0,0|2,0,0]=4 10281 B12R2.612 C[n]1c[n]c2cc(S)ccc12 Amb25214577 [0,1,0,1,0,0|2,0,0]=4 10282 B12R2.612 C[n]1ccc2cc(Cl)ccc12 Amb20241507 [0,1,0,1,0,0|2,0,0]=4 10283 B12R2.612 C[n]1ccc2cc(O)ccc12 Amb21864770 [0,1,0,1,0,0|2,0,0]=4 10284 B12R2.612 C[n]1ccc2cc(S)ccc12 Amb25151402 [0,1,0,1,0,0|2,0,0]=4 10285 B12R2.612 Cc1c[nH]c2cc(Br)ccc21 Amb21964696 [0,1,0,1,0,0|1,0,1]=4 10286 B12R2.612 Cc1c[nH]c2cc(Cl)ccc21 Amb18893519 [0,1,0,1,0,0|1,0,1]=4 10287 B12R2.612 Cc1c[nH]c2cc(F)ccc21 Amb18243509 [0,1,0,1,0,0|1,0,1]=4 10288 B12R2.612 Cc1c[nH]c2cc(I)ccc21 Amb24331789 [0,1,0,1,0,0|1,0,1]=4 10289 B12R2.612 Cc1c[nH]c2cc(N)ccc21 Amb18202358 [0,1,0,1,0,0|1,0,1]=4 10290 B12R2.612 Cc1c[nH]c2cc(O)ccc21 Amb18124816 [0,1,0,1,0,0|1,0,1]=4 10291 B12R2.612 Cc1c[s]c2cc(Br)ccc21 Amb25133721 [0,1,0,1,0,0|0,1,1]=4 10292 B12R2.612 Cc1c[s]c2cc(Cl)ccc21 Amb20620743 [0,1,0,1,0,0|0,1,1]=4 10293 B12R2.612 Cc1cc2[nH]cc(C)c2cc1 Amb18243498 [0,1,0,1,0,0|1,0,1]=4 10294 B12R2.612 Cc1ccc2c(c1)C=CC2N Amb17470376 [0,1,0,1,0,0|2,0,0]=4 10295 B12R2.612 Cc1ccc2c(c1)ncn2C Amb1902103 [0,1,0,1,0,0|2,0,0]=4 10296 B12R2.612 Cc1coc2cc(Cl)ccc21 Amb25689502 [0,1,0,1,0,0|0,0,2]=4 10297 B12R2.612 Cc1coc2cc(F)ccc21 Amb24694357 [0,1,0,1,0,0|0,0,2]=4 10298 B12R2.612 Cc1coc2cc(I)ccc21 Amb25323970 [0,1,0,1,0,0|0,0,2]=4 10299 B12R2.612 Cc1coc2cc(N)ccc21 Amb25086111 [0,1,0,1,0,0|0,0,2]=4 10300 B12R2.612 Cc1coc2cc(O)ccc21 Amb18124876 [0,1,0,1,0,0|0,0,2]=4 10301 B12R2.612 Clc1ccc2c(c1)C=CC2N Amb17470460 [0,1,0,1,0,0|2,0,0]=4 10302 B12R2.612 Clc1ccc2c(c1)ncn2C Amb17622580 [0,1,0,1,0,0|2,0,0]=4 10303 B12R2.612 Fc1ccc2c(c1)C=CC2N Amb17470385 [0,1,0,1,0,0|2,0,0]=4 10304 B12R2.612 Ic1ccc2c(c1)ccn2C Amb17134443 [0,1,0,1,0,0|2,0,0]=4 10305 B12R2.2302 Brc1ccc(cc1)C2CCC2 Amb20617091 [0,1,0,1,0,0|1,0,1]=4 10306 B12R2.2302 Brc1ccc(cc1)C2CCO2 Amb24414336 [0,1,0,1,0,0|2,0,0]=4 10307 B12R2.2302 Brc1ccc(cc1)C2CNC2 Amb18066312 [0,1,0,1,0,0|1,0,1]=4 10308 B12R2.2302 Brc1ccc(cc1)C2COC2 Amb22737350 [0,1,0,1,0,0|0,0,2]=4 10309 B12R2.2302 Cc1ccc(cc1)C2CCC2 Amb25381443 [0,1,0,1,0,0|1,0,1]=4 10310 B12R2.2302 Cc1ccc(cc1)C2CNC2 Amb18065276 [0,1,0,1,0,0|1,0,1]=4 10311 B12R2.2302 Cc1ccc(cc1)C=2CCC2 Amb24672557 [0,1,0,1,0,0|1,0,1]=4 10312 B12R2.2302 Clc1ccc(cc1)C2CCC2 Amb24713440 [0,1,0,1,0,0|1,0,1]=4 10313 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb19370175 [0,1,0,1,0,0|2,0,0]=4 10314 B12R2.2302 Clc1ccc(cc1)C2CCN2 Amb22059427 [0,1,0,1,0,0|2,0,0]=4 10315 B12R2.2302 Clc1ccc(cc1)C2CCO2 Amb24369540 [0,1,0,1,0,0|2,0,0]=4 10316 B12R2.2302 Clc1ccc(cc1)C2CCS2 Amb24640005 [0,1,0,1,0,0|2,0,0]=4 10317 B12R2.2302 Clc1ccc(cc1)C2CNC2 Amb18563827 [0,1,0,1,0,0|1,0,1]=4 10318 B12R2.2302 Clc1ccc(cc1)[C@@H]2CCN2 Amb24585046 [0,1,0,1,0,0|2,0,0]=4 10319 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb18065351 [0,1,0,1,0,0|1,0,1]=4 10320 B12R2.2302 Fc1ccc(cc1)C2CNC2 Amb20669054 [0,1,0,1,0,0|1,0,1]=4 10321 B12R2.2302 Fc1ccc(cc1)C2COC2 Amb22738672 [0,1,0,1,0,0|0,0,2]=4 10322 B12R2.2302 Fc1ccc(cc1)[C@H]2CCN2 Amb25757757 [0,1,0,1,0,0|2,0,0]=4 10323 B12R2.2302 Ic1ccc(cc1)[C@@H]2CCN2 Amb24417322 [0,1,0,1,0,0|2,0,0]=4 10324 B12R2.2302 Nc1ccc(cc1)C2CCC2 Amb20617092 [0,1,0,1,0,0|1,0,1]=4 10325 B12R2.2302 Nc1ccc(cc1)C2CCN2 Amb25843764 [0,1,0,1,0,0|2,0,0]=4 10326 B12R2.2302 Nc1ccc(cc1)C2CCO2 Amb25705796 [0,1,0,1,0,0|2,0,0]=4 10327 B12R2.2302 Nc1ccc(cc1)C2CNC2 Amb25736438 [0,1,0,1,0,0|1,0,1]=4 10328 B12R2.2302 Nc1ccc(cc1)C2COC2 Amb22388448 [0,1,0,1,0,0|0,0,2]=4 10329 B12R2.2302 Nc1ccc(cc1)[C@H]2CCN2 Amb24583496 [0,1,0,1,0,0|2,0,0]=4 10330 B12R2.2302 Oc1ccc(cc1)C2CCC2 Amb20617093 [0,1,0,1,0,0|1,0,1]=4 10331 B12R2.2302 Oc1ccc(cc1)C2CCN2 Amb24533045 [0,1,0,1,0,0|2,0,0]=4 10332 B12R2.2302 Oc1ccc(cc1)[C@H]2CCN2 Amb25762318 [0,1,0,1,0,0|2,0,0]=4 10333 B12R2.2302 Sc1ccc(cc1)C2CCN2 Amb24484464 [0,1,0,1,0,0|2,0,0]=4 10334 B12R2.80 Brc1cccc(c1)C2CC2Br Amb23454931 [0,1,0,1,0,0|1,0,1]=4 10335 B12R2.80 CC1CC1c2cc(O)ccc2 Amb24662408 [0,1,0,1,0,0|1,0,1]=4 10336 