0 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [0,0,0,0,0,0|2,0,1]=3 2 B11R1.16 C#CCC(N)c1c[n]ccc1 Amb18959769 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.16 C#CCC(N)c1cc[n]cc1 Amb18959770 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.16 C#CCC(N)c1cccc[n]1 Amb18284997 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.16 C#CCC(O)c1c[n]ccc1 Amb22756005 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.16 C#CCC(O)c1cccc[n]1 Amb19373060 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.16 C#CCS(=O)c1ccccc1 Amb25241742 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [0,0,0,0,0,0|2,0,1]=3 10 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [0,0,0,0,0,0|2,0,1]=3 11 B11R1.16 C#CC[C@H](O)c1c[n]ccc1 Amb25373838 [0,0,0,0,0,0|3,0,1]=4 12 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [0,0,0,0,0,0|2,0,2]=4 13 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.16 C=CCC(=O)c1ccccc1 Amb17334260 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [0,0,0,0,0,0|2,0,1]=3 16 B11R1.16 C=CCC(N)c1c[n]ccc1 Amb18292092 [0,0,0,0,0,0|3,0,1]=4 17 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb18292093 [0,0,0,0,0,0|3,0,1]=4 18 B11R1.16 C=CCC(N)c1cc[n]cc1 Amb19374106 [0,0,0,0,0,0|3,0,1]=4 19 B11R1.16 C=CCC(N)c1cccc[n]1 Amb18977590 [0,0,0,0,0,0|3,0,1]=4 20 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [0,0,0,0,0,0|2,0,1]=3 21 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [0,0,0,0,0,0|3,0,1]=4 22 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [0,0,0,0,0,0|2,0,1]=3 23 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [0,0,0,0,0,0|2,0,1]=3 24 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [0,0,0,0,0,0|2,0,1]=3 25 B11R1.16 C=CCN(c1ccccc1)N Amb17226668 [0,0,0,0,0,0|3,0,1]=4 26 B11R1.16 C=CCS(=O)c1ccccc1 Amb17933936 [0,0,0,0,0,0|3,0,1]=4 27 B11R1.16 C=CC[C@@H](N)c1c[n]ccc1 Amb24487504 [0,0,0,0,0,0|3,0,1]=4 28 B11R1.16 C=CC[C@@H](N)c1cccc[n]1 Amb25844369 [0,0,0,0,0,0|3,0,1]=4 29 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [0,0,0,0,0,0|2,0,1]=3 30 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [0,0,0,0,0,0|2,0,1]=3 31 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [0,0,0,0,0,0|2,0,1]=3 32 B11R1.16 C=CC[C@H](N)c1c[n]ccc1 Amb24699940 [0,0,0,0,0,0|3,0,1]=4 33 B11R1.16 C=CC[C@H](N)c1cccc[n]1 Amb25117558 [0,0,0,0,0,0|3,0,1]=4 34 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [0,0,0,0,0,0|3,0,1]=4 35 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [0,0,0,0,0,0|3,0,1]=4 36 B11R1.16 C=CC[S@@](=O)c1ccccc1 Amb22747466 [0,0,0,0,0,0|3,0,1]=4 37 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,0,0,0,0,0|2,0,2]=4 38 B11R1.16 CC#CC(N)c1cccc[n]1 Amb25758783 [0,0,0,0,0,0|3,0,1]=4 39 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [0,0,0,0,0,0|2,0,1]=3 40 B11R1.16 CC#CC(O)c1cc[n]cc1 Amb24379335 [0,0,0,0,0,0|3,0,1]=4 41 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [0,0,0,0,0,0|2,0,1]=3 42 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [0,0,0,0,0,0|2,0,1]=3 43 B11R1.16 CC#C[C@H](N)c1cccc[n]1 Amb25076163 [0,0,0,0,0,0|3,0,1]=4 44 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [0,0,0,0,0,0|1,0,2]=3 45 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [0,0,0,0,0,0|1,0,1]=2 46 B11R1.16 CC(CC#N)c1cc[n]cc1 Amb18124804 [0,0,0,0,0,0|3,0,0]=3 47 B11R1.16 CC(CC#N)c1cccc[n]1 Amb25073965 [0,0,0,0,0,0|3,0,0]=3 48 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [0,0,0,0,0,0|2,0,1]=3 49 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [0,0,0,0,0,0|1,0,1]=2 50 B11R1.16 CC(CC=O)c1c[n]cc[n]1 Amb24591956 [0,0,0,0,0,0|4,0,0]=4 51 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [0,0,0,0,0,0|3,0,0]=3 52 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [0,0,0,0,0,0|3,0,0]=3 53 B11R1.16 CC(CCN)c1c[n]c[n]c1 Amb24467901 [0,0,0,0,0,0|4,0,0]=4 54 B11R1.16 CC(CCN)c1c[n]ccc1 Amb18293554 [0,0,0,0,0,0|3,0,0]=3 55 B11R1.16 CC(CCN)c1cc[n]cc1 Amb18293553 [0,0,0,0,0,0|3,0,0]=3 56 B11R1.16 CC(CCN)c1cccc[n]1 Amb18981390 [0,0,0,0,0,0|3,0,0]=3 57 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [0,0,0,0,0,0|2,0,0]=2 58 B11R1.16 CC(CCO)c1c[n]ccc1 Amb25808756 [0,0,0,0,0,0|3,0,0]=3 59 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [0,0,0,0,0,0|2,0,0]=2 60 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [0,0,0,0,0,0|1,0,0]=1 61 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [0,0,0,0,0,0|2,0,0]=2 62 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [0,0,0,0,0,0|2,0,1]=3 63 B11R1.16 CC(NC#N)c1c[n]ccc1 Amb24445387 [0,0,0,0,0,0|4,0,0]=4 64 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [0,0,0,0,0,0|3,0,0]=3 65 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [0,0,0,0,0,0|2,0,1]=3 66 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [0,0,0,0,0,0|2,0,1]=3 67 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [0,0,0,0,0,0|3,0,0]=3 68 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [0,0,0,0,0,0|3,0,0]=3 69 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [0,0,0,0,0,0|3,0,0]=3 70 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [0,0,0,0,0,0|2,0,1]=3 71 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [0,0,0,0,0,0|1,0,2]=3 72 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [0,0,0,0,0,0|2,0,0]=2 73 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [0,0,0,0,0,0|3,0,0]=3 74 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [0,0,0,0,0,0|2,0,1]=3 75 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [0,0,0,0,0,0|1,0,2]=3 76 B11R1.16 CCCC(=O)c1cc[n]cc1 Amb22235246 [0,0,0,0,0,0|3,0,1]=4 77 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,0,0,0,0,0|3,0,1]=4 78 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [0,0,0,0,0,0|3,0,0]=3 79 B11R1.16 CCCC(Cl)c1c[n]c[n]c1 Amb25369663 [0,0,0,0,0,0|4,0,0]=4 80 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [0,0,0,0,0,0|3,0,0]=3 81 B11R1.16 CCCC(N)c1[n]ccc[n]1 Amb18984962 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.16 CCCC(N)c1c[n]c[n]c1 Amb18991851 [0,0,0,0,0,0|4,0,0]=4 83 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [0,0,0,0,0,0|3,0,0]=3 84 B11R1.16 CCCC(N)c1cc[n]c[n]1 Amb25293433 [0,0,0,0,0,0|4,0,0]=4 85 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [0,0,0,0,0,0|3,0,0]=3 86 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [0,0,0,0,0,0|3,0,0]=3 87 B11R1.16 CCCC(O)c1[n]ccc[n]1 Amb18179424 [0,0,0,0,0,0|4,0,0]=4 88 B11R1.16 CCCC(O)c1c[n]c[n]c1 Amb18799414 [0,0,0,0,0,0|4,0,0]=4 89 B11R1.16 CCCC(O)c1c[n]cc[n]1 Amb18179423 [0,0,0,0,0,0|4,0,0]=4 90 B11R1.16 CCCC(O)c1cc[n]c[n]1 Amb25145824 [0,0,0,0,0,0|4,0,0]=4 91 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [0,0,0,0,0,0|3,0,0]=3 92 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [0,0,0,0,0,0|3,0,0]=3 93 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [0,0,0,0,0,0|2,0,0]=2 94 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [0,0,0,0,0,0|3,0,0]=3 95 B11R1.16 CCCC(c1cnccn1)N Amb17505550 [0,0,0,0,0,0|4,0,0]=4 96 B11R1.16 CCCN(C)c1cccc[n]1 Amb24719444 [0,0,0,0,0,0|3,0,0]=3 97 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [0,0,0,0,0,0|3,0,0]=3 98 B11R1.16 CCC[C@@H](N)c1c[n]cc[n]1 Amb24484506 [0,0,0,0,0,0|4,0,0]=4 99 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [0,0,0,0,0,0|3,0,0]=3 100 B11R1.16 CCC[C@@H](N)c1cc[n]c[n]1 Amb25120203 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.16 CCC[C@@H](O)c1c[n]c[n]c1 Amb24622286 [0,0,0,0,0,0|4,0,0]=4 103 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [0,0,0,0,0,0|3,0,0]=3 104 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [0,0,0,0,0,0|3,0,0]=3 105 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [0,0,0,0,0,0|2,0,0]=2 106 B11R1.16 CCC[C@H](N)c1cc[n]c[n]1 Amb25150206 [0,0,0,0,0,0|4,0,0]=4 107 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [0,0,0,0,0,0|3,0,0]=3 108 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [0,0,0,0,0,0|2,0,0]=2 109 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [0,0,0,0,0,0|2,0,0]=2 110 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [0,0,0,0,0,0|3,0,0]=3 111 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [0,0,0,0,0,0|3,0,0]=3 112 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [0,0,0,0,0,0|2,0,0]=2 113 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [0,0,0,0,0,0|2,0,0]=2 114 B11R1.16 CCNC(=N)c1ccccc1 Amb23447118 [0,0,0,0,0,0|3,0,1]=4 115 B11R1.16 CCNC(C)c1[n]ccc[n]1 Amb18968365 [0,0,0,0,0,0|4,0,0]=4 116 B11R1.16 CCNC(C)c1c[n][n]cc1 Amb24718778 [0,0,0,0,0,0|4,0,0]=4 117 B11R1.16 CCNC(C)c1c[n]c[n]c1 Amb18298705 [0,0,0,0,0,0|4,0,0]=4 118 B11R1.16 CCNC(C)c1c[n]cc[n]1 Amb18968355 [0,0,0,0,0,0|4,0,0]=4 119 B11R1.16 CCNC(C)c1cc[n]c[n]1 Amb24357447 [0,0,0,0,0,0|4,0,0]=4 120 B11R1.16 CCNC(C)c1cc[n]cc1 Amb19515613 [0,0,0,0,0,0|3,0,0]=3 121 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [0,0,0,0,0,0|2,0,0]=2 122 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [0,0,0,0,0,0|3,0,0]=3 123 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [0,0,0,0,0,0|2,0,0]=2 124 B11R1.16 CCOC(=C)c1ccccc1 Amb24495644 [0,0,0,0,0,0|2,0,2]=4 125 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,0,0,0,0,0|3,0,1]=4 126 B11R1.16 CCOC(=O)c1ccccc1 Amb22367067 [0,0,0,0,0,0|3,0,1]=4 127 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb22445379 [0,0,0,0,0,0|3,0,1]=4 128 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [0,0,0,0,0,0|3,0,0]=3 129 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,0,0,0,0,0|2,0,0]=2 130 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [0,0,0,0,0,0|3,0,0]=3 131 B11R1.16 CCOC(O)c1c[n]ccc1 Amb24379956 [0,0,0,0,0,0|4,0,0]=4 132 B11R1.16 CCOC(O)c1cccc[n]1 Amb25057798 [0,0,0,0,0,0|4,0,0]=4 133 B11R1.16 CCOP(=O)c1ccccc1 Amb10601587 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [0,0,0,0,0,0|3,0,0]=3 135 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [0,0,0,0,0,0|3,0,0]=3 136 B11R1.16 CC\N=C(\Cl)/c1ccccc1 Amb24463735 [0,0,0,0,0,0|3,0,1]=4 137 B11R1.16 CN(CC#C)c1cccc[n]1 Amb25152733 [0,0,0,0,0,0|3,0,1]=4 138 B11R1.16 CN(CC#C)c1ccccc1 Amb19514873 [0,0,0,0,0,0|2,0,1]=3 139 B11R1.16 CN(CC#N)c1cccc[n]1 Amb24397681 [0,0,0,0,0,0|4,0,0]=4 140 B11R1.16 CN(CC=C)c1cccc[n]1 Amb25072101 [0,0,0,0,0,0|3,0,1]=4 141 B11R1.16 CN(CCBr)c1ccccc1 Amb24477466 [0,0,0,0,0,0|3,0,0]=3 142 B11R1.16 CN(CCCl)c1cccc[n]1 Amb24695070 [0,0,0,0,0,0|4,0,0]=4 143 B11R1.16 CN(CCF)c1ccccc1 Amb24485344 [0,0,0,0,0,0|3,0,0]=3 144 B11R1.16 CN(CCN)c1cc[n]cc1 Amb18993102 [0,0,0,0,0,0|4,0,0]=4 145 B11R1.16 CN(CCN)c1cccc[n]1 Amb18302344 [0,0,0,0,0,0|4,0,0]=4 146 B11R1.16 CN(CCO)c1cc[n]cc1 Amb18179433 [0,0,0,0,0,0|4,0,0]=4 147 B11R1.16 CN(CCO)c1cc[n]cc1 Amb19373596 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.16 CN(CCO)c1cccc[n]1 Amb21955495 [0,0,0,0,0,0|4,0,0]=4 149 B11R1.16 CN(N=C=O)c1ccccc1 Amb25242708 [0,0,0,0,0,0|4,0,0]=4 150 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [0,0,0,0,0,0|4,0,0]=4 151 B11R1.16 CN(\N=C\N)c1ccccc1 Amb25840394 [0,0,0,0,0,0|4,0,0]=4 152 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [0,0,0,0,0,0|0,0,2]=2 153 B11R1.16 CNCC(=O)c1c[n]cc[n]1 Amb21862013 [0,0,0,0,0,0|3,0,1]=4 154 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [0,0,0,0,0,0|1,0,0]=1 155 B11R1.16 CNCC(C)N1CC=CCC1 Amb24590090 [0,0,0,0,0,0|1,0,3]=4 156 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [0,0,0,0,0,0|1,0,0]=1 157 B11R1.16 CNCC(F)c1cc[n]cc1 Amb25331906 [0,0,0,0,0,0|2,0,0]=2 158 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [0,0,0,0,0,0|1,0,0]=1 159 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [0,0,0,0,0,0|1,0,0]=1 160 B11R1.16 CNCC(O)c1c[n]c[n]c1 Amb25141262 [0,0,0,0,0,0|3,0,0]=3 161 B11R1.16 CNCC(O)c1c[n]ccc1 Amb19515701 [0,0,0,0,0,0|2,0,0]=2 162 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [0,0,0,0,0,0|1,0,0]=1 163 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [0,0,0,0,0,0|0,0,0]=0 164 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [0,0,0,0,0,0|1,0,0]=1 165 B11R1.16 CNCC(c1ccccn1)O Amb17138440 [0,0,0,0,0,0|2,0,0]=2 166 B11R1.16 CNCC(c1cccnc1)O Amb17138441 [0,0,0,0,0,0|2,0,0]=2 167 B11R1.16 CNCC(c1ccncc1)O Amb17138442 [0,0,0,0,0,0|2,0,0]=2 168 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [0,0,0,0,0,0|1,0,0]=1 169 B11R1.16 CNC[C@@H](O)c1c[n]cc[n]1 Amb25719382 [0,0,0,0,0,0|3,0,0]=3 170 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [0,0,0,0,0,0|0,0,0]=0 171 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [0,0,0,0,0,0|1,0,0]=1 172 B11R1.16 CNC[C@H](O)c1c[n]cc[n]1 Amb24692961 [0,0,0,0,0,0|3,0,0]=3 173 B11R1.16 CNC[C@H](O)c1c[n]ccc1 Amb25172815 [0,0,0,0,0,0|2,0,0]=2 174 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [0,0,0,0,0,0|1,0,0]=1 175 B11R1.16 CNN=C(N)c1ccccc1 Amb20623020 [0,0,0,0,0,0|2,0,1]=3 176 B11R1.16 CNNC(=N)c1ccc[n]c1 Amb25690466 [0,0,0,0,0,0|3,0,1]=4 177 B11R1.16 CNNC(=N)c1cccc[n]1 Amb24516890 [0,0,0,0,0,0|3,0,1]=4 178 B11R1.16 CNNC(=O)c1ccc[n]c1 Amb25216264 [0,0,0,0,0,0|3,0,1]=4 179 B11R1.16 CNNC(=O)c1ccccc1 Amb24096729 [0,0,0,0,0,0|2,0,1]=3 180 B11R1.16 CNNC(=S)c1ccccc1 Amb25084578 [0,0,0,0,0,0|2,0,1]=3 181 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [0,0,0,0,0,0|2,0,0]=2 182 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,0,0,0,0,0|2,0,1]=3 183 B11R1.16 CN\N=C(\Br)/c1cc[n]cc1 Amb25785501 [0,0,0,0,0,0|3,0,1]=4 184 B11R1.16 COCC(=O)c1ccc[n]c1 Amb18179389 [0,0,0,0,0,0|3,0,1]=4 185 B11R1.16 COCC(=O)c1ccccn1 Amb10607921 [0,0,0,0,0,0|3,0,1]=4 186 B11R1.16 COCC(Br)c1cccc[n]1 Amb24469291 [0,0,0,0,0,0|3,0,0]=3 187 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [0,0,0,0,0,0|1,0,0]=1 188 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [0,0,0,0,0,0|2,0,0]=2 189 B11R1.16 COCC(N)c1c[n]c[n]c1 Amb18992089 [0,0,0,0,0,0|4,0,0]=4 190 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [0,0,0,0,0,0|3,0,0]=3 191 B11R1.16 COCC(O)c1[n]ccc[n]1 Amb25070058 [0,0,0,0,0,0|4,0,0]=4 192 B11R1.16 COCC(O)c1c[n]c[n]c1 Amb18182901 [0,0,0,0,0,0|4,0,0]=4 193 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [0,0,0,0,0,0|3,0,0]=3 194 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [0,0,0,0,0,0|2,0,0]=2 195 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [0,0,0,0,0,0|2,0,0]=2 196 B11R1.16 COCC(c1ccccc1)N Amb1134749 [0,0,0,0,0,0|2,0,0]=2 197 B11R1.16 COCC(c1ccccc1)N Amb13952604 [0,0,0,0,0,0|2,0,0]=2 198 B11R1.16 COCC(c1ccccn1)N Amb10607922 [0,0,0,0,0,0|3,0,0]=3 199 B11R1.16 COCC(c1ccccn1)N Amb13949181 [0,0,0,0,0,0|3,0,0]=3 200 B11R1.16 COC[C@@H](N)c1[n]ccc[n]1 Amb25140231 [0,0,0,0,0,0|4,0,0]=4 201 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [0,0,0,0,0,0|3,0,0]=3 202 B11R1.16 COC[C@@H](N)c1cc[n]cc1 Amb24428710 [0,0,0,0,0,0|3,0,0]=3 203 B11R1.16 COC[C@@H](N)c1cccc[n]1 Amb25104762 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [0,0,0,0,0,0|2,0,0]=2 205 B11R1.16 COC[C@H](N)c1c[n][n]cc1 Amb25280057 [0,0,0,0,0,0|4,0,0]=4 206 B11R1.16 COC[C@H](N)c1c[n]c[n]c1 Amb25151807 [0,0,0,0,0,0|4,0,0]=4 207 B11R1.16 COC[C@H](N)c1c[n]cc[n]1 Amb24485758 [0,0,0,0,0,0|4,0,0]=4 208 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [0,0,0,0,0,0|3,0,0]=3 209 B11R1.16 COC[C@H](N)c1cc[n]c[n]1 Amb25343228 [0,0,0,0,0,0|4,0,0]=4 210 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [0,0,0,0,0,0|2,0,0]=2 211 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [0,0,0,0,0,0|2,0,0]=2 212 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,0,0,0,0,0|3,0,1]=4 213 B11R1.16 CONC(C)c1cccc[n]1 Amb25793754 [0,0,0,0,0,0|3,0,0]=3 214 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [0,0,0,0,0,0|2,0,0]=2 215 B11R1.16 CO\N=C(/N)\c1ccccc1 Amb18224270 [0,0,0,0,0,0|3,0,1]=4 216 B11R1.16 CO\N=C(\c1ccccc1)/C Amb10572535 [0,0,0,0,0,0|2,0,1]=3 217 B11R1.16 CP(CCN)c1ccccc1 Amb25685240 [0,0,0,0,0,0|3,0,0]=3 218 B11R1.16 CSCC(=O)c1cc[n]cc1 Amb22730530 [0,0,0,0,0,0|3,0,1]=4 219 B11R1.16 CSCC(=O)c1ccc[n]c1 Amb18182650 [0,0,0,0,0,0|3,0,1]=4 220 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [0,0,0,0,0,0|1,0,0]=1 221 B11R1.16 CSCC(N)c1c[n]c[n]c1 Amb18995353 [0,0,0,0,0,0|4,0,0]=4 222 B11R1.16 CSCC(N)c1c[n]ccc1 Amb18300195 [0,0,0,0,0,0|3,0,0]=3 223 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [0,0,0,0,0,0|2,0,0]=2 224 B11R1.16 CSCC(O)c1c[n]c[n]c1 Amb18183596 [0,0,0,0,0,0|4,0,0]=4 225 B11R1.16 CSCC(O)c1c[n]ccc1 Amb18801395 [0,0,0,0,0,0|3,0,0]=3 226 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [0,0,0,0,0,0|2,0,0]=2 227 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [0,0,0,0,0,0|2,0,0]=2 228 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [0,0,0,0,0,0|2,0,0]=2 229 B11R1.16 C[C@@H](N=[N+]=[N-])c1c[n]ccc1 Amb25107225 [0,0,0,0,0,0|3,0,1]=4 230 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [0,0,0,0,0,0|2,0,1]=3 231 B11R1.16 C[C@@H](NC#N)c1cccc[n]1 Amb24415395 [0,0,0,0,0,0|4,0,0]=4 232 B11R1.16 C[C@@H](NC=O)c1c[n]ccc1 Amb24390688 [0,0,0,0,0,0|4,0,0]=4 233 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [0,0,0,0,0,0|2,0,0]=2 234 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [0,0,0,0,0,0|2,0,0]=2 235 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [0,0,0,0,0,0|2,0,0]=2 236 B11R1.16 C[C@H](N=[N+]=[N-])c1c[n]ccc1 Amb24476074 [0,0,0,0,0,0|3,0,1]=4 237 B11R1.16 C[C@H](N=[N+]=[N-])c1cccc[n]1 Amb24509550 [0,0,0,0,0,0|3,0,1]=4 238 B11R1.16 C[C@H](NC=O)c1c[n]ccc1 Amb24709803 [0,0,0,0,0,0|4,0,0]=4 239 B11R1.16 C[C@H](NC=O)c1cc[n]cc1 Amb25071847 [0,0,0,0,0,0|4,0,0]=4 240 B11R1.16 C[C@H](NC=O)c1cccc[n]1 Amb25782398 [0,0,0,0,0,0|4,0,0]=4 241 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [0,0,0,0,0,0|3,0,0]=3 242 B11R1.16 C[NH2+]OC(=O)c1ccccc1 Amb22352804 [0,0,0,0,0,0|2,0,2]=4 243 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [0,0,0,0,0,0|1,0,2]=3 244 B11R1.16 C\C(=C/CN)\c1ccccc1 Amb23555622 [0,0,0,0,0,0|2,0,2]=4 245 B11R1.16 C\C(=C\C#N)\c1ccccc1 Amb25720664 [0,0,0,0,0,0|2,0,2]=4 246 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [0,0,0,0,0,0|2,0,2]=4 247 B11R1.16 C\C(=C\CC)\c1cccc[n]1 Amb24101998 [0,0,0,0,0,0|2,0,2]=4 248 B11R1.16 C\C(=C\CCl)\c1ccccc1 Amb24579744 [0,0,0,0,0,0|2,0,2]=4 249 B11R1.16 C\C(=C\CN)\c1ccccc1 Amb25145810 [0,0,0,0,0,0|2,0,2]=4 250 B11R1.16 C\C(=N\NC)\c1cc[n]cc1 Amb25129259 [0,0,0,0,0,0|2,0,1]=3 251 B11R1.16 C\C(=N\NC)\c1cccc[n]1 Amb24101916 [0,0,0,0,0,0|2,0,1]=3 252 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [0,0,0,0,0,0|1,0,1]=2 253 B11R1.16 C\C(=N\OC)\c1c[n]ccc1 Amb25751938 [0,0,0,0,0,0|3,0,1]=4 254 B11R1.16 C\C(=N\OC)\c1cc[n]cc1 Amb25796012 [0,0,0,0,0,0|3,0,1]=4 255 B11R1.16 C\C(=N\OC)\c1cccc[n]1 Amb24353963 [0,0,0,0,0,0|3,0,1]=4 256 B11R1.16 C\C(=N\OC)\c1ccccc1 Amb25189562 [0,0,0,0,0,0|2,0,1]=3 257 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [0,0,0,0,0,0|3,0,1]=4 258 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,0,0,0,0,0|2,0,2]=4 259 B11R1.16 C\C=C\C(C)c1cc[n]cc1 Amb24571960 [0,0,0,0,0,0|2,0,1]=3 260 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [0,0,0,0,0,0|2,0,1]=3 261 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [0,0,0,0,0,0|3,0,1]=4 262 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [0,0,0,0,0,0|2,0,1]=3 263 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [0,0,0,0,0,0|2,0,1]=3 264 B11R1.16 C\C=N/C(=O)c1ccccc1 Amb24072877 [0,0,0,0,0,0|3,0,1]=4 265 B11R1.16 C\C=N\C(=O)c1ccccc1 Amb24563950 [0,0,0,0,0,0|3,0,1]=4 266 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [0,0,0,0,0,0|3,0,0]=3 267 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [0,0,0,0,0,0|3,0,0]=3 268 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [0,0,0,0,0,0|2,0,0]=2 269 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [0,0,0,0,0,0|3,0,0]=3 270 B11R1.16 ClCCN(c1ccccc1)C Amb17334788 [0,0,0,0,0,0|3,0,0]=3 271 B11R1.16 ClCCP(Cl)c1ccccc1 Amb24398805 [0,0,0,0,0,0|4,0,0]=4 272 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [0,0,0,0,0,0|3,0,0]=3 273 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [0,0,0,0,0,0|3,0,1]=4 274 B11R1.16 FCCC(=O)c1ccccc1 Amb10603695 [0,0,0,0,0,0|3,0,1]=4 275 B11R1.16 N#CCC(=O)c1ccccc1 Amb1644485 [0,0,0,0,0,0|3,0,1]=4 276 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [0,0,0,0,0,0|3,0,0]=3 277 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [0,0,0,0,0,0|3,0,0]=3 278 B11R1.16 N#CCC(O)c1c[n]ccc1 Amb24062545 [0,0,0,0,0,0|4,0,0]=4 279 B11R1.16 N#CCC(O)c1cccc[n]1 Amb25149159 [0,0,0,0,0,0|4,0,0]=4 280 B11R1.16 N#CCS(=O)c1ccccc1 Amb22505329 [0,0,0,0,0,0|4,0,0]=4 281 B11R1.16 N#CC[C@@H](O)c1c[n]ccc1 Amb24675507 [0,0,0,0,0,0|4,0,0]=4 282 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [0,0,0,0,0,0|3,0,0]=3 283 B11R1.16 N#CC[C@H](O)c1cc[n]cc1 Amb24398008 [0,0,0,0,0,0|4,0,0]=4 284 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [0,0,0,0,0,0|3,0,0]=3 285 B11R1.16 N=CCC(=O)c1ccccc1 Amb24408300 [0,0,0,0,0,0|3,0,1]=4 286 B11R1.16 NC(CC#N)c1c[n]ccc1 Amb18064998 [0,0,0,0,0,0|4,0,0]=4 287 B11R1.16 NC(CC#N)c1cc[n]cc1 Amb18065148 [0,0,0,0,0,0|4,0,0]=4 288 B11R1.16 NC(CC#N)c1cccc[n]1 Amb18064993 [0,0,0,0,0,0|4,0,0]=4 289 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [0,0,0,0,0,0|3,0,0]=3 290 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [0,0,0,0,0,0|3,0,0]=3 291 B11R1.16 NC(CCCl)c1cccc[n]1 Amb24355932 [0,0,0,0,0,0|4,0,0]=4 292 B11R1.16 NC(CCO)c1cccc[n]1 Amb18120551 [0,0,0,0,0,0|4,0,0]=4 293 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [0,0,0,0,0,0|3,0,0]=3 294 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [0,0,0,0,0,0|3,0,0]=3 295 B11R1.16 NCCC(F)c1cc[n]cc1 Amb25329368 [0,0,0,0,0,0|4,0,0]=4 296 B11R1.16 NCCC(N)c1cccc[n]1 Amb24580750 [0,0,0,0,0,0|4,0,0]=4 297 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [0,0,0,0,0,0|3,0,0]=3 298 B11R1.16 NCCC(O)c1c[n]ccc1 Amb18639338 [0,0,0,0,0,0|4,0,0]=4 299 B11R1.16 NCCC(O)c1cc[n]cc1 Amb18121042 [0,0,0,0,0,0|4,0,0]=4 300 B11R1.16 NCCC(O)c1cccc[n]1 Amb18121017 [0,0,0,0,0,0|4,0,0]=4 301 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [0,0,0,0,0,0|3,0,0]=3 302 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [0,0,0,0,0,0|3,0,0]=3 303 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [0,0,0,0,0,0|3,0,0]=3 304 B11R1.16 NCCN(c1ccccc1)C Amb13949227 [0,0,0,0,0,0|3,0,0]=3 305 B11R1.16 NCCN(c1ccccc1)C Amb2371516 [0,0,0,0,0,0|3,0,0]=3 306 B11R1.16 NCCS(=O)c1ccccc1 Amb18974516 [0,0,0,0,0,0|4,0,0]=4 307 B11R1.16 NCCS(=O)c1ccccc1 Amb19349568 [0,0,0,0,0,0|4,0,0]=4 308 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [0,0,0,0,0,0|3,0,0]=3 309 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [0,0,0,0,0,0|3,0,0]=3 310 B11R1.16 NCC[C@H](N)c1cccc[n]1 Amb25326719 [0,0,0,0,0,0|4,0,0]=4 311 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [0,0,0,0,0,0|3,0,0]=3 312 B11R1.16 NN(CCO)c1ccccc1 Amb24555138 [0,0,0,0,0,0|4,0,0]=4 313 B11R1.16 NNCC(=O)c1cc[n]cc1 Amb25694854 [0,0,0,0,0,0|3,0,1]=4 314 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [0,0,0,0,0,0|2,0,1]=3 315 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [0,0,0,0,0,0|2,0,0]=2 316 B11R1.16 NNCC(O)c1cc[n]cc1 Amb18065401 [0,0,0,0,0,0|3,0,0]=3 317 B11R1.16 NNCC(O)c1cccc[n]1 Amb18065400 [0,0,0,0,0,0|3,0,0]=3 318 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [0,0,0,0,0,0|2,0,0]=2 319 B11R1.16 NNCC(c1cccnc1)O Amb17232118 [0,0,0,0,0,0|3,0,0]=3 320 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [0,0,0,0,0,0|2,0,0]=2 321 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [0,0,0,0,0,0|2,0,0]=2 322 B11R1.16 NOCC(=O)c1ccccc1 Amb22729387 [0,0,0,0,0,0|3,0,1]=4 323 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [0,0,0,0,0,0|3,0,0]=3 324 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [0,0,0,0,0,0|3,0,0]=3 325 B11R1.16 NSCC(=O)c1ccccc1 Amb24564884 [0,0,0,0,0,0|3,0,1]=4 326 B11R1.16 N[C@@H](CC#N)c1cccc[n]1 Amb25843751 [0,0,0,0,0,0|4,0,0]=4 327 B11R1.16 N[C@@H](CCO)c1cc[n]cc1 Amb25131721 [0,0,0,0,0,0|4,0,0]=4 328 B11R1.16 N[C@H](CC#N)c1c[n]ccc1 Amb24700424 [0,0,0,0,0,0|4,0,0]=4 329 B11R1.16 N[C@H](CC#N)c1cc[n]cc1 Amb25090361 [0,0,0,0,0,0|4,0,0]=4 330 B11R1.16 N[C@H](CC#N)c1cccc[n]1 Amb24761314 [0,0,0,0,0,0|4,0,0]=4 331 B11R1.16 N[C@H](CCO)c1cc[n]cc1 Amb25843798 [0,0,0,0,0,0|4,0,0]=4 332 B11R1.16 N[C@H](CCO)c1cccc[n]1 Amb25789774 [0,0,0,0,0,0|4,0,0]=4 333 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [0,0,0,0,0,0|3,0,0]=3 334 B11R1.16 O=C(CN=O)c1ccccc1 Amb25821412 [0,0,0,0,0,0|2,0,2]=4 335 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [0,0,0,0,0,0|3,0,1]=4 336 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [0,0,0,0,0,0|3,0,0]=3 337 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [0,0,0,0,0,0|3,0,0]=3 338 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [0,0,0,0,0,0|4,0,0]=4 339 B11R1.16 O=CNC(c1ccccn1)C Amb10070157 [0,0,0,0,0,0|4,0,0]=4 340 B11R1.16 O=CNC(c1cccnc1)C Amb10070156 [0,0,0,0,0,0|4,0,0]=4 341 B11R1.16 O=CNC(c1ccncc1)C Amb10070155 [0,0,0,0,0,0|4,0,0]=4 342 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [0,0,0,0,0,0|4,0,0]=4 343 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [0,0,0,0,0,0|2,0,2]=4 344 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [0,0,0,0,0,0|2,0,1]=3 345 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [0,0,0,0,0,0|4,0,0]=4 346 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [0,0,0,0,0,0|3,0,0]=3 347 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [0,0,0,0,0,0|3,0,0]=3 348 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [0,0,0,0,0,0|3,0,0]=3 349 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [0,0,0,0,0,0|2,0,0]=2 350 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [0,0,0,0,0,0|3,0,1]=4 351 B11R1.16 OCCC(=O)c1ccccc1 Amb16231606 [0,0,0,0,0,0|3,0,1]=4 352 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [0,0,0,0,0,0|4,0,0]=4 353 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [0,0,0,0,0,0|4,0,0]=4 354 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [0,0,0,0,0,0|3,0,0]=3 355 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [0,0,0,0,0,0|3,0,0]=3 356 B11R1.16 OCCN(c1ccccn1)C Amb2445428 [0,0,0,0,0,0|4,0,0]=4 357 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [0,0,0,0,0,0|4,0,0]=4 358 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [0,0,0,0,0,0|3,0,0]=3 359 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [0,0,0,0,0,0|3,0,0]=3 360 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [0,0,0,0,0,0|3,0,0]=3 361 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [0,0,0,0,0,0|3,0,0]=3 362 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [0,0,0,0,0,0|3,0,0]=3 363 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [0,0,0,0,0,0|4,0,0]=4 364 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [0,0,0,0,0,0|3,0,0]=3 365 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [0,0,0,0,0,0|2,0,2]=4 366 B11R1.16 SCCC(=O)c1ccccc1 Amb17400214 [0,0,0,0,0,0|3,0,1]=4 367 B11R1.16 SCCN(c1ccccc1)C Amb13881732 [0,0,0,0,0,0|3,0,0]=3 368 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [0,0,0,0,0,0|3,0,1]=4 369 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [0,0,0,0,0,0|4,0,0]=4 370 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,0,0,0,0,0|2,0,1]=4 371 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [1,0,0,0,0,0|2,0,0]=3 372 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [1,0,0,0,0,0|2,0,0]=3 373 B10R1.15 C#CC(N)c1ccccc1 Amb23504019 [1,0,0,0,0,0|1,0,2]=4 374 B10R1.15 C#C[C@@H](Cl)c1ccccc1 Amb25114793 [1,0,0,0,0,0|1,0,2]=4 375 B10R1.15 C#C[C@H](N)c1ccccc1 Amb25757944 [1,0,0,0,0,0|1,0,2]=4 376 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [1,0,0,0,0,0|1,0,2]=4 377 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,0,0,0,0,0|0,0,2]=3 378 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [1,0,0,0,0,0|1,0,2]=4 379 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [1,0,0,0,0,0|1,0,2]=4 380 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [1,0,0,0,0,0|1,0,2]=4 381 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [1,0,0,0,0,0|1,0,2]=4 382 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [1,0,0,0,0,0|1,0,2]=4 383 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [1,0,0,0,0,0|0,0,2]=3 384 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [1,0,0,0,0,0|2,0,1]=4 385 B10R1.15 CC(CCl)c1c[n]ccc1 Amb24085112 [1,0,0,0,0,0|2,0,0]=3 386 B10R1.15 CC(CCl)c1cccc[n]1 Amb25791960 [1,0,0,0,0,0|2,0,0]=3 387 B10R1.15 CC(CN)c1c[n]c[n]c1 Amb18251160 [1,0,0,0,0,0|2,0,0]=3 388 B10R1.15 CC(CN)c1c[n]cc[n]1 Amb18832279 [1,0,0,0,0,0|2,0,0]=3 389 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [1,0,0,0,0,0|0,0,0]=1 390 B10R1.15 CC(CO)c1[n]ccc[n]1 Amb24397210 [1,0,0,0,0,0|3,0,0]=4 391 B10R1.15 CC(CO)c1cc[n]cc1 Amb24480432 [1,0,0,0,0,0|2,0,0]=3 392 B10R1.15 CC(CO)c1cccc[n]1 Amb22896757 [1,0,0,0,0,0|2,0,0]=3 393 B10R1.15 CC(NN)c1[n]ccc[n]1 Amb25315935 [1,0,0,0,0,0|3,0,0]=4 394 B10R1.15 CC(NN)c1c[n]cc[n]1 Amb24615634 [1,0,0,0,0,0|3,0,0]=4 395 B10R1.15 CC(NN)c1c[n]ccc1 Amb21961486 [1,0,0,0,0,0|2,0,0]=3 396 B10R1.15 CC(NN)c1cc[n]c[n]1 Amb25088979 [1,0,0,0,0,0|3,0,0]=4 397 B10R1.15 CC(NN)c1cc[n]cc1 Amb21961485 [1,0,0,0,0,0|2,0,0]=3 398 B10R1.15 CC(NN)c1cccc[n]1 Amb21961484 [1,0,0,0,0,0|2,0,0]=3 399 B10R1.15 CC(NO)c1cc[n]c[n]1 Amb25663214 [1,0,0,0,0,0|3,0,0]=4 400 B10R1.15 CC(ON)c1cc[n]cc1 Amb22397090 [1,0,0,0,0,0|2,0,0]=3 401 B10R1.15 CC(ON)c1cccc[n]1 Amb22397048 [1,0,0,0,0,0|2,0,0]=3 402 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [1,0,0,0,0,0|1,0,0]=2 403 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [1,0,0,0,0,0|2,0,0]=3 404 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [1,0,0,0,0,0|2,0,0]=3 405 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [1,0,0,0,0,0|0,0,2]=3 406 B10R1.15 CC(c1ccncc1)[N+]#[C-] Amb2235825 [1,0,0,0,0,0|1,0,2]=4 407 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,0,0,0,0,0|1,0,2]=4 408 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [1,0,0,0,0,0|2,0,0]=3 409 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [1,0,0,0,0,0|2,0,0]=3 410 B10R1.15 CCC(=C)c1cccc[n]1 Amb24467663 [1,0,0,0,0,0|1,0,2]=4 411 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [1,0,0,0,0,0|0,0,2]=3 412 B10R1.15 CCC(=N)c1cc[n]cc1 Amb25303409 [1,0,0,0,0,0|2,0,1]=4 413 B10R1.15 CCC(=O)c1ccncc1 Amb10576400 [1,0,0,0,0,0|2,0,1]=4 414 B10R1.15 CCC(=S)c1ccc[n]c1 Amb25837178 [1,0,0,0,0,0|2,0,1]=4 415 B10R1.15 CCC(Br)c1[n]ccc[n]1 Amb24480847 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [1,0,0,0,0,0|2,0,0]=3 417 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [1,0,0,0,0,0|1,0,0]=2 418 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [1,0,0,0,0,0|2,0,0]=3 419 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [1,0,0,0,0,0|2,0,0]=3 420 B10R1.15 CCC(N)c1[n]ccc[n]1 Amb18949725 [1,0,0,0,0,0|3,0,0]=4 421 B10R1.15 CCC(N)c1c[n]c[n]c1 Amb18523747 [1,0,0,0,0,0|3,0,0]=4 422 B10R1.15 CCC(N)c1c[n]cc[n]1 Amb18281061 [1,0,0,0,0,0|3,0,0]=4 423 B10R1.15 CCC(N)c1c[n]cc[n]1 Amb23440161 [1,0,0,0,0,0|3,0,0]=4 424 B10R1.15 CCC(N)c1cc[n]c[n]1 Amb25274541 [1,0,0,0,0,0|3,0,0]=4 425 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [1,0,0,0,0,0|2,0,0]=3 426 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [1,0,0,0,0,0|1,0,0]=2 427 B10R1.15 CCC(O)c1c[n]cc[n]1 Amb25064709 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.15 CCC(c1ccccc1)N Amb1108026 [1,0,0,0,0,0|1,0,0]=2 429 B10R1.15 CCC(c1ccccn1)N Amb10607917 [1,0,0,0,0,0|2,0,0]=3 430 B10R1.15 CCC(c1cccnc1)N Amb10607957 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.15 CCC(c1cccnc1)O Amb17231904 [1,0,0,0,0,0|2,0,0]=3 432 B10R1.15 CCC(c1ccncc1)O Amb16233288 [1,0,0,0,0,0|2,0,0]=3 433 B10R1.15 CCN(C)c1cc[n]c[n]1 Amb24425418 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.15 CCN(N)c1cccc[n]1 Amb18643189 [1,0,0,0,0,0|3,0,0]=4 435 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [1,0,0,0,0,0|2,0,0]=3 436 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [1,0,0,0,0,0|2,0,0]=3 437 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [1,0,0,0,0,0|2,0,0]=3 438 B10R1.15 CC[C@@H](N)c1c[n]c[n]c1 Amb24643083 [1,0,0,0,0,0|3,0,0]=4 439 B10R1.15 CC[C@@H](N)c1c[n]cc[n]1 Amb24568287 [1,0,0,0,0,0|3,0,0]=4 440 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [1,0,0,0,0,0|2,0,0]=3 441 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [1,0,0,0,0,0|2,0,0]=3 442 B10R1.15 CC[C@@H](N)c1cc[n]c[n]1 Amb24362128 [1,0,0,0,0,0|3,0,0]=4 443 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [1,0,0,0,0,0|2,0,0]=3 444 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [1,0,0,0,0,0|2,0,0]=3 445 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [1,0,0,0,0,0|2,0,0]=3 446 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [1,0,0,0,0,0|2,0,0]=3 447 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [1,0,0,0,0,0|1,0,0]=2 448 B10R1.15 CC[C@@H](O)c1c[n]cc[n]1 Amb24437441 [1,0,0,0,0,0|3,0,0]=4 449 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [1,0,0,0,0,0|2,0,0]=3 450 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [1,0,0,0,0,0|1,0,0]=2 451 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [1,0,0,0,0,0|1,0,0]=2 452 B10R1.15 CC[C@H](N)c1c[n]cc[n]1 Amb25084543 [1,0,0,0,0,0|3,0,0]=4 453 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [1,0,0,0,0,0|2,0,0]=3 454 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [1,0,0,0,0,0|1,0,0]=2 455 B10R1.15 CC[C@H](O)c1c[n]c[n]c1 Amb25087766 [1,0,0,0,0,0|3,0,0]=4 456 B10R1.15 CC[C@H](O)c1c[n]cc[n]1 Amb25805910 [1,0,0,0,0,0|3,0,0]=4 457 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [1,0,0,0,0,0|2,0,0]=3 458 B10R1.15 CC[C@H](O)c1cc[n]c[n]1 Amb25805907 [1,0,0,0,0,0|3,0,0]=4 459 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [1,0,0,0,0,0|2,0,0]=3 460 B10R1.15 CN(C#N)c1ccccc1 Amb24658199 [1,0,0,0,0,0|1,0,2]=4 461 B10R1.15 CN(CCl)c1ccccc1 Amb24479224 [1,0,0,0,0,0|2,0,0]=3 462 B10R1.15 CN(CO)c1cc[n]cc1 Amb24481124 [1,0,0,0,0,0|3,0,0]=4 463 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,0,0,0,0,0|2,0,1]=4 464 B10R1.15 CNC(=N)c1cc[n]cc1 Amb24476946 [1,0,0,0,0,0|2,0,1]=4 465 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [1,0,0,0,0,0|1,0,1]=3 466 B10R1.15 CNC(=N)c1ccccn1 Amb11014510 [1,0,0,0,0,0|2,0,1]=4 467 B10R1.15 CNC(=N)c1ccncc1 Amb11014516 [1,0,0,0,0,0|2,0,1]=4 468 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,0,0,0,0,0|1,0,1]=3 469 B10R1.15 CNC(=O)c1ccncc1 Amb1772729 [1,0,0,0,0,0|2,0,1]=4 470 B10R1.15 CNC(=O)c1ccncc1 Amb1782568 [1,0,0,0,0,0|2,0,1]=4 471 B10R1.15 CNC(=O)c1ccncc1 Amb1787524 [1,0,0,0,0,0|2,0,1]=4 472 B10R1.15 CNC(=S)c1cccc[n]1 Amb24451125 [1,0,0,0,0,0|2,0,1]=4 473 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [1,0,0,0,0,0|1,0,1]=3 474 B10R1.15 CNC(C)c1[n]ccc[n]1 Amb18949733 [1,0,0,0,0,0|2,0,0]=3 475 B10R1.15 CNC(C)c1c[n][n]cc1 Amb24556625 [1,0,0,0,0,0|2,0,0]=3 476 B10R1.15 CNC(C)c1c[n]c[n]c1 Amb18286390 [1,0,0,0,0,0|2,0,0]=3 477 B10R1.15 CNC(C)c1c[n]cc[n]1 Amb18949732 [1,0,0,0,0,0|2,0,0]=3 478 B10R1.15 CNC(C)c1c[n]ccc1 Amb22587688 [1,0,0,0,0,0|1,0,0]=2 479 B10R1.15 CNC(C)c1cc[n]c[n]1 Amb22587685 [1,0,0,0,0,0|2,0,0]=3 480 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [1,0,0,0,0,0|1,0,0]=2 481 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [1,0,0,0,0,0|1,0,0]=2 482 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [1,0,0,0,0,0|1,0,0]=2 483 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [1,0,0,0,0,0|1,0,0]=2 484 B10R1.15 CNC(c1ccccc1)C Amb1215689 [1,0,0,0,0,0|0,0,0]=1 485 B10R1.15 CNC(c1ccccn1)C Amb10189608 [1,0,0,0,0,0|1,0,0]=2 486 B10R1.15 CNC(c1ccccn1)C Amb1115311 [1,0,0,0,0,0|1,0,0]=2 487 B10R1.15 CNC(c1cccnc1)C Amb10189690 [1,0,0,0,0,0|1,0,0]=2 488 B10R1.15 CNC(c1cccnc1)C Amb1121577 [1,0,0,0,0,0|1,0,0]=2 489 B10R1.15 CNC(c1ccncc1)C Amb10189609 [1,0,0,0,0,0|1,0,0]=2 490 B10R1.15 CNC(c1ccncc1)C Amb1119143 [1,0,0,0,0,0|1,0,0]=2 491 B10R1.15 CNC(c1ccncn1)C Amb10608544 [1,0,0,0,0,0|2,0,0]=3 492 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [1,0,0,0,0,0|2,0,0]=3 493 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [1,0,0,0,0,0|1,0,0]=2 494 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [1,0,0,0,0,0|0,0,0]=1 495 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [1,0,0,0,0,0|0,0,0]=1 496 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [1,0,0,0,0,0|0,0,0]=1 497 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [1,0,0,0,0,0|1,0,0]=2 498 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [1,0,0,0,0,0|1,0,0]=2 499 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [1,0,0,0,0,0|1,0,2]=4 500 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [1,0,0,0,0,0|2,0,1]=4 501 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [1,0,0,0,0,0|2,0,1]=4 502 B10R1.15 COC(C)c1c[n][n]cc1 Amb24518776 [1,0,0,0,0,0|3,0,0]=4 503 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [1,0,0,0,0,0|2,0,0]=3 504 B10R1.15 COC(C)c1ccccc1 Amb23568513 [1,0,0,0,0,0|1,0,0]=2 505 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [1,0,0,0,0,0|2,0,0]=3 506 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [1,0,0,0,0,0|3,0,0]=4 507 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [1,0,0,0,0,0|3,0,0]=4 508 B10R1.15 COC(O)c1ccccc1 Amb25225981 [1,0,0,0,0,0|2,0,0]=3 509 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,0,0,0,0,0|2,0,1]=4 510 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [1,0,0,0,0,0|2,0,0]=3 511 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [1,0,0,0,0,0|1,1,0]=3 512 B10R1.15 CSC(=N)c1ccccc1 Amb22488568 [1,0,0,0,0,0|2,0,1]=4 513 B10R1.15 CSC(=N)c1ccccc1 Amb24542868 [1,0,0,0,0,0|2,0,1]=4 514 B10R1.15 CSC(=S)c1ccccc1 Amb24395059 [1,0,0,0,0,0|2,0,1]=4 515 B10R1.15 CSC(C)c1cc[n]cc1 Amb25829904 [1,0,0,0,0,0|2,0,0]=3 516 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,0,0,0,0,0|1,0,1]=3 517 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [1,0,0,0,0,0|1,0,0]=2 518 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [1,0,0,0,0,0|1,0,0]=2 519 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [1,0,0,0,0,0|1,0,0]=2 520 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [1,0,0,0,0,0|1,0,0]=2 521 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [1,0,0,0,0,0|1,0,0]=2 522 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [1,0,0,0,0,0|1,0,0]=2 523 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,0,0,0,0,0|1,0,1]=3 524 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [1,0,0,0,0,0|1,0,0]=2 525 B10R1.15 C[C@H](NO)c1cc[n]cc1 Amb24630448 [1,0,0,0,0,0|2,0,0]=3 526 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [1,0,0,0,0,0|1,0,0]=2 527 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [1,0,0,0,0,0|1,0,0]=2 528 B10R1.15 C[SiH](CCl)c1ccccc1 Amb25053449 [1,0,0,0,0,0|1,1,0]=3 529 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,0,0,0,0,0|1,0,2]=4 530 B10R1.15 C\C(=C/C)\c1c[n]ccc1 Amb24085629 [1,0,0,0,0,0|1,0,2]=4 531 B10R1.15 C\C(=C/C)\c1cc[n]cc1 Amb24103190 [1,0,0,0,0,0|1,0,2]=4 532 B10R1.15 C\C(=C\C)\c1cc[n]cc1 Amb24619216 [1,0,0,0,0,0|1,0,2]=4 533 B10R1.15 C\C(=C\C)\c1cccc[n]1 Amb24580985 [1,0,0,0,0,0|1,0,2]=4 534 B10R1.15 C\C(=C\N)\c1cccc[n]1 Amb24376247 [1,0,0,0,0,0|1,0,2]=4 535 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,0,0,0,0,0|0,0,2]=3 536 B10R1.15 C\C(=N/N)\c1cccc[n]1 Amb22552431 [1,0,0,0,0,0|2,0,1]=4 537 B10R1.15 C\C(=N\C)\c1c[n]ccc1 Amb25230944 [1,0,0,0,0,0|1,0,2]=4 538 B10R1.15 C\C(=N\C)\c1cccc[n]1 Amb24433259 [1,0,0,0,0,0|1,0,2]=4 539 B10R1.15 C\C(=N\N)\c1cc[n]cc1 Amb25092436 [1,0,0,0,0,0|2,0,1]=4 540 B10R1.15 C\C(=N\N)\c1cccc[n]1 Amb22586427 [1,0,0,0,0,0|2,0,1]=4 541 B10R1.15 C\N=C(\Cl)/c1ccccc1 Amb25835717 [1,0,0,0,0,0|1,0,2]=4 542 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [1,0,0,0,0,0|2,0,1]=4 543 B10R1.15 ClC(C#C)c1ccccc1 Amb17670636 [1,0,0,0,0,0|1,0,2]=4 544 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [1,0,0,0,0,0|1,0,2]=4 545 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [1,0,0,0,0,0|2,0,0]=3 546 B10R1.15 ClCC(Cl)c1cccc[n]1 Amb24652322 [1,0,0,0,0,0|3,0,0]=4 547 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [1,0,0,0,0,0|1,0,0]=2 548 B10R1.15 ClCP(Cl)c1ccccc1 Amb25725059 [1,0,0,0,0,0|3,0,0]=4 549 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [1,0,0,0,0,0|2,0,0]=3 550 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [1,0,0,0,0,0|3,0,0]=4 551 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [1,0,0,0,0,0|2,0,0]=3 552 B10R1.15 ClC[SiH](Cl)c1ccccc1 Amb25061252 [1,0,0,0,0,0|2,1,0]=4 553 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [1,0,0,0,0,0|2,0,0]=3 554 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,0,0,0,0,0|2,0,1]=4 555 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [1,0,0,0,0,0|2,0,0]=3 556 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [1,0,0,0,0,0|2,0,0]=3 557 B10R1.15 FCC(c1ccccc1)N Amb2372575 [1,0,0,0,0,0|2,0,0]=3 558 B10R1.15 N#CC(Cl)c1ccccc1 Amb18787437 [1,0,0,0,0,0|1,0,2]=4 559 B10R1.15 N#CC(F)c1ccccc1 Amb22747439 [1,0,0,0,0,0|1,0,2]=4 560 B10R1.15 N#C[C@@H](Br)c1ccccc1 Amb24479015 [1,0,0,0,0,0|1,0,2]=4 561 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [1,0,0,0,0,0|1,0,2]=4 562 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [1,0,0,0,0,0|1,0,2]=4 563 B10R1.15 NC(=NN)c1ccccc1 Amb22488579 [1,0,0,0,0,0|2,0,1]=4 564 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [1,0,0,0,0,0|2,0,0]=3 565 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [1,0,0,0,0,0|2,0,0]=3 566 B10R1.15 NC(CO)c1c[n]ccc1 Amb22756404 [1,0,0,0,0,0|3,0,0]=4 567 B10R1.15 NC(CO)c1cc[n]cc1 Amb18561776 [1,0,0,0,0,0|3,0,0]=4 568 B10R1.15 NC(CO)c1cccc[n]1 Amb18560041 [1,0,0,0,0,0|3,0,0]=4 569 B10R1.15 NC(CO)c1ccccn1 Amb17935880 [1,0,0,0,0,0|3,0,0]=4 570 B10R1.15 NC(CO)c1ccncc1 Amb17935881 [1,0,0,0,0,0|3,0,0]=4 571 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [1,0,0,0,0,0|2,0,0]=3 572 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [1,0,0,0,0,0|0,0,2]=3 573 B10R1.15 NCC(=O)c1cc[n]cc1 Amb18832471 [1,0,0,0,0,0|2,0,1]=4 574 B10R1.15 NCC(=O)c1cc[n]cc1 Amb22002046 [1,0,0,0,0,0|2,0,1]=4 575 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22277079 [1,0,0,0,0,0|2,0,1]=4 576 B10R1.15 NCC(=O)c1ccc[n]c1 Amb22754018 [1,0,0,0,0,0|2,0,1]=4 577 B10R1.15 NCC(=O)c1cccc[n]1 Amb18832469 [1,0,0,0,0,0|2,0,1]=4 578 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,0,0,0,0,0|1,0,1]=3 579 B10R1.15 NCC(=O)c1ccccn1 Amb10601921 [1,0,0,0,0,0|2,0,1]=4 580 B10R1.15 NCC(=O)c1cccnc1 Amb17607867 [1,0,0,0,0,0|2,0,1]=4 581 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [1,0,0,0,0,0|1,0,0]=2 582 B10R1.15 NCC(F)c1c[n]cc[n]1 Amb25756644 [1,0,0,0,0,0|3,0,0]=4 583 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [1,0,0,0,0,0|2,0,0]=3 584 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [1,0,0,0,0,0|1,0,0]=2 585 B10R1.15 NCC(N)c1c[n]c[n]c1 Amb25245254 [1,0,0,0,0,0|3,0,0]=4 586 B10R1.15 NCC(N)c1c[n]cc[n]1 Amb25113386 [1,0,0,0,0,0|3,0,0]=4 587 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [1,0,0,0,0,0|2,0,0]=3 588 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [1,0,0,0,0,0|1,0,0]=2 589 B10R1.15 NCC(O)c1c[n]c[n]c1 Amb25731161 [1,0,0,0,0,0|3,0,0]=4 590 B10R1.15 NCC(O)c1cc[n]c[n]1 Amb24434504 [1,0,0,0,0,0|3,0,0]=4 591 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [1,0,0,0,0,0|2,0,0]=3 592 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [1,0,0,0,0,0|2,0,0]=3 593 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [1,0,0,0,0,0|1,0,0]=2 594 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [1,0,0,0,0,0|1,0,0]=2 595 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [1,0,0,0,0,0|1,0,0]=2 596 B10R1.15 NCC(c1ccccc1)C Amb1085937 [1,0,0,0,0,0|0,0,0]=1 597 B10R1.15 NCC(c1ccccc1)O Amb2383121 [1,0,0,0,0,0|1,0,0]=2 598 B10R1.15 NCC(c1ccccn1)O Amb1109027 [1,0,0,0,0,0|2,0,0]=3 599 B10R1.15 NCC(c1cccnc1)O Amb10068830 [1,0,0,0,0,0|2,0,0]=3 600 B10R1.15 NCC(c1cccnc1)O Amb1108854 [1,0,0,0,0,0|2,0,0]=3 601 B10R1.15 NCC(c1ccncc1)O Amb1108372 [1,0,0,0,0,0|2,0,0]=3 602 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [1,0,0,0,0,0|1,0,0]=2 603 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [1,0,0,0,0,0|1,0,0]=2 604 B10R1.15 NC[C@@H](N)c1c[n]cc[n]1 Amb24674098 [1,0,0,0,0,0|3,0,0]=4 605 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [1,0,0,0,0,0|2,0,0]=3 606 B10R1.15 NC[C@@H](O)c1c[n]cc[n]1 Amb25370172 [1,0,0,0,0,0|3,0,0]=4 607 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [1,0,0,0,0,0|2,0,0]=3 608 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [1,0,0,0,0,0|2,0,0]=3 609 B10R1.15 NC[C@@H](O)c1cc[n]c[n]1 Amb24546069 [1,0,0,0,0,0|3,0,0]=4 610 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [1,0,0,0,0,0|2,0,0]=3 611 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [1,0,0,0,0,0|2,0,0]=3 612 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [1,0,0,0,0,0|1,0,0]=2 613 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [1,0,0,0,0,0|1,0,0]=2 614 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [1,0,0,0,0,0|1,0,0]=2 615 B10R1.15 NC[C@H](N)c1c[n]cc[n]1 Amb25146250 [1,0,0,0,0,0|3,0,0]=4 616 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [1,0,0,0,0,0|2,0,0]=3 617 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [1,0,0,0,0,0|1,0,0]=2 618 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [1,0,0,0,0,0|2,0,0]=3 619 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [1,0,0,0,0,0|2,0,0]=3 620 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [1,0,0,0,0,0|2,0,0]=3 621 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [1,0,0,0,0,0|0,0,0]=1 622 B10R1.15 NNC(=N)c1ccccc1 Amb22234855 [1,0,0,0,0,0|2,0,1]=4 623 B10R1.15 NNC(=N)c1ccccc1 Amb22481319 [1,0,0,0,0,0|2,0,1]=4 624 B10R1.15 NNC(=N)c1ccccc1 Amb22756451 [1,0,0,0,0,0|2,0,1]=4 625 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,0,0,0,0,0|2,0,1]=4 626 B10R1.15 NNC(=S)c1ccccc1 Amb23513674 [1,0,0,0,0,0|2,0,1]=4 627 B10R1.15 NNC(O)c1cc[n]cc1 Amb25215180 [1,0,0,0,0,0|3,0,0]=4 628 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [1,0,0,0,0,0|2,0,0]=3 629 B10R1.15 NNC(c1ccccc1)C Amb10610271 [1,0,0,0,0,0|1,0,0]=2 630 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [1,0,0,0,0,0|2,0,1]=4 631 B10R1.15 NOC(c1ccccc1)C Amb17089185 [1,0,0,0,0,0|1,0,0]=2 632 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb18039831 [1,0,0,0,0,0|1,0,2]=4 633 B10R1.15 N[C@@H](C#N)c1ccccc1 Amb22746711 [1,0,0,0,0,0|1,0,2]=4 634 B10R1.15 N[C@@H](CF)c1cc[n]cc1 Amb24403138 [1,0,0,0,0,0|3,0,0]=4 635 B10R1.15 N[C@@H](CF)c1cccc[n]1 Amb25353862 [1,0,0,0,0,0|3,0,0]=4 636 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [1,0,0,0,0,0|2,0,0]=3 637 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [1,0,0,0,0,0|2,0,0]=3 638 B10R1.15 N[C@@H](CO)c1c[n]ccc1 Amb25146409 [1,0,0,0,0,0|3,0,0]=4 639 B10R1.15 N[C@@H](CO)c1cc[n]cc1 Amb25146410 [1,0,0,0,0,0|3,0,0]=4 640 B10R1.15 N[C@@H](CO)c1cccc[n]1 Amb22756435 [1,0,0,0,0,0|3,0,0]=4 641 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [1,0,0,0,0,0|2,0,0]=3 642 B10R1.15 N[C@@H](c1ccccc1)C#N Amb17399826 [1,0,0,0,0,0|1,0,2]=4 643 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [1,0,0,0,0,0|2,0,0]=3 644 B10R1.15 N[C@H](CF)c1c[n]ccc1 Amb24509342 [1,0,0,0,0,0|3,0,0]=4 645 B10R1.15 N[C@H](CF)c1cc[n]cc1 Amb25677477 [1,0,0,0,0,0|3,0,0]=4 646 B10R1.15 N[C@H](CF)c1cccc[n]1 Amb25840493 [1,0,0,0,0,0|3,0,0]=4 647 B10R1.15 N[C@H](CO)c1c[n]ccc1 Amb24712243 [1,0,0,0,0,0|3,0,0]=4 648 B10R1.15 N[C@H](CO)c1cc[n]cc1 Amb24714739 [1,0,0,0,0,0|3,0,0]=4 649 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [1,0,0,0,0,0|2,0,0]=3 650 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,0,0,0,0,0|1,0,2]=4 651 B10R1.15 N\C(=N/N)\c1ccccc1 Amb20407822 [1,0,0,0,0,0|2,0,1]=4 652 B10R1.15 N\N=C(\c1ccccc1)/N Amb10608779 [1,0,0,0,0,0|2,0,1]=4 653 B10R1.15 N\N=C(\c1ccncc1)/C Amb10552809 [1,0,0,0,0,0|2,0,1]=4 654 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,0,0,0,0,0|2,0,1]=4 655 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [1,0,0,0,0,0|2,0,1]=4 656 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,0,0,0,0,0|2,0,1]=4 657 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,0,0,0,0,0|2,0,1]=4 658 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,0,0,0,0,0|2,0,1]=4 659 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,0,0,0,0,0|2,0,1]=4 660 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,0,0,0,0,0|2,0,1]=4 661 B10R1.15 O=P(CCl)c1ccccc1 Amb25053604 [1,0,0,0,0,0|3,0,0]=4 662 B10R1.15 O=S(CF)c1ccccc1 Amb22723398 [1,0,0,0,0,0|3,0,0]=4 663 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [1,0,0,0,0,0|3,0,0]=4 664 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [1,0,0,0,0,0|3,0,0]=4 665 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [1,0,0,0,0,0|3,0,0]=4 666 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [1,0,0,0,0,0|2,0,0]=3 667 B10R1.15 OCC(F)c1cccc[n]1 Amb24518945 [1,0,0,0,0,0|3,0,0]=4 668 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [1,0,0,0,0,0|2,0,0]=3 669 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [1,0,0,0,0,0|3,0,0]=4 670 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [1,0,0,0,0,0|3,0,0]=4 671 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [1,0,0,0,0,0|2,0,0]=3 672 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [1,0,0,0,0,0|2,0,0]=3 673 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [1,0,0,0,0,0|2,0,0]=3 674 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [1,0,0,0,0,0|2,0,0]=3 675 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [1,0,0,0,0,0|2,0,0]=3 676 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [1,0,0,0,0,0|3,0,0]=4 677 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [1,0,0,0,0,0|3,0,0]=4 678 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,0,0,0,0,0|2,0,1]=4 679 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,0,0,0,0,0|2,0,1]=4 680 B10R1.15 ONC(c1ccccc1)C Amb10605006 [1,0,0,0,0,0|1,0,0]=2 681 B10R1.15 ONC(c1ccccn1)C Amb10605008 [1,0,0,0,0,0|2,0,0]=3 682 B10R1.15 ONC(c1cccnc1)C Amb10605009 [1,0,0,0,0,0|2,0,0]=3 683 B10R1.15 ONC(c1ccncc1)C Amb10605014 [1,0,0,0,0,0|2,0,0]=3 684 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [1,0,0,0,0,0|3,0,0]=4 685 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [1,0,0,0,0,0|2,0,0]=3 686 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [1,0,0,0,0,0|3,0,0]=4 687 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [1,0,0,0,0,0|2,0,0]=3 688 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [1,0,0,0,0,0|2,0,0]=3 689 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [1,0,0,0,0,0|1,0,2]=4 690 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [1,0,0,0,0,0|3,0,0]=4 691 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [1,0,0,0,0,0|3,0,0]=4 692 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [1,0,0,0,0,0|2,0,0]=3 693 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [1,0,0,0,0,0|3,0,0]=4 694 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [1,0,0,0,0,0|2,0,0]=3 695 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,0,0,0,0,0|1,0,2]=4 696 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,0,0,0,0,0|2,0,1]=4 697 B10R1.15 SCC(c1ccccc1)O Amb10608997 [1,0,0,0,0,0|2,0,0]=3 698 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [1,0,0,0,0,0|2,0,1]=4 699 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [1,0,0,0,0,0|2,0,1]=4 700 B10R1.17 BrCCCc1cc[n]cc1 Amb24094393 [1,0,0,0,0,0|3,0,0]=4 701 B10R1.17 BrCCCc1cccnc1 Amb1102301 [1,0,0,0,0,0|3,0,0]=4 702 B10R1.17 BrCCCc1cccnc1 Amb17610084 [1,0,0,0,0,0|3,0,0]=4 703 B10R1.17 BrCCOc1ccccc1 Amb1152333 [1,0,0,0,0,0|3,0,0]=4 704 