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24519928 [0,1,0,1,0,0|1,0,1]=4 10337 B12R2.80 Cc1cc(ccc1)[C@@H]2C[C@H]2N Amb24100230 [0,1,0,1,0,0|1,0,1]=4 10338 B12R2.80 Clc1cc(ccc1)C2CC2Br Amb23454924 [0,1,0,1,0,0|1,0,1]=4 10339 B12R2.80 Fc1cc(ccc1)C2CC2Br Amb23454927 [0,1,0,1,0,0|1,0,1]=4 10340 B12R2.80 Fc1cc(ccc1)[C@@H]2C[C@@H]2Br Amb24671390 [0,1,0,1,0,0|1,0,1]=4 10341 B12R2.80 NC1CC1c2cc(Br)ccc2 Amb19346489 [0,1,0,1,0,0|1,0,1]=4 10342 B12R2.80 NC1CC1c2cc(Cl)ccc2 Amb19374842 [0,1,0,1,0,0|1,0,1]=4 10343 B12R2.80 NC1CC1c2cc(F)ccc2 Amb19514818 [0,1,0,1,0,0|1,0,1]=4 10344 B12R2.80 NC1CC1c2cccc(c2)O Amb17568188 [0,1,0,1,0,0|1,0,1]=4 10345 B12R2.80 N[C@@H]1C[C@H]1c2cc(Br)ccc2 Amb25307909 [0,1,0,1,0,0|1,0,1]=4 10346 B12R2.80 N[C@@H]1C[C@H]1c2cc(Cl)ccc2 Amb25683521 [0,1,0,1,0,0|1,0,1]=4 10347 B12R2.80 N[C@@H]1C[C@H]1c2cc(F)ccc2 Amb24100228 [0,1,0,1,0,0|1,0,1]=4 10348 B12R2.80 N[C@H]1C[C@@H]1c2cc(F)ccc2 Amb24552874 [0,1,0,1,0,0|1,0,1]=4 10349 B12R2.80 OC1CC1c2cc(F)ccc2 Amb24756969 [0,1,0,1,0,0|0,0,2]=4 10350 B12R2.132 Brc1ccc2c(c1)c(C)c[nH]2 Amb2447301 [0,1,0,1,0,0|1,0,1]=4 10351 B12R2.132 Brc1ccc2c(c1)c(C)cs2 Amb10068740 [0,1,0,1,0,0|0,1,1]=4 10352 B12R2.132 Brc1ccc2c(c1)n(C)cn2 Amb10071743 [0,1,0,1,0,0|2,0,0]=4 10353 B12R2.132 CC1=CCc2ccc(Cl)cc21 Amb25857141 [0,1,0,1,0,0|1,0,1]=4 10354 B12R2.132 CC1CCc2ccc(O)cc21 Amb24099164 [0,1,0,1,0,0|1,0,1]=4 10355 B12R2.132 CC1CNc2ccc(Br)cc21 Amb18561153 [0,1,0,1,0,0|1,0,1]=4 10356 B12R2.132 CC1CNc2ccc(Cl)cc21 Amb18063404 [0,1,0,1,0,0|1,0,1]=4 10357 B12R2.132 CC1CNc2ccc(F)cc21 Amb18063403 [0,1,0,1,0,0|1,0,1]=4 10358 B12R2.132 CC1COc2ccc(N)cc21 Amb24688008 [0,1,0,1,0,0|0,0,2]=4 10359 B12R2.132 CC1NCc2ccc(Br)cc21 Amb25693070 [0,1,0,1,0,0|2,0,0]=4 10360 B12R2.132 CC1NCc2ccc(Cl)cc21 Amb25265748 [0,1,0,1,0,0|2,0,0]=4 10361 B12R2.132 CC1NCc2ccc(F)cc21 Amb24414067 [0,1,0,1,0,0|2,0,0]=4 10362 B12R2.132 CC1NCc2ccc(N)cc21 Amb25085461 [0,1,0,1,0,0|2,0,0]=4 10363 B12R2.132 C[C@@H]1NCc2ccc(Br)cc21 Amb25710280 [0,1,0,1,0,0|2,0,0]=4 10364 B12R2.132 C[C@@H]1NCc2ccc(Cl)cc21 Amb25859052 [0,1,0,1,0,0|2,0,0]=4 10365 B12R2.132 C[C@@H]1NCc2ccc(F)cc21 Amb25343338 [0,1,0,1,0,0|2,0,0]=4 10366 B12R2.132 C[C@@H]1NCc2ccc(N)cc21 Amb25121208 [0,1,0,1,0,0|2,0,0]=4 10367 B12R2.132 C[C@H]1NCc2ccc(Br)cc21 Amb24642891 [0,1,0,1,0,0|2,0,0]=4 10368 B12R2.132 C[C@H]1NCc2ccc(Cl)cc21 Amb25711286 [0,1,0,1,0,0|2,0,0]=4 10369 B12R2.132 C[C@H]1NCc2ccc(O)cc21 Amb25280892 [0,1,0,1,0,0|2,0,0]=4 10370 B12R2.132 C[n]1c[n]c2ccc(F)cc12 Amb20075808 [0,1,0,1,0,0|2,0,0]=4 10371 B12R2.132 C[n]1c[n]c2ccc(I)cc12 Amb24611129 [0,1,0,1,0,0|2,0,0]=4 10372 B12R2.132 C[n]1c[n]c2ccc(N)cc12 Amb22587978 [0,1,0,1,0,0|2,0,0]=4 10373 B12R2.132 C[n]1c[n]c2ccc(O)cc12 Amb18124891 [0,1,0,1,0,0|2,0,0]=4 10374 B12R2.132 C[n]1ccc2ccc(Cl)cc12 Amb19895323 [0,1,0,1,0,0|2,0,0]=4 10375 B12R2.132 C[n]1ccc2ccc(I)cc12 Amb24679324 [0,1,0,1,0,0|2,0,0]=4 10376 B12R2.132 C[n]1ccc2ccc(O)cc12 Amb18124818 [0,1,0,1,0,0|2,0,0]=4 10377 B12R2.132 Cc1c[nH]c2ccc(N)cc21 Amb24331783 [0,1,0,1,0,0|1,0,1]=4 10378 B12R2.132 Cc1c[s]c2ccc(N)cc21 Amb25151209 [0,1,0,1,0,0|0,1,1]=4 10379 B12R2.132 Cc1c[s]c2ccc(O)cc21 Amb18126407 [0,1,0,1,0,0|0,1,1]=4 10380 B12R2.132 Cc1cc2c(cc1)[nH]cc2C Amb18243496 [0,1,0,1,0,0|1,0,1]=4 10381 B12R2.132 Cc1cc2c(cc1)occ2C Amb23440813 [0,1,0,1,0,0|0,0,2]=4 10382 B12R2.132 Cc1ccc2CN[C@H](C)c2c1 Amb25049401 [0,1,0,1,0,0|2,0,0]=4 10383 B12R2.132 Cc1ccc2c(c1)C(C)CN2 Amb17040660 [0,1,0,1,0,0|1,0,1]=4 10384 B12R2.132 Cc1ccc2c(c1)n(C)cn2 Amb1902126 [0,1,0,1,0,0|2,0,0]=4 10385 B12R2.132 Cc1coc2ccc(Cl)cc21 Amb20622396 [0,1,0,1,0,0|0,0,2]=4 10386 B12R2.132 Cc1coc2ccc(F)cc21 Amb20622399 [0,1,0,1,0,0|0,0,2]=4 10387 B12R2.132 Cc1coc2ccc(I)cc21 Amb25363008 [0,1,0,1,0,0|0,0,2]=4 10388 B12R2.132 Cc1coc2ccc(O)cc21 Amb18124872 [0,1,0,1,0,0|0,0,2]=4 10389 B12R2.132 Clc1ccc2c(c1)c(C)c[nH]2 Amb16185772 [0,1,0,1,0,0|1,0,1]=4 10390 B12R2.132 Clc1ccc2c(c1)n(C)cn2 Amb1902106 [0,1,0,1,0,0|2,0,0]=4 10391 B12R2.132 Nc1ccc2c(c1)n(C)cn2 