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [1,0,0,0,0,0|2,0,0]=3 705 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [1,0,0,0,0,0|2,0,0]=3 706 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [1,0,0,0,0,0|2,0,1]=4 707 B10R1.17 C#CCCc1c[n]ccc1 Amb24085226 [1,0,0,0,0,0|2,0,1]=4 708 B10R1.17 C#CCCc1cc[n]cc1 Amb24091331 [1,0,0,0,0,0|2,0,1]=4 709 B10R1.17 C#CCCc1cccc[n]1 Amb24571654 [1,0,0,0,0,0|2,0,1]=4 710 B10R1.17 C#CCNc1ccccc1 Amb21953889 [1,0,0,0,0,0|2,0,1]=4 711 B10R1.17 C=CCCc1c[n]ccc1 Amb24477186 [1,0,0,0,0,0|2,0,1]=4 712 B10R1.17 C=CCCc1cc[n]cc1 Amb25719590 [1,0,0,0,0,0|2,0,1]=4 713 B10R1.17 C=CCCc1cccc[n]1 Amb25337662 [1,0,0,0,0,0|2,0,1]=4 714 B10R1.17 C=CC[Se]c1ccccc1 Amb22729991 [1,0,0,0,0,0|2,0,1]=4 715 B10R1.17 C=CNCc1ccccc1 Amb24505107 [1,0,0,0,0,0|2,0,1]=4 716 B10R1.17 C=COCc1ccccc1 Amb17940722 [1,0,0,0,0,0|2,0,1]=4 717 B10R1.17 C=NOCc1ccccc1 Amb24704253 [1,0,0,0,0,0|1,0,2]=4 718 B10R1.17 CC#COc1ccccc1 Amb25146348 [1,0,0,0,0,0|2,0,1]=4 719 B10R1.17 CC/C=C/c1ccccc1 Amb17673826 [1,0,0,0,0,0|1,0,2]=4 720 B10R1.17 CCCCC1C=CC=CN1 Amb25721630 [1,0,0,0,0,0|2,0,1]=4 721 B10R1.17 CCCCc1[n]ccc[n]1 Amb24104101 [1,0,0,0,0,0|3,0,0]=4 722 B10R1.17 CCCCc1c[n]c[n]c1 Amb24071084 [1,0,0,0,0,0|3,0,0]=4 723 B10R1.17 CCCCc1cc[n]c[n]1 Amb24091332 [1,0,0,0,0,0|3,0,0]=4 724 B10R1.17 CCCCc1ccc[n][n]1 Amb22235740 [1,0,0,0,0,0|3,0,0]=4 725 B10R1.17 CCCCc1ccccn1 Amb10574134 [1,0,0,0,0,0|2,0,0]=3 726 B10R1.17 CCCCc1ccncc1 Amb10555008 [1,0,0,0,0,0|2,0,0]=3 727 B10R1.17 CCCNc1ccccc1 Amb22284540 [1,0,0,0,0,0|2,0,0]=3 728 B10R1.17 CCCOc1c[n]ccc1 Amb25064833 [1,0,0,0,0,0|3,0,0]=4 729 B10R1.17 CCCOc1cccc[n]1 Amb24096899 [1,0,0,0,0,0|3,0,0]=4 730 B10R1.17 CCCSc1cccc[n]1 Amb24733306 [1,0,0,0,0,0|3,0,0]=4 731 B10R1.17 CCN=Cc1ccccc1 Amb15692852 [1,0,0,0,0,0|2,0,1]=4 732 B10R1.17 CCNCc1c[n]ccc1 Amb21972163 [1,0,0,0,0,0|3,0,0]=4 733 B10R1.17 CCNCc1ccncc1 Amb1214646 [1,0,0,0,0,0|3,0,0]=4 734 B10R1.17 CC\N=C\c1ccccc1 Amb10558476 [1,0,0,0,0,0|2,0,1]=4 735 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [1,0,0,0,0,0|1,0,1]=3 736 B10R1.17 CN=C=Nc1ccccc1 Amb24096797 [1,0,0,0,0,0|1,0,2]=4 737 B10R1.17 CNCCc1[n][n]cc[n]1 Amb18224135 [1,0,0,0,0,0|3,0,0]=4 738 B10R1.17 CNCCc1[n]c[n]c[n]1 Amb18861081 [1,0,0,0,0,0|3,0,0]=4 739 B10R1.17 CNCCc1c[n]cc[n]1 Amb22059364 [1,0,0,0,0,0|2,0,0]=3 740 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [1,0,0,0,0,0|1,0,0]=2 741 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [1,0,0,0,0,0|1,0,0]=2 742 B10R1.17 CNCCc1ccccc1 Amb1132990 [1,0,0,0,0,0|0,0,0]=1 743 B10R1.17 CNCCc1ccccc1 Amb2119452 [1,0,0,0,0,0|0,0,0]=1 744 B10R1.17 CNCCc1ccccn1 Amb1651624 [1,0,0,0,0,0|1,0,0]=2 745 B10R1.17 CNCCc1cccnc1 Amb10068754 [1,0,0,0,0,0|1,0,0]=2 746 B10R1.17 CNCCc1cccnc1 Amb10576212 [1,0,0,0,0,0|1,0,0]=2 747 B10R1.17 CNCCc1cccnc1 Amb10576410 [1,0,0,0,0,0|1,0,0]=2 748 B10R1.17 CNCCc1ccncc1 Amb10071184 [1,0,0,0,0,0|1,0,0]=2 749 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [1,0,0,0,0,0|2,0,0]=3 750 B10R1.17 CNNCc1ccccc1 Amb10553073 [1,0,0,0,0,0|1,0,0]=2 751 B10R1.17 CNOCc1ccccc1 Amb22059601 [1,0,0,0,0,0|1,0,0]=2 752 B10R1.17 CN\C=N\c1c[n]ccc1 Amb24671021 [1,0,0,0,0,0|2,0,1]=4 753 B10R1.17 CN\C=N\c1cc[n]cc1 Amb25147549 [1,0,0,0,0,0|2,0,1]=4 754 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [1,0,0,0,0,0|1,0,1]=3 755 B10R1.17 CN\N=C\c1cc[n]cc1 Amb25071810 [1,0,0,0,0,0|2,0,1]=4 756 B10R1.17 CN\N=C\c1cccc[n]1 Amb24356439 [1,0,0,0,0,0|2,0,1]=4 757 B10R1.17 CN\N=N/c1cc[n]cc1 Amb24103183 [1,0,0,0,0,0|3,0,0]=4 758 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [1,0,0,0,0,0|2,0,0]=3 759 B10R1.17 COCCN1CC=CC=C1 Amb24064033 [1,0,0,0,0,0|2,0,1]=4 760 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [1,0,0,0,0,0|2,0,0]=3 761 B10R1.17 COCCc1cccc[n]1 Amb24089662 [1,0,0,0,0,0|2,0,0]=3 762 B10R1.17 COCNc1ccccc1 Amb10565397 [1,0,0,0,0,0|2,0,0]=3 763 B10R1.17 COCOc1cccnc1 Amb10561791 [1,0,0,0,0,0|3,0,0]=4 764 B10R1.17 COCSc1cc[n]cc1 Amb25185189 [1,0,0,0,0,0|3,0,0]=4 765 B10R1.17 COCSc1cccc[n]1 Amb24482838 [1,0,0,0,0,0|3,0,0]=4 766 B10R1.17 CON=Cc1ccccc1 Amb22896936 [1,0,0,0,0,0|2,0,1]=4 767 B10R1.17 CONCc1c[n]ccc1 Amb24062508 [1,0,0,0,0,0|3,0,0]=4 768 B10R1.17 CONCc1cc[n]cc1 Amb25046027 [1,0,0,0,0,0|3,0,0]=4 769 B10R1.17 CONCc1cccc[n]1 Amb25723329 [1,0,0,0,0,0|3,0,0]=4 770 B10R1.17 CO\C=C\c1ccccc1 Amb22002452 [1,0,0,0,0,0|1,0,2]=4 771 B10R1.17 CO\N=C\c1ccccc1 Amb25762975 [1,0,0,0,0,0|2,0,1]=4 772 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [1,0,0,0,0,0|2,0,0]=3 773 B10R1.17 CSCCc1ccncc1 Amb1864660 [1,0,0,0,0,0|2,0,0]=3 774 B10R1.17 CSCOc1ccccc1 Amb22231357 [1,0,0,0,0,0|2,0,0]=3 775 B10R1.17 CSCSc1cccc[n]1 Amb24658343 [1,0,0,0,0,0|3,0,0]=4 776 B10R1.17 CSCSc1ccccc1 Amb25162526 [1,0,0,0,0,0|2,0,0]=3 777 B10R1.17 CSSCc1ccccc1 Amb22230274 [1,0,0,0,0,0|2,0,0]=3 778 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [1,0,0,0,0,0|2,0,1]=4 779 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [1,0,0,0,0,0|2,0,1]=4 780 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [1,0,0,0,0,0|2,0,1]=4 781 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [1,0,0,0,0,0|3,0,0]=4 782 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [1,0,0,0,0,0|2,0,1]=4 783 B10R1.17 ClCCC[n+]1ccccc1 Amb24487853 [1,0,0,0,0,0|3,0,0]=4 784 B10R1.17 ClCCCc1cc[n]cc1 Amb21961566 [1,0,0,0,0,0|3,0,0]=4 785 B10R1.17 ClCCCc1ccccn1 Amb17477793 [1,0,0,0,0,0|3,0,0]=4 786 B10R1.17 ClCCCc1cccnc1 Amb17477795 [1,0,0,0,0,0|3,0,0]=4 787 B10R1.17 ClCCCc1ccncc1 Amb17477794 [1,0,0,0,0,0|3,0,0]=4 788 B10R1.17 ClCCNc1ccccc1 Amb17334388 [1,0,0,0,0,0|3,0,0]=4 789 B10R1.17 ClCCPc1ccccc1 Amb24390336 [1,0,0,0,0,0|3,0,0]=4 790 B10R1.17 ClCSCc1ccccc1 Amb16231183 [1,0,0,0,0,0|3,0,0]=4 791 B10R1.17 ClC[SiH2]Cc1ccccc1 Amb24433498 [1,0,0,0,0,0|2,1,0]=4 792 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [1,0,0,0,0,0|2,0,0]=3 793 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [1,0,0,0,0,0|2,0,1]=4 794 B10R1.17 FCCCc1ccccc1 Amb25737014 [1,0,0,0,0,0|2,0,0]=3 795 B10R1.17 FCCOc1ccccc1 Amb25350055 [1,0,0,0,0,0|3,0,0]=4 796 B10R1.17 ICCCc1ccccc1 Amb10605506 [1,0,0,0,0,0|2,0,0]=3 797 B10R1.17 ICCOc1ccccc1 Amb10608588 [1,0,0,0,0,0|3,0,0]=4 798 B10R1.17 N#CCCc1ccccn1 Amb1102488 [1,0,0,0,0,0|3,0,0]=4 799 B10R1.17 N#CCCc1cccnc1 Amb10605345 [1,0,0,0,0,0|3,0,0]=4 800 B10R1.17 N#CCNc1ccccc1 Amb1651088 [1,0,0,0,0,0|3,0,0]=4 801 B10R1.17 N#C[Se]Cc1ccccc1 Amb22731764 [1,0,0,0,0,0|3,0,0]=4 802 B10R1.17 N=COCc1ccccc1 Amb22269902 [1,0,0,0,0,0|3,0,0]=4 803 B10R1.17 N=COCc1ccccc1 Amb24652885 [1,0,0,0,0,0|3,0,0]=4 804 B10R1.17 NCCCc1c[n]ccc1 Amb18363942 [1,0,0,0,0,0|3,0,0]=4 805 B10R1.17 NCCCc1cc[n]cc1 Amb22490382 [1,0,0,0,0,0|3,0,0]=4 806 B10R1.17 NCCCc1cc[n]cc1 Amb24099592 [1,0,0,0,0,0|3,0,0]=4 807 B10R1.17 NCCCc1cccc[n]1 Amb21954278 [1,0,0,0,0,0|3,0,0]=4 808 B10R1.17 NCCCc1ccccc1 Amb22490482 [1,0,0,0,0,0|2,0,0]=3 809 B10R1.17 NCCCc1ccccn1 Amb1088884 [1,0,0,0,0,0|3,0,0]=4 810 B10R1.17 NCCNc1ccccc1 Amb23412206 [1,0,0,0,0,0|3,0,0]=4 811 B10R1.17 NCCOc1ccccc1 Amb1214559 [1,0,0,0,0,0|3,0,0]=4 812 B10R1.17 NCCOc1ccccc1 Amb2099529 [1,0,0,0,0,0|3,0,0]=4 813 B10R1.17 NCCPc1ccccc1 Amb24482461 [1,0,0,0,0,0|3,0,0]=4 814 B10R1.17 NNC#Cc1ccccc1 Amb24443265 [1,0,0,0,0,0|1,0,2]=4 815 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [1,0,0,0,0,0|2,0,0]=3 816 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [1,0,0,0,0,0|2,0,0]=3 817 B10R1.17 NNCCc1ccccc1 Amb10608987 [1,0,0,0,0,0|1,0,0]=2 818 B10R1.17 NNCCc1ccccc1 Amb1117029 [1,0,0,0,0,0|1,0,0]=2 819 B10R1.17 NOCCc1c[n]ccc1 Amb25779030 [1,0,0,0,0,0|3,0,0]=4 820 B10R1.17 NOCCc1ccccn1 Amb17231907 [1,0,0,0,0,0|3,0,0]=4 821 B10R1.17 NOCCc1ccncc1 Amb17231908 [1,0,0,0,0,0|3,0,0]=4 822 B10R1.17 O=CCCc1ccccn1 Amb17081674 [1,0,0,0,0,0|3,0,0]=4 823 B10R1.17 O=CCCc1cccnc1 Amb17081675 [1,0,0,0,0,0|3,0,0]=4 824 B10R1.17 O=CCNc1ccccc1 Amb24566865 [1,0,0,0,0,0|3,0,0]=4 825 B10R1.17 O=CCSc1ccccc1 Amb17082903 [1,0,0,0,0,0|3,0,0]=4 826 B10R1.17 O=CNCc1ccccc1 Amb1916036 [1,0,0,0,0,0|3,0,0]=4 827 B10R1.17 OCCCc1cccc[n]1 Amb22749323 [1,0,0,0,0,0|3,0,0]=4 828 B10R1.17 OCCNc1ccccc1 Amb24065196 [1,0,0,0,0,0|3,0,0]=4 829 B10R1.17 OCCNc1ccccc1 Amb24065197 [1,0,0,0,0,0|3,0,0]=4 830 B10R1.17 OCCOc1ccccc1 Amb2209344 [1,0,0,0,0,0|3,0,0]=4 831 B10R1.17 OCNCc1ccccc1 Amb24756521 [1,0,0,0,0,0|3,0,0]=4 832 B10R1.17 OCOCc1ccccc1 Amb25727798 [1,0,0,0,0,0|3,0,0]=4 833 B10R1.17 ONCCc1ccccc1 Amb24117032 [1,0,0,0,0,0|1,0,0]=2 834 B10R1.17 S=C=NCc1ccccc1 Amb1102095 [1,0,0,0,0,0|3,0,0]=4 835 B10R1.17 SCCCc1ccccn1 Amb17399950 [1,0,0,0,0,0|3,0,0]=4 836 B10R1.17 SCCCc1cccnc1 Amb17399951 [1,0,0,0,0,0|3,0,0]=4 837 B10R1.17 SCCCc1ccncc1 Amb17399952 [1,0,0,0,0,0|3,0,0]=4 838 B10R1.17 SCCNc1ccccc1 Amb24065195 [1,0,0,0,0,0|3,0,0]=4 839 B10R1.17 SCCSc1ccccc1 Amb13881734 [1,0,0,0,0,0|3,0,0]=4 840 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [1,0,0,0,0,0|0,0,2]=3 841 B10R1.17 [C-]#[N+]CCc1ccncc1 Amb2235948 [1,0,0,0,0,0|1,0,2]=4 842 B10R1.17 [NH-]\[NH+]=N\Cc1ccccc1 Amb25857928 [1,0,0,0,0,0|2,0,1]=4 843 B10R1.17 [SiH3]CCCc1c[n]ccc1 Amb24085247 [1,0,0,0,0,0|2,1,0]=4 844 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [1,0,0,0,0,0|1,1,0]=3 845 B12R1.3 C#CC(CCO)c1ccccc1 Amb25369422 [0,1,0,0,0,0|2,0,1]=4 846 B12R1.3 C#CC(c1ccccc1)CC#C Amb10072781 [0,1,0,0,0,0|1,0,2]=4 847 B12R1.3 C#CCC(C=O)c1ccccc1 Amb24741811 [0,1,0,0,0,0|1,0,2]=4 848 B12R1.3 C=C=CC(CO)c1ccccc1 Amb25837883 [0,1,0,0,0,0|1,0,2]=4 849 B12R1.3 C=CCC(c1ccccc1)C#N Amb17593937 [0,1,0,0,0,0|1,0,2]=4 850 B12R1.3 CCC(N=C=S)c1ccccc1 Amb18809003 [0,1,0,0,0,0|3,0,0]=4 851 B12R1.3 CCC(NC#N)c1ccccc1 Amb18800414 [0,1,0,0,0,0|3,0,0]=4 852 B12R1.3 CCC(NCC)c1cc[n]cc1 Amb19003595 [0,1,0,0,0,0|3,0,0]=4 853 B12R1.3 CCC(NOC)c1ccccc1 Amb22896961 [0,1,0,0,0,0|2,0,0]=3 854 B12R1.3 CCCC(=[N+]=[N-])c1ccccc1 Amb24095317 [0,1,0,0,0,0|2,0,1]=4 855 B12R1.3 CCCC(C#N)c1cc[n]cc1 Amb18645395 [0,1,0,0,0,0|2,0,1]=4 856 B12R1.3 CCCC(C#N)c1cccc[n]1 Amb18645394 [0,1,0,0,0,0|2,0,1]=4 857 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [0,1,0,0,0,0|1,0,0]=2 858 B12R1.3 CCCC(NC)c1cccc[n]1 Amb18792590 [0,1,0,0,0,0|2,0,0]=3 859 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [0,1,0,0,0,0|1,0,1]=3 860 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [0,1,0,0,0,0|1,0,0]=2 861 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [0,1,0,0,0,0|1,0,0]=2 862 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [0,1,0,0,0,0|1,0,0]=2 863 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [0,1,0,0,0,0|2,0,0]=3 864 B12R1.3 CCNC(C#N)c1ccccc1 Amb22736556 [0,1,0,0,0,0|2,0,1]=4 865 B12R1.3 CCNC(c1ccccn1)CO Amb15692071 [0,1,0,0,0,0|3,0,0]=4 866 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [0,1,0,0,0,0|2,0,0]=3 867 B12R1.3 CC[C@@H](N=[N+]=[N-])c1ccccc1 Amb25758807 [0,1,0,0,0,0|2,0,1]=4 868 B12R1.3 CC[C@@H](NC=O)c1ccccc1 Amb24756579 [0,1,0,0,0,0|3,0,0]=4 869 B12R1.3 CC[C@H](N=C=O)c1ccccc1 Amb22045308 [0,1,0,0,0,0|3,0,0]=4 870 B12R1.3 CC[C@H](N=C=S)c1ccccc1 Amb22045322 [0,1,0,0,0,0|3,0,0]=4 871 B12R1.3 CC[C@H](N=[N+]=[N-])c1ccccc1 Amb24698404 [0,1,0,0,0,0|2,0,1]=4 872 B12R1.3 CC[C@H](NC=S)c1ccccc1 Amb25700860 [0,1,0,0,0,0|3,0,0]=4 873 B12R1.3 CC\C=C(\CO)/c1ccccc1 Amb24397985 [0,1,0,0,0,0|1,0,2]=4 874 B12R1.3 CNC(C=C=C)c1ccccc1 Amb24427541 [0,1,0,0,0,0|1,0,2]=4 875 B12R1.3 CNC(CC#C)c1c[n]ccc1 Amb18296082 [0,1,0,0,0,0|2,0,1]=4 876 B12R1.3 CNC(CC#C)c1cc[n]cc1 Amb18987803 [0,1,0,0,0,0|2,0,1]=4 877 B12R1.3 CNC(CC#C)c1cccc[n]1 Amb18296092 [0,1,0,0,0,0|2,0,1]=4 878 B12R1.3 CNC(CC#C)c1ccccc1 Amb18800161 [0,1,0,0,0,0|1,0,1]=3 879 B12R1.3 CNC(CC#C)c1ccccc1 Amb19514703 [0,1,0,0,0,0|1,0,1]=3 880 B12R1.3 CNC(CC#N)c1ccccc1 Amb18997456 [0,1,0,0,0,0|2,0,0]=3 881 B12R1.3 CNC(CCO)c1ccccc1 Amb18563697 [0,1,0,0,0,0|2,0,0]=3 882 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [0,1,0,0,0,0|0,0,0]=1 883 B12R1.3 CN\C(=N\OC)\c1ccccc1 Amb24519522 [0,1,0,0,0,0|2,0,1]=4 884 B12R1.3 CN\C=C(/C=S)\c1ccccc1 Amb24637960 [0,1,0,0,0,0|0,0,3]=4 885 B12R1.3 CN\C=C(\C=S)/c1ccccc1 Amb24642034 [0,1,0,0,0,0|0,0,3]=4 886 B12R1.3 COC(CC#N)c1ccccc1 Amb18797978 [0,1,0,0,0,0|2,0,0]=3 887 B12R1.3 COC(N=C=O)c1ccccc1 Amb25102728 [0,1,0,0,0,0|3,0,0]=4 888 B12R1.3 COC(\C=C/Cl)c1ccccc1 Amb24426163 [0,1,0,0,0,0|2,0,1]=4 889 B12R1.3 COCC(C#N)c1ccccc1 Amb25728276 [0,1,0,0,0,0|1,0,1]=3 890 B12R1.3 COCC(c1ccccn1)NC Amb10607923 [0,1,0,0,0,0|2,0,0]=3 891 B12R1.3 COCN(C#N)c1ccccc1 Amb24705539 [0,1,0,0,0,0|2,0,1]=4 892 B12R1.3 COC\C(=N\N)\c1ccccc1 Amb25160254 [0,1,0,0,0,0|2,0,1]=4 893 B12R1.3 CONC(C#C)c1ccccc1 Amb24351536 [0,1,0,0,0,0|2,0,1]=4 894 B12R1.3 CO\N=C(\CCl)/c1ccccc1 Amb25700961 [0,1,0,0,0,0|2,0,1]=4 895 B12R1.3 CO\N=C(\CN)/c1ccccc1 Amb25114719 [0,1,0,0,0,0|2,0,1]=4 896 B12R1.3 CO\N=C(\CO)/c1ccccc1 Amb24413008 [0,1,0,0,0,0|2,0,1]=4 897 B12R1.3 CSC(CC#N)c1ccccc1 Amb18804687 [0,1,0,0,0,0|2,0,0]=3 898 B12R1.3 CSCN(C#N)c1ccccc1 Amb25278868 [0,1,0,0,0,0|2,0,1]=4 899 B12R1.3 C\C=C(\CCN)/c1ccccc1 Amb25349495 [0,1,0,0,0,0|2,0,1]=4 900 B12R1.3 C\C=C(\CCO)/c1ccccc1 Amb25256435 [0,1,0,0,0,0|2,0,1]=4 901 B12R1.3 C\C=C\C(C=O)c1ccccc1 Amb24628954 [0,1,0,0,0,0|1,0,2]=4 902 B12R1.3 C\C=C\C(CN)c1ccccc1 Amb24483889 [0,1,0,0,0,0|1,0,1]=3 903 B12R1.3 C\C=C\C(CO)c1ccccc1 Amb24431887 [0,1,0,0,0,0|1,0,1]=3 904 B12R1.3 C\C=C\C(NC)c1ccccc1 Amb18645551 [0,1,0,0,0,0|1,0,1]=3 905 B12R1.3 C\C=N\C(CO)c1ccccc1 Amb25038797 [0,1,0,0,0,0|2,0,0]=3 906 B12R1.3 C\C=N\[C@@H](CO)c1ccccc1 Amb25236547 [0,1,0,0,0,0|2,0,0]=3 907 B12R1.3 N#CC(CCCl)c1ccccc1 Amb18648314 [0,1,0,0,0,0|2,0,1]=4 908 B12R1.3 N#CN[C@H](CO)c1ccccc1 Amb25085864 [0,1,0,0,0,0|3,0,0]=4 909 B12R1.3 NCC(c1ccccc1)OCC Amb17605997 [0,1,0,0,0,0|2,0,0]=3 910 B12R1.3 NCCC(c1ccccc1)CN Amb1111605 [0,1,0,0,0,0|2,0,0]=3 911 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [0,1,0,0,0,0|2,0,0]=3 912 B12R1.3 NCCC(c1cccnc1)CN Amb17232561 [0,1,0,0,0,0|3,0,0]=4 913 B12R1.3 NCCN(c1ccccc1)CC Amb1136918 [0,1,0,0,0,0|3,0,0]=4 914 B12R1.3 OCCC(c1ccccc1)C#N Amb17334526 [0,1,0,0,0,0|2,0,1]=4 915 B12R1.3 OCCC(c1ccccc1)CC Amb17232488 [0,1,0,0,0,0|2,0,0]=3 916 B12R1.3 OCCC(c1cccnc1)CN Amb17232607 [0,1,0,0,0,0|3,0,0]=4 917 B12R1.3 OCCN(c1ccccc1)CC Amb1208392 [0,1,0,0,0,0|3,0,0]=4 918 B12R1.3 OC[C@@H](N=C=O)c1ccccc1 Amb25137163 [0,1,0,0,0,0|3,0,0]=4 919 B12R1.3 OC[C@H](c1ccccc1)NC=O Amb16203101 [0,1,0,0,0,0|3,0,0]=4 920 B12R1.3 SCCN(c1ccccc1)CC Amb13881733 [0,1,0,0,0,0|3,0,0]=4 921 B12R1.3 [C-]#[N+]C(CCO)c1ccccc1 Amb24431832 [0,1,0,0,0,0|2,0,1]=4 922 B12R1.3 [N-]=[N+]=NC(CCl)c1ccccc1 Amb25350559 [0,1,0,0,0,0|2,0,1]=4 923 B12R1.3 [N-]=[N+]=NC(CO)c1ccccc1 Amb25806192 [0,1,0,0,0,0|2,0,1]=4 924 B12R1.3 [N-]=[N+]=N[C@@H](CO)c1ccccc1 Amb25772941 [0,1,0,0,0,0|2,0,1]=4 925 B12R1.16 BrCCC(c1ccc(cc1)Br)C Amb17290540 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.16 BrCCC(c1ccc(cc1)Cl)C Amb17259616 [0,1,0,0,0,0|2,0,0]=3 927 B12R1.16 BrCCC(c1ccc(cc1)F)C Amb17249285 [0,1,0,0,0,0|2,0,0]=3 928 B12R1.16 Brc1ccc(cc1)C(Br)CCBr Amb21864681 [0,1,0,0,0,0|3,0,0]=4 929 B12R1.16 C#CCC(N)c1ccc(Cl)cc1 Amb18809277 [0,1,0,0,0,0|2,0,1]=4 930 B12R1.16 C#CCC(N)c1ccc(F)cc1 Amb18959767 [0,1,0,0,0,0|2,0,1]=4 931 B12R1.16 C#CCC(O)c1ccc(Cl)cc1 Amb18186756 [0,1,0,0,0,0|2,0,1]=4 932 B12R1.16 C#CCC(O)c1ccc(F)cc1 Amb18800772 [0,1,0,0,0,0|2,0,1]=4 933 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [0,1,0,0,0,0|2,0,1]=4 934 B12R1.16 C#CC[C@@H](O)c1ccc(F)cc1 Amb24100212 [0,1,0,0,0,0|2,0,1]=4 935 B12R1.16 C#CC[C@H](N)c1ccc(Br)cc1 Amb24688092 [0,1,0,0,0,0|2,0,1]=4 936 B12R1.16 C#CC[C@H](N)c1ccc(F)cc1 Amb24388527 [0,1,0,0,0,0|2,0,1]=4 937 B12R1.16 C#CC[C@H](O)c1ccc(Cl)cc1 Amb24705595 [0,1,0,0,0,0|2,0,1]=4 938 B12R1.16 C#CC[C@H](O)c1ccc(F)cc1 Amb25136315 [0,1,0,0,0,0|2,0,1]=4 939 B12R1.16 C=CCC(Cl)c1ccc(Cl)cc1 Amb25039265 [0,1,0,0,0,0|2,0,1]=4 940 B12R1.16 C=CCC(N)c1ccc(Br)cc1 Amb18977585 [0,1,0,0,0,0|2,0,1]=4 941 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb18977583 [0,1,0,0,0,0|2,0,1]=4 942 B12R1.16 C=CCC(N)c1ccc(F)cc1 Amb19889920 [0,1,0,0,0,0|2,0,1]=4 943 B12R1.16 C=CCC(N)c1ccc(S)cc1 Amb24744499 [0,1,0,0,0,0|2,0,1]=4 944 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [0,1,0,0,0,0|2,0,1]=4 945 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [0,1,0,0,0,0|2,0,1]=4 946 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [0,1,0,0,0,0|2,0,1]=4 947 B12R1.16 C=CCC(c1ccc(cc1)Cl)N Amb17226689 [0,1,0,0,0,0|2,0,1]=4 948 B12R1.16 C=CC[C@@H](N)c1ccc(Br)cc1 Amb22831742 [0,1,0,0,0,0|2,0,1]=4 949 B12R1.16 C=CC[C@@H](N)c1ccc(Cl)cc1 Amb22831187 [0,1,0,0,0,0|2,0,1]=4 950 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb22831777 [0,1,0,0,0,0|2,0,1]=4 951 B12R1.16 C=CC[C@@H](N)c1ccc(F)cc1 Amb23440406 [0,1,0,0,0,0|2,0,1]=4 952 B12R1.16 C=CC[C@@H](N)c1ccc(O)cc1 Amb25113869 [0,1,0,0,0,0|2,0,1]=4 953 B12R1.16 C=CC[C@@H](N)c1ccc(S)cc1 Amb25127949 [0,1,0,0,0,0|2,0,1]=4 954 B12R1.16 C=CC[C@H](N)c1ccc(Br)cc1 Amb24682606 [0,1,0,0,0,0|2,0,1]=4 955 B12R1.16 C=CC[C@H](N)c1ccc(Cl)cc1 Amb25698455 [0,1,0,0,0,0|2,0,1]=4 956 B12R1.16 C=CC[C@H](N)c1ccc(O)cc1 Amb25737463 [0,1,0,0,0,0|2,0,1]=4 957 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [0,1,0,0,0,0|2,0,1]=4 958 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [0,1,0,0,0,0|2,0,1]=4 959 B12R1.16 CC#CC(O)c1ccc(Br)cc1 Amb25036422 [0,1,0,0,0,0|2,0,1]=4 960 B12R1.16 CC(CC#N)c1ccc(Br)cc1 Amb25794629 [0,1,0,0,0,0|2,0,0]=3 961 B12R1.16 CC(CCN)c1ccc(Cl)cc1 Amb22034632 [0,1,0,0,0,0|2,0,0]=3 962 B12R1.16 CC(CCN)c1ccc(N)cc1 Amb25856793 [0,1,0,0,0,0|2,0,0]=3 963 B12R1.16 CC(CCO)c1ccc(N)cc1 Amb24553218 [0,1,0,0,0,0|2,0,0]=3 964 B12R1.16 CC(CCS)c1ccc(N)cc1 Amb24442941 [0,1,0,0,0,0|2,0,0]=3 965 B12R1.16 CC(N=C=O)c1ccc(Cl)cc1 Amb24709048 [0,1,0,0,0,0|3,0,0]=4 966 B12R1.16 CC(N=C=O)c1ccc(O)cc1 Amb24636992 [0,1,0,0,0,0|3,0,0]=4 967 B12R1.16 CC(N=C=S)c1ccc(Br)cc1 Amb25045923 [0,1,0,0,0,0|3,0,0]=4 968 B12R1.16 CC(N=[N+]=[N-])c1ccc(Br)cc1 Amb25296094 [0,1,0,0,0,0|2,0,1]=4 969 B12R1.16 CC(NC#N)c1ccc(Br)cc1 Amb25285975 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.16 CC(NC#N)c1ccc(Cl)cc1 Amb18809458 [0,1,0,0,0,0|3,0,0]=4 971 B12R1.16 CC(NC#N)c1ccc(F)cc1 Amb18800781 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.16 CC(NC=O)c1ccc(Cl)cc1 Amb24692281 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.16 CC(NC=O)c1ccc(F)cc1 Amb25793871 [0,1,0,0,0,0|3,0,0]=4 974 B12R1.16 CC(NC=O)c1ccc(O)cc1 Amb24432160 [0,1,0,0,0,0|3,0,0]=4 975 B12R1.16 CC(NCC)c1ccc(O)[n]c1 Amb24450428 [0,1,0,0,0,0|3,0,0]=4 976 B12R1.16 CC(SC#N)c1ccc(O)cc1 Amb25039082 [0,1,0,0,0,0|3,0,0]=4 977 B12R1.16 CC(c1ccc(cc1)Br)N=C=O Amb10808012 [0,1,0,0,0,0|3,0,0]=4 978 B12R1.16 CCCC(=C)c1ccc(N)cc1 Amb25258551 [0,1,0,0,0,0|1,0,2]=4 979 B12R1.16 CCCC(=O)c1ccc(cc1)Br Amb2567820 [0,1,0,0,0,0|2,0,1]=4 980 B12R1.16 CCCC(=O)c1ccc(cc1)Cl Amb1679791 [0,1,0,0,0,0|2,0,1]=4 981 B12R1.16 CCCC(=O)c1ccc(cc1)O Amb1033062 [0,1,0,0,0,0|2,0,1]=4 982 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [0,1,0,0,0,0|2,0,0]=3 983 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [0,1,0,0,0,0|1,0,0]=2 984 B12R1.16 CCCC(N)c1c[n]c(Cl)cc1 Amb25041595 [0,1,0,0,0,0|3,0,0]=4 985 B12R1.16 CCCC(N)c1c[n]c(N)cc1 Amb24504676 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.16 CCCC(N)c1c[n]c(O)cc1 Amb24487260 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.16 CCCC(N)c1ccc(Cl)c[n]1 Amb25082356 [0,1,0,0,0,0|3,0,0]=4 988 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [0,1,0,0,0,0|2,0,0]=3 989 B12R1.16 CCCC(N)c1ccc(F)c[n]1 Amb25368372 [0,1,0,0,0,0|3,0,0]=4 990 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [0,1,0,0,0,0|2,0,0]=3 991 B12R1.16 CCCC(N)c1ccc(O)c[n]1 Amb25326909 [0,1,0,0,0,0|3,0,0]=4 992 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [0,1,0,0,0,0|2,0,0]=3 993 B12R1.16 CCCC(O)c1c[n]c(N)cc1 Amb24532792 [0,1,0,0,0,0|3,0,0]=4 994 B12R1.16 CCCC(O)c1ccc(Cl)c[n]1 Amb25152356 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.16 CCCC(O)c1ccc(F)c[n]1 Amb24417756 [0,1,0,0,0,0|3,0,0]=4 996 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [0,1,0,0,0,0|2,0,0]=3 997 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [0,1,0,0,0,0|2,0,0]=3 998 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [0,1,0,0,0,0|2,0,0]=3 999 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [0,1,0,0,0,0|2,0,0]=3 1000 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [0,1,0,0,0,0|2,0,0]=3 1001 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [0,1,0,0,0,0|1,0,0]=2 1002 B12R1.16 CCCN(C)c1ccc(Br)c[n]1 Amb25291891 [0,1,0,0,0,0|3,0,0]=4 1003 B12R1.16 CCCS(=O)c1ccc(N)cc1 Amb18977331 [0,1,0,0,0,0|3,0,0]=4 1004 B12R1.16 CCC[C@@H](N)c1c[n]c(Cl)cc1 Amb25824629 [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.16 CCC[C@@H](N)c1c[n]c(F)cc1 Amb24657257 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.16 CCC[C@@H](N)c1c[n]c(I)cc1 Amb24714642 [0,1,0,0,0,0|3,0,0]=4 1007 B12R1.16 CCC[C@@H](N)c1c[n]c(N)cc1 Amb24702941 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.16 CCC[C@@H](N)c1c[n]c(O)cc1 Amb24436481 [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [0,1,0,0,0,0|2,0,0]=3 1010 B12R1.16 CCC[C@@H](N)c1ccc(Cl)c[n]1 Amb25148611 [0,1,0,0,0,0|3,0,0]=4 1011 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [0,1,0,0,0,0|2,0,0]=3 1012 B12R1.16 CCC[C@@H](N)c1ccc(F)c[n]1 Amb24488505 [0,1,0,0,0,0|3,0,0]=4 1013 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [0,1,0,0,0,0|2,0,0]=3 1014 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [0,1,0,0,0,0|2,0,0]=3 1015 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [0,1,0,0,0,0|2,0,0]=3 1016 B12R1.16 CCC[C@@H](N)c1ccc(N)c[n]1 Amb25112711 [0,1,0,0,0,0|3,0,0]=4 1017 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [0,1,0,0,0,0|2,0,0]=3 1018 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [0,1,0,0,0,0|2,0,0]=3 1019 B12R1.16 CCC[C@@H](N)c1ccc(O)c[n]1 Amb25703124 [0,1,0,0,0,0|3,0,0]=4 1020 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [0,1,0,0,0,0|2,0,0]=3 1021 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [0,1,0,0,0,0|2,0,0]=3 1022 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [0,1,0,0,0,0|2,0,0]=3 1023 B12R1.16 CCC[C@@H](O)c1ccc(Cl)c[n]1 Amb25047962 [0,1,0,0,0,0|3,0,0]=4 1024 B12R1.16 CCC[C@@H](O)c1ccc(F)c[n]1 Amb25795724 [0,1,0,0,0,0|3,0,0]=4 1025 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [0,1,0,0,0,0|2,0,0]=3 1026 B12R1.16 CCC[C@H](N)c1c[n]c(Cl)cc1 Amb24680920 [0,1,0,0,0,0|3,0,0]=4 1027 B12R1.16 CCC[C@H](N)c1c[n]c(I)cc1 Amb24537710 [0,1,0,0,0,0|3,0,0]=4 1028 B12R1.16 CCC[C@H](N)c1c[n]c(O)cc1 Amb24745589 [0,1,0,0,0,0|3,0,0]=4 1029 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [0,1,0,0,0,0|2,0,0]=3 1030 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [0,1,0,0,0,0|2,0,0]=3 1031 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [0,1,0,0,0,0|2,0,0]=3 1032 B12R1.16 CCC[C@H](N)c1ccc(N)c[n]1 Amb25150954 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [0,1,0,0,0,0|2,0,0]=3 1034 B12R1.16 CCC[C@H](N)c1ccc(O)c[n]1 Amb25751435 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [0,1,0,0,0,0|2,0,0]=3 1036 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [0,1,0,0,0,0|2,0,0]=3 1037 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [0,1,0,0,0,0|2,0,0]=3 1038 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [0,1,0,0,0,0|2,0,0]=3 1039 B12R1.16 CCNC(c1ccc(cc1)Br)C Amb1095032 [0,1,0,0,0,0|2,0,0]=3 1040 B12R1.16 CCNC(c1ccc(cc1)F)C Amb10188230 [0,1,0,0,0,0|2,0,0]=3 1041 B12R1.16 CCN[C@@H](C)c1ccc(Cl)cc1 Amb25138514 [0,1,0,0,0,0|2,0,0]=3 1042 B12R1.16 CCN[C@H](C)c1ccc(Br)cc1 Amb25788596 [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.16 CCN[C@H](C)c1ccc(Cl)cc1 Amb24383514 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.16 CCOC(C)c1ccc(Br)cc1 Amb23443733 [0,1,0,0,0,0|2,0,0]=3 1045 B12R1.16 CCOC(C)c1ccc(N)cc1 Amb18974004 [0,1,0,0,0,0|2,0,0]=3 1046 B12R1.16 CCOC(C)c1ccc(S)cc1 Amb23568732 [0,1,0,0,0,0|2,0,0]=3 1047 B12R1.16 CCSC(C)c1ccc(N)cc1 Amb18974009 [0,1,0,0,0,0|2,0,0]=3 1048 B12R1.16 CN(CC#C)c1ccc(F)cc1 Amb18792473 [0,1,0,0,0,0|2,0,1]=4 1049 B12R1.16 CN(CC#C)c1ccc(I)cc1 Amb24412869 [0,1,0,0,0,0|2,0,1]=4 1050 B12R1.16 CN(CC#C)c1ccc(N)cc1 Amb24590328 [0,1,0,0,0,0|2,0,1]=4 1051 B12R1.16 CN(CC#C)c1ccc(O)cc1 Amb25669925 [0,1,0,0,0,0|2,0,1]=4 1052 B12R1.16 CN(CC#N)c1ccc(I)cc1 Amb25686737 [0,1,0,0,0,0|3,0,0]=4 1053 B12R1.16 CN(CC=C)c1ccc(F)cc1 Amb24370860 [0,1,0,0,0,0|2,0,1]=4 1054 B12R1.16 CN(CC=C)c1ccc(I)cc1 Amb24541418 [0,1,0,0,0,0|2,0,1]=4 1055 B12R1.16 CN(CC=O)c1ccc(F)cc1 Amb18788556 [0,1,0,0,0,0|3,0,0]=4 1056 B12R1.16 CN(CCBr)c1ccc(F)cc1 Amb24450490 [0,1,0,0,0,0|3,0,0]=4 1057 B12R1.16 CN(CCCl)c1ccc(O)cc1 Amb25321957 [0,1,0,0,0,0|3,0,0]=4 1058 B12R1.16 CN(CCF)c1ccc(N)cc1 Amb25093879 [0,1,0,0,0,0|3,0,0]=4 1059 B12R1.16 CN(CCI)c1ccc(F)cc1 Amb24555424 [0,1,0,0,0,0|3,0,0]=4 1060 B12R1.16 CN(CCN)c1ccc(N)cc1 Amb18251776 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.16 CN(CCN)c1ccc(O)cc1 Amb18251791 [0,1,0,0,0,0|3,0,0]=4 1062 B12R1.16 CN(CCO)c1ccc(O)cc1 Amb25202702 [0,1,0,0,0,0|3,0,0]=4 1063 B12R1.16 CN(c1ccc(cc1)Br)CC#N Amb17343205 [0,1,0,0,0,0|3,0,0]=4 1064 B12R1.16 CN(c1ccc(cc1)C)CC#N Amb17334503 [0,1,0,0,0,0|3,0,0]=4 1065 B12R1.16 CN(c1ccc(cc1)Cl)CC#N Amb17335465 [0,1,0,0,0,0|3,0,0]=4 1066 B12R1.16 CN(c1ccc(cc1)F)CC#N Amb17334603 [0,1,0,0,0,0|3,0,0]=4 1067 B12R1.16 CNCC(=C)c1ccc(O)cc1 Amb24727996 [0,1,0,0,0,0|0,0,2]=3 1068 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [0,1,0,0,0,0|1,0,1]=3 1069 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [0,1,0,0,0,0|1,0,1]=3 1070 B12R1.16 CNCC(=O)c1ccc(cc1)Br Amb17248090 [0,1,0,0,0,0|1,0,1]=3 1071 B12R1.16 CNCC(=O)c1ccc(cc1)C Amb17232427 [0,1,0,0,0,0|1,0,1]=3 1072 B12R1.16 CNCC(=O)c1ccc(cc1)F Amb17232631 [0,1,0,0,0,0|1,0,1]=3 1073 B12R1.16 CNCC(=O)c1ccc(cc1)O Amb1075808 [0,1,0,0,0,0|1,0,1]=3 1074 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [0,1,0,0,0,0|0,0,0]=1 1075 B12R1.16 CNCC(O)c1ccc(Br)c[n]1 Amb23586103 [0,1,0,0,0,0|2,0,0]=3 1076 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb19373245 [0,1,0,0,0,0|1,0,0]=2 1077 B12R1.16 CNCC(O)c1ccc(I)cc1 Amb25742345 [0,1,0,0,0,0|1,0,0]=2 1078 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [0,1,0,0,0,0|1,0,0]=2 1079 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [0,1,0,0,0,0|1,0,0]=2 1080 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22346160 [0,1,0,0,0,0|1,0,0]=2 1081 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [0,1,0,0,0,0|0,0,0]=1 1082 B12R1.16 CNCC(c1ccc(cc1)Br)O Amb17142608 [0,1,0,0,0,0|1,0,0]=2 1083 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [0,1,0,0,0,0|0,0,0]=1 1084 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [0,1,0,0,0,0|0,0,0]=1 1085 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [0,1,0,0,0,0|0,0,0]=1 1086 B12R1.16 CNC[C@@H](N)c1ccc(Cl)cc1 Amb25693381 [0,1,0,0,0,0|1,0,0]=2 1087 B12R1.16 CNC[C@@H](O)c1ccc(Cl)cc1 Amb25152551 [0,1,0,0,0,0|1,0,0]=2 1088 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [0,1,0,0,0,0|1,0,0]=2 1089 B12R1.16 CNC[C@H](O)c1ccc(Br)cc1 Amb25845203 [0,1,0,0,0,0|1,0,0]=2 1090 B12R1.16 CNC[C@H](O)c1ccc(Cl)cc1 Amb24423892 [0,1,0,0,0,0|1,0,0]=2 1091 B12R1.16 CNC[C@H](O)c1ccc(F)c[n]1 Amb25300377 [0,1,0,0,0,0|2,0,0]=3 1092 B12R1.16 CNOC(=O)c1ccc(Cl)cc1 Amb22441604 [0,1,0,0,0,0|2,0,1]=4 1093 B12R1.16 CNOC(=O)c1ccc(I)cc1 Amb22434649 [0,1,0,0,0,0|2,0,1]=4 1094 B12R1.16 COCC(=C)c1ccc(N)cc1 Amb18126371 [0,1,0,0,0,0|1,0,2]=4 1095 B12R1.16 COCC(=O)c1ccc(cc1)N Amb17202004 [0,1,0,0,0,0|2,0,1]=4 1096 B12R1.16 COCC(=O)c1ccc(cc1)O Amb17616985 [0,1,0,0,0,0|2,0,1]=4 1097 B12R1.16 COCC(C)c1[n]cc(N)c[n]1 Amb24524906 [0,1,0,0,0,0|3,0,0]=4 1098 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [0,1,0,0,0,0|1,0,0]=2 1099 B12R1.16 COCC(F)c1ccc(O)cc1 Amb25845176 [0,1,0,0,0,0|2,0,0]=3 1100 B12R1.16 COCC(N)c1ccc(Br)[n]c1 Amb25785088 [0,1,0,0,0,0|3,0,0]=4 1101 B12R1.16 COCC(N)c1ccc(Br)c[n]1 Amb25731941 [0,1,0,0,0,0|3,0,0]=4 1102 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [0,1,0,0,0,0|2,0,0]=3 1103 B12R1.16 COCC(N)c1ccc(Cl)[n]c1 Amb25148566 [0,1,0,0,0,0|3,0,0]=4 1104 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [0,1,0,0,0,0|2,0,0]=3 1105 B12R1.16 COCC(N)c1ccc(F)c[n]1 Amb24487379 [0,1,0,0,0,0|3,0,0]=4 1106 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [0,1,0,0,0,0|2,0,0]=3 1107 B12R1.16 COCC(N)c1ccc(I)[n]c1 Amb25786591 [0,1,0,0,0,0|3,0,0]=4 1108 B12R1.16 COCC(N)c1ccc(I)cc1 Amb24648633 [0,1,0,0,0,0|2,0,0]=3 1109 B12R1.16 COCC(N)c1ccc(N)[n]c1 Amb25113369 [0,1,0,0,0,0|3,0,0]=4 1110 B12R1.16 COCC(N)c1ccc(O)c[n]1 Amb24560345 [0,1,0,0,0,0|3,0,0]=4 1111 B12R1.16 COCC(N)c1ccc(O)cc1 Amb24581245 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.16 COCC(N)c1ccc(S)cc1 Amb24393366 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.16 COCC(O)c1ccc(Br)[n]c1 Amb24363729 [0,1,0,0,0,0|3,0,0]=4 1114 B12R1.16 COCC(O)c1ccc(Cl)cc1 Amb19058986 [0,1,0,0,0,0|2,0,0]=3 1115 B12R1.16 COCC(O)c1ccc(F)c[n]1 Amb24377421 [0,1,0,0,0,0|3,0,0]=4 1116 B12R1.16 COCC(O)c1ccc(F)cc1 Amb18793595 [0,1,0,0,0,0|2,0,0]=3 1117 B12R1.16 COCC(O)c1ccc(I)cc1 Amb25680763 [0,1,0,0,0,0|2,0,0]=3 1118 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [0,1,0,0,0,0|2,0,0]=3 1119 B12R1.16 COCC(c1ccc(cc1)C)N Amb1127416 [0,1,0,0,0,0|2,0,0]=3 1120 B12R1.16 COCC(c1ccc(cc1)F)N Amb1139881 [0,1,0,0,0,0|2,0,0]=3 1121 B12R1.16 COCS(=O)c1ccc(F)cc1 Amb24760828 [0,1,0,0,0,0|3,0,0]=4 1122 B12R1.16 COCS(=O)c1ccc(N)cc1 Amb25742705 [0,1,0,0,0,0|3,0,0]=4 1123 B12R1.16 COC[C@@H](N)c1ccc(Br)c[n]1 Amb25131237 [0,1,0,0,0,0|3,0,0]=4 1124 B12R1.16 COC[C@@H](N)c1ccc(Cl)[n]c1 Amb25149888 [0,1,0,0,0,0|3,0,0]=4 1125 B12R1.16 COC[C@@H](N)c1ccc(Cl)c[n]1 Amb25112716 [0,1,0,0,0,0|3,0,0]=4 1126 B12R1.16 COC[C@@H](N)c1ccc(Cl)cc1 Amb25709133 [0,1,0,0,0,0|2,0,0]=3 1127 B12R1.16 COC[C@@H](N)c1ccc(I)[n]c1 Amb25857011 [0,1,0,0,0,0|3,0,0]=4 1128 B12R1.16 COC[C@@H](N)c1ccc(N)[n]c1 Amb24548855 [0,1,0,0,0,0|3,0,0]=4 1129 B12R1.16 COC[C@@H](N)c1ccc(N)cc1 Amb24585135 [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.16 COC[C@@H](N)c1ccc(O)[n]c1 Amb24504717 [0,1,0,0,0,0|3,0,0]=4 1131 B12R1.16 COC[C@@H](N)c1ccc(S)cc1 Amb25340455 [0,1,0,0,0,0|2,0,0]=3 1132 B12R1.16 COC[C@H](N)c1ccc(Br)[n]c1 Amb24597015 [0,1,0,0,0,0|3,0,0]=4 1133 B12R1.16 COC[C@H](N)c1ccc(Br)c[n]1 Amb24341992 [0,1,0,0,0,0|3,0,0]=4 1134 B12R1.16 COC[C@H](N)c1ccc(Cl)c[n]1 Amb24377610 [0,1,0,0,0,0|3,0,0]=4 1135 B12R1.16 COC[C@H](N)c1ccc(Cl)cc1 Amb25128001 [0,1,0,0,0,0|2,0,0]=3 1136 B12R1.16 COC[C@H](N)c1ccc(F)[n]c1 Amb25831240 [0,1,0,0,0,0|3,0,0]=4 1137 B12R1.16 COC[C@H](N)c1ccc(I)[n]c1 Amb24537863 [0,1,0,0,0,0|3,0,0]=4 1138 B12R1.16 COC[C@H](N)c1ccc(N)cc1 Amb25756886 [0,1,0,0,0,0|2,0,0]=3 1139 B12R1.16 COC[C@H](N)c1ccc(O)[n]c1 Amb25189492 [0,1,0,0,0,0|3,0,0]=4 1140 B12R1.16 COC[C@H](N)c1ccc(O)cc1 Amb24452863 [0,1,0,0,0,0|2,0,0]=3 1141 B12R1.16 COC[C@H](O)c1ccc(Cl)cc1 Amb25158166 [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.16 CONC(C)c1ccc(Br)cc1 Amb18747016 [0,1,0,0,0,0|2,0,0]=3 1143 B12R1.16 CONC(C)c1ccc(F)cc1 Amb25109738 [0,1,0,0,0,0|2,0,0]=3 1144 B12R1.16 CSCC(=O)c1ccc(Br)cc1 Amb24638487 [0,1,0,0,0,0|2,0,1]=4 1145 B12R1.16 CSCC(=O)c1ccc(Cl)cc1 Amb18320090 [0,1,0,0,0,0|2,0,1]=4 1146 B12R1.16 CSCC(=O)c1ccc(F)cc1 Amb19057445 [0,1,0,0,0,0|2,0,1]=4 1147 B12R1.16 CSCC(=O)c1ccc(I)cc1 Amb25826398 [0,1,0,0,0,0|2,0,1]=4 1148 B12R1.16 CSCC(=O)c1ccc(O)cc1 Amb18181564 [0,1,0,0,0,0|2,0,1]=4 1149 B12R1.16 CSCC(N)c1ccc(Cl)cc1 Amb18995345 [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [0,1,0,0,0,0|2,0,0]=3 1151 B12R1.16 CSCC(O)c1ccc(Cl)cc1 Amb24488689 [0,1,0,0,0,0|2,0,0]=3 1152 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [0,1,0,0,0,0|2,0,0]=3 1153 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [0,1,0,0,0,0|2,0,0]=3 1154 B12R1.16 C[15NH][13CH2][13CH](c1ccc(cc1)O)O Amb17620274 [0,1,0,0,0,0|1,0,0]=2 1155 B12R1.16 C[C@@H](CCBr)c1ccc(Cl)cc1 Amb24667919 [0,1,0,0,0,0|2,0,0]=3 1156 B12R1.16 C[C@@H](CCO)c1ccc(Cl)cc1 Amb25832765 [0,1,0,0,0,0|2,0,0]=3 1157 B12R1.16 C[C@@H](CCO)c1ccc(F)cc1 Amb25317656 [0,1,0,0,0,0|2,0,0]=3 1158 B12R1.16 C[C@@H](N=C=O)c1ccc(Br)cc1 Amb22053849 [0,1,0,0,0,0|3,0,0]=4 1159 B12R1.16 C[C@@H](N=C=S)c1ccc(F)cc1 Amb22045282 [0,1,0,0,0,0|3,0,0]=4 1160 B12R1.16 C[C@@H](N=[N+]=[N-])c1ccc(Br)cc1 Amb25131793 [0,1,0,0,0,0|2,0,1]=4 1161 B12R1.16 C[C@@H](N=[N+]=[N-])c1ccc(I)cc1 Amb25131792 [0,1,0,0,0,0|2,0,1]=4 1162 B12R1.16 C[C@@H](NC#N)c1ccc(Br)cc1 Amb25145005 [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.16 C[C@@H](NC#N)c1ccc(Cl)cc1 Amb24391197 [0,1,0,0,0,0|3,0,0]=4 1164 B12R1.16 C[C@@H](NC=O)c1ccc(F)cc1 Amb25088808 [0,1,0,0,0,0|3,0,0]=4 1165 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [0,1,0,0,0,0|2,0,0]=3 1166 B12R1.16 C[C@H](N=C=O)c1ccc(Br)cc1 Amb22045324 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.16 C[C@H](N=C=O)c1ccc(Cl)cc1 Amb22045301 [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.16 C[C@H](N=C=O)c1ccc(F)cc1 Amb22045303 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.16 C[C@H](N=C=S)c1ccc(Br)cc1 Amb22045323 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.16 C[C@H](N=C=S)c1ccc(Cl)cc1 Amb22045279 [0,1,0,0,0,0|3,0,0]=4 1171 B12R1.16 C[C@H](N=C=S)c1ccc(F)cc1 Amb22045283 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.16 C[C@H](NC#N)c1ccc(Cl)cc1 Amb24442761 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.16 C[C@H](NC=O)c1ccc(Br)cc1 Amb25674481 [0,1,0,0,0,0|3,0,0]=4 1174 B12R1.16 C[C@H](NC=O)c1ccc(F)cc1 Amb25039112 [0,1,0,0,0,0|3,0,0]=4 1175 B12R1.16 C\C(=N/OC)\c1ccc(Cl)cc1 Amb21856198 [0,1,0,0,0,0|2,0,1]=4 1176 B12R1.16 C\C(=N\NC)\c1ccc(Cl)cc1 Amb25160129 [0,1,0,0,0,0|1,0,1]=3 1177 B12R1.16 C\C(=N\NC)\c1ccc(N)cc1 Amb24720450 [0,1,0,0,0,0|1,0,1]=3 1178 B12R1.16 C\C(=N\OC)\c1ccc(Cl)cc1 Amb24556729 [0,1,0,0,0,0|2,0,1]=4 1179 B12R1.16 C\C(=N\OC)\c1ccc(N)cc1 Amb25764511 [0,1,0,0,0,0|2,0,1]=4 1180 B12R1.16 C\C(=N\OC)\c1ccc(O)cc1 Amb24747784 [0,1,0,0,0,0|2,0,1]=4 1181 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [0,1,0,0,0,0|1,0,1]=3 1182 B12R1.16 C\C=C\C(C)c1ccc(O)cc1 Amb24737403 [0,1,0,0,0,0|1,0,1]=3 1183 B12R1.16 Cc1ccc([n]c1)C(C)NCC Amb24538938 [0,1,0,0,0,0|3,0,0]=4 1184 B12R1.16 Cc1ccc([n]c1)C(N)COC Amb25112013 [0,1,0,0,0,0|3,0,0]=4 1185 B12R1.16 Cc1ccc([n]c1)C(O)CCC Amb24412250 [0,1,0,0,0,0|3,0,0]=4 1186 B12R1.16 Cc1ccc([n]c1)C(O)CNC Amb24380693 [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.16 Cc1ccc([n]c1)N(C)CCC Amb24354004 [0,1,0,0,0,0|3,0,0]=4 1188 B12R1.16 Cc1ccc([n]c1)[C@@H](N)CCC Amb25189382 [0,1,0,0,0,0|3,0,0]=4 1189 B12R1.16 Cc1ccc([n]c1)[C@@H](N)COC Amb25751301 [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.16 Cc1ccc([n]c1)[C@H](N)CCC Amb25340368 [0,1,0,0,0,0|3,0,0]=4 1191 B12R1.16 Cc1ccc([n]c1)[C@H](N)COC Amb24497616 [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.16 Cc1ccc(c[n]1)C(=O)CNC Amb25154107 [0,1,0,0,0,0|2,0,1]=4 1193 B12R1.16 Cc1ccc(c[n]1)C(C)CCN Amb24525060 [0,1,0,0,0,0|3,0,0]=4 1194 B12R1.16 Cc1ccc(c[n]1)C(N)COC Amb24341775 [0,1,0,0,0,0|3,0,0]=4 1195 B12R1.16 Cc1ccc(c[n]1)C(N)CSC Amb25223065 [0,1,0,0,0,0|3,0,0]=4 1196 B12R1.16 Cc1ccc(c[n]1)C(O)CCC Amb25683800 [0,1,0,0,0,0|3,0,0]=4 1197 B12R1.16 Cc1ccc(c[n]1)C(O)COC Amb25765115 [0,1,0,0,0,0|3,0,0]=4 1198 B12R1.16 Cc1ccc(c[n]1)[C@@H](N)CCC Amb24488506 [0,1,0,0,0,0|3,0,0]=4 1199 B12R1.16 Cc1ccc(cc1)C(=O)CNO Amb25140702 [0,1,0,0,0,0|2,0,1]=4 1200 B12R1.16 Cc1ccc(cc1)C(=O)CSC Amb18796320 [0,1,0,0,0,0|2,0,1]=4 1201 B12R1.16 Cc1ccc(cc1)C(Br)CCBr Amb23456168 [0,1,0,0,0,0|3,0,0]=4 1202 B12R1.16 Cc1ccc(cc1)C(Br)CCCl Amb24544004 [0,1,0,0,0,0|3,0,0]=4 1203 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [0,1,0,0,0,0|1,0,1]=3 1204 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [0,1,0,0,0,0|2,0,0]=3 1205 B12R1.16 Cc1ccc(cc1)C(C)N=C=O Amb25189504 [0,1,0,0,0,0|3,0,0]=4 1206 B12R1.16 Cc1ccc(cc1)C(C)N=C=S Amb18795946 [0,1,0,0,0,0|3,0,0]=4 1207 B12R1.16 Cc1ccc(cc1)C(C)NC#N Amb18800413 [0,1,0,0,0,0|3,0,0]=4 1208 B12R1.16 Cc1ccc(cc1)C(C)NC=O Amb25675923 [0,1,0,0,0,0|3,0,0]=4 1209 B12R1.16 Cc1ccc(cc1)C(C)NOC Amb25829141 [0,1,0,0,0,0|2,0,0]=3 1210 B12R1.16 Cc1ccc(cc1)C(Cl)CC=C Amb25772787 [0,1,0,0,0,0|2,0,1]=4 1211 B12R1.16 Cc1ccc(cc1)C(Cl)CCO Amb24552889 [0,1,0,0,0,0|3,0,0]=4 1212 B12R1.16 Cc1ccc(cc1)C(Cl)CSC Amb25805205 [0,1,0,0,0,0|2,0,0]=3 1213 B12R1.16 Cc1ccc(cc1)C(Cl)\C=C\C Amb25779946 [0,1,0,0,0,0|2,0,1]=4 1214 B12R1.16 Cc1ccc(cc1)C(N)CC#C Amb18800158 [0,1,0,0,0,0|2,0,1]=4 1215 B12R1.16 Cc1ccc(cc1)C(N)CC#N Amb18563500 [0,1,0,0,0,0|3,0,0]=4 1216 B12R1.16 Cc1ccc(cc1)C(N)CC=C Amb18977589 [0,1,0,0,0,0|2,0,1]=4 1217 B12R1.16 Cc1ccc(cc1)C(N)CCN Amb18646152 [0,1,0,0,0,0|3,0,0]=4 1218 B12R1.16 Cc1ccc(cc1)C(N)CSC Amb18995350 [0,1,0,0,0,0|2,0,0]=3 1219 B12R1.16 Cc1ccc(cc1)C(O)CC#C Amb18800361 [0,1,0,0,0,0|2,0,1]=4 1220 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [0,1,0,0,0,0|2,0,1]=4 1221 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [0,1,0,0,0,0|3,0,0]=4 1222 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [0,1,0,0,0,0|3,0,0]=4 1223 B12R1.16 Cc1ccc(cc1)C(O)COC Amb18792767 [0,1,0,0,0,0|2,0,0]=3 1224 B12R1.16 Cc1ccc(cc1)C(O)CSC Amb19061295 [0,1,0,0,0,0|2,0,0]=3 1225 B12R1.16 Cc1ccc(cc1)C(S)CCN Amb25112044 [0,1,0,0,0,0|3,0,0]=4 1226 B12R1.16 Cc1ccc(cc1)N(C)CC#C Amb18787879 [0,1,0,0,0,0|2,0,1]=4 1227 B12R1.16 Cc1ccc(cc1)N(C)CC=O Amb18788188 [0,1,0,0,0,0|3,0,0]=4 1228 B12R1.16 Cc1ccc(cc1)N(C)CCC Amb25154383 [0,1,0,0,0,0|2,0,0]=3 1229 B12R1.16 Cc1ccc(cc1)N(C)CCF Amb25355436 [0,1,0,0,0,0|3,0,0]=4 1230 B12R1.16 Cc1ccc(cc1)N(C)CCS Amb25858637 [0,1,0,0,0,0|3,0,0]=4 1231 B12R1.16 Cc1ccc(cc1)[C@@H](C)CCO Amb25058547 [0,1,0,0,0,0|2,0,0]=3 1232 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCC Amb24425911 [0,1,0,0,0,0|2,0,0]=3 1233 B12R1.16 Cc1ccc(cc1)[C@@H](N)CC=C Amb22831227 [0,1,0,0,0,0|2,0,1]=4 1234 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [0,1,0,0,0,0|2,0,0]=3 1235 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb19888370 [0,1,0,0,0,0|3,0,0]=4 1236 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCO Amb23399704 [0,1,0,0,0,0|3,0,0]=4 1237 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#C Amb25706066 [0,1,0,0,0,0|2,0,1]=4 1238 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#N Amb24706705 [0,1,0,0,0,0|3,0,0]=4 1239 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [0,1,0,0,0,0|2,0,0]=3 1240 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [0,1,0,0,0,0|2,0,0]=3 1241 B12R1.16 Cc1ccc(cc1)[C@H](C)CCO Amb24671505 [0,1,0,0,0,0|2,0,0]=3 1242 B12R1.16 Cc1ccc(cc1)[C@H](C)N=[N+]=[N-] Amb25791441 [0,1,0,0,0,0|2,0,1]=4 1243 B12R1.16 Cc1ccc(cc1)[C@H](C)NC#N Amb25362970 [0,1,0,0,0,0|3,0,0]=4 1244 B12R1.16 Cc1ccc(cc1)[C@H](C)NC=O Amb24442760 [0,1,0,0,0,0|3,0,0]=4 1245 B12R1.16 Cc1ccc(cc1)[C@H](C)NCC Amb24415678 [0,1,0,0,0,0|2,0,0]=3 1246 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [0,1,0,0,0,0|2,0,0]=3 1247 B12R1.16 Cc1ccc(cc1)[C@H](N)CCO Amb19887704 [0,1,0,0,0,0|3,0,0]=4 1248 B12R1.16 Cc1ccc(cc1)[C@H](N)COC Amb24734357 [0,1,0,0,0,0|2,0,0]=3 1249 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [0,1,0,0,0,0|2,0,0]=3 1250 B12R1.16 Cc1ccc(cc1)[C@H](O)CCCl Amb25361013 [0,1,0,0,0,0|3,0,0]=4 1251 B12R1.16 Cc1ccc(cc1)\C(\C)=C/NC Amb25804209 [0,1,0,0,0,0|0,0,2]=3 1252 B12R1.16 Cc1ccc(cc1)\C(\C)=N/NC Amb25816631 [0,1,0,0,0,0|1,0,1]=3 1253 B12R1.16 ClC(CCBr)c1ccc(Br)cc1 Amb21864682 [0,1,0,0,0,0|3,0,0]=4 1254 B12R1.16 ClCCC(c1ccc(cc1)Br)C Amb17259618 [0,1,0,0,0,0|2,0,0]=3 1255 B12R1.16 ClCCC(c1ccc(cc1)Br)O Amb17196599 [0,1,0,0,0,0|3,0,0]=4 1256 B12R1.16 ClCCC(c1ccc(cc1)C)C Amb17233970 [0,1,0,0,0,0|2,0,0]=3 1257 B12R1.16 ClCCC(c1ccc(cc1)C)O Amb17194565 [0,1,0,0,0,0|3,0,0]=4 1258 B12R1.16 ClCCC(c1ccc(cc1)Cl)C Amb17237597 [0,1,0,0,0,0|2,0,0]=3 1259 B12R1.16 ClCCC(c1ccc(cc1)Cl)O Amb17194897 [0,1,0,0,0,0|3,0,0]=4 1260 B12R1.16 ClCCC(c1ccc(cc1)F)C Amb17234366 [0,1,0,0,0,0|2,0,0]=3 1261 B12R1.16 ClCCC(c1ccc(cc1)F)O Amb17194592 [0,1,0,0,0,0|3,0,0]=4 1262 B12R1.16 ClCCN(c1ccc(cc1)Br)C Amb17351918 [0,1,0,0,0,0|3,0,0]=4 1263 B12R1.16 ClCCN(c1ccc(cc1)C)C Amb17335672 [0,1,0,0,0,0|3,0,0]=4 1264 B12R1.16 ClCCN(c1ccc(cc1)Cl)C Amb17338057 [0,1,0,0,0,0|3,0,0]=4 1265 B12R1.16 ClCCN(c1ccc(cc1)F)C Amb17335952 [0,1,0,0,0,0|3,0,0]=4 1266 B12R1.16 Clc1ccc(cc1)C(Br)CCBr Amb22001093 [0,1,0,0,0,0|3,0,0]=4 1267 B12R1.16 Clc1ccc(cc1)C(Br)CCCl Amb25089461 [0,1,0,0,0,0|3,0,0]=4 1268 B12R1.16 Fc1ccc(cc1)C(Br)CCCl Amb24741485 [0,1,0,0,0,0|3,0,0]=4 1269 B12R1.16 ICC[C@@H](c1ccc(cc1)F)O Amb16233257 [0,1,0,0,0,0|3,0,0]=4 1270 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [0,1,0,0,0,0|3,0,0]=4 1271 B12R1.16 N#CC[C@H](O)c1ccc(F)cc1 Amb24683357 [0,1,0,0,0,0|3,0,0]=4 1272 B12R1.16 NC(CC#N)c1ccc(Br)cc1 Amb18069916 [0,1,0,0,0,0|3,0,0]=4 1273 B12R1.16 NC(CC#N)c1ccc(Cl)cc1 Amb18564160 [0,1,0,0,0,0|3,0,0]=4 1274 B12R1.16 NC(CC#N)c1ccc(F)cc1 Amb18563605 [0,1,0,0,0,0|3,0,0]=4 1275 B12R1.16 NC(CCO)c1ccc(Cl)cc1 Amb19888463 [0,1,0,0,0,0|3,0,0]=4 1276 B12R1.16 NC(CCO)c1ccc(F)cc1 Amb22490662 [0,1,0,0,0,0|3,0,0]=4 1277 B12R1.16 NCCC(F)c1ccc(Br)cc1 Amb25255565 [0,1,0,0,0,0|3,0,0]=4 1278 B12R1.16 NCCC(N)c1ccc(Br)cc1 Amb24655128 [0,1,0,0,0,0|3,0,0]=4 1279 B12R1.16 NCCC(N)c1ccc(F)cc1 Amb18646990 [0,1,0,0,0,0|3,0,0]=4 1280 B12R1.16 NCCC(N)c1ccc(I)cc1 Amb25339716 [0,1,0,0,0,0|3,0,0]=4 1281 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [0,1,0,0,0,0|3,0,0]=4 1282 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [0,1,0,0,0,0|3,0,0]=4 1283 B12R1.16 NCCC(c1ccc(cc1)Br)O Amb17079141 [0,1,0,0,0,0|3,0,0]=4 1284 B12R1.16 NCCC(c1ccc(cc1)C)O Amb17079132 [0,1,0,0,0,0|3,0,0]=4 1285 B12R1.16 NCCC(c1ccc(cc1)Cl)O Amb17079140 [0,1,0,0,0,0|3,0,0]=4 1286 B12R1.16 NCCC(c1ccc(cc1)F)O Amb17079139 [0,1,0,0,0,0|3,0,0]=4 1287 B12R1.16 NCCN(c1ccc(cc1)Br)C Amb17059648 [0,1,0,0,0,0|3,0,0]=4 1288 B12R1.16 NCCN(c1ccc(cc1)C)C Amb13893182 [0,1,0,0,0,0|3,0,0]=4 1289 B12R1.16 NCCN(c1ccc(cc1)Cl)C Amb17059647 [0,1,0,0,0,0|3,0,0]=4 1290 B12R1.16 NCCN(c1ccc(cc1)F)C Amb17059644 [0,1,0,0,0,0|3,0,0]=4 1291 B12R1.16 NCC[C@@H](N)c1ccc(Br)cc1 Amb24655137 [0,1,0,0,0,0|3,0,0]=4 1292 B12R1.16 NCC[C@@H](N)c1ccc(F)cc1 Amb24549962 [0,1,0,0,0,0|3,0,0]=4 1293 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [0,1,0,0,0,0|3,0,0]=4 1294 B12R1.16 NCC[C@H](N)c1ccc(Br)cc1 Amb24617766 [0,1,0,0,0,0|3,0,0]=4 1295 B12R1.16 NCC[C@H](N)c1ccc(F)cc1 Amb25314561 [0,1,0,0,0,0|3,0,0]=4 1296 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [0,1,0,0,0,0|3,0,0]=4 1297 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [0,1,0,0,0,0|3,0,0]=4 1298 B12R1.16 NNCC(c1ccc(cc1)Br)O Amb17249280 [0,1,0,0,0,0|2,0,0]=3 1299 B12R1.16 NNCC(c1ccc(cc1)C)O Amb17232610 [0,1,0,0,0,0|2,0,0]=3 1300 B12R1.16 NNCC(c1ccc(cc1)Cl)O Amb17234362 [0,1,0,0,0,0|2,0,0]=3 1301 B12R1.16 NNCC(c1ccc(cc1)F)O Amb17232743 [0,1,0,0,0,0|2,0,0]=3 1302 B12R1.16 NOCC(c1ccc(cc1)Br)O Amb17345008 [0,1,0,0,0,0|3,0,0]=4 1303 B12R1.16 NOCC(c1ccc(cc1)C)O Amb17334705 [0,1,0,0,0,0|3,0,0]=4 1304 B12R1.16 NOCC(c1ccc(cc1)Cl)O Amb17335950 [0,1,0,0,0,0|3,0,0]=4 1305 B12R1.16 NOCC(c1ccc(cc1)F)O Amb17334839 [0,1,0,0,0,0|3,0,0]=4 1306 B12R1.16 N[C@@H](CC#N)c1ccc(Cl)cc1 Amb25679689 [0,1,0,0,0,0|3,0,0]=4 1307 B12R1.16 N[C@@H](CC#N)c1ccc(F)cc1 Amb24458202 [0,1,0,0,0,0|3,0,0]=4 1308 B12R1.16 N[C@@H](CC#N)c1ccc(O)cc1 Amb25107906 [0,1,0,0,0,0|3,0,0]=4 1309 B12R1.16 N[C@@H](CC#N)c1ccc(S)cc1 Amb25359865 [0,1,0,0,0,0|3,0,0]=4 1310 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb19888405 [0,1,0,0,0,0|3,0,0]=4 1311 B12R1.16 N[C@@H](CCO)c1ccc(Cl)cc1 Amb22747365 [0,1,0,0,0,0|3,0,0]=4 1312 B12R1.16 N[C@@H](CCO)c1ccc(F)cc1 Amb19888378 [0,1,0,0,0,0|3,0,0]=4 1313 B12R1.16 N[C@@H](CCO)c1ccc(O)cc1 Amb24446583 [0,1,0,0,0,0|3,0,0]=4 1314 B12R1.16 N[C@H](CC#N)c1ccc(Cl)cc1 Amb25149820 [0,1,0,0,0,0|3,0,0]=4 1315 B12R1.16 N[C@H](CC#N)c1ccc(F)cc1 Amb25092307 [0,1,0,0,0,0|3,0,0]=4 1316 B12R1.16 N[C@H](CC#N)c1ccc(S)cc1 Amb24485695 [0,1,0,0,0,0|3,0,0]=4 1317 B12R1.16 N[C@H](CCO)c1ccc(Br)cc1 Amb19887638 [0,1,0,0,0,0|3,0,0]=4 1318 B12R1.16 N[C@H](CCO)c1ccc(Cl)cc1 Amb19887657 [0,1,0,0,0,0|3,0,0]=4 1319 B12R1.16 N[C@H](CCO)c1ccc(F)cc1 Amb19887667 [0,1,0,0,0,0|3,0,0]=4 1320 B12R1.16 N[C@H](CCO)c1ccc(O)cc1 Amb25339383 [0,1,0,0,0,0|3,0,0]=4 1321 B12R1.16 N[C@H](CCO)c1ccc(S)cc1 Amb25824151 [0,1,0,0,0,0|3,0,0]=4 1322 B12R1.16 Nc1ccc(cc1)C(N)CCO Amb19887602 [0,1,0,0,0,0|3,0,0]=4 1323 B12R1.16 Nc1ccc(cc1)[C@@H](N)CC#N Amb24703347 [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.16 Nc1ccc(cc1)[C@H](N)CCO Amb19887604 [0,1,0,0,0,0|3,0,0]=4 1325 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [0,1,0,0,0,0|3,0,0]=4 1327 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [0,1,0,0,0,0|3,0,0]=4 1328 B12R1.16 OC(c1ccc(cc1)C)CC#N Amb17232362 [0,1,0,0,0,0|3,0,0]=4 1329 B12R1.16 OC(c1ccc(cc1)F)CC#N Amb17232518 [0,1,0,0,0,0|3,0,0]=4 1330 B12R1.16 OCCC(Cl)c1ccc(Cl)cc1 Amb24752170 [0,1,0,0,0,0|3,0,0]=4 1331 B12R1.16 OCCC(F)c1ccc(F)cc1 Amb25158049 [0,1,0,0,0,0|3,0,0]=4 1332 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [0,1,0,0,0,0|3,0,0]=4 1333 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [0,1,0,0,0,0|3,0,0]=4 1335 B12R1.16 OCCC(c1ccc(cc1)Br)C Amb17248426 [0,1,0,0,0,0|2,0,0]=3 1336 B12R1.16 OCCC(c1ccc(cc1)C)C Amb17232490 [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.16 OCCC(c1ccc(cc1)C)N Amb17103955 [0,1,0,0,0,0|3,0,0]=4 1338 B12R1.16 OCCC(c1ccc(cc1)Cl)C Amb17234157 [0,1,0,0,0,0|2,0,0]=3 1339 B12R1.16 OCCC(c1ccc(cc1)Cl)N Amb1993959 [0,1,0,0,0,0|3,0,0]=4 1340 B12R1.16 OCCC(c1ccc(cc1)F)C Amb17232668 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.16 OCCN(c1ccc(cc1)Br)C Amb17344450 [0,1,0,0,0,0|3,0,0]=4 1342 B12R1.16 OCCN(c1ccc(cc1)C)C Amb17334645 [0,1,0,0,0,0|3,0,0]=4 1343 B12R1.16 OCCN(c1ccc(cc1)Cl)C Amb17335812 [0,1,0,0,0,0|3,0,0]=4 1344 B12R1.16 OCCN(c1ccc(cc1)F)C Amb17334764 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [0,1,0,0,0,0|3,0,0]=4 1346 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [0,1,0,0,0,0|3,0,0]=4 1347 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [0,1,0,0,0,0|3,0,0]=4 1348 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [0,1,0,0,0,0|3,0,0]=4 1349 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [0,1,0,0,0,0|2,0,0]=3 1350 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [0,1,0,0,0,0|2,0,0]=3 1352 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [0,1,0,0,0,0|2,0,0]=3 1354 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [0,1,0,0,0,0|3,0,0]=4 1355 B12R1.16 O[C@H](CCCl)c1ccc(F)cc1 Amb24711502 [0,1,0,0,0,0|3,0,0]=4 1356 B12R1.16 [C-]#[N+]CC(Cl)c1ccc(Cl)cc1 Amb25086191 [0,1,0,0,0,0|1,0,2]=4 1357 B12R1.17 C#CCC(N)c1cccc(Br)c1 Amb24387869 [0,1,0,0,0,0|2,0,1]=4 1358 B12R1.17 C#CCC(N)c1cccc(Cl)c1 Amb18809278 [0,1,0,0,0,0|2,0,1]=4 1359 B12R1.17 C#CCC(N)c1cccc(F)c1 Amb18959768 [0,1,0,0,0,0|2,0,1]=4 1360 B12R1.17 C#CCC(O)c1cc(O)ccc1 Amb18117926 [0,1,0,0,0,0|2,0,1]=4 1361 B12R1.17 C#CCC(O)c1cccc(Cl)c1 Amb18186757 [0,1,0,0,0,0|2,0,1]=4 1362 B12R1.17 C#CCC(O)c1cccc(F)c1 Amb18800773 [0,1,0,0,0,0|2,0,1]=4 1363 B12R1.17 C#CCC(O)c1cccc(N)c1 Amb24650876 [0,1,0,0,0,0|2,0,1]=4 1364 B12R1.17 C#CC[C@H](O)c1cc(O)ccc1 Amb25767097 [0,1,0,0,0,0|2,0,1]=4 1365 B12R1.17 C#CC[C@H](O)c1cccc(Cl)c1 Amb25788894 [0,1,0,0,0,0|2,0,1]=4 1366 B12R1.17 C=CCC(N)c1cc(N)ccc1 Amb24417276 [0,1,0,0,0,0|2,0,1]=4 1367 B12R1.17 C=CCC(N)c1cccc(Br)c1 Amb18292095 [0,1,0,0,0,0|2,0,1]=4 1368 B12R1.17 C=CCC(N)c1cccc(Cl)c1 Amb18292091 [0,1,0,0,0,0|2,0,1]=4 1369 B12R1.17 C=CCC(N)c1cccc(F)c1 Amb18977587 [0,1,0,0,0,0|2,0,1]=4 1370 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [0,1,0,0,0,0|2,0,1]=4 1371 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [0,1,0,0,0,0|2,0,1]=4 1372 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [0,1,0,0,0,0|2,0,1]=4 1373 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb19929879 [0,1,0,0,0,0|2,0,1]=4 1374 B12R1.17 C=CC[C@@H](N)c1cccc(Br)c1 Amb22831442 [0,1,0,0,0,0|2,0,1]=4 1375 B12R1.17 C=CC[C@@H](N)c1cccc(Cl)c1 Amb22831578 [0,1,0,0,0,0|2,0,1]=4 1376 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [0,1,0,0,0,0|2,0,1]=4 1377 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [0,1,0,0,0,0|2,0,1]=4 1378 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [0,1,0,0,0,0|2,0,1]=4 1379 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb19929880 [0,1,0,0,0,0|2,0,1]=4 1380 B12R1.17 C=CC[C@H](N)c1cccc(Br)c1 Amb25221639 [0,1,0,0,0,0|2,0,1]=4 1381 B12R1.17 C=CC[C@H](N)c1cccc(Cl)c1 Amb25775422 [0,1,0,0,0,0|2,0,1]=4 1382 B12R1.17 C=CC[C@H](N)c1cccc(I)c1 Amb25784765 [0,1,0,0,0,0|2,0,1]=4 1383 B12R1.17 C=CC[C@H](N)c1cccc(O)c1 Amb24487270 [0,1,0,0,0,0|2,0,1]=4 1384 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [0,1,0,0,0,0|2,0,1]=4 1385 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [0,1,0,0,0,0|2,0,1]=4 1386 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [0,1,0,0,0,0|2,0,1]=4 1387 B12R1.17 CC#CC(O)c1cc(I)ccc1 Amb25064927 [0,1,0,0,0,0|2,0,1]=4 1388 B12R1.17 CC(CC#N)c1cccc(Br)c1 Amb24645330 [0,1,0,0,0,0|2,0,0]=3 1389 B12R1.17 CC(CC#N)c1cccc(F)c1 Amb24732112 [0,1,0,0,0,0|2,0,0]=3 1390 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.17 CC(CCBr)c1cccc(Cl)c1 Amb25751472 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.17 CC(CCN)c1c[n]cc(F)c1 Amb25068199 [0,1,0,0,0,0|3,0,0]=4 1393 B12R1.17 CC(N=C=O)c1cccc(Br)c1 Amb25045945 [0,1,0,0,0,0|3,0,0]=4 1394 B12R1.17 CC(N=C=O)c1cccc(Cl)c1 Amb25189503 [0,1,0,0,0,0|3,0,0]=4 1395 B12R1.17 CC(N=C=O)c1cccc(F)c1 Amb25782325 [0,1,0,0,0,0|3,0,0]=4 1396 B12R1.17 CC(N=C=O)c1cccc(O)c1 Amb25253119 [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.17 CC(N=C=S)c1cccc(Cl)c1 Amb18321565 [0,1,0,0,0,0|3,0,0]=4 1398 B12R1.17 CC(N=C=S)c1cccc(F)c1 Amb18796432 [0,1,0,0,0,0|3,0,0]=4 1399 B12R1.17 CC(N=[N+]=[N-])c1cccc(F)c1 Amb24414933 [0,1,0,0,0,0|2,0,1]=4 1400 B12R1.17 CC(NC#N)c1cccc(Br)c1 Amb24565626 [0,1,0,0,0,0|3,0,0]=4 1401 B12R1.17 CC(NC#N)c1cccc(Cl)c1 Amb18809455 [0,1,0,0,0,0|3,0,0]=4 1402 B12R1.17 CC(NC#N)c1cccc(F)c1 Amb18800783 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.17 CC(NC#N)c1cccc(O)c1 Amb24608412 [0,1,0,0,0,0|3,0,0]=4 1404 B12R1.17 CC(NC=O)c1cccc(Cl)c1 Amb25042206 [0,1,0,0,0,0|3,0,0]=4 1405 B12R1.17 CC(NC=O)c1cccc(F)c1 Amb24432563 [0,1,0,0,0,0|3,0,0]=4 1406 B12R1.17 CC(NC=O)c1cccc(O)c1 Amb24406138 [0,1,0,0,0,0|3,0,0]=4 1407 B12R1.17 CC(NCC)c1c[n]cc(F)c1 Amb18978755 [0,1,0,0,0,0|3,0,0]=4 1408 B12R1.17 CC(NCC)c1cc[n]c(F)c1 Amb25796156 [0,1,0,0,0,0|3,0,0]=4 1409 B12R1.17 CC(NCC)c1cc[n]c(O)c1 Amb24539260 [0,1,0,0,0,0|3,0,0]=4 1410 B12R1.17 CC(\C=N\N)c1cccc(Br)c1 Amb24473846 [0,1,0,0,0,0|1,0,2]=4 1411 B12R1.17 CC(\C=N\N)c1cccc(Cl)c1 Amb25285373 [0,1,0,0,0,0|1,0,2]=4 1412 B12R1.17 CCCC(=O)c1cc(I)ccc1 Amb24424807 [0,1,0,0,0,0|2,0,1]=4 1413 B12R1.17 CCCC(=O)c1cc(N)ccc1 Amb22730482 [0,1,0,0,0,0|2,0,1]=4 1414 B12R1.17 CCCC(=O)c1cc(O)ccc1 Amb24736503 [0,1,0,0,0,0|2,0,1]=4 1415 B12R1.17 CCCC(=O)c1cccc(c1)Br Amb17193987 [0,1,0,0,0,0|2,0,1]=4 1416 B12R1.17 CCCC(=O)c1cccc(c1)Cl Amb17198744 [0,1,0,0,0,0|2,0,1]=4 1417 B12R1.17 CCCC(=O)c1cccc(c1)F Amb17232581 [0,1,0,0,0,0|2,0,1]=4 1418 B12R1.17 CCCC(C)C=1NC(=O)C=CN1 Amb24600516 [0,1,0,0,0,0|3,0,0]=4 1419 B12R1.17 CCCC(C)c1[n]c(N)cc[n]1 Amb24532215 [0,1,0,0,0,0|3,0,0]=4 1420 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [0,1,0,0,0,0|1,0,0]=2 1421 B12R1.17 CCCC(Cl)c1c[n]cc(F)c1 Amb25682732 [0,1,0,0,0,0|3,0,0]=4 1422 B12R1.17 CCCC(N)c1c[n]cc(Cl)c1 Amb24487263 [0,1,0,0,0,0|3,0,0]=4 1423 B12R1.17 CCCC(N)c1c[n]cc(F)c1 Amb18978747 [0,1,0,0,0,0|3,0,0]=4 1424 B12R1.17 CCCC(N)c1c[n]cc(N)c1 Amb24523044 [0,1,0,0,0,0|3,0,0]=4 1425 B12R1.17 