Amb2196924 [0,1,0,1,0,0|2,0,0]=4 10392 B12R2.132 Oc1ccc2c(c1)c(C)c[nH]2 Amb17593673 [0,1,0,1,0,0|1,0,1]=4 10393 B12R2.196 CC1=CCc2c(F)cccc21 Amb25114614 [0,1,0,1,0,0|1,0,1]=4 10394 B12R2.196 CC1C=Cc2c(O)cccc21 Amb25142700 [0,1,0,1,0,0|1,0,0]=3 10395 B12R2.196 CC1CCc2c(O)cccc21 Amb24099162 [0,1,0,1,0,0|1,0,1]=4 10396 B12R2.196 CC1CNc2c(Cl)cccc21 Amb18063135 [0,1,0,1,0,0|1,0,1]=4 10397 B12R2.196 CC1CNc2c(F)cccc21 Amb18063405 [0,1,0,1,0,0|1,0,1]=4 10398 B12R2.196 CC1CNc2c1cccc2C Amb17040659 [0,1,0,1,0,0|1,0,1]=4 10399 B12R2.196 CC1NCc2c(Br)cccc21 Amb24730648 [0,1,0,1,0,0|2,0,0]=4 10400 B12R2.196 CC1NCc2c(F)cccc21 Amb25198238 [0,1,0,1,0,0|2,0,0]=4 10401 B12R2.196 CC1NCc2c(I)cccc21 Amb24437406 [0,1,0,1,0,0|2,0,0]=4 10402 B12R2.196 CC1NCc2c(O)cccc21 Amb24601012 [0,1,0,1,0,0|2,0,0]=4 10403 B12R2.196 C[C@@H]1NCc2c(Cl)cccc21 Amb25825909 [0,1,0,1,0,0|2,0,0]=4 10404 B12R2.196 C[C@@H]1NCc2c(N)cccc21 Amb25133622 [0,1,0,1,0,0|2,0,0]=4 10405 B12R2.196 C[C@H]1NCc2c(Cl)cccc21 Amb24669653 [0,1,0,1,0,0|2,0,0]=4 10406 B12R2.196 C[C@H]1NCc2c(F)cccc21 Amb24436830 [0,1,0,1,0,0|2,0,0]=4 10407 B12R2.196 C[n]1c[n]c2c(Br)cccc12 Amb18176119 [0,1,0,1,0,0|2,0,0]=4 10408 B12R2.196 C[n]1c[n]c2c(Cl)cccc12 Amb21971815 [0,1,0,1,0,0|2,0,0]=4 10409 B12R2.196 C[n]1c[n]c2c(F)cccc12 Amb24487735 [0,1,0,1,0,0|2,0,0]=4 10410 B12R2.196 C[n]1c[n]c2c(I)cccc12 Amb25218000 [0,1,0,1,0,0|2,0,0]=4 10411 B12R2.196 C[n]1ccc2c(Cl)cccc12 Amb22751213 [0,1,0,1,0,0|2,0,0]=4 10412 B12R2.196 C[n]1ccc2c(F)cccc12 Amb25348450 [0,1,0,1,0,0|2,0,0]=4 10413 B12R2.196 C[n]1ccc2c(I)cccc12 Amb22751214 [0,1,0,1,0,0|2,0,0]=4 10414 B12R2.196 C[n]1ccc2c(N)cccc12 Amb22587189 [0,1,0,1,0,0|2,0,0]=4 10415 B12R2.196 C[n]1ccc2c(N)cccc12 Amb22741110 [0,1,0,1,0,0|2,0,0]=4 10416 B12R2.196 Cc1c[nH]c2c(Cl)cccc21 Amb18893518 [0,1,0,1,0,0|1,0,1]=4 10417 B12R2.196 Cc1c[nH]c2c(F)cccc21 Amb18243508 [0,1,0,1,0,0|1,0,1]=4 10418 B12R2.196 Cc1c[nH]c2c(I)cccc21 Amb24331788 [0,1,0,1,0,0|1,0,1]=4 10419 B12R2.196 Cc1c[nH]c2c(N)cccc21 Amb24067491 [0,1,0,1,0,0|1,0,1]=4 10420 B12R2.196 Cc1c[nH]c2c(O)cccc21 Amb24067492 [0,1,0,1,0,0|1,0,1]=4 10421 B12R2.196 Cc1c[s]c2c(Br)cccc21 Amb22500032 [0,1,0,1,0,0|0,1,1]=4 10422 B12R2.196 Cc1c[s]c2c(F)cccc21 Amb24420304 [0,1,0,1,0,0|0,1,1]=4 10423 B12R2.196 Cc1c[s]c2c(N)cccc21 Amb18645930 [0,1,0,1,0,0|0,1,1]=4 10424 B12R2.196 Cc1c[s]c2c(O)cccc21 Amb24097251 [0,1,0,1,0,0|0,1,1]=4 10425 B12R2.196 Cc1cccc2c1[nH]cc2C Amb18243497 [0,1,0,1,0,0|1,0,1]=4 10426 B12R2.196 Cc1cccc2c1[n]c[n]2C Amb25856350 [0,1,0,1,0,0|2,0,0]=4 10427 B12R2.196 Cc1cccc2c1[s]cc2C Amb24085608 [0,1,0,1,0,0|0,1,1]=4 10428 B12R2.196 Cc1coc2c(N)cccc21 Amb24086379 [0,1,0,1,0,0|0,0,2]=4 10429 B12R2.196 Cn1cnc2c1cccc2N Amb10066878 [0,1,0,1,0,0|2,0,0]=4 10430 B12R2.196 Cn1cnc2c1cccc2O Amb10561806 [0,1,0,1,0,0|2,0,0]=4 10431 B12R2.196 Oc1cccc2c1ccn2C Amb13884900 [0,1,0,1,0,0|2,0,0]=4 10432 B12R2.1094 Cc1cccc2c1C(=O)C2=O Amb21948301 [0,1,0,1,0,0|1,0,1]=4 10433 B12R2.1094 Nc1cccc2c1C(=O)C2=O Amb24744452 [0,1,0,1,0,0|1,0,1]=4 10434 B12R2.1282 CC1(CO1)c2cccc(Cl)c2 Amb18182720 [0,1,0,1,0,0|0,0,2]=4 10435 B12R2.1282 CC1(CO1)c2cccc(F)c2 Amb18181718 [0,1,0,1,0,0|0,0,2]=4 10436 B12R2.1282 CC1(CO1)c2cccc(N)c2 Amb25208455 [0,1,0,1,0,0|0,0,2]=4 10437 B12R2.1282 CC1(N=N1)c2cccc(N)c2 Amb24056413 [0,1,0,1,0,0|2,0,0]=4 10438 B12R2.1282 CC1(NN1)c2cccc(N)c2 Amb24567685 [0,1,0,1,0,0|2,0,0]=4 10439 B12R2.1728 CO[C@@H]1Cc2ccc(Br)cc21 Amb24363643 [0,1,0,1,0,0|2,0,0]=4 10440 B12R2.1728 CO[C@H]1Cc2ccc(Br)cc21 Amb24733147 [0,1,0,1,0,0|2,0,0]=4 10441 B12R2.1728 N#CC1Cc2ccc(Cl)cc21 Amb24627225 [0,1,0,1,0,0|1,0,1]=4 10442 B12R2.1728 N#CC1Cc2ccc(O)cc21 Amb25169268 [0,1,0,1,0,0|1,0,1]=4 10443 B12R2.1728 NCC1Cc2ccc(O)cc21 Amb25324245 [0,1,0,1,0,0|1,0,1]=4 10444 B12R2.2313 Brc1cc(ccc1)C2CCC2 Amb20617094 [0,1,0,1,0,0|1,0,1]=4 10445 B12R2.2313 Brc1cc(ccc1)C2CNC2 Amb18066357 [0,1,0,1,0,0|1,0,1]=4 10446 B12R2.2313 Brc1cc(ccc1)C2COC2 Amb22737351 [0,1,0,1,0,0|0,0,2]=4 10447 B12R2.2313 