CCCC(N)c1cc(Br)cc[n]1 Amb24483864 [0,1,0,0,0,0|3,0,0]=4 1426 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [0,1,0,0,0,0|2,0,0]=3 1427 B12R1.17 CCCC(N)c1cccc(Br)[n]1 Amb25800145 [0,1,0,0,0,0|3,0,0]=4 1428 B12R1.17 CCCC(N)c1cccc(F)[n]1 Amb18199297 [0,1,0,0,0,0|3,0,0]=4 1429 B12R1.17 CCCC(O)c1c[n]cc(Cl)c1 Amb25104366 [0,1,0,0,0,0|3,0,0]=4 1430 B12R1.17 CCCC(O)c1c[n]cc(F)c1 Amb18180201 [0,1,0,0,0,0|3,0,0]=4 1431 B12R1.17 CCCC(O)c1cc(Cl)cc[n]1 Amb25847785 [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [0,1,0,0,0,0|2,0,0]=3 1435 B12R1.17 CCCC(O)c1cccc(Br)[n]1 Amb25706154 [0,1,0,0,0,0|3,0,0]=4 1436 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [0,1,0,0,0,0|2,0,0]=3 1437 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [0,1,0,0,0,0|2,0,0]=3 1438 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [0,1,0,0,0,0|2,0,0]=3 1439 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [0,1,0,0,0,0|2,0,0]=3 1440 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [0,1,0,0,0,0|2,0,0]=3 1441 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [0,1,0,0,0,0|2,0,0]=3 1443 B12R1.17 CCCN(C)c1cc(N)cc[n]1 Amb18981480 [0,1,0,0,0,0|3,0,0]=4 1444 B12R1.17 CCCN(C)c1cc[n]c(F)c1 Amb24342141 [0,1,0,0,0,0|3,0,0]=4 1445 B12R1.17 CCCN(C)c1cccc(Br)c1 Amb25154384 [0,1,0,0,0,0|2,0,0]=3 1446 B12R1.17 CCCN(C)c1cccc(F)[n]1 Amb18177870 [0,1,0,0,0,0|3,0,0]=4 1447 B12R1.17 CCCN(C)c1cccc(F)c1 Amb25285140 [0,1,0,0,0,0|2,0,0]=3 1448 B12R1.17 CCCN(C)c1cccc(N)[n]1 Amb25366806 [0,1,0,0,0,0|3,0,0]=4 1449 B12R1.17 CCCN(C)c1cccc(O)c1 Amb18646357 [0,1,0,0,0,0|2,0,0]=3 1450 B12R1.17 CCC[C@@H](N)c1cc(Br)[n]cc1 Amb25055143 [0,1,0,0,0,0|3,0,0]=4 1451 B12R1.17 CCC[C@@H](N)c1cc(Br)cc[n]1 Amb24679998 [0,1,0,0,0,0|3,0,0]=4 1452 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [0,1,0,0,0,0|2,0,0]=3 1453 B12R1.17 CCC[C@@H](N)c1cc(Cl)[n]cc1 Amb24446987 [0,1,0,0,0,0|3,0,0]=4 1454 B12R1.17 CCC[C@@H](N)c1cc(Cl)cc[n]1 Amb24379650 [0,1,0,0,0,0|3,0,0]=4 1455 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [0,1,0,0,0,0|2,0,0]=3 1456 B12R1.17 CCC[C@@H](N)c1cc(F)[n]cc1 Amb25694340 [0,1,0,0,0,0|3,0,0]=4 1457 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [0,1,0,0,0,0|2,0,0]=3 1458 B12R1.17 CCC[C@@H](N)c1cc(N)[n]cc1 Amb25674867 [0,1,0,0,0,0|3,0,0]=4 1459 B12R1.17 CCC[C@@H](N)c1cc(N)cc[n]1 Amb25286779 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [0,1,0,0,0,0|2,0,0]=3 1461 B12R1.17 CCC[C@@H](N)c1cccc(Cl)[n]1 Amb24386087 [0,1,0,0,0,0|3,0,0]=4 1462 B12R1.17 CCC[C@@H](N)c1cccc(N)[n]1 Amb25372021 [0,1,0,0,0,0|3,0,0]=4 1463 B12R1.17 CCC[C@@H](O)c1c[n]cc(Br)c1 Amb25763374 [0,1,0,0,0,0|3,0,0]=4 1464 B12R1.17 CCC[C@@H](O)c1cc(Cl)cc[n]1 Amb25156889 [0,1,0,0,0,0|3,0,0]=4 1465 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [0,1,0,0,0,0|2,0,0]=3 1466 B12R1.17 CCC[C@H](N)c1c[n]cc(Br)c1 Amb24680148 [0,1,0,0,0,0|3,0,0]=4 1467 B12R1.17 CCC[C@H](N)c1c[n]cc(Cl)c1 Amb25063767 [0,1,0,0,0,0|3,0,0]=4 1468 B12R1.17 CCC[C@H](N)c1c[n]cc(N)c1 Amb25330227 [0,1,0,0,0,0|3,0,0]=4 1469 B12R1.17 CCC[C@H](N)c1cc(Br)[n]cc1 Amb24427757 [0,1,0,0,0,0|3,0,0]=4 1470 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [0,1,0,0,0,0|2,0,0]=3 1471 B12R1.17 CCC[C@H](N)c1cc(F)[n]cc1 Amb24761412 [0,1,0,0,0,0|3,0,0]=4 1472 B12R1.17 CCC[C@H](N)c1cc(O)[n]cc1 Amb24484170 [0,1,0,0,0,0|3,0,0]=4 1473 B12R1.17 CCC[C@H](N)c1cccc(F)[n]1 Amb25113431 [0,1,0,0,0,0|3,0,0]=4 1474 B12R1.17 CCC[C@H](O)c1c[n]cc(Br)c1 Amb24704858 [0,1,0,0,0,0|3,0,0]=4 1475 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.17 CCNC(C)c1cccc(I)c1 Amb25061694 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.17 CCNC(C)c1cccc(S)c1 Amb25798719 [0,1,0,0,0,0|2,0,0]=3 1478 B12R1.17 CCN[C@@H](C)c1cccc(Cl)c1 Amb25081589 [0,1,0,0,0,0|2,0,0]=3 1479 B12R1.17 CCN[C@H](C)c1cccc(Br)c1 Amb25075777 [0,1,0,0,0,0|2,0,0]=3 1480 B12R1.17 CCN[C@H](C)c1cccc(Cl)c1 Amb25067502 [0,1,0,0,0,0|2,0,0]=3 1481 B12R1.17 CCOC(C)c1cc(Cl)cc[n]1 Amb24458654 [0,1,0,0,0,0|3,0,0]=4 1482 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [0,1,0,0,0,0|2,0,0]=3 1483 B12R1.17 CCOC(Cl)c1cccc(F)c1 Amb24429076 [0,1,0,0,0,0|3,0,0]=4 1484 B12R1.17 CCSC(C)c1cccc(Cl)c1 Amb25036538 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.17 CCSC(C)c1cccc(N)c1 Amb18973995 [0,1,0,0,0,0|2,0,0]=3 1486 B12R1.17 CN(CC#C)c1cccc(Br)c1 Amb25160249 [0,1,0,0,0,0|2,0,1]=4 1487 B12R1.17 CN(CC#C)c1cccc(F)c1 Amb18788177 [0,1,0,0,0,0|2,0,1]=4 1488 B12R1.17 CN(CC#C)c1cccc(N)c1 Amb24600436 [0,1,0,0,0,0|2,0,1]=4 1489 B12R1.17 CN(CC#N)c1cccc(N)c1 Amb18952694 [0,1,0,0,0,0|3,0,0]=4 1490 B12R1.17 CN(CC=C)c1cccc(O)c1 Amb25723219 [0,1,0,0,0,0|2,0,1]=4 1491 B12R1.17 CN(CC=O)c1cccc(F)c1 Amb18788558 [0,1,0,0,0,0|3,0,0]=4 1492 B12R1.17 CN(CCBr)c1cccc(Cl)c1 Amb25854316 [0,1,0,0,0,0|3,0,0]=4 1493 B12R1.17 CN(CCBr)c1cccc(F)c1 Amb22886711 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.17 CN(CCI)c1cccc(Br)c1 Amb25680335 [0,1,0,0,0,0|3,0,0]=4 1495 B12R1.17 CN(CCI)c1cccc(F)c1 Amb24732661 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.17 CN(CCI)c1cccc(O)c1 Amb24397741 [0,1,0,0,0,0|3,0,0]=4 1497 B12R1.17 CN(CCN)c1cc(Br)ccc1 Amb24525334 [0,1,0,0,0,0|3,0,0]=4 1498 B12R1.17 CN(CCN)c1cc(O)ccc1 Amb25804629 [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.17 CNCC(=O)c1cc(Cl)cc[n]1 Amb24653655 [0,1,0,0,0,0|2,0,1]=4 1500 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [0,1,0,0,0,0|1,0,1]=3 1501 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [0,1,0,0,0,0|1,0,1]=3 1502 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [0,1,0,0,0,0|1,0,1]=3 1503 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [0,1,0,0,0,0|1,0,1]=3 1504 B12R1.17 CNCC(=O)c1cccc(c1)Br Amb17315041 [0,1,0,0,0,0|1,0,1]=3 1505 B12R1.17 CNCC(=O)c1cccc(c1)O Amb16231895 [0,1,0,0,0,0|1,0,1]=3 1506 B12R1.17 CNCC(=O)c1cccc(c1)O Amb17619313 [0,1,0,0,0,0|1,0,1]=3 1507 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [0,1,0,0,0,0|0,0,0]=1 1508 B12R1.17 CNCC(Cl)c1cccc(F)c1 Amb24635680 [0,1,0,0,0,0|1,0,0]=2 1509 B12R1.17 CNCC(O)c1c[n]cc(Br)c1 Amb23586082 [0,1,0,0,0,0|2,0,0]=3 1510 B12R1.17 CNCC(O)c1c[n]cc(F)c1 Amb25787544 [0,1,0,0,0,0|2,0,0]=3 1511 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [0,1,0,0,0,0|1,0,0]=2 1512 B12R1.17 CNCC(O)c1cccc(I)c1 Amb25121468 [0,1,0,0,0,0|1,0,0]=2 1513 B12R1.17 CNCC(c1cccc(c1)Br)O Amb17142607 [0,1,0,0,0,0|1,0,0]=2 1514 B12R1.17 CNCC(c1cccc(c1)N)O Amb17594135 [0,1,0,0,0,0|1,0,0]=2 1515 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb19133645 [0,1,0,0,0,0|1,0,0]=2 1516 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb22799790 [0,1,0,0,0,0|1,0,0]=2 1517 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [0,1,0,0,0,0|0,0,0]=1 1518 B12R1.17 CNC[C@H](O)c1cc(O)ccc1 Amb22168059 [0,1,0,0,0,0|1,0,0]=2 1519 B12R1.17 CNC[C@H](c1cccc(c1)O)O Amb16231685 [0,1,0,0,0,0|1,0,0]=2 1520 B12R1.17 COCC(C)c1[n]c(Cl)cc[n]1 Amb25702607 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.17 COCC(C)c1[n]c(N)cc[n]1 Amb25667489 [0,1,0,0,0,0|3,0,0]=4 1522 B12R1.17 COCC(F)c1cccc(O)c1 Amb25283248 [0,1,0,0,0,0|2,0,0]=3 1523 B12R1.17 COCC(N)c1c[n]cc(Br)c1 Amb24696546 [0,1,0,0,0,0|3,0,0]=4 1524 B12R1.17 COCC(N)c1c[n]cc(F)c1 Amb18979039 [0,1,0,0,0,0|3,0,0]=4 1525 B12R1.17 COCC(N)c1c[n]cc(O)c1 Amb25843785 [0,1,0,0,0,0|3,0,0]=4 1526 B12R1.17 COCC(N)c1cc(Br)cc[n]1 Amb24573063 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.17 COCC(N)c1cc(N)[n]cc1 Amb25836376 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.17 COCC(N)c1cc(N)c[n]c1 Amb24502101 [0,1,0,0,0,0|3,0,0]=4 1529 B12R1.17 COCC(N)c1cc[n]c(Br)c1 Amb25055633 [0,1,0,0,0,0|3,0,0]=4 1530 B12R1.17 COCC(N)c1cccc(Br)[n]1 Amb24367173 [0,1,0,0,0,0|3,0,0]=4 1531 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.17 COCC(N)c1cccc(F)[n]1 Amb24715729 [0,1,0,0,0,0|3,0,0]=4 1533 B12R1.17 COCC(N)c1cccc(I)c1 Amb25034579 [0,1,0,0,0,0|2,0,0]=3 1534 B12R1.17 COCC(N)c1cccc(N)[n]1 Amb24763585 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.17 COCC(N)c1cccc(O)c1 Amb24378072 [0,1,0,0,0,0|2,0,0]=3 1536 B12R1.17 COCC(N)c1cccc(S)c1 Amb24428810 [0,1,0,0,0,0|2,0,0]=3 1537 B12R1.17 COCC(O)c1c[n]cc(F)c1 Amb18180316 [0,1,0,0,0,0|3,0,0]=4 1538 B12R1.17 COCC(O)c1cccc(Cl)c1 Amb19076385 [0,1,0,0,0,0|2,0,0]=3 1539 B12R1.17 COCC(O)c1cccc(F)c1 Amb18793594 [0,1,0,0,0,0|2,0,0]=3 1540 B12R1.17 COCC(c1cccc(c1)N)O Amb13952267 [0,1,0,0,0,0|2,0,0]=3 1541 B12R1.17 COCS(=O)c1cccc(F)c1 Amb24487397 [0,1,0,0,0,0|3,0,0]=4 1542 B12R1.17 COC[C@@H](N)c1c[n]cc(Br)c1 Amb25150004 [0,1,0,0,0,0|3,0,0]=4 1543 B12R1.17 COC[C@@H](N)c1c[n]cc(Cl)c1 Amb25707582 [0,1,0,0,0,0|3,0,0]=4 1544 B12R1.17 COC[C@@H](N)c1cc(Br)cc[n]1 Amb25148887 [0,1,0,0,0,0|3,0,0]=4 1545 B12R1.17 COC[C@@H](N)c1cc(Cl)cc[n]1 Amb25116657 [0,1,0,0,0,0|3,0,0]=4 1546 B12R1.17 COC[C@@H](N)c1cc(F)cc[n]1 Amb24591578 [0,1,0,0,0,0|3,0,0]=4 1547 B12R1.17 COC[C@@H](N)c1cc(N)c[n]c1 Amb24670278 [0,1,0,0,0,0|3,0,0]=4 1548 B12R1.17 COC[C@@H](N)c1cc(N)ccc1 Amb25132108 [0,1,0,0,0,0|2,0,0]=3 1549 B12R1.17 COC[C@@H](N)c1cc[n]c(Br)c1 Amb24483679 [0,1,0,0,0,0|3,0,0]=4 1550 B12R1.17 COC[C@@H](N)c1cc[n]c(Cl)c1 Amb24424982 [0,1,0,0,0,0|3,0,0]=4 1551 B12R1.17 COC[C@@H](N)c1cccc(Br)[n]1 Amb25378640 [0,1,0,0,0,0|3,0,0]=4 1552 B12R1.17 COC[C@@H](N)c1cccc(Br)c1 Amb25669519 [0,1,0,0,0,0|2,0,0]=3 1553 B12R1.17 COC[C@@H](N)c1cccc(Cl)c1 Amb24670292 [0,1,0,0,0,0|2,0,0]=3 1554 B12R1.17 COC[C@@H](N)c1cccc(F)c1 Amb25794807 [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.17 COC[C@@H](N)c1cccc(N)[n]1 Amb24351683 [0,1,0,0,0,0|3,0,0]=4 1556 B12R1.17 COC[C@@H](N)c1cccc(O)[n]1 Amb24581247 [0,1,0,0,0,0|3,0,0]=4 1557 B12R1.17 COC[C@@H](N)c1cccc(O)c1 Amb25809467 [0,1,0,0,0,0|2,0,0]=3 1558 B12R1.17 COC[C@H](N)c1c[n]cc(F)c1 Amb24488625 [0,1,0,0,0,0|3,0,0]=4 1559 B12R1.17 COC[C@H](N)c1cc(Cl)cc[n]1 Amb25669449 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.17 COC[C@H](N)c1cc(N)[n]cc1 Amb24488626 [0,1,0,0,0,0|3,0,0]=4 1561 B12R1.17 COC[C@H](N)c1cc(N)c[n]c1 Amb25081582 [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.17 COC[C@H](N)c1cc(N)cc[n]1 Amb24488624 [0,1,0,0,0,0|3,0,0]=4 1563 B12R1.17 COC[C@H](N)c1cc(N)ccc1 Amb24360714 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.17 COC[C@H](N)c1cc[n]c(Cl)c1 Amb25324311 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.17 COC[C@H](N)c1cc[n]c(O)c1 Amb25719575 [0,1,0,0,0,0|3,0,0]=4 1566 B12R1.17 COC[C@H](N)c1cccc(I)c1 Amb25691760 [0,1,0,0,0,0|2,0,0]=3 1567 B12R1.17 COC[C@H](N)c1cccc(N)[n]1 Amb25189386 [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.17 COC[C@H](N)c1cccc(O)[n]1 Amb25839409 [0,1,0,0,0,0|3,0,0]=4 1569 B12R1.17 CONC(C)c1cccc(Br)c1 Amb25097009 [0,1,0,0,0,0|2,0,0]=3 1570 B12R1.17 CONC(C)c1cccc(F)c1 Amb24429508 [0,1,0,0,0,0|2,0,0]=3 1571 B12R1.17 CONC(C)c1cccc(O)c1 Amb24372902 [0,1,0,0,0,0|2,0,0]=3 1572 B12R1.17 CSCC(=O)c1cccc(Br)c1 Amb25149784 [0,1,0,0,0,0|2,0,1]=4 1573 B12R1.17 CSCC(=O)c1cccc(Cl)c1 Amb18320097 [0,1,0,0,0,0|2,0,1]=4 1574 B12R1.17 CSCC(=O)c1cccc(F)c1 Amb19057446 [0,1,0,0,0,0|2,0,1]=4 1575 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [0,1,0,0,0,0|1,0,0]=2 1576 B12R1.17 CSCC(N)c1c[n]cc(F)c1 Amb18300372 [0,1,0,0,0,0|3,0,0]=4 1577 B12R1.17 CSCC(N)c1cccc(Cl)c1 Amb18995356 [0,1,0,0,0,0|2,0,0]=3 1578 B12R1.17 CSCC(N)c1cccc(F)c1 Amb18995351 [0,1,0,0,0,0|2,0,0]=3 1579 B12R1.17 CSCC(O)c1c[n]cc(F)c1 Amb19070729 [0,1,0,0,0,0|3,0,0]=4 1580 B12R1.17 CSCC(O)c1cccc(F)c1 Amb19070007 [0,1,0,0,0,0|2,0,0]=3 1581 B12R1.17 CSCC(O)c1cccc(N)c1 Amb18296181 [0,1,0,0,0,0|2,0,0]=3 1582 B12R1.17 C[C@@H](N=[N+]=[N-])c1cccc(Br)c1 Amb24671071 [0,1,0,0,0,0|2,0,1]=4 1583 B12R1.17 C[C@@H](NC#N)c1cccc(F)c1 Amb25834654 [0,1,0,0,0,0|3,0,0]=4 1584 B12R1.17 C[C@@H](NC=O)c1cccc(Br)c1 Amb24342087 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.17 C[C@@H](NC=O)c1cccc(Cl)c1 Amb25708277 [0,1,0,0,0,0|3,0,0]=4 1586 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [0,1,0,0,0,0|2,0,0]=3 1587 B12R1.17 C[C@H](NC#N)c1cccc(F)c1 Amb24712714 [0,1,0,0,0,0|3,0,0]=4 1588 B12R1.17 C[C@H](NC=O)c1cccc(Br)c1 Amb24525072 [0,1,0,0,0,0|3,0,0]=4 1589 B12R1.17 C[C@H](NC=O)c1cccc(F)c1 Amb25844630 [0,1,0,0,0,0|3,0,0]=4 1590 B12R1.17 C\C(=N/NC)\c1cc(O)ccc1 Amb24646585 [0,1,0,0,0,0|1,0,1]=3 1591 B12R1.17 C\C(=N/OC)\c1cc(O)ccc1 Amb25347420 [0,1,0,0,0,0|2,0,1]=4 1592 B12R1.17 C\C(=N\NC)\c1cc(Cl)ccc1 Amb25236437 [0,1,0,0,0,0|1,0,1]=3 1593 B12R1.17 C\C(=N\NC)\c1cc(O)ccc1 Amb25788840 [0,1,0,0,0,0|1,0,1]=3 1594 B12R1.17 Cc1c[n]cc([n]1)C(O)CNC Amb24579216 [0,1,0,0,0,0|3,0,0]=4 1595 B12R1.17 Cc1c[n]cc(c1)C(=O)CNC Amb25041572 [0,1,0,0,0,0|2,0,1]=4 1596 B12R1.17 Cc1c[n]cc(c1)C(N)CSC Amb24720741 [0,1,0,0,0,0|3,0,0]=4 1597 B12R1.17 Cc1c[n]cc(c1)C(O)CSC Amb24753350 [0,1,0,0,0,0|3,0,0]=4 1598 B12R1.17 Cc1c[n]cc(c1)[C@@H](N)CCC Amb25824214 [0,1,0,0,0,0|3,0,0]=4 1599 B12R1.17 Cc1c[n]cc(c1)[C@H](N)CCC Amb25727231 [0,1,0,0,0,0|3,0,0]=4 1600 B12R1.17 Cc1c[n]cc(c1)[C@H](N)COC Amb25064359 [0,1,0,0,0,0|3,0,0]=4 1601 B12R1.17 Cc1cc(cc[n]1)C(C)NCC Amb25704930 [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.17 Cc1cc(cc[n]1)C(O)CCC Amb25331562 [0,1,0,0,0,0|3,0,0]=4 1603 B12R1.17 Cc1cc(cc[n]1)[C@@H](N)CCC Amb25324356 [0,1,0,0,0,0|3,0,0]=4 1604 B12R1.17 Cc1cc(cc[n]1)[C@@H](N)COC Amb24725581 [0,1,0,0,0,0|3,0,0]=4 1605 B12R1.17 Cc1cc(cc[n]1)[C@H](N)CCC Amb25104806 [0,1,0,0,0,0|3,0,0]=4 1606 B12R1.17 Cc1cc(ccc1)C(=O)CNC Amb18862586 [0,1,0,0,0,0|1,0,1]=3 1607 B12R1.17 Cc1cc(ccc1)C(=O)CSC Amb18796323 [0,1,0,0,0,0|2,0,1]=4 1608 B12R1.17 Cc1cc(ccc1)C(Cl)CCO Amb24355343 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.17 Cc1cc(ccc1)C(F)CCN Amb25043004 [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.17 Cc1cc(ccc1)C(N)CC#C Amb18800160 [0,1,0,0,0,0|2,0,1]=4 1611 B12R1.17 Cc1cc(ccc1)C(N)CC#N Amb18563499 [0,1,0,0,0,0|3,0,0]=4 1612 B12R1.17 Cc1cc(ccc1)C(N)CC=C Amb18977591 [0,1,0,0,0,0|2,0,1]=4 1613 B12R1.17 Cc1cc(ccc1)C(O)CC#C Amb18800364 [0,1,0,0,0,0|2,0,1]=4 1614 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [0,1,0,0,0,0|2,0,1]=4 1615 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [0,1,0,0,0,0|3,0,0]=4 1616 B12R1.17 Cc1cc(ccc1)C(O)CCCl Amb25725000 [0,1,0,0,0,0|3,0,0]=4 1617 B12R1.17 Cc1cc(ccc1)[C@@H](N)CC=C Amb25681927 [0,1,0,0,0,0|2,0,1]=4 1618 B12R1.17 Cc1cc(ccc1)[C@@H](N)CCO Amb19888371 [0,1,0,0,0,0|3,0,0]=4 1619 B12R1.17 Cc1cc(ccc1)[C@@H](O)CC#N Amb25092023 [0,1,0,0,0,0|3,0,0]=4 1620 B12R1.17 Cc1cc(ccc1)[C@H](N)CC=C Amb24392927 [0,1,0,0,0,0|2,0,1]=4 1621 B12R1.17 Cc1cc(ccc1)[C@H](N)CCN Amb24612216 [0,1,0,0,0,0|3,0,0]=4 1622 B12R1.17 Cc1cc(ccc1)[C@H](N)CCO Amb19887706 [0,1,0,0,0,0|3,0,0]=4 1623 B12R1.17 Cc1cc(ccc1)[C@H](O)CC#C Amb25157924 [0,1,0,0,0,0|2,0,1]=4 1624 B12R1.17 Cc1cc[n]c(c1)C(N)CCC Amb18828646 [0,1,0,0,0,0|3,0,0]=4 1625 B12R1.17 Cc1cc[n]c(c1)C(N)COC Amb24551069 [0,1,0,0,0,0|3,0,0]=4 1626 B12R1.17 Cc1cc[n]c(c1)C(O)CCC Amb24425208 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.17 Cc1cc[n]c(c1)C(O)COC Amb25115393 [0,1,0,0,0,0|3,0,0]=4 1628 B12R1.17 Cc1cc[n]c(c1)[C@@H](N)CCC Amb24548212 [0,1,0,0,0,0|3,0,0]=4 1629 B12R1.17 Cc1cc[n]c(c1)[C@@H](O)CCC Amb25848810 [0,1,0,0,0,0|3,0,0]=4 1630 B12R1.17 Cc1cc[n]c(c1)[C@H](N)CCC Amb24761470 [0,1,0,0,0,0|3,0,0]=4 1631 B12R1.17 Cc1cc[n]c(c1)[C@H](O)CCC Amb25048748 [0,1,0,0,0,0|3,0,0]=4 1632 B12R1.17 Cc1cccc([n]1)C(C)CCC Amb25847085 [0,1,0,0,0,0|2,0,0]=3 1633 B12R1.17 Cc1cccc([n]1)C(N)CCC Amb18828650 [0,1,0,0,0,0|3,0,0]=4 1634 B12R1.17 Cc1cccc([n]1)N(C)CCC Amb25182793 [0,1,0,0,0,0|3,0,0]=4 1635 B12R1.17 Cc1cccc([n]1)[C@@H](N)COC Amb24487326 [0,1,0,0,0,0|3,0,0]=4 1636 B12R1.17 Cc1cccc([n]1)[C@@H](O)CCC Amb25787490 [0,1,0,0,0,0|3,0,0]=4 1637 B12R1.17 Cc1cccc([n]1)[C@H](N)COC Amb25141970 [0,1,0,0,0,0|3,0,0]=4 1638 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [0,1,0,0,0,0|0,0,0]=1 1639 B12R1.17 Cc1cccc(c1)C(C)N=C=O Amb25160024 [0,1,0,0,0,0|3,0,0]=4 1640 B12R1.17 Cc1cccc(c1)C(C)NC=O Amb25274948 [0,1,0,0,0,0|3,0,0]=4 1641 B12R1.17 Cc1cccc(c1)C(C)SCC Amb25792019 [0,1,0,0,0,0|2,0,0]=3 1642 B12R1.17 Cc1cccc(c1)C(N)COC Amb18975558 [0,1,0,0,0,0|2,0,0]=3 1643 B12R1.17 Cc1cccc(c1)C(N)CSC Amb18995349 [0,1,0,0,0,0|2,0,0]=3 1644 B12R1.17 Cc1cccc(c1)C(O)C#CC Amb24619196 [0,1,0,0,0,0|2,0,1]=4 1645 B12R1.17 Cc1cccc(c1)C(O)COC Amb18792769 [0,1,0,0,0,0|2,0,0]=3 1646 B12R1.17 Cc1cccc(c1)C(O)CSC Amb19061294 [0,1,0,0,0,0|2,0,0]=3 1647 B12R1.17 Cc1cccc(c1)N(C)CC#C Amb18787878 [0,1,0,0,0,0|2,0,1]=4 1648 B12R1.17 Cc1cccc(c1)N(C)CC=O Amb18788187 [0,1,0,0,0,0|3,0,0]=4 1649 B12R1.17 Cc1cccc(c1)N(C)CCF Amb25057274 [0,1,0,0,0,0|3,0,0]=4 1650 B12R1.17 Cc1cccc(c1)N(C)CCI Amb25802690 [0,1,0,0,0,0|3,0,0]=4 1651 B12R1.17 Cc1cccc(c1)[C@@H](C)CCO Amb25155793 [0,1,0,0,0,0|2,0,0]=3 1652 B12R1.17 Cc1cccc(c1)[C@@H](C)NCC Amb24448414 [0,1,0,0,0,0|2,0,0]=3 1653 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [0,1,0,0,0,0|2,0,0]=3 1654 B12R1.17 Cc1cccc(c1)[C@H](C)NC=O Amb25141298 [0,1,0,0,0,0|3,0,0]=4 1655 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [0,1,0,0,0,0|2,0,0]=3 1656 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [0,1,0,0,0,0|2,0,0]=3 1657 B12R1.17 ClCCN(c1cccc(c1)Br)C Amb17351920 [0,1,0,0,0,0|3,0,0]=4 1658 B12R1.17 ClCCN(c1cccc(c1)C)C Amb17335671 [0,1,0,0,0,0|3,0,0]=4 1659 B12R1.17 ClCCN(c1cccc(c1)Cl)C Amb17338056 [0,1,0,0,0,0|3,0,0]=4 1660 B12R1.17 ClCCN(c1cccc(c1)F)C Amb17335953 [0,1,0,0,0,0|3,0,0]=4 1661 B12R1.17 N#CCC(O)c1cc(O)ccc1 Amb25674244 [0,1,0,0,0,0|3,0,0]=4 1662 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [0,1,0,0,0,0|3,0,0]=4 1663 B12R1.17 N#CCC(c1cccc(c1)C)O Amb1111387 [0,1,0,0,0,0|3,0,0]=4 1664 B12R1.17 N#CCC(c1cccc(c1)Cl)O Amb17233865 [0,1,0,0,0,0|3,0,0]=4 1665 B12R1.17 N#CCC(c1cccc(c1)F)O Amb17232517 [0,1,0,0,0,0|3,0,0]=4 1666 B12R1.17 N#CCN(c1cccc(c1)Br)C Amb17343207 [0,1,0,0,0,0|3,0,0]=4 1667 B12R1.17 N#CCN(c1cccc(c1)C)C Amb17334502 [0,1,0,0,0,0|3,0,0]=4 1668 B12R1.17 N#CCN(c1cccc(c1)Cl)C Amb17335464 [0,1,0,0,0,0|3,0,0]=4 1669 B12R1.17 N#CCN(c1cccc(c1)F)C Amb17334604 [0,1,0,0,0,0|3,0,0]=4 1670 B12R1.17 N#CC[C@@H](O)c1cc(O)ccc1 Amb24492822 [0,1,0,0,0,0|3,0,0]=4 1671 B12R1.17 N#CC[C@@H](O)c1cccc(Cl)c1 Amb24360505 [0,1,0,0,0,0|3,0,0]=4 1672 B12R1.17 N#CC[C@@H](O)c1cccc(F)c1 Amb25721001 [0,1,0,0,0,0|3,0,0]=4 1673 B12R1.17 N#CC[C@H](O)c1cccc(F)c1 Amb25699065 [0,1,0,0,0,0|3,0,0]=4 1674 B12R1.17 NC(CC#N)c1cccc(Br)c1 Amb18068031 [0,1,0,0,0,0|3,0,0]=4 1675 B12R1.17 NC(CC#N)c1cccc(Cl)c1 Amb18564159 [0,1,0,0,0,0|3,0,0]=4 1676 B12R1.17 NC(CC#N)c1cccc(F)c1 Amb18563606 [0,1,0,0,0,0|3,0,0]=4 1677 B12R1.17 NC(CC#N)c1cccc(O)c1 Amb25760250 [0,1,0,0,0,0|3,0,0]=4 1678 B12R1.17 NC(CCO)c1cc(Br)ccc1 Amb18990231 [0,1,0,0,0,0|3,0,0]=4 1679 B12R1.17 NC(CCO)c1cc(O)ccc1 Amb19887678 [0,1,0,0,0,0|3,0,0]=4 1680 B12R1.17 NC(CCO)c1cc(S)ccc1 Amb24655390 [0,1,0,0,0,0|3,0,0]=4 1681 B12R1.17 NCCC(O)c1cc(Br)ccc1 Amb18121493 [0,1,0,0,0,0|3,0,0]=4 1682 B12R1.17 NCCC(O)c1cc(I)ccc1 Amb24493265 [0,1,0,0,0,0|3,0,0]=4 1683 B12R1.17 NCCC(O)c1cc(O)ccc1 Amb18251885 [0,1,0,0,0,0|3,0,0]=4 1684 B12R1.17 NCCC(c1cccc(c1)C)C Amb17232450 [0,1,0,0,0,0|2,0,0]=3 1685 B12R1.17 NCCC(c1cccc(c1)C)O Amb17232540 [0,1,0,0,0,0|3,0,0]=4 1686 B12R1.17 NCCC(c1cccc(c1)Cl)C Amb17234051 [0,1,0,0,0,0|2,0,0]=3 1687 B12R1.17 NCCC(c1cccc(c1)Cl)O Amb17234260 [0,1,0,0,0,0|3,0,0]=4 1688 B12R1.17 NCCC(c1cccc(c1)F)C Amb17232650 [0,1,0,0,0,0|2,0,0]=3 1689 B12R1.17 NCCC(c1cccc(c1)F)O Amb17232697 [0,1,0,0,0,0|3,0,0]=4 1690 B12R1.17 NCCN(c1cccc(c1)Br)C Amb17059773 [0,1,0,0,0,0|3,0,0]=4 1691 B12R1.17 NCCN(c1cccc(c1)C)C Amb17059641 [0,1,0,0,0,0|3,0,0]=4 1692 B12R1.17 NCCN(c1cccc(c1)Cl)C Amb17059646 [0,1,0,0,0,0|3,0,0]=4 1693 B12R1.17 NCCN(c1cccc(c1)F)C Amb17059643 [0,1,0,0,0,0|3,0,0]=4 1694 B12R1.17 NCC[C@@H](N)c1cccc(Br)c1 Amb25314552 [0,1,0,0,0,0|3,0,0]=4 1695 B12R1.17 NCC[C@@H](N)c1cccc(Cl)c1 Amb25850090 [0,1,0,0,0,0|3,0,0]=4 1696 B12R1.17 NCC[C@@H](N)c1cccc(F)c1 Amb24610239 [0,1,0,0,0,0|3,0,0]=4 1697 B12R1.17 NCC[C@@H](O)c1cc(Cl)ccc1 Amb25105024 [0,1,0,0,0,0|3,0,0]=4 1698 B12R1.17 NCC[C@H](N)c1cccc(F)c1 Amb25230671 [0,1,0,0,0,0|3,0,0]=4 1699 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [0,1,0,0,0,0|2,0,0]=3 1700 B12R1.17 NNCC(c1cccc(c1)Br)O Amb17249279 [0,1,0,0,0,0|2,0,0]=3 1701 B12R1.17 NNCC(c1cccc(c1)C)O Amb17232609 [0,1,0,0,0,0|2,0,0]=3 1702 B12R1.17 NNCC(c1cccc(c1)Cl)O Amb17234361 [0,1,0,0,0,0|2,0,0]=3 1703 B12R1.17 N[C@@H](CC#N)c1cccc(Cl)c1 Amb24351211 [0,1,0,0,0,0|3,0,0]=4 1704 B12R1.17 N[C@@H](CC#N)c1cccc(O)c1 Amb25820726 [0,1,0,0,0,0|3,0,0]=4 1705 B12R1.17 N[C@@H](CCO)c1cc(Cl)ccc1 Amb19888404 [0,1,0,0,0,0|3,0,0]=4 1706 B12R1.17 N[C@@H](CCO)c1cc(F)ccc1 Amb19888379 [0,1,0,0,0,0|3,0,0]=4 1707 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19888375 [0,1,0,0,0,0|3,0,0]=4 1708 B12R1.17 N[C@@H](CCO)c1cc(O)ccc1 Amb19929578 [0,1,0,0,0,0|3,0,0]=4 1709 B12R1.17 N[C@@H](CCO)c1cc(S)ccc1 Amb24745621 [0,1,0,0,0,0|3,0,0]=4 1710 B12R1.17 N[C@H](CC#N)c1cccc(Cl)c1 Amb24573692 [0,1,0,0,0,0|3,0,0]=4 1711 B12R1.17 N[C@H](CC#N)c1cccc(F)c1 Amb24674109 [0,1,0,0,0,0|3,0,0]=4 1712 B12R1.17 N[C@H](CC#N)c1cccc(S)c1 Amb24364680 [0,1,0,0,0,0|3,0,0]=4 1713 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19887619 [0,1,0,0,0,0|3,0,0]=4 1714 B12R1.17 N[C@H](CCO)c1cc(Br)ccc1 Amb19943918 [0,1,0,0,0,0|3,0,0]=4 1715 B12R1.17 N[C@H](CCO)c1cc(Cl)ccc1 Amb19887652 [0,1,0,0,0,0|3,0,0]=4 1716 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19887668 [0,1,0,0,0,0|3,0,0]=4 1717 B12R1.17 N[C@H](CCO)c1cc(F)ccc1 Amb19888995 [0,1,0,0,0,0|3,0,0]=4 1718 B12R1.17 N[C@H](CCO)c1cc(O)ccc1 Amb19887679 [0,1,0,0,0,0|3,0,0]=4 1719 B12R1.17 Nc1cccc(c1)C(N)CCO Amb19929590 [0,1,0,0,0,0|3,0,0]=4 1720 B12R1.17 Nc1cccc(c1)C(N)CCO Amb22235814 [0,1,0,0,0,0|3,0,0]=4 1721 B12R1.17 Nc1cccc(c1)[C@@H](N)CC#N Amb25707936 [0,1,0,0,0,0|3,0,0]=4 1722 B12R1.17 Nc1cccc(c1)[C@H](N)CC#N Amb25360884 [0,1,0,0,0,0|3,0,0]=4 1723 B12R1.17 Nc1cccc(c1)[C@H](N)CCO Amb19887593 [0,1,0,0,0,0|3,0,0]=4 1724 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [0,1,0,0,0,0|3,0,0]=4 1725 B12R1.17 OCCC(Cl)c1cc(F)ccc1 Amb24444966 [0,1,0,0,0,0|3,0,0]=4 1726 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [0,1,0,0,0,0|3,0,0]=4 1727 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [0,1,0,0,0,0|3,0,0]=4 1728 B12R1.17 OCCC(c1cccc(c1)C)C Amb17232501 [0,1,0,0,0,0|2,0,0]=3 1729 B12R1.17 OCCC(c1cccc(c1)C)N Amb17103954 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.17 OCCC(c1cccc(c1)Cl)C Amb17234166 [0,1,0,0,0,0|2,0,0]=3 1731 B12R1.17 OCCC(c1cccc(c1)Cl)N Amb2417047 [0,1,0,0,0,0|3,0,0]=4 1732 B12R1.17 OCCC(c1cccc(c1)F)C Amb17232674 [0,1,0,0,0,0|2,0,0]=3 1733 B12R1.17 OCCN(c1cccc(c1)Br)C Amb17344452 [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.17 OCCN(c1cccc(c1)C)C Amb17334644 [0,1,0,0,0,0|3,0,0]=4 1735 B12R1.17 OCCN(c1cccc(c1)Cl)C Amb17335811 [0,1,0,0,0,0|3,0,0]=4 1736 B12R1.17 OCCN(c1cccc(c1)F)C Amb17334765 [0,1,0,0,0,0|3,0,0]=4 1737 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [0,1,0,0,0,0|3,0,0]=4 1738 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [0,1,0,0,0,0|2,0,0]=3 1740 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [0,1,0,0,0,0|2,0,0]=3 1741 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [0,1,0,0,0,0|2,0,0]=3 1742 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [0,1,0,0,0,0|2,0,0]=3 1743 B12R1.17 O[C@@H](CCCl)c1cc(Cl)ccc1 Amb24655785 [0,1,0,0,0,0|3,0,0]=4 1744 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [0,1,0,0,0,0|3,0,0]=4 1745 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [0,1,0,0,0,0|3,0,0]=4 1746 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [0,1,0,0,0,0|3,0,0]=4 1747 B12R1.30 BrCCCC(=O)c1ccccc1 Amb17247624 [0,1,0,0,0,0|2,0,1]=4 1748 B12R1.30 BrCC\C=C(\c1ccccc1)/C Amb17246875 [0,1,0,0,0,0|1,0,2]=4 1749 B12R1.30 C#CCCC(Cl)c1ccccc1 Amb25756186 [0,1,0,0,0,0|2,0,1]=4 1750 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [0,1,0,0,0,0|2,0,1]=4 1751 B12R1.30 C=C(CNC=S)c1ccccc1 Amb25742952 [0,1,0,0,0,0|0,0,3]=4 1752 B12R1.30 C=C=CCC(Cl)c1ccccc1 Amb25700989 [0,1,0,0,0,0|2,0,1]=4 1753 B12R1.30 C=CCCC(N)c1ccccc1 Amb18126305 [0,1,0,0,0,0|2,0,1]=4 1754 B12R1.30 C=CCCN(c1ccccc1)C Amb10559130 [0,1,0,0,0,0|2,0,1]=4 1755 B12R1.30 CC#CCC(=O)c1ccccc1 Amb18182348 [0,1,0,0,0,0|2,0,1]=4 1756 B12R1.30 CC#CCC(N)c1c[n]ccc1 Amb18988275 [0,1,0,0,0,0|3,0,0]=4 1757 B12R1.30 CC#CCC(N)c1cc[n]cc1 Amb18988276 [0,1,0,0,0,0|3,0,0]=4 1758 B12R1.30 CC#CCC(N)c1cccc[n]1 Amb18988274 [0,1,0,0,0,0|3,0,0]=4 1759 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [0,1,0,0,0,0|2,0,0]=3 1760 B12R1.30 CC#CCC(O)c1c[n]ccc1 Amb18797973 [0,1,0,0,0,0|3,0,0]=4 1761 B12R1.30 CC#CCC(O)c1cc[n]cc1 Amb18797974 [0,1,0,0,0,0|3,0,0]=4 1762 B12R1.30 CC#CCC(O)c1cccc[n]1 Amb18797972 [0,1,0,0,0,0|3,0,0]=4 1763 B12R1.30 CC#CCC(O)c1ccccc1 Amb18797803 [0,1,0,0,0,0|2,0,0]=3 1764 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [0,1,0,0,0,0|2,0,0]=3 1765 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [0,1,0,0,0,0|1,0,2]=4 1766 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [0,1,0,0,0,0|1,0,1]=3 1767 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [0,1,0,0,0,0|1,0,1]=3 1768 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [0,1,0,0,0,0|1,0,0]=2 1769 B12R1.30 CC(CN=C=O)c1c[n]ccc1 Amb25762873 [0,1,0,0,0,0|1,0,2]=4 1770 B12R1.30 CC(CN=C=O)c1cccc[n]1 Amb25045651 [0,1,0,0,0,0|1,0,2]=4 1771 B12R1.30 CC(CN=C=S)c1ccccc1 Amb25102676 [0,1,0,0,0,0|0,0,2]=3 1772 B12R1.30 CC(CNC#N)c1ccccc1 Amb24419584 [0,1,0,0,0,0|0,0,1]=2 1773 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [0,1,0,0,0,0|1,0,1]=3 1774 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [0,1,0,0,0,0|2,0,0]=3 1775 B12R1.30 CC(SCC#C)c1ccccc1 Amb25763673 [0,1,0,0,0,0|1,0,1]=3 1776 B12R1.30 CC(\C=C\C#N)c1ccccc1 Amb18644939 [0,1,0,0,0,0|1,0,2]=4 1777 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [0,1,0,0,0,0|1,0,2]=4 1778 