Brc1cc(ccc1)C=2CCC2 Amb24707396 [0,1,0,1,0,0|1,0,1]=4 10448 B12R2.2313 Brc1cc(ccc1)[C@H]2CCN2 Amb25149014 [0,1,0,1,0,0|2,0,0]=4 10449 B12R2.2313 Cc1cc(ccc1)C2CNC2 Amb18065251 [0,1,0,1,0,0|1,0,1]=4 10450 B12R2.2313 Clc1cc(ccc1)C2CNC2 Amb18563826 [0,1,0,1,0,0|1,0,1]=4 10451 B12R2.2313 Clc1cc(ccc1)C2COC2 Amb24739899 [0,1,0,1,0,0|0,0,2]=4 10452 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb19375411 [0,1,0,1,0,0|2,0,0]=4 10453 B12R2.2313 Fc1cc(ccc1)C2CCN2 Amb25273667 [0,1,0,1,0,0|2,0,0]=4 10454 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb20669554 [0,1,0,1,0,0|1,0,1]=4 10455 B12R2.2313 Fc1cc(ccc1)C2CNC2 Amb22055311 [0,1,0,1,0,0|1,0,1]=4 10456 B12R2.2313 Fc1cc(ccc1)C2COC2 Amb25219965 [0,1,0,1,0,0|0,0,2]=4 10457 B12R2.2313 Fc1cc(ccc1)[C@@H]2CCN2 Amb24753481 [0,1,0,1,0,0|2,0,0]=4 10458 B12R2.2313 Ic1cc(ccc1)C2CCN2 Amb24444284 [0,1,0,1,0,0|2,0,0]=4 10459 B12R2.2313 Nc1cc(ccc1)C2CCC2 Amb20617095 [0,1,0,1,0,0|1,0,1]=4 10460 B12R2.2313 Nc1cc(ccc1)C2CNC2 Amb25292216 [0,1,0,1,0,0|1,0,1]=4 10461 B12R2.2313 Nc1cc(ccc1)[C@@H]2CCN2 Amb25152853 [0,1,0,1,0,0|2,0,0]=4 10462 B12R2.2313 Nc1cc(ccc1)[C@H]2CCN2 Amb25839840 [0,1,0,1,0,0|2,0,0]=4 10463 B12R2.2313 Oc1cc(ccc1)C2CCC2 Amb20617090 [0,1,0,1,0,0|1,0,1]=4 10464 B12R2.2313 Oc1cc(ccc1)C2CCN2 Amb24085164 [0,1,0,1,0,0|2,0,0]=4 10465 B12R2.2313 Oc1cc(ccc1)[C@@H]2CCN2 Amb25064272 [0,1,0,1,0,0|2,0,0]=4 10466 B12R2.2313 Sc1cc(ccc1)C2CNC2 Amb25152864 [0,1,0,1,0,0|1,0,1]=4 10467 B12R2.2313 Sc1cc(ccc1)[C@@H]2CCN2 Amb24465071 [0,1,0,1,0,0|2,0,0]=4 10468 B12R2.92 BrC1(Br)CC1c2ccccc2 Amb22363907 [0,1,0,1,0,0|1,0,1]=4 10469 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [0,1,0,1,0,0|1,0,1]=4 10470 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [0,1,0,1,0,0|1,0,1]=4 10471 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [0,1,0,1,0,0|1,0,1]=4 10472 B12R2.92 FC1(F)CC1c2ccccc2 Amb22227684 [0,1,0,1,0,0|1,0,1]=4 10473 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [0,1,0,1,0,0|1,0,0]=3 10474 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [0,1,0,1,0,0|0,0,2]=4 10475 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [0,1,0,1,0,0|1,0,1]=4 10476 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [0,1,0,1,0,0|0,0,2]=4 10477 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [0,1,0,1,0,0|0,0,2]=4 10478 B12R2.3190 NC(=N)C1Cc2ccccc21 Amb25152697 [0,1,0,1,0,0|1,0,0]=3 10479 B12R2.3190 NC(=O)C1=Cc2ccccc21 Amb25169267 [0,1,0,1,0,0|0,0,2]=4 10480 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [0,1,0,1,0,0|0,0,0]=2 10481 B12R2.3190 NC(=S)C1Cc2ccccc21 Amb25152696 [0,1,0,1,0,0|0,1,0]=3 10482 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [0,1,0,1,0,0|0,0,0]=2 10483 B12R2.3190 O=C(Cl)C=1C=C2C=CC=CC21 Amb25779648 [0,1,0,1,0,0|0,0,2]=4 10484 B12R2.3190 OC(=O)C1=Cc2c1cccc2 Amb17593654 [0,1,0,1,0,0|0,0,2]=4 10485 B12R2.88 CC1(CC1)c2ccccc2Br Amb25147845 [0,1,0,1,0,0|1,0,1]=4 10486 B12R2.88 CC1(CC1)c2ccccc2Cl Amb25288623 [0,1,0,1,0,0|1,0,1]=4 10487 B12R2.88 CC1(CC1)c2ccccc2F Amb25276883 [0,1,0,1,0,0|1,0,1]=4 10488 B12R2.88 CC1(CO1)c2ccccc2Cl Amb18182719 [0,1,0,1,0,0|0,0,2]=4 10489 B12R2.88 CC1(CO1)c2ccccc2F Amb18181717 [0,1,0,1,0,0|0,0,2]=4 10490 B12R2.88 Cc1ccccc1C2(C)CO2 Amb23558281 [0,1,0,1,0,0|0,0,2]=4 10491 B12R2.115 BrC1CC1c2ccccc2I Amb25150585 [0,1,0,1,0,0|1,0,1]=4 10492 B12R2.115 Brc1ccccc1C2CC2Br Amb23454930 [0,1,0,1,0,0|1,0,1]=4 10493 B12R2.115 CC1CC1c2ccccc2Br Amb23247715 [0,1,0,1,0,0|1,0,1]=4 10494 B12R2.115 CC1CC1c2ccccc2N Amb24378033 [0,1,0,1,0,0|1,0,1]=4 10495 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2N Amb24581604 [0,1,0,1,0,0|1,0,1]=4 10496 B12R2.115 C[C@@H]1C[C@H]1c2ccccc2O Amb25373423 [0,1,0,1,0,0|1,0,1]=4 10497 B12R2.115 C[C@H]1C[C@@H]1c2ccccc2N Amb25228469 [0,1,0,1,0,0|1,0,1]=4 10498 B12R2.115 C[C@H]1C[C@H]1c2ccccc2N Amb24514820 [0,1,0,1,0,0|1,0,1]=4 10499 B12R2.115 Cc1ccccc1C2CC2Br Amb24484845 [0,1,0,1,0,0|1,0,1]=4 10500 B12R2.115 Cc1ccccc1C2CC2N Amb19374843 [0,1,0,1,0,0|1,0,1]=4 10501 B12R2.115 Cc1ccccc1C2CC2O Amb24526800 [0,1,0,1,0,0|0,0,2]=4 10502 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Br Amb24718273 [0,1,0,1,0,0|1,0,1]=4 10503 B12R2.115 Cc1ccccc1[C@@H]2C[C@@H]2Cl Amb25176073 [0,1,0,1,0,0|1,0,1]=4 10504 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Br Amb24624562 [0,1,0,1,0,0|1,0,1]=4 10505 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2Cl Amb24540820 [0,1,0,1,0,0|1,0,1]=4 10506 B12R2.115 Cc1ccccc1[C@@H]2C[C@H]2N Amb24560305 [0,1,0,1,0,0|1,0,1]=4 10507 B12R2.115 Clc1ccccc1C2CC2Br Amb23454909 [0,1,0,1,0,0|1,0,1]=4 10508 B12R2.115 Fc1ccccc1C2CC2Br Amb23454901 [0,1,0,1,0,0|1,0,1]=4 10509 B12R2.115 NC1CC1c2ccccc2Br Amb19373270 [0,1,0,1,0,0|1,0,1]=4 10510 B12R2.115 NC1CC1c2ccccc2Cl Amb19346493 [0,1,0,1,0,0|1,0,1]=4 10511 B12R2.115 NC1CC1c2ccccc2F Amb19514922 [0,1,0,1,0,0|1,0,1]=4 10512 B12R2.115 NC1CC1c2ccccc2O Amb25223496 [0,1,0,1,0,0|1,0,1]=4 10513 B12R2.115 N[C@@H]1C[C@H]1c2ccccc2Cl Amb25095403 [0,1,0,1,0,0|1,0,1]=4 10514 B12R2.203 CC1CCc2cccc(N)c21 Amb24654837 [0,1,0,1,0,0|1,0,1]=4 10515 B12R2.203 CC1CCc2cccc(O)c21 Amb24631584 [0,1,0,1,0,0|1,0,1]=4 10516 B12R2.203 CC1CNc2cccc(F)c21 Amb24596681 [0,1,0,1,0,0|1,0,1]=4 10517 B12R2.203 CC1CNc2cccc(O)c21 Amb18124995 [0,1,0,1,0,0|1,0,1]=4 10518 B12R2.203 CC1COc2cccc(N)c21 Amb25694320 [0,1,0,1,0,0|0,0,2]=4 10519 B12R2.203 CC1NCc2cccc(N)c21 Amb25315263 [0,1,0,1,0,0|2,0,0]=4 10520 B12R2.203 CC1NCc2cccc(O)c21 Amb25188765 [0,1,0,1,0,0|2,0,0]=4 10521 B12R2.203 C[C@@H]1NCc2cccc(F)c21 Amb25692606 [0,1,0,1,0,0|2,0,0]=4 10522 B12R2.203 C[C@@H]1NCc2cccc(I)c21 Amb25197963 [0,1,0,1,0,0|2,0,0]=4 10523 B12R2.203 C[C@@H]1NCc2cccc(N)c21 Amb24623869 [0,1,0,1,0,0|2,0,0]=4 10524 B12R2.203 C[C@H]1NCc2cccc(Cl)c21 Amb25121260 [0,1,0,1,0,0|2,0,0]=4 10525 B12R2.203 C[C@H]1NCc2cccc(O)c21 Amb24730569 [0,1,0,1,0,0|2,0,0]=4 10526 B12R2.203 C[n]1c[n]c2cccc(Br)c12 Amb23402255 [0,1,0,1,0,0|2,0,0]=4 10527 B12R2.203 C[n]1c[n]c2cccc(Cl)c12 Amb25213317 [0,1,0,1,0,0|2,0,0]=4 10528 B12R2.203 C[n]1c[n]c2cccc(F)c12 Amb24645134 [0,1,0,1,0,0|2,0,0]=4 10529 B12R2.203 C[n]1c[n]c2cccc(N)c12 Amb18202288 [0,1,0,1,0,0|2,0,0]=4 10530 B12R2.203 C[n]1ccc2cccc(Cl)c12 Amb24532946 [0,1,0,1,0,0|2,0,0]=4 10531 B12R2.203 C[n]1ccc2cccc(F)c12 Amb24444091 [0,1,0,1,0,0|2,0,0]=4 10532 B12R2.203 C[n]1ccc2cccc(N)c12 Amb24671296 [0,1,0,1,0,0|2,0,0]=4 10533 B12R2.203 Cc1c[nH]c2cccc(Br)c21 Amb21856939 [0,1,0,1,0,0|1,0,1]=4 10534 B12R2.203 Cc1c[nH]c2cccc(C)c12 Amb24331786 [0,1,0,1,0,0|1,0,1]=4 10535 B12R2.203 Cc1c[nH]c2cccc(Cl)c21 Amb24331785 [0,1,0,1,0,0|1,0,1]=4 10536 B12R2.203 Cc1c[nH]c2cccc(F)c21 Amb25339434 [0,1,0,1,0,0|1,0,1]=4 10537 B12R2.203 Cc1c[nH]c2cccc(I)c21 Amb24331784 [0,1,0,1,0,0|1,0,1]=4 10538 B12R2.203 Cc1c[nH]c2cccc(N)c21 Amb23439613 [0,1,0,1,0,0|1,0,1]=4 10539 B12R2.203 Cc1c[s]c2cccc(O)c21 Amb18126406 [0,1,0,1,0,0|0,1,1]=4 10540 B12R2.203 Cc1cccc2CNC(C)c12 Amb25244716 [0,1,0,1,0,0|2,0,0]=4 10541 B12R2.203 Cc1cccc2CN[C@@H](C)c12 Amb24731811 [0,1,0,1,0,0|2,0,0]=4 10542 B12R2.203 Cc1cccc2c1n(C)cn2 Amb1902105 [0,1,0,1,0,0|2,0,0]=4 10543 B12R2.203 Cc1cccc2cc[n](C)c12 Amb24729400 [0,1,0,1,0,0|2,0,0]=4 10544 B12R2.203 Cc1coc2cccc(Br)c21 Amb18773208 [0,1,0,1,0,0|0,0,2]=4 10545 B12R2.203 Cc1coc2cccc(N)c21 Amb18202307 [0,1,0,1,0,0|0,0,2]=4 10546 B12R2.203 Cn1cnc2c1c(O)ccc2 Amb10561676 [0,1,0,1,0,0|2,0,0]=4 10547 B12R2.203 NC1C=Cc2c1c(C)ccc2 Amb17470377 [0,1,0,1,0,0|2,0,0]=4 10548 B12R2.203 NC1C=Cc2c1c(Cl)ccc2 Amb17470461 [0,1,0,1,0,0|2,0,0]=4 10549 B12R2.203 NC1C=Cc2c1c(F)ccc2 Amb17470386 [0,1,0,1,0,0|2,0,0]=4 10550 B12R2.517 Brc1ccccc1C2CCC2 Amb20617096 [0,1,0,1,0,0|1,0,1]=4 10551 B12R2.517 Brc1ccccc1C2CCN2 Amb22054565 [0,1,0,1,0,0|2,0,0]=4 10552 B12R2.517 Brc1ccccc1[C@@H]2CCN2 Amb25301204 [0,1,0,1,0,0|2,0,0]=4 10553 B12R2.517 Brc1ccccc1[C@H]2CCN2 Amb25805155 [0,1,0,1,0,0|2,0,0]=4 10554 B12R2.517 Cc1ccccc1C2CNC2 Amb18065237 [0,1,0,1,0,0|1,0,1]=4 10555 B12R2.517 Cc1ccccc1[C@@H]2CCN2 Amb24446967 [0,1,0,1,0,0|2,0,0]=4 10556 B12R2.517 Cc1ccccc1[C@H]2CCN2 Amb25694410 [0,1,0,1,0,0|2,0,0]=4 10557 B12R2.517 Clc1ccccc1C2CCN2 Amb23555564 [0,1,0,1,0,0|2,0,0]=4 10558 B12R2.517 Clc1ccccc1C2CNC2 Amb18563825 [0,1,0,1,0,0|1,0,1]=4 10559 B12R2.517 Clc1ccccc1C2COC2 Amb25266061 [0,1,0,1,0,0|0,0,2]=4 10560 B12R2.517 Clc1ccccc1[C@@H]2CCN2 Amb25840853 [0,1,0,1,0,0|2,0,0]=4 10561 B12R2.517 Fc1ccccc1C2CCN2 Amb20623300 [0,1,0,1,0,0|2,0,0]=4 10562 B12R2.517 Fc1ccccc1C2CCN2 Amb22059455 [0,1,0,1,0,0|2,0,0]=4 10563 B12R2.517 Fc1ccccc1C2CNC2 Amb18065350 [0,1,0,1,0,0|1,0,1]=4 10564 B12R2.517 Fc1ccccc1[C@@H]2CCN2 Amb25145827 [0,1,0,1,0,0|2,0,0]=4 10565 B12R2.517 Ic1ccccc1C2CCN2 Amb25047375 [0,1,0,1,0,0|2,0,0]=4 10566 B12R2.517 Ic1ccccc1[C@@H]2CCN2 Amb25858528 [0,1,0,1,0,0|2,0,0]=4 10567 B12R2.517 Ic1ccccc1[C@H]2CCN2 Amb25116697 [0,1,0,1,0,0|2,0,0]=4 10568 B12R2.517 Nc1ccccc1C2CCC2 Amb20617097 [0,1,0,1,0,0|1,0,1]=4 10569 B12R2.517 Nc1ccccc1C2CCN2 Amb24484457 [0,1,0,1,0,0|2,0,0]=4 10570 B12R2.517 Nc1ccccc1C2CNC2 Amb25744446 [0,1,0,1,0,0|1,0,1]=4 10571 B12R2.517 Oc1ccccc1C2CCC2 Amb20617098 [0,1,0,1,0,0|1,0,1]=4 10572 B12R2.517 Oc1ccccc1C2CCN2 Amb24715881 [0,1,0,1,0,0|2,0,0]=4 10573 B12R2.517 Oc1ccccc1C2CNC2 Amb22228635 [0,1,0,1,0,0|1,0,1]=4 10574 B12R2.517 Oc1ccccc1C2COC2 Amb22737352 [0,1,0,1,0,0|0,0,2]=4 10575 B12R2.517 Oc1ccccc1[C@H]2CCN2 Amb25111618 [0,1,0,1,0,0|2,0,0]=4 10576 B12R2.517 Sc1ccccc1[C@@H]2CCN2 Amb25736329 [0,1,0,1,0,0|2,0,0]=4 10577 B12R2.517 Sc1ccccc1[C@H]2CCN2 Amb25152747 [0,1,0,1,0,0|2,0,0]=4 10578 B12R2.1783 N#CC1Cc2cccc(F)c21 Amb25681332 [0,1,0,1,0,0|1,0,1]=4 10579 B8R1.7 CC(=C)c1ccco1 Amb24532306 [1,0,0,0,1,0|1,0,1]=4 10580 B8R1.7 CC(=O)C1=C[CH-]C=C1 Amb2227554 [1,0,0,0,1,0|0,0,2]=4 10581 B8R1.7 CC(=O)C1C=CC=C1 Amb25358886 [1,0,0,0,1,0|0,0,2]=4 10582 B8R1.7 CC(=O)C=1C=CCC1 Amb24334264 [1,0,0,0,1,0|0,0,2]=4 10583 B8R1.7 CC(=O)c1ccc[nH]1 Amb1151321 [1,0,0,0,1,0|1,0,1]=4 10584 B8R1.7 CC(=O)c1ccc[se]1 Amb17673999 [1,0,0,0,1,0|1,0,1]=4 10585 B8R1.7 CC(=O)c1cocc1 Amb2440799 [1,0,0,0,1,0|1,0,1]=4 10586 B8R1.7 CC(Br)c1c[s]cc1 Amb23450038 [1,0,0,0,1,0|2,0,0]=4 10587 B8R1.7 CC(C)=C1C=CC=C1 Amb22043296 [1,0,0,0,1,0|0,0,2]=4 10588 B8R1.7 CC(C)C1C=CC=C1 Amb22736083 [1,0,0,0,1,0|0,0,2]=4 10589 B8R1.7 CC(C)C=1CC=CC1 Amb22227970 [1,0,0,0,1,0|0,0,2]=4 10590 B8R1.7 CC(C)[c-]1cccc1 Amb25209567 [1,0,0,0,1,0|0,0,2]=4 10591 B8R1.7 CC(C)c1c[nH]cc1 Amb25169371 [1,0,0,0,1,0|1,0,1]=4 10592 B8R1.7 CC(C)c1cc[cH-]c1 Amb22336213 [1,0,0,0,1,0|0,0,2]=4 10593 B8R1.7 CC(C)c1ccc[nH]1 Amb17666650 [1,0,0,0,1,0|1,0,1]=4 10594 B8R1.7 CC(C)c1ccco1 Amb22168231 [1,0,0,0,1,0|1,0,1]=4 10595 B8R1.7 CC(C)c1cccs1 Amb17689449 [1,0,0,0,1,0|1,0,1]=4 10596 B8R1.7 CC(Cl)c1c[s]cc1 Amb24373829 [1,0,0,0,1,0|2,0,0]=4 10597 B8R1.7 CC(Cl)c1ccc[nH]1 Amb20615921 [1,0,0,0,1,0|2,0,0]=4 10598 B8R1.7 CC(N)c1c[nH]cc1 Amb18893398 [1,0,0,0,1,0|2,0,0]=4 10599 B8R1.7 CC(N)c1cocc1 Amb20622299 [1,0,0,0,1,0|2,0,0]=4 10600 B8R1.7 CC(N)c1cocc1 Amb22011563 [1,0,0,0,1,0|2,0,0]=4 10601 B8R1.7 CC(O)c1ccc[nH]1 Amb20618684 [1,0,0,0,1,0|1,0,1]=4 10602 B8R1.7 CC(S)c1cocc1 Amb25727398 [1,0,0,0,1,0|1,1,0]=4 10603 B8R1.7 CC(c1ccco1)Cl Amb17138373 [1,0,0,0,1,0|2,0,0]=4 10604 B8R1.7 CC(c1ccco1)N Amb1154062 [1,0,0,0,1,0|2,0,0]=4 10605 B8R1.7 CC(c1cccs1)Br Amb17447081 [1,0,0,0,1,0|2,0,0]=4 10606 B8R1.7 CC(c1cccs1)Cl Amb17138413 [1,0,0,0,1,0|2,0,0]=4 10607 B8R1.7 CC(c1cccs1)N Amb1790688 [1,0,0,0,1,0|2,0,0]=4 10608 B8R1.7 CC(c1cocc1)O Amb2440797 [1,0,0,0,1,0|1,0,1]=4 10609 B8R1.7 CC(c1cscc1)N Amb13952135 [1,0,0,0,1,0|2,0,0]=4 10610 B8R1.7 CS(=O)[n]1cccc1 Amb24691728 [1,0,0,0,1,0|2,0,0]=4 10611 B8R1.7 CS(=O)c1c[nH]cc1 Amb25082099 [1,0,0,0,1,0|2,0,0]=4 10612 B8R1.7 CS(=O)c1c[s]cc1 Amb24759235 [1,0,0,0,1,0|2,0,0]=4 10613 B8R1.7 CS(=O)c1ccco1 Amb25208644 [1,0,0,0,1,0|2,0,0]=4 10614 B8R1.7 C[C@@H](N)c1ccc[s]1 Amb19514729 [1,0,0,0,1,0|2,0,0]=4 10615 B8R1.7 C[C@@H](O)c1c[nH]cc1 Amb24635383 [1,0,0,0,1,0|1,0,1]=4 10616 B8R1.7 C[C@@H](c1ccc[nH]1)O