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [0,1,0,0,0,0|1,0,1]=3 1779 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [0,1,0,0,0,0|1,0,1]=3 1780 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [0,1,0,0,0,0|2,0,0]=3 1781 B12R1.30 CC(c1ccccc1)SCC#N Amb17501742 [0,1,0,0,0,0|2,0,0]=3 1782 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [0,1,0,0,0,0|2,0,1]=4 1783 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [0,1,0,0,0,0|2,0,1]=4 1784 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [0,1,0,0,0,0|1,0,0]=2 1785 B12R1.30 CCC#CC(O)c1ccccc1 Amb24672537 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.30 CCC/N=C(\C)c1ccccc1 Amb17779516 [0,1,0,0,0,0|1,0,1]=3 1787 B12R1.30 CCCCC(N)c1cccc[n]1 Amb19026090 [0,1,0,0,0,0|3,0,0]=4 1788 B12R1.30 CCCCC(c1cccnc1)N Amb10607965 [0,1,0,0,0,0|3,0,0]=4 1789 B12R1.30 CCCCC(c1ccncc1)N Amb10573553 [0,1,0,0,0,0|3,0,0]=4 1790 B12R1.30 CCCCN(c1ccccc1)N Amb17226670 [0,1,0,0,0,0|3,0,0]=4 1791 B12R1.30 CCCNC(=N)c1ccccc1 Amb23447119 [0,1,0,0,0,0|2,0,1]=4 1792 B12R1.30 CCCNC(=S)c1ccccc1 Amb25827093 [0,1,0,0,0,0|2,0,1]=4 1793 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [0,1,0,0,0,0|1,0,0]=2 1794 B12R1.30 CCC\N=C(\Cl)/c1ccccc1 Amb25142394 [0,1,0,0,0,0|2,0,1]=4 1795 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [0,1,0,0,0,0|1,0,0]=2 1796 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [0,1,0,0,0,0|1,0,0]=2 1797 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [0,1,0,0,0,0|0,0,0]=1 1798 B12R1.30 CCNCC(c1ccccn1)O Amb17138608 [0,1,0,0,0,0|2,0,0]=3 1799 B12R1.30 CCNCC(c1cccnc1)O Amb17138609 [0,1,0,0,0,0|2,0,0]=3 1800 B12R1.30 CCNCC(c1ccncc1)O Amb17138610 [0,1,0,0,0,0|2,0,0]=3 1801 B12R1.30 CCNN=C(N)c1ccccc1 Amb24096580 [0,1,0,0,0,0|2,0,1]=4 1802 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [0,1,0,0,0,0|2,0,0]=3 1803 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [0,1,0,0,0,0|2,0,1]=4 1804 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [0,1,0,0,0,0|2,0,1]=4 1805 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [0,1,0,0,0,0|2,0,1]=4 1806 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [0,1,0,0,0,0|2,0,1]=4 1807 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [0,1,0,0,0,0|1,0,1]=3 1808 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [0,1,0,0,0,0|2,0,1]=4 1809 B12R1.30 CN(c1ccccc1)CCC#C Amb10559135 [0,1,0,0,0,0|2,0,1]=4 1810 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [0,1,0,0,0,0|1,0,1]=3 1811 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [0,1,0,0,0,0|1,0,0]=2 1812 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [0,1,0,0,0,0|1,0,0]=2 1813 B12R1.30 CN\C=C/C(=O)c1ccccc1 Amb2386631 [0,1,0,0,0,0|1,0,2]=4 1814 B12R1.30 CN\C=N\N(C)c1ccccc1 Amb24443088 [0,1,0,0,0,0|1,0,1]=3 1815 B12R1.30 CN\N=C\C(=O)c1ccccc1 Amb25202730 [0,1,0,0,0,0|1,0,2]=4 1816 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [0,1,0,0,0,0|0,0,1]=2 1817 B12R1.30 COCCC(=O)c1ccccc1 Amb10602329 [0,1,0,0,0,0|2,0,1]=4 1818 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [0,1,0,0,0,0|2,0,0]=3 1819 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [0,1,0,0,0,0|2,0,1]=4 1820 B12R1.30 CO\N=C\C(C)c1ccccc1 Amb24403672 [0,1,0,0,0,0|0,0,2]=3 1821 B12R1.30 CO\N=C\C(O)c1ccccc1 Amb25788975 [0,1,0,0,0,0|1,0,2]=4 1822 B12R1.30 CO\N=C\[C@@H](O)c1ccccc1 Amb24592391 [0,1,0,0,0,0|1,0,2]=4 1823 B12R1.30 CSCNC(=S)c1ccccc1 Amb24634347 [0,1,0,0,0,0|2,0,1]=4 1824 B12R1.30 C[C@@H](CN=C=S)c1ccccc1 Amb19892937 [0,1,0,0,0,0|0,0,2]=3 1825 B12R1.30 C[C@@H](NCC#C)c1c[n]ccc1 Amb25073667 [0,1,0,0,0,0|2,0,1]=4 1826 B12R1.30 C[C@@H](NCC#N)c1c[n]ccc1 Amb25310882 [0,1,0,0,0,0|3,0,0]=4 1827 B12R1.30 C[C@@H](NCC#N)c1cc[n]cc1 Amb25823710 [0,1,0,0,0,0|3,0,0]=4 1828 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [0,1,0,0,0,0|2,0,0]=3 1829 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [0,1,0,0,0,0|2,0,0]=3 1830 B12R1.30 C[C@H](CN=C=S)c1ccccc1 Amb19892936 [0,1,0,0,0,0|0,0,2]=3 1831 B12R1.30 C[C@H](NCC#C)c1c[n]ccc1 Amb25348197 [0,1,0,0,0,0|2,0,1]=4 1832 B12R1.30 C[C@H](NCC#C)c1cc[n]cc1 Amb25134563 [0,1,0,0,0,0|2,0,1]=4 1833 B12R1.30 C[C@H](NCC#N)c1cc[n]cc1 Amb24659981 [0,1,0,0,0,0|3,0,0]=4 1834 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [0,1,0,0,0,0|2,0,0]=3 1835 B12R1.30 C\C(=C/CC=O)\c1ccccc1 Amb18645375 [0,1,0,0,0,0|2,0,1]=4 1836 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [0,1,0,0,0,0|0,0,1]=2 1837 B12R1.30 C\C(=C/NC=O)\c1ccccc1 Amb24637832 [0,1,0,0,0,0|0,0,3]=4 1838 B12R1.30 C\C(=C\CC=O)\c1ccccc1 Amb24757521 [0,1,0,0,0,0|2,0,1]=4 1839 B12R1.30 C\C(=C\CCCl)\c1ccccc1 Amb24394711 [0,1,0,0,0,0|1,0,2]=4 1840 B12R1.30 C\C(=C\CNC)\c1cc[n]cc1 Amb24555199 [0,1,0,0,0,0|1,0,1]=3 1841 B12R1.30 C\C(=C\CNC)\c1cccc[n]1 Amb25699200 [0,1,0,0,0,0|1,0,1]=3 1842 B12R1.30 C\C(=N/NC=O)\c1ccccc1 Amb25844967 [0,1,0,0,0,0|1,0,2]=4 1843 B12R1.30 C\C(=N\NC=O)\c1ccccc1 Amb25091882 [0,1,0,0,0,0|1,0,2]=4 1844 B12R1.30 C\C(=N\OCC)\c1ccccc1 Amb25833281 [0,1,0,0,0,0|2,0,1]=4 1845 B12R1.30 C\C=C/CC(=O)c1ccccc1 Amb24594702 [0,1,0,0,0,0|2,0,1]=4 1846 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [0,1,0,0,0,0|1,0,1]=3 1847 B12R1.30 C\C=C\CC(O)c1c[n]ccc1 Amb25832725 [0,1,0,0,0,0|3,0,0]=4 1848 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [0,1,0,0,0,0|2,0,0]=3 1849 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [0,1,0,0,0,0|1,0,1]=3 1850 B12R1.30 C\N=C\CC(=O)c1ccccc1 Amb25834458 [0,1,0,0,0,0|1,0,2]=4 1851 B12R1.30 ClCC#CC(Cl)c1ccccc1 Amb25772764 [0,1,0,0,0,0|2,0,1]=4 1852 B12R1.30 ClCCCC(=O)c1ccccc1 Amb1229841 [0,1,0,0,0,0|2,0,1]=4 1853 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [0,1,0,0,0,0|2,0,0]=3 1854 B12R1.30 ClCCCN(c1ccccc1)C Amb17335669 [0,1,0,0,0,0|2,0,0]=3 1855 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [0,1,0,0,0,0|2,0,0]=3 1856 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [0,1,0,0,0,0|2,0,0]=3 1857 B12R1.30 ClCC\C=C(\c1ccccc1)/C Amb17233775 [0,1,0,0,0,0|1,0,2]=4 1858 B12R1.30 ClC\C=C\C(Cl)c1ccccc1 Amb24642037 [0,1,0,0,0,0|2,0,1]=4 1859 B12R1.30 N#CCCC(Cl)c1ccccc1 Amb18648313 [0,1,0,0,0,0|2,0,1]=4 1860 B12R1.30 N#CCC[C@H](O)c1ccccc1 Amb24466214 [0,1,0,0,0,0|2,0,1]=4 1861 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [0,1,0,0,0,0|1,0,1]=3 1862 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [0,1,0,0,0,0|2,0,1]=4 1863 B12R1.30 NCCCC(=O)c1ccccc1 Amb18623671 [0,1,0,0,0,0|2,0,1]=4 1864 B12R1.30 NCCCC(O)c1cc[n]cc1 Amb18563731 [0,1,0,0,0,0|3,0,0]=4 1865 B12R1.30 NCCCC(O)c1cccc[n]1 Amb18563728 [0,1,0,0,0,0|3,0,0]=4 1866 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [0,1,0,0,0,0|2,0,0]=3 1868 B12R1.30 NCCCC(c1ccccn1)N Amb10070102 [0,1,0,0,0,0|3,0,0]=4 1869 B12R1.30 NCCCC(c1cccnc1)N Amb10070101 [0,1,0,0,0,0|3,0,0]=4 1870 B12R1.30 NCCCC(c1cccnc1)O Amb17232606 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.30 NCCCC(c1ccncc1)N Amb10070100 [0,1,0,0,0,0|3,0,0]=4 1872 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [0,1,0,0,0,0|2,0,0]=3 1873 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.30 NCC\C=C(\c1ccccc1)/C Amb17232384 [0,1,0,0,0,0|1,0,2]=4 1875 B12R1.30 NOCCN(c1ccccc1)C Amb17104857 [0,1,0,0,0,0|3,0,0]=4 1876 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [0,1,0,0,0,0|2,0,0]=3 1877 B12R1.30 O=C(CNC=O)c1ccccc1 Amb20075907 [0,1,0,0,0,0|1,0,2]=4 1878 B12R1.30 O=C=NCC(Cl)c1ccccc1 Amb24692969 [0,1,0,0,0,0|1,0,2]=4 1879 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [0,1,0,0,0,0|1,0,1]=3 1880 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [0,1,0,0,0,0|2,0,1]=4 1881 B12R1.30 OC(c1ccccc1)CCC#N Amb17232364 [0,1,0,0,0,0|2,0,1]=4 1882 B12R1.30 OCC#C[C@H](O)c1ccccc1 Amb24588419 [0,1,0,0,0,0|2,0,1]=4 1883 B12R1.30 OCCCC(=O)c1ccccc1 Amb17334609 [0,1,0,0,0,0|2,0,1]=4 1884 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [0,1,0,0,0,0|2,0,0]=3 1885 B12R1.30 OCCCC(c1cccnc1)O Amb17619700 [0,1,0,0,0,0|3,0,0]=4 1886 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [0,1,0,0,0,0|2,0,0]=3 1887 B12R1.30 OCNNC(=O)c1ccccc1 Amb24608056 [0,1,0,0,0,0|2,0,1]=4 1888 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [0,1,0,0,0,0|2,0,1]=4 1889 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [0,1,0,0,0,0|2,0,1]=4 1890 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [0,1,0,0,0,0|2,0,1]=4 1891 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [0,1,0,0,0,0|2,0,1]=4 1892 B12R1.30 [C-]#[N+]CCC(F)c1ccccc1 Amb25217234 [0,1,0,0,0,0|1,0,2]=4 1893 B12R1.30 [N-]=[N+]=NCC(Cl)c1ccccc1 Amb25276328 [0,1,0,0,0,0|2,0,1]=4 1894 B12R1.30 [N-]=[N+]=NCC(N)c1ccccc1 Amb25694755 [0,1,0,0,0,0|2,0,1]=4 1895 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [0,1,0,0,0,0|2,0,1]=4 1896 B12R1.30 [N-]=[N+]=NC[C@@H](N)c1ccccc1 Amb24398753 [0,1,0,0,0,0|2,0,1]=4 1897 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [0,1,0,0,0,0|2,0,1]=4 1898 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,1,0,0,0,0|3,0,0]=4 1899 B12R1.34 C#CC(F)C(O)c1ccccc1 Amb25129675 [0,1,0,0,0,0|2,0,1]=4 1900 B12R1.34 C#C[C@@H](O)[C@@H](O)c1ccccc1 Amb25138509 [0,1,0,0,0,0|2,0,1]=4 1901 B12R1.34 C#C[C@H](F)[C@@H](O)c1ccccc1 Amb24733476 [0,1,0,0,0,0|2,0,1]=4 1902 B12R1.34 C#C[C@H](O)[C@@H](O)c1ccccc1 Amb24748425 [0,1,0,0,0,0|2,0,1]=4 1903 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,1,0,0,0,0|2,0,1]=4 1904 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,1,0,0,0,0|2,0,1]=4 1905 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,1,0,0,0,0|2,0,1]=4 1906 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,1,0,0,0,0|2,0,1]=4 1907 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,1,0,0,0,0|2,0,1]=4 1908 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,1,0,0,0,0|2,0,1]=4 1909 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,1,0,0,0,0|2,0,1]=4 1910 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,1,0,0,0,0|2,0,1]=4 1911 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,1,0,0,0,0|2,0,1]=4 1912 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,1,0,0,0,0|2,0,1]=4 1913 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,1,0,0,0,0|2,0,1]=4 1914 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,1,0,0,0,0|2,0,1]=4 1915 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,1,0,0,0,0|2,0,1]=4 1916 B12R1.34 CC(C#C)C(O)c1ccccc1 Amb25145323 [0,1,0,0,0,0|2,0,1]=4 1917 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [0,1,0,0,0,0|1,0,2]=4 1918 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [0,1,0,0,0,0|2,0,1]=4 1919 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [0,1,0,0,0,0|2,0,1]=4 1920 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [0,1,0,0,0,0|2,0,1]=4 1921 B12R1.34 CC(C(=O)NN)c1ccc[n]c1 Amb25163409 [0,1,0,0,0,0|2,0,1]=4 1922 B12R1.34 CC(C(=O)NN)c1cccc[n]1 Amb25045003 [0,1,0,0,0,0|2,0,1]=4 1923 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,1,0,0,0,0|1,0,1]=3 1924 B12R1.34 CC(C(Br)CC)c1cccc[n]1 Amb24737683 [0,1,0,0,0,0|2,0,0]=3 1925 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,1,0,0,0,0|1,0,0]=2 1926 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,1,0,0,0,0|2,0,0]=3 1927 B12R1.34 CC(C(C)CN)c1c[n]ccc1 Amb18828712 [0,1,0,0,0,0|3,0,0]=4 1928 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,1,0,0,0,0|2,0,0]=3 1929 B12R1.34 CC(C(C)NN)c1ccccc1 Amb24488638 [0,1,0,0,0,0|1,0,0]=2 1930 B12R1.34 CC(C(Cl)C#N)c1ccccc1 Amb18791080 [0,1,0,0,0,0|2,0,0]=3 1931 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,1,0,0,0,0|2,0,0]=3 1932 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,1,0,0,0,0|2,0,0]=3 1933 B12R1.34 CC(C(N)C#C)c1ccccc1 Amb25159878 [0,1,0,0,0,0|1,0,1]=3 1934 B12R1.34 CC(C(N)C#N)c1ccccc1 Amb18953074 [0,1,0,0,0,0|2,0,0]=3 1935 B12R1.34 CC(C(N)CC)c1cc[n]cc1 Amb18828706 [0,1,0,0,0,0|2,0,0]=3 1936 B12R1.34 CC(C(N)CC)c1cccc[n]1 Amb18828694 [0,1,0,0,0,0|2,0,0]=3 1937 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,1,0,0,0,0|1,0,0]=2 1938 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,1,0,0,0,0|1,0,0]=2 1939 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [0,1,0,0,0,0|2,0,0]=3 1940 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,1,0,0,0,0|2,0,0]=3 1941 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,1,0,0,0,0|2,0,0]=3 1942 B12R1.34 CC(C(O)C#C)c1ccccc1 Amb25700248 [0,1,0,0,0,0|1,0,1]=3 1943 B12R1.34 CC(C(O)C#N)c1ccccc1 Amb18788076 [0,1,0,0,0,0|2,0,0]=3 1944 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,1,0,0,0,0|1,0,1]=3 1945 B12R1.34 CC(C(O)CC)c1cccc[n]1 Amb24367087 [0,1,0,0,0,0|2,0,0]=3 1946 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,1,0,0,0,0|2,0,0]=3 1947 B12R1.34 CC(CC)C(Cl)c1c[n]ccc1 Amb25156869 [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,1,0,0,0,0|2,0,0]=3 1949 B12R1.34 CC(CC)C(N)c1cc[n]cc1 Amb18828651 [0,1,0,0,0,0|3,0,0]=4 1950 B12R1.34 CC(CC)C(N)c1cccc[n]1 Amb25674376 [0,1,0,0,0,0|3,0,0]=4 1951 B12R1.34 CC(CC)C(O)c1c[n]ccc1 Amb24665088 [0,1,0,0,0,0|3,0,0]=4 1952 B12R1.34 CC(CC)C(O)c1cc[n]cc1 Amb24446286 [0,1,0,0,0,0|3,0,0]=4 1953 B12R1.34 CC(CC)C(O)c1cccc[n]1 Amb24437193 [0,1,0,0,0,0|3,0,0]=4 1954 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,1,0,0,0,0|2,0,0]=3 1955 B12R1.34 CC(CC)[C@@H](N)c1c[n]ccc1 Amb25201730 [0,1,0,0,0,0|3,0,0]=4 1956 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,1,0,0,0,0|2,0,0]=3 1957 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,1,0,0,0,0|2,0,0]=3 1958 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,1,0,0,0,0|3,0,0]=4 1959 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,1,0,0,0,0|3,0,0]=4 1960 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,1,0,0,0,0|3,0,0]=4 1961 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,1,0,0,0,0|3,0,0]=4 1962 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [0,1,0,0,0,0|3,0,0]=4 1963 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,1,0,0,0,0|1,0,0]=2 1964 B12R1.34 CC(NC)C(O)c1c[n]ccc1 Amb24728174 [0,1,0,0,0,0|2,0,0]=3 1965 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,1,0,0,0,0|1,0,0]=2 1966 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,1,0,0,0,0|1,0,0]=2 1967 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,1,0,0,0,0|1,0,0]=2 1968 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,1,0,0,0,0|2,0,1]=4 1969 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,1,0,0,0,0|2,0,0]=3 1970 B12R1.34 CC(OC)C(N)c1c[n]ccc1 Amb25307005 [0,1,0,0,0,0|3,0,0]=4 1971 B12R1.34 CC(OC)C(O)c1c[n]ccc1 Amb25847380 [0,1,0,0,0,0|3,0,0]=4 1972 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,1,0,0,0,0|2,0,0]=3 1973 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,1,0,0,0,0|2,0,0]=3 1974 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,1,0,0,0,0|2,0,0]=3 1975 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,1,0,0,0,0|1,0,1]=3 1976 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [0,1,0,0,0,0|1,0,2]=4 1977 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [0,1,0,0,0,0|2,0,1]=4 1978 B12R1.34 CC(c1ccccc1)\C(\N)=N\N Amb25159879 [0,1,0,0,0,0|1,0,2]=4 1979 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,1,0,0,0,0|1,0,1]=3 1980 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,1,0,0,0,0|2,0,1]=4 1981 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,1,0,0,0,0|2,0,1]=4 1982 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,1,0,0,0,0|1,0,1]=3 1983 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,1,0,0,0,0|1,0,1]=3 1984 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,1,0,0,0,0|2,0,1]=4 1985 B12R1.34 CCC(C(=O)c1ccccc1)N Amb17138555 [0,1,0,0,0,0|2,0,1]=4 1986 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,1,0,0,0,0|1,0,2]=4 1987 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,1,0,0,0,0|2,0,0]=3 1988 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,1,0,0,0,0|2,0,1]=4 1989 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,1,0,0,0,0|2,0,0]=3 1990 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,1,0,0,0,0|2,0,0]=3 1991 B12R1.34 CCC(I)C(=O)c1ccccc1 Amb20621476 [0,1,0,0,0,0|2,0,1]=4 1992 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,1,0,0,0,0|2,0,1]=4 1993 B12R1.34 CCC(N)C(N)c1c[n]ccc1 Amb24558425 [0,1,0,0,0,0|3,0,0]=4 1994 B12R1.34 CCC(N)C(N)c1cccc[n]1 Amb25261365 [0,1,0,0,0,0|3,0,0]=4 1995 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,1,0,0,0,0|2,0,0]=3 1996 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,1,0,0,0,0|2,0,0]=3 1997 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,1,0,0,0,0|2,0,1]=4 1998 B12R1.34 CCC(O)C(N)c1ccc[n]c1 Amb25343553 [0,1,0,0,0,0|3,0,0]=4 1999 B12R1.34 CCC(O)C(O)c1c[n]ccc1 Amb25354449 [0,1,0,0,0,0|3,0,0]=4 2000 B12R1.34 CCC(O)C(O)c1cc[n]cc1 Amb24524979 [0,1,0,0,0,0|3,0,0]=4 2001 B12R1.34 CCC(O)C(O)c1cccc[n]1 Amb25769439 [0,1,0,0,0,0|3,0,0]=4 2002 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,1,0,0,0,0|2,0,1]=4 2003 B12R1.34 CC[C@@H](N)C(=O)c1ccccc1 Amb24595929 [0,1,0,0,0,0|2,0,1]=4 2004 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,1,0,0,0,0|2,0,0]=3 2005 B12R1.34 CC[C@@H](N)[C@H](O)c1ccc[n]c1 Amb25228779 [0,1,0,0,0,0|3,0,0]=4 2006 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,1,0,0,0,0|2,0,0]=3 2007 B12R1.34 CC[C@@H](O)C(=O)c1ccccc1 Amb24691713 [0,1,0,0,0,0|2,0,1]=4 2008 B12R1.34 CC[C@@H](O)[C@@H](N)c1cc[n]cc1 Amb25251848 [0,1,0,0,0,0|3,0,0]=4 2009 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccc[n]c1 Amb24450166 [0,1,0,0,0,0|3,0,0]=4 2010 B12R1.34 CC[C@@H](O)[C@@H](N)c1cccc[n]1 Amb25714479 [0,1,0,0,0,0|3,0,0]=4 2011 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,1,0,0,0,0|2,0,0]=3 2012 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,1,0,0,0,0|2,0,0]=3 2013 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,1,0,0,0,0|2,0,1]=4 2014 B12R1.34 CC[C@H](N)C(=O)c1ccccc1 Amb25302294 [0,1,0,0,0,0|2,0,1]=4 2015 B12R1.34 CC[C@H](N)[C@@H](N)c1cc[n]cc1 Amb24744764 [0,1,0,0,0,0|3,0,0]=4 2016 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,1,0,0,0,0|2,0,0]=3 2017 B12R1.34 CC[C@H](O)C(=O)c1ccccc1 Amb25799278 [0,1,0,0,0,0|2,0,1]=4 2018 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,1,0,0,0,0|2,0,0]=3 2019 B12R1.34 CC[C@H](O)[C@H](N)c1cc[n]cc1 Amb25245868 [0,1,0,0,0,0|3,0,0]=4 2020 B12R1.34 CC[C@H](O)[C@H](N)c1cccc[n]1 Amb25159912 [0,1,0,0,0,0|3,0,0]=4 2021 B12R1.34 CN(C(=N)CC)c1ccccc1 Amb24634785 [0,1,0,0,0,0|2,0,1]=4 2022 B12R1.34 CN(C(=N)NC)c1ccccc1 Amb18798220 [0,1,0,0,0,0|1,0,1]=3 2023 B12R1.34 CN(C(=O)NC)c1ccccc1 Amb24488531 [0,1,0,0,0,0|1,0,1]=3 2024 B12R1.34 CN(C(=O)OC)c1ccccc1 Amb24612519 [0,1,0,0,0,0|2,0,1]=4 2025 B12R1.34 CN(C(=S)NC)c1ccc[n]c1 Amb25039141 [0,1,0,0,0,0|2,0,1]=4 2026 B12R1.34 CN(C(=S)NC)c1cccc[n]1 Amb25798954 [0,1,0,0,0,0|2,0,1]=4 2027 B12R1.34 CN(C(=S)NN)c1ccccc1 Amb18564176 [0,1,0,0,0,0|2,0,1]=4 2028 B12R1.34 CN(NC)C(=O)c1ccccc1 Amb25174185 [0,1,0,0,0,0|2,0,1]=4 2029 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,1,0,0,0,0|1,0,2]=4 2030 B12R1.34 CNC(=O)C(C)c1c[n]c[n]c1 Amb24513527 [0,1,0,0,0,0|2,0,1]=4 2031 B12R1.34 CNC(=O)C(C)c1ccc[n]c1 Amb25093295 [0,1,0,0,0,0|1,0,1]=3 2032 B12R1.34 CNC(=O)C(Cl)c1ccc[n]c1 Amb19075150 [0,1,0,0,0,0|2,0,1]=4 2033 B12R1.34 CNC(=O)C(N)c1cc[n]cc1 Amb24396250 [0,1,0,0,0,0|2,0,1]=4 2034 B12R1.34 CNC(=O)C(O)c1cc[n]cc1 Amb24497547 [0,1,0,0,0,0|2,0,1]=4 2035 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,1,0,0,0,0|1,0,1]=3 2036 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,1,0,0,0,0|1,0,1]=3 2037 B12R1.34 CNC(=O)N(N)c1ccccc1 Amb18646326 [0,1,0,0,0,0|2,0,1]=4 2038 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,1,0,0,0,0|0,0,1]=2 2039 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,1,0,0,0,0|0,0,1]=2 2040 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,1,0,0,0,0|1,0,1]=3 2041 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,1,0,0,0,0|1,0,1]=3 2042 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,1,0,0,0,0|1,0,1]=3 2043 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,1,0,0,0,0|0,0,1]=2 2044 B12R1.34 CNC(=S)N(N)c1ccccc1 Amb25732915 [0,1,0,0,0,0|2,0,1]=4 2045 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,1,0,0,0,0|0,0,1]=2 2046 B12R1.34 CNC(C(=O)c1ccccc1)C Amb17616803 [0,1,0,0,0,0|1,0,1]=3 2047 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,1,0,0,0,0|1,0,0]=2 2048 B12R1.34 CNC(C)C(=O)c1cc[n]cc1 Amb25381151 [0,1,0,0,0,0|2,0,1]=4 2049 B12R1.34 CNC(C)C(C)c1cc[n]cc1 Amb24366596 [0,1,0,0,0,0|1,0,0]=2 2050 B12R1.34 CNC(C)C(C)c1cccc[n]1 Amb25751315 [0,1,0,0,0,0|1,0,0]=2 2051 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,1,0,0,0,0|0,0,0]=1 2052 B12R1.34 CN[C@@H](C)C(=C)c1ccccc1 Amb24758988 [0,1,0,0,0,0|0,0,2]=3 2053 B12R1.34 CN[C@@H](C)C(=O)c1ccccc1 Amb25312230 [0,1,0,0,0,0|1,0,1]=3 2054 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,1,0,0,0,0|0,0,0]=1 2055 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,1,0,0,0,0|1,0,0]=2 2056 B12R1.34 CN[C@H](C)C(=C)c1ccccc1 Amb24697574 [0,1,0,0,0,0|0,0,2]=3 2057 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,1,0,0,0,0|0,0,0]=1 2058 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [0,1,0,0,0,0|1,0,1]=3 2059 B12R1.34 COC(=N)C(N)c1ccccc1 Amb22471822 [0,1,0,0,0,0|2,0,1]=4 2060 B12R1.34 COC(=N)[C@H](O)c1ccccc1 Amb25832728 [0,1,0,0,0,0|2,0,1]=4 2061 B12R1.34 COC(=O)C(C)c1cc[n]cc1 Amb19374810 [0,1,0,0,0,0|2,0,1]=4 2062 B12R1.34 COC(=O)C(C)c1ccc[n]c1 Amb18798400 [0,1,0,0,0,0|2,0,1]=4 2063 B12R1.34 COC(=O)C(C)c1cccc[n]1 Amb19375013 [0,1,0,0,0,0|2,0,1]=4 2064 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,1,0,0,0,0|2,0,1]=4 2065 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [0,1,0,0,0,0|2,0,1]=4 2066 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [0,1,0,0,0,0|1,0,1]=3 2067 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [0,1,0,0,0,0|2,0,1]=4 2068 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [0,1,0,0,0,0|2,0,1]=4 2069 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [0,1,0,0,0,0|2,0,1]=4 2070 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,1,0,0,0,0|1,0,1]=3 2071 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [0,1,0,0,0,0|2,0,1]=4 2072 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,1,0,0,0,0|2,0,1]=4 2073 B12R1.34 COC(Br)C(=O)c1ccccc1 Amb25729950 [0,1,0,0,0,0|2,0,1]=4 2074 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,1,0,0,0,0|2,0,0]=3 2075 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,1,0,0,0,0|2,0,0]=3 2076 B12R1.34 COC(O)C(=O)c1ccccc1 Amb24416714 [0,1,0,0,0,0|2,0,1]=4 2077 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,1,0,0,0,0|2,0,0]=3 2078 B12R1.34 COP(=O)[C@@H](O)c1ccccc1 Amb25065497 [0,1,0,0,0,0|3,0,0]=4 2079 B12R1.34 CO[C@@H](C)C(=O)c1ccccc1 Amb25116501 [0,1,0,0,0,0|2,0,1]=4 2080 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,1,0,0,0,0|2,0,0]=3 2081 B12R1.34 CO[C@H](O)C(=O)c1ccccc1 Amb25735094 [0,1,0,0,0,0|2,0,1]=4 2082 B12R1.34 CSC(C(=O)c1ccccc1)O Amb17594697 [0,1,0,0,0,0|2,0,1]=4 2083 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,1,0,0,0,0|2,0,1]=4 2084 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,1,0,0,0,0|1,0,1]=3 2085 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,1,0,0,0,0|1,0,1]=3 2086 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,1,0,0,0,0|2,0,1]=4 2087 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,1,0,0,0,0|2,0,1]=4 2088 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,1,0,0,0,0|2,0,1]=4 2089 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,1,0,0,0,0|2,0,1]=4 2090 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,1,0,0,0,0|3,0,0]=4 2091 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,1,0,0,0,0|3,0,0]=4 2092 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,1,0,0,0,0|3,0,0]=4 2093 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,1,0,0,0,0|3,0,0]=4 2094 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,1,0,0,0,0|3,0,0]=4 2095 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,1,0,0,0,0|3,0,0]=4 2096 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,1,0,0,0,0|3,0,0]=4 2097 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,1,0,0,0,0|3,0,0]=4 2098 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,1,0,0,0,0|3,0,0]=4 2099 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,1,0,0,0,0|1,0,0]=2 2100 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,1,0,0,0,0|1,0,0]=2 2101 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,1,0,0,0,0|1,0,0]=2 2102 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,1,0,0,0,0|1,0,0]=2 2103 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,1,0,0,0,0|1,0,0]=2 2104 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,1,0,0,0,0|1,0,0]=2 2105 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,1,0,0,0,0|2,0,0]=3 2106 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,1,0,0,0,0|2,0,0]=3 2107 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,1,0,0,0,0|2,0,0]=3 2108 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,1,0,0,0,0|2,0,0]=3 2109 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,1,0,0,0,0|2,0,0]=3 2110 B12R1.34 C[C@@H]([C@@H](O)C#N)c1ccccc1 Amb25099408 [0,1,0,0,0,0|2,0,0]=3 2111 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,1,0,0,0,0|2,0,0]=3 2112 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,1,0,0,0,0|2,0,0]=3 2113 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,1,0,0,0,0|2,0,0]=3 2114 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,1,0,0,0,0|1,0,0]=2 2115 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [0,1,0,0,0,0|2,0,1]=4 2116 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,1,0,0,0,0|1,0,1]=3 2117 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,1,0,0,0,0|2,0,0]=3 2118 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,1,0,0,0,0|2,0,1]=4 2119 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,1,0,0,0,0|3,0,0]=4 2120 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,1,0,0,0,0|2,0,0]=3 2121 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,1,0,0,0,0|2,0,0]=3 2122 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,1,0,0,0,0|3,0,0]=4 2123 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,1,0,0,0,0|3,0,0]=4 2124 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,1,0,0,0,0|3,0,0]=4 2125 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,1,0,0,0,0|3,0,0]=4 2126 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,1,0,0,0,0|3,0,0]=4 2127 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,1,0,0,0,0|1,0,0]=2 2128 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,1,0,0,0,0|1,0,0]=2 2129 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,1,0,0,0,0|1,0,0]=2 2130 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,1,0,0,0,0|1,0,0]=2 2131 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,1,0,0,0,0|1,0,0]=2 2132 B12R1.34 C[C@H](NN)[C@H](O)c1ccccc1 Amb25346319 [0,1,0,0,0,0|2,0,0]=3 2133 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,1,0,0,0,0|2,0,0]=3 2134 B12R1.34 C[C@H](OC)C(O)c1cccc[n]1 Amb25306303 [0,1,0,0,0,0|3,0,0]=4 2135 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,1,0,0,0,0|2,0,0]=3 2136 B12R1.34 C[C@H](OC)[C@H](O)c1cccc[n]1 Amb25832718 [0,1,0,0,0,0|3,0,0]=4 2137 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,1,0,0,0,0|2,0,0]=3 2138 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,1,0,0,0,0|0,0,0]=1 2139 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,1,0,0,0,0|1,0,0]=2 2140 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,1,0,0,0,0|2,0,0]=3 2141 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,1,0,0,0,0|1,0,1]=3 2142 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,1,0,0,0,0|2,0,0]=3 2143 B12R1.34 C\C(=N/C)\C(N)c1ccccc1 Amb24100399 [0,1,0,0,0,0|1,0,2]=4 2144 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,1,0,0,0,0|1,0,2]=4 2145 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,1,0,0,0,0|1,0,2]=4 2146 B12R1.34 C\C(=N\C)\C(N)c1ccccc1 Amb24493500 [0,1,0,0,0,0|1,0,2]=4 2147 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [0,1,0,0,0,0|2,0,1]=4 2148 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [0,1,0,0,0,0|2,0,1]=4 2149 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [0,1,0,0,0,0|2,0,1]=4 2150 B12R1.34 N#CC(Cl)C(Cl)c1ccccc1 Amb18130480 [0,1,0,0,0,0|3,0,0]=4 2151 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,1,0,0,0,0|3,0,0]=4 2152 B12R1.34 N#CC(O)[C@@H](O)c1ccccc1 Amb24353058 [0,1,0,0,0,0|3,0,0]=4 2153 B12R1.34 N#C[C@@H](F)[C@@H](O)c1ccccc1 Amb24386850 [0,1,0,0,0,0|3,0,0]=4 2154 B12R1.34 N#C[C@@H](O)[C@H](O)c1ccccc1 Amb25157844 [0,1,0,0,0,0|3,0,0]=4 2155 B12R1.34 N#C[C@H](O)[C@@H](F)c1ccccc1 Amb25157415 [0,1,0,0,0,0|3,0,0]=4 2156 B12R1.34 N#C[C@H](O)[C@@H](O)c1ccccc1 Amb24705594 [0,1,0,0,0,0|3,0,0]=4 2157 B12R1.34 N#C[C@H](O)[C@H](O)c1ccccc1 Amb25285601 [0,1,0,0,0,0|3,0,0]=4 2158 B12R1.34 NC(C#N)C(F)c1ccccc1 Amb25335487 [0,1,0,0,0,0|3,0,0]=4 2159 B12R1.34 NC(C(N)C#N)c1ccccc1 Amb25121131 [0,1,0,0,0,0|3,0,0]=4 2160 B12R1.34 NC(C(O)C#N)c1ccccc1 Amb24713669 [0,1,0,0,0,0|3,0,0]=4 2161 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,1,0,0,0,0|3,0,0]=4 2162 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [0,1,0,0,0,0|3,0,0]=4 2163 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [0,1,0,0,0,0|3,0,0]=4 2164 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,1,0,0,0,0|3,0,0]=4 2165 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,1,0,0,0,0|3,0,0]=4 2166 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,1,0,0,0,0|3,0,0]=4 2167 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,1,0,0,0,0|2,0,0]=3 2168 B12R1.34 NCC(F)C(F)c1ccccc1 Amb25851560 [0,1,0,0,0,0|3,0,0]=4 2169 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,1,0,0,0,0|3,0,0]=4 2170 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,1,0,0,0,0|3,0,0]=4 2171 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,1,0,0,0,0|3,0,0]=4 2172 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,1,0,0,0,0|3,0,0]=4 2173 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,1,0,0,0,0|3,0,0]=4 2174 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,1,0,0,0,0|3,0,0]=4 2175 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,1,0,0,0,0|3,0,0]=4 2176 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,1,0,0,0,0|2,0,1]=4 2177 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,1,0,0,0,0|2,0,1]=4 2178 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,1,0,0,0,0|2,0,1]=4 2179 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,1,0,0,0,0|2,0,1]=4 2180 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,1,0,0,0,0|2,0,1]=4 2181 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,1,0,0,0,0|2,0,1]=4 2182 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,1,0,0,0,0|2,0,1]=4 2183 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,1,0,0,0,0|3,0,0]=4 2184 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,1,0,0,0,0|3,0,0]=4 2185 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,1,0,0,0,0|3,0,0]=4 2186 B12R1.34 N[C@H]([C@@H](N)C#N)c1ccccc1 Amb25084618 [0,1,0,0,0,0|3,0,0]=4 2187 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,1,0,0,0,0|3,0,0]=4 2188 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,1,0,0,0,0|3,0,0]=4 2189 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,1,0,0,0,0|3,0,0]=4 2190 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [0,1,0,0,0,0|3,0,0]=4 2191 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,1,0,0,0,0|3,0,0]=4 2192 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,1,0,0,0,0|3,0,0]=4 2193 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,1,0,0,0,0|3,0,0]=4 2194 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,1,0,0,0,0|3,0,0]=4 2195 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,1,0,0,0,0|3,0,0]=4 2196 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,1,0,0,0,0|3,0,0]=4 2197 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,1,0,0,0,0|3,0,0]=4 2198 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,1,0,0,0,0|3,0,0]=4 2199 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,1,0,0,0,0|3,0,0]=4 2200 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,1,0,0,0,0|3,0,0]=4 2201 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,1,0,0,0,0|3,0,0]=4 2202 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,1,0,0,0,0|3,0,0]=4 2203 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,1,0,0,0,0|2,0,1]=4 2204 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,1,0,0,0,0|2,0,1]=4 2205 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,1,0,0,0,0|2,0,1]=4 2206 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,1,0,0,0,0|2,0,1]=4 2207 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,1,0,0,0,0|2,0,1]=4 2208 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,1,0,0,0,0|3,0,0]=4 2209 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,1,0,0,0,0|3,0,0]=4 2210 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,1,0,0,0,0|3,0,0]=4 2211 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,1,0,0,0,0|3,0,0]=4 2212 B12R1.39 C=CC[N+](c1ccccc1)(C)C Amb2228411 [0,1,0,0,0,0|2,0,1]=4 2213 B12R1.39 C=CC[Si](c1ccccc1)(C)C Amb2389294 [0,1,0,0,0,0|1,1,1]=4 2214 B12R1.39 CC(C)(CC#N)c1ccccc1 Amb18645224 [0,1,0,0,0,0|2,0,0]=3 2215 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [0,1,0,0,0,0|1,0,1]=3 2216 B12R1.39 CC(C)(CC=O)c1cccc[n]1 Amb24458826 [0,1,0,0,0,0|3,0,0]=4 2217 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [0,1,0,0,0,0|2,0,0]=3 2218 B12R1.39 CC(C)(CCBr)c1ccccc1 Amb25726868 [0,1,0,0,0,0|2,0,0]=3 2219 B12R1.39 CC(C)(CCCl)c1cc[n]cc1 Amb24710201 [0,1,0,0,0,0|3,0,0]=4 2220 B12R1.39 CC(C)(CCN)c1ccccc1 Amb22755963 [0,1,0,0,0,0|2,0,0]=3 2221 B12R1.39 CC(C)(CCO)c1ccccc1 Amb23440831 [0,1,0,0,0,0|2,0,0]=3 2222 B12R1.39 CC(C)(C[Hg]Cl)c1ccccc1 Amb22347662 [0,1,0,0,0,0|2,0,0]=3 2223 B12R1.39 CC(C)(C[Mg]Cl)c1ccccc1 Amb22336292 [0,1,0,0,0,0|2,0,0]=3 2224 B12R1.39 CC(C)(C[Zn]Cl)c1ccccc1 Amb22897847 [0,1,0,0,0,0|2,0,0]=3 2225 B12R1.39 CC(C)(N=[N+]=[N-])c1ccccc1 Amb25159577 [0,1,0,0,0,0|2,0,1]=4 2226 B12R1.39 CC(F)(CC#N)c1ccccc1 Amb24702719 [0,1,0,0,0,0|2,0,0]=3 2227 B12R1.39 CC(N)(CC=C)c1cc[n]cc1 Amb24405750 [0,1,0,0,0,0|2,0,1]=4 2228 B12R1.39 CC(N)(CC=C)c1cccc[n]1 Amb24555088 [0,1,0,0,0,0|2,0,1]=4 2229 B12R1.39 CC(N)(CCO)c1c[n]ccc1 Amb25686451 [0,1,0,0,0,0|3,0,0]=4 2230 B12R1.39 CC(N)(CCO)c1cc[n]cc1 Amb25732906 [0,1,0,0,0,0|3,0,0]=4 2231 B12R1.39 CC(N)(CCO)c1cccc[n]1 Amb24468790 [0,1,0,0,0,0|3,0,0]=4 2232 B12R1.39 CC(N)(CCO)c1ccccc1 Amb18862633 [0,1,0,0,0,0|2,0,0]=3 2233 B12R1.39 CC(O)(C#CBr)c1ccccc1 Amb22445849 [0,1,0,0,0,0|2,0,1]=4 2234 B12R1.39 CC(O)(CC#C)c1cc[n]cc1 Amb25153969 [0,1,0,0,0,0|2,0,1]=4 2235 B12R1.39 CC(O)(CC#C)c1cccc[n]1 Amb24686664 [0,1,0,0,0,0|2,0,1]=4 2236 B12R1.39 CC(O)(CC=O)c1c[n]ccc1 Amb24631274 [0,1,0,0,0,0|3,0,0]=4 2237 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [0,1,0,0,0,0|2,0,0]=3 2238 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [0,1,0,0,0,0|2,0,0]=3 2239 B12R1.39 CC(O)(CCN)c1c[n]ccc1 Amb18827674 [0,1,0,0,0,0|3,0,0]=4 2240 B12R1.39 CC(O)(CCN)c1cc[n]cc1 Amb18827672 [0,1,0,0,0,0|3,0,0]=4 2241 B12R1.39 CC(O)(CCN)c1cccc[n]1 Amb18827673 [0,1,0,0,0,0|3,0,0]=4 2242 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [0,1,0,0,0,0|2,0,0]=3 2243 B12R1.39 CC(O)(\C=C\Cl)c1ccccc1 Amb25257949 [0,1,0,0,0,0|2,0,1]=4 2244 B12R1.39 CC(S)(CCO)c1ccccc1 Amb24630816 [0,1,0,0,0,0|2,0,0]=3 2245 B12R1.39 CCCC(C)(O)c1c[n]c[n]c1 Amb24487648 [0,1,0,0,0,0|3,0,0]=4 2246 B12R1.39 CCCC(C)(O)c1c[n]cc[n]1 Amb25034679 [0,1,0,0,0,0|3,0,0]=4 2247 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [0,1,0,0,0,0|2,0,0]=3 2248 B12R1.39 CCCS(=O)(=O)c1ccccc1 Amb24485446 [0,1,0,0,0,0|3,0,0]=4 2249 B12R1.39 CCOP(C)(=O)c1ccccc1 Amb24487373 [0,1,0,0,0,0|3,0,0]=4 2250 B12R1.39 CCO[Si](C)(C)c1ccccc1 Amb19894004 [0,1,0,0,0,0|2,1,0]=4 2251 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [0,1,0,0,0,0|0,0,0]=1 2252 B12R1.39 CNCC(C)(O)c1c[n]c[n]c1 Amb25148910 [0,1,0,0,0,0|2,0,0]=3 2253 B12R1.39 CNCC(C)(O)c1c[n]cc[n]1 Amb25719998 [0,1,0,0,0,0|2,0,0]=3 2254 B12R1.39 CNCC(C)(O)c1c[n]ccc1 Amb18062824 [0,1,0,0,0,0|1,0,0]=2 2255 B12R1.39 CNCC(C)(O)c1cc[n]cc1 Amb18562953 [0,1,0,0,0,0|1,0,0]=2 2256 B12R1.39 CNCC(C)(O)c1cccc[n]1 Amb18064992 [0,1,0,0,0,0|1,0,0]=2 2257 B12R1.39 CNCC(F)(F)c1c[n]ccc1 Amb25062659 [0,1,0,0,0,0|2,0,0]=3 2258 B12R1.39 COCC(C)(N)c1c[n]c[n]c1 Amb18299361 [0,1,0,0,0,0|3,0,0]=4 2259 B12R1.39 COCC(C)(N)c1c[n]ccc1 Amb18992599 [0,1,0,0,0,0|2,0,0]=3 2260 B12R1.39 COCC(C)(N)c1cc[n]cc1 Amb24593523 [0,1,0,0,0,0|2,0,0]=3 2261 B12R1.39 COCC(C)(N)c1cccc[n]1 Amb25762842 [0,1,0,0,0,0|2,0,0]=3 2262 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [0,1,0,0,0,0|1,0,0]=2 2263 B12R1.39 COCC(C)(O)c1c[n]c[n]c1 Amb18805826 [0,1,0,0,0,0|3,0,0]=4 2264 B12R1.39 COCC(C)(O)c1c[n]cc[n]1 Amb24679828 [0,1,0,0,0,0|3,0,0]=4 2265 B12R1.39 COCC(C)(O)c1c[n]ccc1 Amb18805605 [0,1,0,0,0,0|2,0,0]=3 2266 B12R1.39 COCC(C)(O)c1cc[n]c[n]1 Amb24600251 [0,1,0,0,0,0|3,0,0]=4 2267 B12R1.39 COCC(C)(O)c1cc[n]cc1 Amb22897033 [0,1,0,0,0,0|2,0,0]=3 2268 B12R1.39 COCC(C)(O)c1cccc[n]1 Amb22897034 [0,1,0,0,0,0|2,0,0]=3 2269 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [0,1,0,0,0,0|1,0,0]=2 2270 B12R1.39 COCS(=O)(=O)c1ccccc1 Amb24324970 [0,1,0,0,0,0|3,0,0]=4 2271 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [0,1,0,0,0,0|1,0,0]=2 2272 B12R1.39 CP(=S)(CC=O)c1ccccc1 Amb25743462 [0,1,0,0,0,0|3,0,0]=4 2273 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [0,1,0,0,0,0|1,0,0]=2 2274 B12R1.39 C[C@@](N)(CC#N)c1ccccc1 Amb25059074 [0,1,0,0,0,0|2,0,0]=3 2275 B12R1.39 C[C@@](N)(CC=C)c1cc[n]cc1 Amb24414079 [0,1,0,0,0,0|2,0,1]=4 2276 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [0,1,0,0,0,0|1,0,1]=3 2277 B12R1.39 C[C@@](N)(CCO)c1c[n]ccc1 Amb25709797 [0,1,0,0,0,0|3,0,0]=4 2278 B12R1.39 C[C@@](N)(CCO)c1cc[n]cc1 Amb25776127 [0,1,0,0,0,0|3,0,0]=4 2279 B12R1.39 C[C@@](N)(CCO)c1cccc[n]1 Amb25704179 [0,1,0,0,0,0|3,0,0]=4 2280 B12R1.39 C[C@@](N)(CCO)c1ccccc1 Amb25097043 [0,1,0,0,0,0|2,0,0]=3 2281 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [0,1,0,0,0,0|2,0,0]=3 2282 B12R1.39 C[C@](N)(CC#N)c1ccccc1 Amb24559923 [0,1,0,0,0,0|2,0,0]=3 2283 B12R1.39 C[C@](N)(CC=C)c1c[n]ccc1 Amb25751494 [0,1,0,0,0,0|2,0,1]=4 2284 B12R1.39 C[C@](N)(CC=C)c1cccc[n]1 Amb25141113 [0,1,0,0,0,0|2,0,1]=4 2285 B12R1.39 C[C@](N)(CCO)c1cccc[n]1 Amb24341958 [0,1,0,0,0,0|3,0,0]=4 2286 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [0,1,0,0,0,0|2,0,0]=3 2287 B12R1.39 C[C@](S)(CCO)c1ccccc1 Amb25120134 [0,1,0,0,0,0|2,0,0]=3 2288 B12R1.39 C[Si](C)(CC=O)c1ccccc1 Amb25264011 [0,1,0,0,0,0|2,1,0]=4 2289 B12R1.39 C[Si](C)(CCCl)c1ccccc1 Amb25765655 [0,1,0,0,0,0|2,1,0]=4 2290 B12R1.39 C[Si](C)(CCO)c1ccccc1 Amb25788909 [0,1,0,0,0,0|2,1,0]=4 2291 B12R1.39 C[Si](C)(C[Mg]Cl)c1ccccc1 Amb19928778 [0,1,0,0,0,0|2,1,0]=4 2292 B12R1.39 C[Si](C)(C[Zn]Cl)c1ccccc1 Amb22898104 [0,1,0,0,0,0|2,1,0]=4 2293 B12R1.39 N#CCC(F)(F)c1ccccc1 Amb25070879 [0,1,0,0,0,0|3,0,0]=4 2294 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [0,1,0,0,0,0|3,0,0]=4 2295 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [0,1,0,0,0,0|2,0,0]=3 2296 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [0,1,0,0,0,0|2,0,0]=3 2297 B12R1.39 NNCC(c1ccccc1)(O)C Amb17232616 [0,1,0,0,0,0|1,0,0]=2 2298 B12R1.39 NOCC(F)(F)c1ccccc1 Amb25842068 [0,1,0,0,0,0|3,0,0]=4 2299 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [0,1,0,0,0,0|3,0,0]=4 2300 B12R1.39 O=C=NC(c1ccccc1)(C)C Amb17232367 [0,1,0,0,0,0|3,0,0]=4 2301 B12R1.39 [BH3-][P+](C)(CC=O)c1ccccc1 Amb24378353 [0,1,0,0,0,0|3,0,0]=4 2302 B12R1.39 [C-]#[N+]CC(F)(F)c1ccccc1 Amb25249868 [0,1,0,0,0,0|1,0,2]=4 2303 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [0,1,0,0,0,0|1,0,0]=2 2304 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,1,0,0,0,0|2,0,1]=4 2305 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,1,0,0,0,0|2,0,1]=4 2306 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,1,0,0,0,0|2,0,1]=4 2307 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,1,0,0,0,0|2,0,1]=4 2308 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,1,0,0,0,0|2,0,0]=3 2309 B12R1.107 CC(=C)CC(O)c1cc[n]cc1 Amb24439149 [0,1,0,0,0,0|3,0,0]=4 2310 B12R1.107 CC(=C)CC(O)c1ccc[n]c1 Amb25083900 [0,1,0,0,0,0|3,0,0]=4 2311 B12R1.107 CC(=C)CC(O)c1cccc[n]1 Amb25675378 [0,1,0,0,0,0|3,0,0]=4 2312 B12R1.107 CC(=C)CN(C)c1cc[n]cc1 Amb24459023 [0,1,0,0,0,0|3,0,0]=4 2313 B12R1.107 CC(=C)CN(C)c1cccc[n]1 Amb24619418 [0,1,0,0,0,0|3,0,0]=4 2314 B12R1.107 CC(=C)C[C@@H](N)c1ccc[n]c1 Amb24612157 [0,1,0,0,0,0|3,0,0]=4 2315 B12R1.107 CC(=C)C[C@H](N)c1cccc[n]1 Amb24629000 [0,1,0,0,0,0|3,0,0]=4 2316 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,1,0,0,0,0|2,0,0]=3 2317 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,1,0,0,0,0|2,0,0]=3 2318 B12R1.107 CC(=N)NC(C)c1c[n]ccc1 Amb25054353 [0,1,0,0,0,0|3,0,0]=4 2319 B12R1.107 CC(=N)NC(C)c1cc[n]cc1 Amb25242908 [0,1,0,0,0,0|3,0,0]=4 2320 B12R1.107 CC(=N)NC(C)c1cccc[n]1 Amb25799324 [0,1,0,0,0,0|3,0,0]=4 2321 B12R1.107 CC(=NN(C)C)c1ccccc1 Amb22230212 [0,1,0,0,0,0|1,0,1]=3 2322 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [0,1,0,0,0,0|2,0,0]=3 2323 B12R1.107 CC(=O)CC(C)c1cc[n]c[n]1 Amb24580545 [0,1,0,0,0,0|3,0,0]=4 2324 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [0,1,0,0,0,0|2,0,0]=3 2325 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [0,1,0,0,0,0|3,0,0]=4 2326 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [0,1,0,0,0,0|3,0,0]=4 2327 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [0,1,0,0,0,0|2,0,0]=3 2328 B12R1.107 CC(=O)NC(C)c1cc[n]cc1 Amb25150955 [0,1,0,0,0,0|3,0,0]=4 2329 B12R1.107 CC(=O)NC(C)c1cccc[n]1 Amb25150956 [0,1,0,0,0,0|3,0,0]=4 2330 B12R1.107 CC(=O)N[C@@H](C)c1cccc[n]1 Amb25134946 [0,1,0,0,0,0|3,0,0]=4 2331 B12R1.107 CC(=O)N[C@H](C)c1cccc[n]1 Amb24659356 [0,1,0,0,0,0|3,0,0]=4 2332 B12R1.107 CC(=O)OC(C)c1c[n]ccc1 Amb25723772 [0,1,0,0,0,0|3,0,0]=4 2333 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,1,0,0,0,0|2,0,0]=3 2334 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,1,0,0,0,0|2,0,0]=3 2335 B12R1.107 CC(=S)N[C@@H](C)c1ccccc1 Amb24532689 [0,1,0,0,0,0|2,0,0]=3 2336 B12R1.107 CC(Br)CN(C)c1cc[n]cc1 Amb25115310 [0,1,0,0,0,0|3,0,0]=4 2337 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,1,0,0,0,0|2,0,1]=4 2338 B12R1.107 CC(C)CC(Cl)c1ccc[n]c1 Amb24703067 [0,1,0,0,0,0|3,0,0]=4 2339 B12R1.107 CC(C)CC(N)c1cc[n]cc1 Amb18968290 [0,1,0,0,0,0|3,0,0]=4 2340 B12R1.107 CC(C)CC(N)c1cccc[n]1 Amb18993299 [0,1,0,0,0,0|3,0,0]=4 2341 B12R1.107 CC(C)CC(N)c1cccc[n]1 Amb22499080 [0,1,0,0,0,0|3,0,0]=4 2342 B12R1.107 CC(C)CC(O)c1cc[n]cc1 Amb18792668 [0,1,0,0,0,0|3,0,0]=4 2343 B12R1.107 CC(C)CC(O)c1cccc[n]1 Amb18792671 [0,1,0,0,0,0|3,0,0]=4 2344 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,1,0,0,0,0|2,0,0]=3 2345 B12R1.107 CC(C)C[C@@H](N)c1cc[n]cc1 Amb24573501 [0,1,0,0,0,0|3,0,0]=4 2346 B12R1.107 CC(C)C[C@@H](N)c1ccc[n]c1 Amb24450038 [0,1,0,0,0,0|3,0,0]=4 2347 B12R1.107 CC(C)C[C@@H](N)c1cccc[n]1 Amb25850213 [0,1,0,0,0,0|3,0,0]=4 2348 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,1,0,0,0,0|2,0,0]=3 2349 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,1,0,0,0,0|2,0,0]=3 2350 B12R1.107 CC(C)C[C@H](N)c1cc[n]cc1 Amb24567925 [0,1,0,0,0,0|3,0,0]=4 2351 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,1,0,0,0,0|2,0,0]=3 2352 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,1,0,0,0,0|2,0,0]=3 2353 B12R1.107 CC(C)NC(C)c1cccc[n]1 Amb22274350 [0,1,0,0,0,0|3,0,0]=4 2354 B12R1.107 CC(C)N[C@@H](C)c1c[n]ccc1 Amb24739309 [0,1,0,0,0,0|3,0,0]=4 2355 B12R1.107 CC(C)N[C@@H](C)c1cc[n]cc1 Amb25282212 [0,1,0,0,0,0|3,0,0]=4 2356 B12R1.107 CC(C)N[C@@H](C)c1cccc[n]1 Amb25234954 [0,1,0,0,0,0|3,0,0]=4 2357 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,1,0,0,0,0|2,0,0]=3 2358 B12R1.107 CC(C)N[C@H](C)c1c[n]ccc1 Amb25830845 [0,1,0,0,0,0|3,0,0]=4 2359 B12R1.107 CC(C)SC(C)c1c[n]ccc1 Amb25788724 [0,1,0,0,0,0|3,0,0]=4 2360 B12R1.107 CC(C)SC(C)c1ccccc1 Amb24371858 [0,1,0,0,0,0|2,0,0]=3 2361 B12R1.107 CC(C)[NH2+][C@@H](C)c1ccccc1 Amb22049556 [0,1,0,0,0,0|2,0,0]=3 2362 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,1,0,0,0,0|2,0,0]=3 2363 B12R1.107 CC(CC(C)Br)c1c[n]cc[n]1 Amb25094735 [0,1,0,0,0,0|3,0,0]=4 2364 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,1,0,0,0,0|1,0,0]=2 2365 B12R1.107 CC(CC(C)O)c1c[n]cc[n]1 Amb25117161 [0,1,0,0,0,0|3,0,0]=4 2366 B12R1.107 CC(CC(C)O)c1c[n]ccc1 Amb25278209 [0,1,0,0,0,0|2,0,0]=3 2367 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,1,0,0,0,0|3,0,0]=4 2368 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,1,0,0,0,0|2,0,0]=3 2369 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,1,0,0,0,0|2,0,0]=3 2370 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,1,0,0,0,0|2,0,0]=3 2371 B12R1.107 CC(CC(c1cccnc1)N)C Amb10607963 [0,1,0,0,0,0|3,0,0]=4 2372 B12R1.107 CC(CC(c1cccnc1)O)C Amb17232541 [0,1,0,0,0,0|3,0,0]=4 2373 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,1,0,0,0,0|0,0,0]=1 2374 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,1,0,0,0,0|0,0,0]=1 2375 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,1,0,0,0,0|0,0,0]=1 2376 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,1,0,0,0,0|2,0,0]=3 2377 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,1,0,0,0,0|2,0,0]=3 2378 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,1,0,0,0,0|2,0,0]=3 2379 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,1,0,0,0,0|2,0,0]=3 2380 B12R1.107 CC(CN(c1ccccc1)N)C Amb17226667 [0,1,0,0,0,0|3,0,0]=4 2381 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,1,0,0,0,0|1,0,0]=2 2382 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,1,0,0,0,0|2,0,0]=3 2383 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,1,0,0,0,0|2,0,0]=3 2384 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,1,0,0,0,0|2,0,0]=3 2385 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb20668879 [0,1,0,0,0,0|2,0,1]=4 2386 B12R1.107 CC(N)CC(=O)c1ccccc1 Amb22059727 [0,1,0,0,0,0|2,0,1]=4 2387 B12R1.107 CC(N)CC(O)c1ccc[n]c1 Amb25798886 [0,1,0,0,0,0|3,0,0]=4 2388 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,1,0,0,0,0|2,0,0]=3 2389 B12R1.107 CC(N)CN(C)c1cc[n]cc1 Amb25070787 [0,1,0,0,0,0|3,0,0]=4 2390 B12R1.107 CC(N)CN(C)c1cccc[n]1 Amb18828177 [0,1,0,0,0,0|3,0,0]=4 2391 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,1,0,0,0,0|2,0,0]=3 2392 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [0,1,0,0,0,0|3,0,0]=4 2393 B12R1.107 CC(NC(N)=N)c1ccccc1 Amb22284229 [0,1,0,0,0,0|3,0,0]=4 2394 B12R1.107 CC(NN(C)C)c1c[n]cc[n]1 Amb25314111 [0,1,0,0,0,0|3,0,0]=4 2395 B12R1.107 CC(NN(C)C)c1cc[n]cc1 Amb25156586 [0,1,0,0,0,0|2,0,0]=3 2396 B12R1.107 CC(NN(C)C)c1cccc[n]1 Amb24364346 [0,1,0,0,0,0|2,0,0]=3 2397 B12R1.107 CC(NN(C)C)c1ccccc1 Amb24608774 [0,1,0,0,0,0|1,0,0]=2 2398 B12R1.107 CC(O)CC(N)c1cc[n]cc1 Amb25124085 [0,1,0,0,0,0|3,0,0]=4 2399 B12R1.107 CC(O)CC(N)c1ccc[n]c1 Amb25362253 [0,1,0,0,0,0|3,0,0]=4 2400 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,1,0,0,0,0|2,0,0]=3 2401 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,1,0,0,0,0|2,0,0]=3 2402 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,1,0,0,0,0|2,0,0]=3 2403 B12R1.107 CC(O)CN(C)c1cc[n]cc1 Amb18798599 [0,1,0,0,0,0|3,0,0]=4 2404 B12R1.107 CC(O)CN(C)c1cccc[n]1 Amb18798612 [0,1,0,0,0,0|3,0,0]=4 2405 B12R1.107 CC(O)CS(=O)c1ccccc1 Amb25042910 [0,1,0,0,0,0|3,0,0]=4 2406 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,1,0,0,0,0|2,0,0]=3 2407 B12R1.107 CC(OC(C)=O)c1ccccn1 Amb17912737 [0,1,0,0,0,0|3,0,0]=4 2408 B12R1.107 CC(OC(C)=O)c1ccncc1 Amb17689315 [0,1,0,0,0,0|3,0,0]=4 2409 B12R1.107 CC([SiH2]C(Cl)Cl)c1ccccc1 Amb25743475 [0,1,0,0,0,0|2,1,0]=4 2410 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,1,0,0,0,0|2,0,0]=3 2411 B12R1.107 CC(c1ccccc1)NC(=N)N Amb10669498 [0,1,0,0,0,0|3,0,0]=4 2412 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,1,0,0,0,0|3,0,0]=4 2413 B12R1.107 CC(c1ccccc1)NC(=S)N Amb1645582 [0,1,0,0,0,0|3,0,0]=4 2414 B12R1.107 CN(C)CC(=C)c1cc[n]cc1 Amb25202370 [0,1,0,0,0,0|1,0,2]=4 2415 B12R1.107 CN(C)CC(=O)c1cc[n]cc1 Amb25222976 [0,1,0,0,0,0|2,0,1]=4 2416 B12R1.107 CN(C)CC(=O)c1ccc[n]c1 Amb25054451 [0,1,0,0,0,0|2,0,1]=4 2417 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [0,1,0,0,0,0|1,0,1]=3 2418 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [0,1,0,0,0,0|1,0,0]=2 2419 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [0,1,0,0,0,0|1,0,0]=2 2420 B12R1.107 CN(C)CC(N)c1c[n]cc[n]1 Amb25035171 [0,1,0,0,0,0|3,0,0]=4 2421 B12R1.107 CN(C)CC(N)c1cc[n]cc1 Amb25315967 [0,1,0,0,0,0|2,0,0]=3 2422 B12R1.107 CN(C)CC(N)c1cccc[n]1 Amb24543991 [0,1,0,0,0,0|2,0,0]=3 2423 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,1,0,0,0,0|1,0,0]=2 2424 B12R1.107 CN(C)CC(O)c1c[n]c[n]c1 Amb25316533 [0,1,0,0,0,0|3,0,0]=4 2425 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,1,0,0,0,0|1,0,0]=2 2426 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [0,1,0,0,0,0|1,0,0]=2 2427 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,1,0,0,0,0|1,0,0]=2 2428 B12R1.107 CN(C)NC(=N)c1ccccc1 Amb24720079 [0,1,0,0,0,0|2,0,1]=4 2429 B12R1.107 CN(C)\C=C(/O)\c1ccccc1 Amb24068870 [0,1,0,0,0,0|1,0,2]=4 2430 B12R1.107 CN(CC(Cl)Cl)c1ccccc1 Amb24351871 [0,1,0,0,0,0|3,0,0]=4 2431 B12R1.107 CN(CC(F)F)c1ccccc1 Amb25079937 [0,1,0,0,0,0|3,0,0]=4 2432 B12R1.107 CN(CC(c1ccccn1)O)C Amb17550347 [0,1,0,0,0,0|2,0,0]=3 2433 B12R1.107 CN(CC(c1cccnc1)O)C Amb17550203 [0,1,0,0,0,0|2,0,0]=3 2434 B12R1.107 CN(NC(=O)c1ccccc1)C Amb10574824 [0,1,0,0,0,0|2,0,1]=4 2435 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,1,0,0,0,0|2,0,0]=3 2436 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,1,0,0,0,0|3,0,0]=4 2437 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,1,0,0,0,0|3,0,0]=4 2438 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,1,0,0,0,0|3,0,0]=4 2439 B12R1.107 CS(=O)CC(=O)c1ccccc1 Amb24741512 [0,1,0,0,0,0|2,0,1]=4 2440 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,1,0,0,0,0|2,0,0]=3 2441 B12R1.107 CS(=O)CC(O)c1cc[n]cc1 Amb25753341 [0,1,0,0,0,0|3,0,0]=4 2442 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,1,0,0,0,0|2,0,0]=3 2443 B12R1.107 CS(=O)C[C@@H](O)c1cc[n]cc1 Amb25333612 [0,1,0,0,0,0|3,0,0]=4 2444 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,1,0,0,0,0|2,0,0]=3 2445 B12R1.107 C[C@@H](N)CS(=O)c1ccccc1 Amb24381565 [0,1,0,0,0,0|3,0,0]=4 2446 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,1,0,0,0,0|2,0,0]=3 2447 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,1,0,0,0,0|3,0,0]=4 2448 B12R1.107 C[C@@H](O)CN(C)c1cc[n]cc1 Amb25065978 [0,1,0,0,0,0|3,0,0]=4 2449 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,1,0,0,0,0|2,0,0]=3 2450 B12R1.107 C[C@@H](O)CS(=O)c1ccccc1 Amb25788068 [0,1,0,0,0,0|3,0,0]=4 2451 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,1,0,0,0,0|2,0,0]=3 2452 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,1,0,0,0,0|2,0,0]=3 2453 B12R1.107 C[C@@H](SC(N)=N)c1ccccc1 Amb25807975 [0,1,0,0,0,0|3,0,0]=4 2454 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,1,0,0,0,0|2,0,0]=3 2455 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,1,0,0,0,0|1,0,0]=2 2456 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,1,0,0,0,0|2,0,0]=3 2457 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,1,0,0,0,0|2,0,0]=3 2458 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,1,0,0,0,0|2,0,0]=3 2459 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,1,0,0,0,0|3,0,0]=4 