Amb13953007 [1,0,0,0,1,0|1,0,1]=4 10617 B8R1.7 C[C@@H](c1ccco1)N Amb13952985 [1,0,0,0,1,0|2,0,0]=4 10618 B8R1.7 C[C@@H](c1cccs1)N Amb13952997 [1,0,0,0,1,0|2,0,0]=4 10619 B8R1.7 C[C@@H](c1cccs1)O Amb13952996 [1,0,0,0,1,0|1,0,1]=4 10620 B8R1.7 C[C@H](N)c1c[s]cc1 Amb22641886 [1,0,0,0,1,0|2,0,0]=4 10621 B8R1.7 C[C@H](N)c1cocc1 Amb24455235 [1,0,0,0,1,0|2,0,0]=4 10622 B8R1.7 C[C@H](O)[n]1cccc1 Amb25846939 [1,0,0,0,1,0|1,0,1]=4 10623 B8R1.7 C[C@H](O)c1c[nH]cc1 Amb25060835 [1,0,0,0,1,0|1,0,1]=4 10624 B8R1.7 C[C@H](c1ccc[nH]1)O Amb13953008 [1,0,0,0,1,0|1,0,1]=4 10625 B8R1.7 C[C@H](c1ccco1)N Amb13952986 [1,0,0,0,1,0|2,0,0]=4 10626 B8R1.7 C[C@H](c1cccs1)N Amb13952998 [1,0,0,0,1,0|2,0,0]=4 10627 B8R1.7 C[C@H](c1cccs1)O Amb10603205 [1,0,0,0,1,0|1,0,1]=4 10628 B8R1.8 C=CCc1c[nH]cc1 Amb24426386 [1,0,0,0,1,0|2,0,0]=4 10629 B8R1.8 C=CCc1ccc[nH]1 Amb25075519 [1,0,0,0,1,0|2,0,0]=4 10630 B8R1.8 C=CCc1cocc1 Amb24729373 [1,0,0,0,1,0|2,0,0]=4 10631 B8R1.8 O=CC[n]1c[n]cc1 Amb24580294 [1,0,0,0,1,0|2,0,0]=4 10632 B8R1.8 O=CC[n]1cccc1 Amb18203408 [1,0,0,0,1,0|1,0,0]=3 10633 B8R1.8 O=CCc1c[nH][n]c1 Amb25216022 [1,0,0,0,1,0|2,0,0]=4 10634 B8R1.8 O=CCc1c[nH]c[n]1 Amb18124130 [1,0,0,0,1,0|2,0,0]=4 10635 B8R1.8 O=CCc1c[n]co1 Amb24653904 [1,0,0,0,1,0|2,0,0]=4 10636 B8R1.8 O=CCc1c[n]oc1 Amb24502003 [1,0,0,0,1,0|2,0,0]=4 10637 B8R1.8 O=CCc1c[s]c[n]1 Amb24469342 [1,0,0,0,1,0|2,0,0]=4 10638 B8R1.8 O=CCc1ccc[nH]1 Amb24763675 [1,0,0,0,1,0|1,0,0]=3 10639 B8R1.8 O=CCc1ccco1 Amb17089526 [1,0,0,0,1,0|1,0,0]=3 10640 B8R1.8 O=CCc1cccs1 Amb17089527 [1,0,0,0,1,0|1,0,0]=3 10641 B8R1.8 O=CCc1cocc1 Amb18641576 [1,0,0,0,1,0|1,0,0]=3 10642 B8R1.8 O=COc1ccc[nH]1 Amb24756546 [1,0,0,0,1,0|2,0,0]=4 10643 B10R1.348 CC(=O)C=1C=CN=C=CC1 Amb24363721 [1,0,0,0,0,1|0,0,2]=4 10644 B10R1.348 CC(O)C=1CC=CC=CC1 Amb24361954 [1,0,0,0,0,1|0,0,1]=3 10645 B10R1.348 NC(=O)C1=CC=CC=CO1 Amb24428634 [1,0,0,0,0,1|1,0,1]=4 10646 B10R1.348 NC(=O)C=1C=CC=CCC1 Amb25730515 [1,0,0,0,0,1|1,0,1]=4 10647 B10R1.348 NC(=O)C=1C=CCC=CC1 Amb25368351 [1,0,0,0,0,1|1,0,1]=4 10648 B10R1.348 NC(=O)C=1CC=CC=CC1 Amb25709062 [1,0,0,0,0,1|1,0,1]=4 10649 B10R1.348 O=C(Cl)C=1CC=CC=CC1 Amb25374042 [1,0,0,0,0,1|1,0,1]=4 10650 B10R1.348 OC(=O)C=1C=COC=CC1 Amb25132139 [1,0,0,0,0,1|1,0,1]=4 10651 B10R1.85 Cl\C=C\C=1CC=CC=CC1 Amb24529939 [1,0,0,0,0,1|1,0,1]=4 10652 B10R1.85 NCCC=1C=COC=CC1 Amb24615627 [1,0,0,0,0,1|1,0,1]=4 10653 B10R1.85 O=C=NC1=CC=CCC=C1 Amb25690426 [1,0,0,0,0,1|1,0,1]=4 10654 B10R1.85 O=C=NC1=CCC=CC=C1 Amb24381422 [1,0,0,0,0,1|1,0,1]=4 10655 B10R1.85 O=CC=C1C=CC=CC=C1 Amb24070046 [1,0,0,0,0,1|0,0,1]=3 10656 B10R1.85 O=CCC1C=CC=CC=C1 Amb24663757 [1,0,0,0,0,1|0,0,1]=3 10657 B12R1.27 C=C(C=O)C#Cc1ccccc1 Amb25821448 [0,0,0,0,0,2|0,0,2]=4 10658 B12R1.27 C=C(C=O)ONc1ccccc1 Amb24676829 [0,0,0,0,0,2|0,0,2]=4 10659 B12R1.27 C=CC(O)CSc1ccccc1 Amb24273355 [0,0,0,0,0,2|2,0,0]=4 10660 B12R1.27 C=C[C@@H](O)C#Cc1ccccc1 Amb25817128 [0,0,0,0,0,2|2,0,0]=4 10661 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [0,0,0,0,0,2|1,0,1]=4 10662 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [0,0,0,0,0,2|1,0,1]=4 10663 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [0,0,0,0,0,2|1,0,1]=4 10664 B12R1.27 CC(C#N)SCc1ccccc1 Amb18808999 [0,0,0,0,0,2|1,0,1]=4 10665 B12R1.27 CC(C=O)=C=Cc1ccccc1 Amb24452570 [0,0,0,0,0,2|0,0,1]=3 10666 B12R1.27 CC(C=O)C#Cc1ccccc1 Amb25075672 [0,0,0,0,0,2|0,0,0]=2 10667 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [0,0,0,0,0,2|0,0,0]=2 10668 B12R1.27 CC(C=O)ONc1ccccc1 Amb25239411 [0,0,0,0,0,2|0,0,0]=2 10669 B12R1.27 CC(C=O)\C=C\c1ccccc1 Amb24573489 [0,0,0,0,0,2|0,0,0]=2 10670 B12R1.27 CC(CCc1ccccc1)NN Amb22445317 [0,0,0,0,0,2|2,0,0]=4 10671 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [0,0,0,0,0,2|1,0,1]=4 10672 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [0,0,0,0,0,2|1,0,1]=4 10673 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [0,0,0,0,0,2|1,0,1]=4 10674 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [0,0,0,0,0,2|1,0,1]=4 10675 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [0,0,0,0,0,2|1,0,1]=4 10676 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [0,0,0,0,0,2|1,0,1]=4 10677 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [0,0,0,0,0,2|1,0,0]=3 10678 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [0,0,0,0,0,2|2,0,0]=4 10679 B12R1.27 CC(CO)C#Cc1ccccc1 Amb25071626 [0,0,0,0,0,2|0,0,2]=4 10680 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [0,0,0,0,0,2|0,0,2]=4 10681 B12R1.27 CC(CO)\C=C\c1ccccc1 Amb25378732 [0,0,0,0,0,2|0,0,2]=4 10682 B12R1.27 CC(CO)\C=N\c1ccccc1 Amb20248421 [0,0,0,0,0,2|0,0,2]=4 10683 B12R1.27 CC(CO)\N=C\c1ccccc1 Amb25680631 [0,0,0,0,0,2|0,0,2]=4 10684 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [0,0,0,0,0,2|2,0,0]=4 10685 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [0,0,0,0,0,2|1,0,1]=4 10686 B12R1.27 CN(CNc1ccccc1)N=O Amb25690722 [0,0,0,0,0,2|2,0,0]=4 10687 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [0,0,0,0,0,2|2,0,0]=4 10688 B12R1.27 CNC(C)\C=C\c1ccccc1 Amb18126307 [0,0,0,0,0,2|2,0,0]=4 10689 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,0,0,0,0,2|2,0,0]=4 10690 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,0,0,0,0,2|2,0,0]=4 10691 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [0,0,0,0,0,2|2,0,0]=4 10692 B12R1.27 C[C@@H](C=O)ONc1ccccc1 Amb25701904 [0,0,0,0,0,2|0,0,0]=2 10693 B12R1.27 C[C@@H](C=O)\C=C\c1ccccc1 Amb24441531 [0,0,0,0,0,2|0,0,0]=2 10694 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [0,0,0,0,0,2|1,0,1]=4 10695 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [0,0,0,0,0,2|1,0,1]=4 10696 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [0,0,0,0,0,2|0,0,2]=4 10697 B12R1.27 C[C@@H](CO)\C=C\c1ccccc1 Amb25127764 [0,0,0,0,0,2|0,0,2]=4 10698 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [0,0,0,0,0,2|0,0,0]=2 10699 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [0,0,0,0,0,2|0,0,2]=4 10700 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [0,0,0,0,0,2|0,0,2]=4 10701 B12R1.27 C[C@H](CO)ONc1ccccc1 Amb24625280 [0,0,0,0,0,2|0,0,2]=4 10702 B12R1.27 C[C@H](CO)\N=C\c1ccccc1 Amb25048456 [0,0,0,0,0,2|0,0,2]=4 10703 B12R1.27 C\C(=C\O)\C#Cc1ccccc1 Amb24379979 [0,0,0,0,0,2|0,0,2]=4 10704 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [0,0,0,0,0,2|0,0,1]=3 10705 B12R1.27 C\C(\C=O)=C/Nc1ccccc1 Amb18645511 [0,0,0,0,0,2|0,0,1]=3 10706 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [0,0,0,0,0,2|0,0,1]=3 10707 B12R1.27 C\C(\C=O)=C\Sc1ccccc1 Amb25277189 [0,0,0,0,0,2|0,0,1]=3 10708 B12R1.27 C\C(\C=O)=N/Nc1ccccc1 Amb18645673 [0,0,0,0,0,2|0,0,1]=3 10709 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,0,0,0,0,2|1,0,1]=4 10710 B12R1.27 C\C(\COc1ccccc1)=C\Cl Amb25241242 [0,0,0,0,0,2|1,0,1]=4 10711 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,0,0,0,0,2|1,0,1]=4 10712 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [0,0,0,0,0,2|1,0,1]=4 10713 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [0,0,0,0,0,2|0,0,0]=2 10714 B12R1.27 O=CC(Cl)\C=N\c1ccccc1 Amb24433968 [0,0,0,0,0,2|1,0,0]=3 10715 B12R1.27 O=CC(\C=N\c1ccccc1)Br Amb2233921 [0,0,0,0,0,2|1,0,0]=3 10716 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [0,0,0,0,0,2|0,0,0]=2 10717 B12R1.27 O=C\C(\Cl)=C/Nc1ccccc1 Amb24603974 [0,0,0,0,0,2|1,0,1]=4 10718 B12R1.27 O=C\C(\Cl)=C\Nc1ccccc1 Amb25797781 [0,0,0,0,0,2|1,0,1]=4 10719 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [0,0,0,0,0,2|1,0,1]=4 10720 B12R1.27 O=C\C(\F)=N/Nc1ccccc1 Amb24611193 [0,0,0,0,0,2|1,0,1]=4 10721 B12R1.27 OC(C=O)C#Cc1ccccc1 Amb25375035 [0,0,0,0,0,2|1,0,0]=3 10722 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [0,0,0,0,0,2|0,0,2]=4 10723 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [0,0,0,0,0,2|0,0,2]=4 10724 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [0,0,0,0,0,2|1,0,1]=4 10725 B12R1.1659 C=CC(O)C=1C=CC=CC=CC1 Amb25792351 [0,0,0,0,0,2|2,0,0]=4