2460 B12R1.107 C[C@H](O)CC(=C)c1ccccc1 Amb25741335 [0,1,0,0,0,0|1,0,2]=4 2461 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,1,0,0,0,0|2,0,0]=3 2462 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,1,0,0,0,0|2,0,0]=3 2463 B12R1.107 C[C@H](O)CN(C)c1cccc[n]1 Amb25182856 [0,1,0,0,0,0|3,0,0]=4 2464 B12R1.107 C[C@H](O)CS(=O)c1ccccc1 Amb24364273 [0,1,0,0,0,0|3,0,0]=4 2465 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,1,0,0,0,0|2,0,0]=3 2466 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,1,0,0,0,0|2,0,0]=3 2467 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,1,0,0,0,0|2,0,0]=3 2468 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,1,0,0,0,0|2,0,0]=3 2469 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,1,0,0,0,0|1,0,2]=4 2470 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,1,0,0,0,0|1,0,2]=4 2471 B12R1.107 C\C(=C\N(C)C)\c1ccccc1 Amb25711045 [0,1,0,0,0,0|0,0,2]=3 2472 B12R1.107 C\C(=N/C(C)C)\c1ccccc1 Amb24053029 [0,1,0,0,0,0|2,0,1]=4 2473 B12R1.107 C\C(=N/N(C)C)\c1c[n]ccc1 Amb24351643 [0,1,0,0,0,0|2,0,1]=4 2474 B12R1.107 C\C(=N\N(C)C)\c1c[n]ccc1 Amb25057539 [0,1,0,0,0,0|2,0,1]=4 2475 B12R1.107 C\C(=N\N(C)C)\c1cc[n]cc1 Amb24393560 [0,1,0,0,0,0|2,0,1]=4 2476 B12R1.107 C\C(=N\N(C)C)\c1ccccc1 Amb22347640 [0,1,0,0,0,0|1,0,1]=3 2477 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,1,0,0,0,0|2,0,1]=4 2478 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,1,0,0,0,0|2,0,1]=4 2479 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [0,1,0,0,0,0|1,0,0]=2 2480 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [0,1,0,0,0,0|1,0,0]=2 2481 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,1,0,0,0,0|3,0,0]=4 2482 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,1,0,0,0,0|3,0,0]=4 2483 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,1,0,0,0,0|3,0,0]=4 2484 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,1,0,0,0,0|3,0,0]=4 2485 B12R1.107 NC(CB(O)O)c1ccccc1 Amb24658322 [0,1,0,0,0,0|3,0,0]=4 2486 B12R1.107 NC(CC(Cl)Cl)c1ccccc1 Amb25324519 [0,1,0,0,0,0|3,0,0]=4 2487 B12R1.107 NC(CC(F)F)c1ccccc1 Amb18802187 [0,1,0,0,0,0|3,0,0]=4 2488 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,1,0,0,0,0|3,0,0]=4 2489 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,1,0,0,0,0|3,0,0]=4 2490 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,1,0,0,0,0|3,0,0]=4 2491 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,1,0,0,0,0|2,0,0]=3 2492 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [0,1,0,0,0,0|1,0,0]=2 2493 B12R1.107 O=C(c1ccccc1)C[NH+](C)C Amb10554030 [0,1,0,0,0,0|1,0,2]=4 2494 B12R1.107 O=C(c1ccccc1)C[S+](C)C Amb10838263 [0,1,0,0,0,0|2,0,1]=4 2495 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,1,0,0,0,0|3,0,0]=4 2496 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,1,0,0,0,0|3,0,0]=4 2497 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,1,0,0,0,0|3,0,0]=4 2498 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [0,1,0,0,0,0|3,0,0]=4 2499 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,1,0,0,0,0|3,0,0]=4 2500 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,1,0,0,0,0|2,0,0]=3 2501 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,1,0,0,0,0|2,0,0]=3 2502 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [0,1,0,0,0,0|1,0,0]=2 2503 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [0,1,0,0,0,0|1,0,0]=2 2504 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,1,0,0,0,0|2,0,1]=4 2505 B12R1.107 OC(c1ccncc1)CN(C)C Amb17550252 [0,1,0,0,0,0|2,0,0]=3 2506 B12R1.308 C#CCC(N)c1ccccc1Cl Amb18809279 [0,1,0,0,0,0|2,0,1]=4 2507 B12R1.308 C#CCC(N)c1ccccc1F Amb18967422 [0,1,0,0,0,0|2,0,1]=4 2508 B12R1.308 C#CCC(O)c1ccccc1Cl Amb18186758 [0,1,0,0,0,0|2,0,1]=4 2509 B12R1.308 C#CCC(O)c1ccccc1F Amb18788274 [0,1,0,0,0,0|2,0,1]=4 2510 B12R1.308 C#CC[C@@H](O)c1ccccc1F Amb24100209 [0,1,0,0,0,0|2,0,1]=4 2511 B12R1.308 C#CC[C@H](O)c1ccccc1Cl Amb25158196 [0,1,0,0,0,0|2,0,1]=4 2512 B12R1.308 C=CCC(N)c1ccccc1Br Amb18293502 [0,1,0,0,0,0|2,0,1]=4 2513 B12R1.308 C=CCC(N)c1ccccc1Cl Amb18986268 [0,1,0,0,0,0|2,0,1]=4 2514 B12R1.308 C=CCC(N)c1ccccc1F Amb19002611 [0,1,0,0,0,0|2,0,1]=4 2515 B12R1.308 C=CCC(N)c1ccccc1I Amb25377094 [0,1,0,0,0,0|2,0,1]=4 2516 B12R1.308 C=CCC(N)c1ccccc1O Amb25261429 [0,1,0,0,0,0|2,0,1]=4 2517 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [0,1,0,0,0,0|2,0,1]=4 2518 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [0,1,0,0,0,0|2,0,1]=4 2519 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [0,1,0,0,0,0|2,0,1]=4 2520 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [0,1,0,0,0,0|2,0,1]=4 2521 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [0,1,0,0,0,0|2,0,1]=4 2522 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb19889592 [0,1,0,0,0,0|2,0,1]=4 2523 B12R1.308 C=CC[C@@H](N)c1ccccc1Cl Amb22831179 [0,1,0,0,0,0|2,0,1]=4 2524 B12R1.308 C=CC[C@@H](N)c1ccccc1F Amb22831408 [0,1,0,0,0,0|2,0,1]=4 2525 B12R1.308 C=CC[C@@H](N)c1ccccc1N Amb25368389 [0,1,0,0,0,0|2,0,1]=4 2526 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [0,1,0,0,0,0|2,0,1]=4 2527 B12R1.308 C=CC[C@H](N)c1ccccc1Cl Amb19889591 [0,1,0,0,0,0|2,0,1]=4 2528 B12R1.308 C=CC[C@H](N)c1ccccc1N Amb25138190 [0,1,0,0,0,0|2,0,1]=4 2529 B12R1.308 C=CC[C@H](N)c1ccccc1S Amb24460315 [0,1,0,0,0,0|2,0,1]=4 2530 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [0,1,0,0,0,0|2,0,1]=4 2531 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [0,1,0,0,0,0|2,0,1]=4 2532 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [0,1,0,0,0,0|2,0,1]=4 2533 B12R1.308 CC#CC(C)c1ccccc1O Amb24497018 [0,1,0,0,0,0|1,0,1]=3 2534 B12R1.308 CC#CC(O)c1ccccc1Cl Amb25859323 [0,1,0,0,0,0|2,0,1]=4 2535 B12R1.308 CC(CC#N)c1ccccc1Cl Amb25083306 [0,1,0,0,0,0|2,0,0]=3 2536 B12R1.308 CC(CC#N)c1ccccc1O Amb18645498 [0,1,0,0,0,0|2,0,0]=3 2537 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [0,1,0,0,0,0|2,0,0]=3 2538 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [0,1,0,0,0,0|2,0,0]=3 2539 B12R1.308 CC(CCN)c1cc[n]cc1F Amb25378379 [0,1,0,0,0,0|3,0,0]=4 2540 B12R1.308 CC(CCN)c1ccccc1O Amb24643805 [0,1,0,0,0,0|2,0,0]=3 2541 B12R1.308 CC(N=C=O)c1ccccc1F Amb24483318 [0,1,0,0,0,0|3,0,0]=4 2542 B12R1.308 CC(N=C=O)c1ccccc1O Amb25178459 [0,1,0,0,0,0|3,0,0]=4 2543 B12R1.308 CC(N=C=S)c1ccccc1Cl Amb19054917 [0,1,0,0,0,0|3,0,0]=4 2544 B12R1.308 CC(N=C=S)c1ccccc1F Amb18796431 [0,1,0,0,0,0|3,0,0]=4 2545 B12R1.308 CC(N=[N+]=[N-])c1ccccc1Cl Amb25779276 [0,1,0,0,0,0|2,0,1]=4 2546 B12R1.308 CC(NC#N)c1ccccc1Cl Amb18809457 [0,1,0,0,0,0|3,0,0]=4 2547 B12R1.308 CC(NC#N)c1ccccc1F Amb18800782 [0,1,0,0,0,0|3,0,0]=4 2548 B12R1.308 CC(NC=O)c1ccccc1Cl Amb25717177 [0,1,0,0,0,0|3,0,0]=4 2549 B12R1.308 CC(NC=O)c1ccccc1F Amb25700735 [0,1,0,0,0,0|3,0,0]=4 2550 B12R1.308 CC(NC=O)c1ccccc1O Amb24485592 [0,1,0,0,0,0|3,0,0]=4 2551 B12R1.308 CCCC(=N)c1ccccc1O Amb24721703 [0,1,0,0,0,0|2,0,1]=4 2552 B12R1.308 CCCC(=O)c1ccccc1Br Amb17343723 [0,1,0,0,0,0|2,0,1]=4 2553 B12R1.308 CCCC(=O)c1ccccc1C Amb17198733 [0,1,0,0,0,0|2,0,1]=4 2554 B12R1.308 CCCC(=O)c1ccccc1Cl Amb17198743 [0,1,0,0,0,0|2,0,1]=4 2555 B12R1.308 CCCC(=O)c1ccccc1F Amb17198734 [0,1,0,0,0,0|2,0,1]=4 2556 B12R1.308 CCCC(=O)c1ccccc1I Amb24397248 [0,1,0,0,0,0|2,0,1]=4 2557 B12R1.308 CCCC(=O)c1ccccc1N Amb18645869 [0,1,0,0,0,0|2,0,1]=4 2558 B12R1.308 CCCC(C)c1[n]cc[n]c1N Amb24350913 [0,1,0,0,0,0|3,0,0]=4 2559 B12R1.308 CCCC(C)c1c[n]ccc1N Amb25350094 [0,1,0,0,0,0|2,0,0]=3 2560 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [0,1,0,0,0,0|1,0,0]=2 2561 B12R1.308 CCCC(Cl)c1cc[n]cc1F Amb24388670 [0,1,0,0,0,0|3,0,0]=4 2562 B12R1.308 CCCC(Cl)c1ccc[n]c1N Amb25801186 [0,1,0,0,0,0|3,0,0]=4 2563 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [0,1,0,0,0,0|2,0,0]=3 2564 B12R1.308 CCCC(N)c1[n]cccc1Br Amb25756399 [0,1,0,0,0,0|3,0,0]=4 2565 B12R1.308 CCCC(N)c1[n]cccc1F Amb25698331 [0,1,0,0,0,0|3,0,0]=4 2566 B12R1.308 CCCC(N)c1c[n]ccc1Cl Amb24551068 [0,1,0,0,0,0|3,0,0]=4 2567 B12R1.308 CCCC(N)c1cc[n]cc1N Amb24718260 [0,1,0,0,0,0|3,0,0]=4 2568 B12R1.308 CCCC(N)c1cc[n]cc1O Amb24487322 [0,1,0,0,0,0|3,0,0]=4 2569 B12R1.308 CCCC(N)c1ccc[n]c1F Amb24744474 [0,1,0,0,0,0|3,0,0]=4 2570 B12R1.308 CCCC(N)c1ccc[n]c1S Amb24763765 [0,1,0,0,0,0|3,0,0]=4 2571 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [0,1,0,0,0,0|2,0,0]=3 2572 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [0,1,0,0,0,0|2,0,0]=3 2573 B12R1.308 CCCC(O)c1[n]cccc1Br Amb24554689 [0,1,0,0,0,0|3,0,0]=4 2574 B12R1.308 CCCC(O)c1[n]cccc1O Amb25092013 [0,1,0,0,0,0|3,0,0]=4 2575 B12R1.308 CCCC(O)c1c[n]ccc1Cl Amb25317649 [0,1,0,0,0,0|3,0,0]=4 2576 B12R1.308 CCCC(O)c1ccc[n]c1N Amb25719741 [0,1,0,0,0,0|3,0,0]=4 2577 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [0,1,0,0,0,0|2,0,0]=3 2578 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [0,1,0,0,0,0|2,0,0]=3 2579 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [0,1,0,0,0,0|2,0,0]=3 2580 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [0,1,0,0,0,0|2,0,0]=3 2581 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [0,1,0,0,0,0|2,0,0]=3 2582 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [0,1,0,0,0,0|2,0,0]=3 2583 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [0,1,0,0,0,0|2,0,0]=3 2584 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [0,1,0,0,0,0|2,0,0]=3 2585 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [0,1,0,0,0,0|2,0,0]=3 2586 B12R1.308 CCCN(C)c1[n]cccc1Br Amb25809736 [0,1,0,0,0,0|3,0,0]=4 2587 B12R1.308 CCCN(C)c1[n]cccc1Cl Amb25078817 [0,1,0,0,0,0|3,0,0]=4 2588 B12R1.308 CCCN(C)c1[n]cccc1F Amb25355785 [0,1,0,0,0,0|3,0,0]=4 2589 B12R1.308 CCCN(C)c1[n]cccc1I Amb24672321 [0,1,0,0,0,0|3,0,0]=4 2590 B12R1.308 CCCN(C)c1c[n]ccc1N Amb25693507 [0,1,0,0,0,0|3,0,0]=4 2591 B12R1.308 CCCN(C)c1cc[n]cc1Br Amb24376766 [0,1,0,0,0,0|3,0,0]=4 2592 B12R1.308 CCCN(C)c1ccccc1Br Amb25306279 [0,1,0,0,0,0|2,0,0]=3 2593 B12R1.308 CCCN(C)c1ccccc1F Amb25345830 [0,1,0,0,0,0|2,0,0]=3 2594 B12R1.308 CCCS(=O)c1ccccc1N Amb18291960 [0,1,0,0,0,0|3,0,0]=4 2595 B12R1.308 CCCS(=O)c1ccccc1O Amb25143473 [0,1,0,0,0,0|3,0,0]=4 2596 B12R1.308 CCC[C@@H](N)c1c[n]ccc1Cl Amb24554560 [0,1,0,0,0,0|3,0,0]=4 2597 B12R1.308 CCC[C@@H](N)c1ccc[n]c1F Amb24359891 [0,1,0,0,0,0|3,0,0]=4 2598 B12R1.308 CCC[C@@H](N)c1ccc[n]c1N Amb24502096 [0,1,0,0,0,0|3,0,0]=4 2599 B12R1.308 CCC[C@@H](N)c1ccc[n]c1O Amb25789514 [0,1,0,0,0,0|3,0,0]=4 2600 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [0,1,0,0,0,0|2,0,0]=3 2601 B12R1.308 CCC[C@@H](O)c1[n]cccc1Cl Amb24343501 [0,1,0,0,0,0|3,0,0]=4 2602 B12R1.308 CCC[C@@H](O)c1cc[n]cc1Cl Amb25210984 [0,1,0,0,0,0|3,0,0]=4 2603 B12R1.308 CCC[C@@H](O)c1cc[n]cc1F Amb25719941 [0,1,0,0,0,0|3,0,0]=4 2604 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [0,1,0,0,0,0|2,0,0]=3 2605 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [0,1,0,0,0,0|2,0,0]=3 2606 B12R1.308 CCC[C@H](N)c1[n]cccc1Br Amb25738631 [0,1,0,0,0,0|3,0,0]=4 2607 B12R1.308 CCC[C@H](N)c1[n]cccc1Cl Amb25148612 [0,1,0,0,0,0|3,0,0]=4 2608 B12R1.308 CCC[C@H](N)c1[n]cccc1F Amb25324305 [0,1,0,0,0,0|3,0,0]=4 2609 B12R1.308 CCC[C@H](N)c1[n]cccc1O Amb24585638 [0,1,0,0,0,0|3,0,0]=4 2610 B12R1.308 CCC[C@H](N)c1c[n]ccc1N Amb24546358 [0,1,0,0,0,0|3,0,0]=4 2611 B12R1.308 CCC[C@H](N)c1cc[n]cc1Cl Amb24671287 [0,1,0,0,0,0|3,0,0]=4 2612 B12R1.308 CCC[C@H](N)c1cc[n]cc1F Amb25815303 [0,1,0,0,0,0|3,0,0]=4 2613 B12R1.308 CCC[C@H](N)c1cc[n]cc1N Amb25337593 [0,1,0,0,0,0|3,0,0]=4 2614 B12R1.308 CCC[C@H](N)c1cc[n]cc1O Amb25144000 [0,1,0,0,0,0|3,0,0]=4 2615 B12R1.308 CCC[C@H](N)c1ccc[n]c1Cl Amb24746738 [0,1,0,0,0,0|3,0,0]=4 2616 B12R1.308 CCC[C@H](N)c1ccc[n]c1N Amb24361372 [0,1,0,0,0,0|3,0,0]=4 2617 B12R1.308 CCC[C@H](N)c1ccc[n]c1S Amb24485710 [0,1,0,0,0,0|3,0,0]=4 2618 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [0,1,0,0,0,0|2,0,0]=3 2619 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [0,1,0,0,0,0|2,0,0]=3 2620 B12R1.308 CCC[C@H](O)c1[n]cccc1F Amb25355276 [0,1,0,0,0,0|3,0,0]=4 2621 B12R1.308 CCC[C@H](O)c1c[n]ccc1Cl Amb24386986 [0,1,0,0,0,0|3,0,0]=4 2622 B12R1.308 CCC[C@H](O)c1cc[n]cc1Cl Amb25361495 [0,1,0,0,0,0|3,0,0]=4 2623 B12R1.308 CCC[C@H](O)c1cc[n]cc1F Amb24718709 [0,1,0,0,0,0|3,0,0]=4 2624 B12R1.308 CCNC(C)c1cc[n]cc1Br Amb24595233 [0,1,0,0,0,0|3,0,0]=4 2625 B12R1.308 CCNC(C)c1cc[n]cc1F Amb25674314 [0,1,0,0,0,0|3,0,0]=4 2626 B12R1.308 CCNC(C)c1ccc[n]c1O Amb24715175 [0,1,0,0,0,0|3,0,0]=4 2627 B12R1.308 CCN[C@@H](C)c1ccccc1Br Amb25073112 [0,1,0,0,0,0|2,0,0]=3 2628 B12R1.308 CCN[C@@H](C)c1ccccc1Cl Amb25764966 [0,1,0,0,0,0|2,0,0]=3 2629 B12R1.308 CCN[C@H](C)c1ccccc1F Amb24665516 [0,1,0,0,0,0|2,0,0]=3 2630 B12R1.308 CCOC(C)c1ccccc1Cl Amb24061174 [0,1,0,0,0,0|2,0,0]=3 2631 B12R1.308 CCOC(C)c1ccccc1O Amb25667447 [0,1,0,0,0,0|2,0,0]=3 2632 B12R1.308 CCSC(C)c1ccccc1Br Amb24732685 [0,1,0,0,0,0|2,0,0]=3 2633 B12R1.308 CCSC(C)c1ccccc1O Amb18648671 [0,1,0,0,0,0|2,0,0]=3 2634 B12R1.308 CN(CC#C)c1ccccc1F Amb18788176 [0,1,0,0,0,0|2,0,1]=4 2635 B12R1.308 CN(CC#C)c1ccccc1I Amb24632856 [0,1,0,0,0,0|2,0,1]=4 2636 B12R1.308 CN(CC#C)c1ccccc1N Amb25299537 [0,1,0,0,0,0|2,0,1]=4 2637 B12R1.308 CN(CC#C)c1ccccc1O Amb24577764 [0,1,0,0,0,0|2,0,1]=4 2638 B12R1.308 CN(CC#N)c1ccccc1N Amb18957837 [0,1,0,0,0,0|3,0,0]=4 2639 B12R1.308 CN(CC=C)c1ccccc1F Amb24474650 [0,1,0,0,0,0|2,0,1]=4 2640 B12R1.308 CN(CC=C)c1ccccc1O Amb25674265 [0,1,0,0,0,0|2,0,1]=4 2641 B12R1.308 CN(CC=O)c1ccccc1F Amb18788557 [0,1,0,0,0,0|3,0,0]=4 2642 B12R1.308 CN(CCBr)c1ccccc1F Amb24454501 [0,1,0,0,0,0|3,0,0]=4 2643 B12R1.308 CN(CCI)c1ccccc1F Amb25344514 [0,1,0,0,0,0|3,0,0]=4 2644 B12R1.308 CN(CCO)c1ccccc1I Amb25307387 [0,1,0,0,0,0|3,0,0]=4 2645 B12R1.308 CN(CCS)c1ccccc1F Amb24577221 [0,1,0,0,0,0|3,0,0]=4 2646 B12R1.308 CN(OCC)c1ccccc1N Amb24760740 [0,1,0,0,0,0|3,0,0]=4 2647 B12R1.308 CNCC(=O)c1cc[n]cc1F Amb25076936 [0,1,0,0,0,0|2,0,1]=4 2648 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [0,1,0,0,0,0|1,0,1]=3 2649 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [0,1,0,0,0,0|1,0,1]=3 2650 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [0,1,0,0,0,0|1,0,1]=3 2651 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [0,1,0,0,0,0|0,0,0]=1 2652 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [0,1,0,0,0,0|0,0,0]=1 2653 B12R1.308 CNCC(O)c1[n]cccc1Br Amb23586111 [0,1,0,0,0,0|2,0,0]=3 2654 B12R1.308 CNCC(O)c1cc[n]cc1F Amb25259123 [0,1,0,0,0,0|2,0,0]=3 2655 B12R1.308 CNCC(O)c1cc[n]cc1O Amb25195080 [0,1,0,0,0,0|2,0,0]=3 2656 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [0,1,0,0,0,0|1,0,0]=2 2657 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [0,1,0,0,0,0|1,0,0]=2 2658 B12R1.308 CNC[C@@H](O)c1ccccc1O Amb24427596 [0,1,0,0,0,0|1,0,0]=2 2659 B12R1.308 CNNC(=O)c1ccccc1N Amb18646316 [0,1,0,0,0,0|2,0,1]=4 2660 B12R1.308 CNNC(=S)c1ccccc1O Amb25286654 [0,1,0,0,0,0|2,0,1]=4 2661 B12R1.308 CN\N=C(\N)/c1ccccc1N Amb24427653 [0,1,0,0,0,0|2,0,1]=4 2662 B12R1.308 COCC(=O)c1ccccc1N Amb24449095 [0,1,0,0,0,0|2,0,1]=4 2663 B12R1.308 COCC(N)c1[n]cccc1Cl Amb25214672 [0,1,0,0,0,0|3,0,0]=4 2664 B12R1.308 COCC(N)c1c[n]ccc1Cl Amb25709169 [0,1,0,0,0,0|3,0,0]=4 2665 B12R1.308 COCC(N)c1c[n]ccc1N Amb24483354 [0,1,0,0,0,0|3,0,0]=4 2666 B12R1.308 COCC(N)c1cc[n]cc1O Amb24428737 [0,1,0,0,0,0|3,0,0]=4 2667 B12R1.308 COCC(N)c1ccc[n]c1Br Amb25123324 [0,1,0,0,0,0|3,0,0]=4 2668 B12R1.308 COCC(N)c1ccc[n]c1Cl Amb25148567 [0,1,0,0,0,0|3,0,0]=4 2669 B12R1.308 COCC(N)c1ccc[n]c1F Amb24744446 [0,1,0,0,0,0|3,0,0]=4 2670 B12R1.308 COCC(N)c1ccc[n]c1S Amb24349749 [0,1,0,0,0,0|3,0,0]=4 2671 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [0,1,0,0,0,0|2,0,0]=3 2672 B12R1.308 COCC(N)c1ccccc1N Amb25709589 [0,1,0,0,0,0|2,0,0]=3 2673 B12R1.308 COCC(N)c1ccccc1S Amb25790028 [0,1,0,0,0,0|2,0,0]=3 2674 B12R1.308 COCC(O)c1ccc[n]c1N Amb24667513 [0,1,0,0,0,0|3,0,0]=4 2675 B12R1.308 COCC(O)c1ccccc1Br Amb24641135 [0,1,0,0,0,0|2,0,0]=3 2676 B12R1.308 COCC(O)c1ccccc1Cl Amb19058987 [0,1,0,0,0,0|2,0,0]=3 2677 B12R1.308 COCC(O)c1ccccc1F Amb18806459 [0,1,0,0,0,0|2,0,0]=3 2678 B12R1.308 COCC(O)c1ccccc1N Amb18987946 [0,1,0,0,0,0|2,0,0]=3 2679 B12R1.308 COCC(c1ccccc1C)N Amb1129629 [0,1,0,0,0,0|2,0,0]=3 2680 B12R1.308 COCC(c1ccccc1F)N Amb1139580 [0,1,0,0,0,0|2,0,0]=3 2681 B12R1.308 COCS(=O)c1ccccc1F Amb24603777 [0,1,0,0,0,0|3,0,0]=4 2682 B12R1.308 COC[C@@H](N)c1[n]cccc1F Amb24376724 [0,1,0,0,0,0|3,0,0]=4 2683 B12R1.308 COC[C@@H](N)c1[n]cccc1N Amb25824676 [0,1,0,0,0,0|3,0,0]=4 2684 B12R1.308 COC[C@@H](N)c1c[n]ccc1Br Amb25081200 [0,1,0,0,0,0|3,0,0]=4 2685 B12R1.308 COC[C@@H](N)c1c[n]ccc1N Amb24392928 [0,1,0,0,0,0|3,0,0]=4 2686 B12R1.308 COC[C@@H](N)c1cc[n]cc1Br Amb25268218 [0,1,0,0,0,0|3,0,0]=4 2687 B12R1.308 COC[C@@H](N)c1cc[n]cc1F Amb24401078 [0,1,0,0,0,0|3,0,0]=4 2688 B12R1.308 COC[C@@H](N)c1ccc[n]c1Br Amb24758878 [0,1,0,0,0,0|3,0,0]=4 2689 B12R1.308 COC[C@@H](N)c1ccc[n]c1N Amb24621830 [0,1,0,0,0,0|3,0,0]=4 2690 B12R1.308 COC[C@@H](N)c1ccccc1Cl Amb24670291 [0,1,0,0,0,0|2,0,0]=3 2691 B12R1.308 COC[C@@H](N)c1ccccc1F Amb25852206 [0,1,0,0,0,0|2,0,0]=3 2692 B12R1.308 COC[C@H](N)c1[n]cccc1Cl Amb25148600 [0,1,0,0,0,0|3,0,0]=4 2693 B12R1.308 COC[C@H](N)c1[n]cccc1N Amb25751303 [0,1,0,0,0,0|3,0,0]=4 2694 B12R1.308 COC[C@H](N)c1cc[n]cc1Br Amb25049001 [0,1,0,0,0,0|3,0,0]=4 2695 B12R1.308 COC[C@H](N)c1cc[n]cc1Cl Amb25791555 [0,1,0,0,0,0|3,0,0]=4 2696 B12R1.308 COC[C@H](N)c1cc[n]cc1N Amb25843294 [0,1,0,0,0,0|3,0,0]=4 2697 B12R1.308 COC[C@H](N)c1ccc[n]c1Br Amb25365025 [0,1,0,0,0,0|3,0,0]=4 2698 B12R1.308 COC[C@H](N)c1ccc[n]c1F Amb25047612 [0,1,0,0,0,0|3,0,0]=4 2699 B12R1.308 COC[C@H](N)c1ccc[n]c1O Amb25360139 [0,1,0,0,0,0|3,0,0]=4 2700 B12R1.308 COC[C@H](N)c1ccc[n]c1S Amb24401037 [0,1,0,0,0,0|3,0,0]=4 2701 B12R1.308 COC[C@H](N)c1ccccc1Br Amb25225784 [0,1,0,0,0,0|2,0,0]=3 2702 B12R1.308 COC[C@H](N)c1ccccc1Cl Amb25118021 [0,1,0,0,0,0|2,0,0]=3 2703 B12R1.308 COC[C@H](N)c1ccccc1I Amb24483885 [0,1,0,0,0,0|2,0,0]=3 2704 B12R1.308 COC[C@H](N)c1ccccc1S Amb25063716 [0,1,0,0,0,0|2,0,0]=3 2705 B12R1.308 CONC(C)c1ccccc1O Amb24441195 [0,1,0,0,0,0|2,0,0]=3 2706 B12R1.308 CSCC(=O)c1ccccc1Cl Amb18320104 [0,1,0,0,0,0|2,0,1]=4 2707 B12R1.308 CSCC(=O)c1ccccc1F Amb19057447 [0,1,0,0,0,0|2,0,1]=4 2708 B12R1.308 CSCC(=O)c1ccccc1O Amb18648632 [0,1,0,0,0,0|2,0,1]=4 2709 B12R1.308 CSCC(N)c1ccc[n]c1N Amb24483356 [0,1,0,0,0,0|3,0,0]=4 2710 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [0,1,0,0,0,0|2,0,0]=3 2711 B12R1.308 CSCC(N)c1ccccc1F Amb18995354 [0,1,0,0,0,0|2,0,0]=3 2712 B12R1.308 CSCC(O)c1c[n]ccc1N Amb24640917 [0,1,0,0,0,0|3,0,0]=4 2713 B12R1.308 CSCC(O)c1ccc[n]c1N Amb24483399 [0,1,0,0,0,0|3,0,0]=4 2714 B12R1.308 CSCC(O)c1ccccc1Cl Amb25789089 [0,1,0,0,0,0|2,0,0]=3 2715 B12R1.308 CSCC(O)c1ccccc1F Amb19070008 [0,1,0,0,0,0|2,0,0]=3 2716 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [0,1,0,0,0,0|2,0,0]=3 2717 B12R1.308 C[C@@H](NC#N)c1ccccc1Br Amb25853589 [0,1,0,0,0,0|3,0,0]=4 2718 B12R1.308 C[C@@H](NC#N)c1ccccc1Cl Amb24432525 [0,1,0,0,0,0|3,0,0]=4 2719 B12R1.308 C[C@@H](NC=O)c1ccccc1Br Amb24406943 [0,1,0,0,0,0|3,0,0]=4 2720 B12R1.308 C[C@@H](NC=O)c1ccccc1Cl Amb24665517 [0,1,0,0,0,0|3,0,0]=4 2721 B12R1.308 C[C@@H](NC=O)c1ccccc1F Amb24756310 [0,1,0,0,0,0|3,0,0]=4 2722 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [0,1,0,0,0,0|2,0,0]=3 2723 B12R1.308 C[C@H](CCO)c1ccccc1O Amb24686462 [0,1,0,0,0,0|2,0,0]=3 2724 B12R1.308 C[C@H](N=[N+]=[N-])c1ccccc1F Amb25824301 [0,1,0,0,0,0|2,0,1]=4 2725 B12R1.308 C[C@H](NC=O)c1ccccc1Br Amb25073668 [0,1,0,0,0,0|3,0,0]=4 2726 B12R1.308 C[C@H](NC=O)c1ccccc1Cl Amb25736127 [0,1,0,0,0,0|3,0,0]=4 2727 B12R1.308 C\C(=C/CC)\c1ccccc1N Amb24347670 [0,1,0,0,0,0|1,0,2]=4 2728 B12R1.308 C\C(=C\CC)\c1ccccc1N Amb25274437 [0,1,0,0,0,0|1,0,2]=4 2729 B12R1.308 C\C(=N/OC)\c1ccccc1N Amb25039197 [0,1,0,0,0,0|2,0,1]=4 2730 B12R1.308 C\C(=N\CC)\c1ccccc1O Amb24690698 [0,1,0,0,0,0|2,0,1]=4 2731 B12R1.308 C\C(=N\NC)\c1ccccc1Br Amb24720451 [0,1,0,0,0,0|1,0,1]=3 2732 B12R1.308 C\C(=N\NC)\c1ccccc1Cl Amb25066007 [0,1,0,0,0,0|1,0,1]=3 2733 B12R1.308 C\C(=N\NC)\c1ccccc1F Amb25369241 [0,1,0,0,0,0|1,0,1]=3 2734 B12R1.308 C\C(=N\OC)\c1ccccc1F Amb25681905 [0,1,0,0,0,0|2,0,1]=4 2735 B12R1.308 C\C(=N\OC)\c1ccccc1I Amb25284182 [0,1,0,0,0,0|2,0,1]=4 2736 B12R1.308 C\C(=N\OC)\c1ccccc1O Amb25080780 [0,1,0,0,0,0|2,0,1]=4 2737 B12R1.308 C\C(\NCC)=C\1/C=CC=CC1=O Amb25294420 [0,1,0,0,0,0|2,0,1]=4 2738 B12R1.308 C\C=C/C(C)c1ccccc1O Amb25059645 [0,1,0,0,0,0|1,0,1]=3 2739 B12R1.308 C\C=C\C(C)c1ccccc1N Amb18645537 [0,1,0,0,0,0|1,0,1]=3 2740 B12R1.308 C\C=C\C(C)c1ccccc1O Amb24608614 [0,1,0,0,0,0|1,0,1]=3 2741 B12R1.308 C\C=C\C(O)c1ccccc1O Amb24378436 [0,1,0,0,0,0|2,0,1]=4 2742 B12R1.308 Cc1[n]cccc1C(N)COC Amb25727205 [0,1,0,0,0,0|3,0,0]=4 2743 B12R1.308 Cc1[n]cccc1C(O)COC Amb24429455 [0,1,0,0,0,0|3,0,0]=4 2744 B12R1.308 Cc1[n]cccc1[C@@H](N)COC Amb24488520 [0,1,0,0,0,0|3,0,0]=4 2745 B12R1.308 Cc1[n]cccc1[C@H](N)CCC Amb25148613 [0,1,0,0,0,0|3,0,0]=4 2746 B12R1.308 Cc1[n]cccc1[C@H](N)COC Amb25104719 [0,1,0,0,0,0|3,0,0]=4 2747 B12R1.308 Cc1c[n]ccc1C(C)NCC Amb24422554 [0,1,0,0,0,0|3,0,0]=4 2748 B12R1.308 Cc1c[n]ccc1C(O)CCC Amb25354367 [0,1,0,0,0,0|3,0,0]=4 2749 B12R1.308 Cc1c[n]ccc1C(O)COC Amb24471169 [0,1,0,0,0,0|3,0,0]=4 2750 B12R1.308 Cc1c[n]ccc1N(C)CCC Amb25285141 [0,1,0,0,0,0|3,0,0]=4 2751 B12R1.308 Cc1c[n]ccc1[C@@H](N)CCC Amb25340450 [0,1,0,0,0,0|3,0,0]=4 2752 B12R1.308 Cc1c[n]ccc1[C@@H](N)COC Amb24565017 [0,1,0,0,0,0|3,0,0]=4 2753 B12R1.308 Cc1cc[n]cc1C(C)CCN Amb24566086 [0,1,0,0,0,0|3,0,0]=4 2754 B12R1.308 Cc1cc[n]cc1C(Cl)CCC Amb25688230 [0,1,0,0,0,0|3,0,0]=4 2755 B12R1.308 Cc1cc[n]cc1C(N)CCC Amb18828707 [0,1,0,0,0,0|3,0,0]=4 2756 B12R1.308 Cc1cc[n]cc1C(O)CCC Amb25751730 [0,1,0,0,0,0|3,0,0]=4 2757 B12R1.308 Cc1cc[n]cc1C(O)CSC Amb24594847 [0,1,0,0,0,0|3,0,0]=4 2758 B12R1.308 Cc1cc[n]cc1[C@@H](N)COC Amb25773948 [0,1,0,0,0,0|3,0,0]=4 2759 B12R1.308 Cc1cc[n]cc1[C@H](N)COC Amb24488663 [0,1,0,0,0,0|3,0,0]=4 2760 B12R1.308 Cc1cc[n]cc1[C@H](O)CCC Amb24398454 [0,1,0,0,0,0|3,0,0]=4 2761 B12R1.308 Cc1ccc[n]c1C(C)NCC Amb18981754 [0,1,0,0,0,0|3,0,0]=4 2762 B12R1.308 Cc1ccc[n]c1C(N)CCC Amb18985048 [0,1,0,0,0,0|3,0,0]=4 2763 B12R1.308 Cc1ccc[n]c1C(O)CCC Amb18182634 [0,1,0,0,0,0|3,0,0]=4 2764 B12R1.308 Cc1ccc[n]c1C(O)CNC Amb24711552 [0,1,0,0,0,0|2,0,0]=3 2765 B12R1.308 Cc1ccc[n]c1C(O)COC Amb24446154 [0,1,0,0,0,0|3,0,0]=4 2766 B12R1.308 Cc1ccc[n]c1[C@@H](N)COC Amb24394079 [0,1,0,0,0,0|3,0,0]=4 2767 B12R1.308 Cc1ccc[n]c1[C@H](N)CCC Amb25789996 [0,1,0,0,0,0|3,0,0]=4 2768 B12R1.308 Cc1ccc[n]c1[C@H](N)COC Amb24447022 [0,1,0,0,0,0|3,0,0]=4 2769 B12R1.308 Cc1ccc[n]c1[C@H](O)CCC Amb25043993 [0,1,0,0,0,0|3,0,0]=4 2770 B12R1.308 Cc1ccccc1C(=O)CNC Amb18862585 [0,1,0,0,0,0|1,0,1]=3 2771 B12R1.308 Cc1ccccc1C(=O)CSC Amb18796321 [0,1,0,0,0,0|2,0,1]=4 2772 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [0,1,0,0,0,0|0,0,0]=1 2773 B12R1.308 Cc1ccccc1C(C)CNN Amb24365526 [0,1,0,0,0,0|1,0,0]=2 2774 B12R1.308 Cc1ccccc1C(C)N=C=O Amb25189609 [0,1,0,0,0,0|3,0,0]=4 2775 B12R1.308 Cc1ccccc1C(C)N=C=S Amb18795944 [0,1,0,0,0,0|3,0,0]=4 2776 B12R1.308 Cc1ccccc1C(C)NC#N Amb18800411 [0,1,0,0,0,0|3,0,0]=4 2777 B12R1.308 Cc1ccccc1C(C)NC=O Amb24464016 [0,1,0,0,0,0|3,0,0]=4 2778 B12R1.308 Cc1ccccc1C(C)SCC Amb25157280 [0,1,0,0,0,0|2,0,0]=3 2779 B12R1.308 Cc1ccccc1C(Cl)CC=C Amb25044767 [0,1,0,0,0,0|2,0,1]=4 2780 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [0,1,0,0,0,0|2,0,0]=3 2781 B12R1.308 Cc1ccccc1C(Cl)CCO Amb24692648 [0,1,0,0,0,0|3,0,0]=4 2782 B12R1.308 Cc1ccccc1C(N)CC#C Amb18800159 [0,1,0,0,0,0|2,0,1]=4 2783 B12R1.308 Cc1ccccc1C(N)CC#N Amb18563498 [0,1,0,0,0,0|3,0,0]=4 2784 B12R1.308 Cc1ccccc1C(N)CC=C Amb18292097 [0,1,0,0,0,0|2,0,1]=4 2785 B12R1.308 Cc1ccccc1C(N)CCCl Amb24739582 [0,1,0,0,0,0|3,0,0]=4 2786 B12R1.308 Cc1ccccc1C(N)CSC Amb18995352 [0,1,0,0,0,0|2,0,0]=3 2787 B12R1.308 Cc1ccccc1C(O)CC#C Amb18800363 [0,1,0,0,0,0|2,0,1]=4 2788 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [0,1,0,0,0,0|2,0,1]=4 2789 B12R1.308 Cc1ccccc1C(O)COC Amb18792768 [0,1,0,0,0,0|2,0,0]=3 2790 B12R1.308 Cc1ccccc1C(O)CSC Amb19061296 [0,1,0,0,0,0|2,0,0]=3 2791 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [0,1,0,0,0,0|2,0,1]=4 2792 B12R1.308 Cc1ccccc1N(C)CC#C Amb18787877 [0,1,0,0,0,0|2,0,1]=4 2793 B12R1.308 Cc1ccccc1N(C)CC=O Amb18788186 [0,1,0,0,0,0|3,0,0]=4 2794 B12R1.308 Cc1ccccc1N(C)CCBr Amb24418265 [0,1,0,0,0,0|3,0,0]=4 2795 B12R1.308 Cc1ccccc1[C@@H](C)NC=O Amb24388804 [0,1,0,0,0,0|3,0,0]=4 2796 B12R1.308 Cc1ccccc1[C@@H](N)CC#N Amb25113376 [0,1,0,0,0,0|3,0,0]=4 2797 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [0,1,0,0,0,0|2,0,0]=3 2798 B12R1.308 Cc1ccccc1[C@@H](N)CCN Amb24567843 [0,1,0,0,0,0|3,0,0]=4 2799 B12R1.308 Cc1ccccc1[C@@H](N)CCO Amb24393358 [0,1,0,0,0,0|3,0,0]=4 2800 B12R1.308 Cc1ccccc1[C@@H](N)COC Amb24447174 [0,1,0,0,0,0|2,0,0]=3 2801 B12R1.308 Cc1ccccc1[C@H](C)NC#N Amb25767191 [0,1,0,0,0,0|3,0,0]=4 2802 B12R1.308 Cc1ccccc1[C@H](C)NC=O Amb24448498 [0,1,0,0,0,0|3,0,0]=4 2803 B12R1.308 Cc1ccccc1[C@H](C)NCC Amb24361005 [0,1,0,0,0,0|2,0,0]=3 2804 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [0,1,0,0,0,0|2,0,0]=3 2805 B12R1.308 Cc1ccccc1[C@H](N)CCN Amb24580760 [0,1,0,0,0,0|3,0,0]=4 2806 B12R1.308 Cc1ccccc1[C@H](O)CNC Amb24398599 [0,1,0,0,0,0|1,0,0]=2 2807 B12R1.308 ClCCN(c1ccccc1Br)C Amb17351919 [0,1,0,0,0,0|3,0,0]=4 2808 B12R1.308 ClCCN(c1ccccc1C)C Amb17335670 [0,1,0,0,0,0|3,0,0]=4 2809 B12R1.308 ClCCN(c1ccccc1Cl)C Amb17338055 [0,1,0,0,0,0|3,0,0]=4 2810 B12R1.308 ClCCN(c1ccccc1F)C Amb17335951 [0,1,0,0,0,0|3,0,0]=4 2811 B12R1.308 N#CCC(F)c1ccccc1F Amb24439552 [0,1,0,0,0,0|3,0,0]=4 2812 B12R1.308 N#CCC(c1ccccc1C)O Amb1111330 [0,1,0,0,0,0|3,0,0]=4 2813 B12R1.308 N#CCC(c1ccccc1F)O Amb17232516 [0,1,0,0,0,0|3,0,0]=4 2814 B12R1.308 N#CCN(c1ccccc1Br)C Amb17343206 [0,1,0,0,0,0|3,0,0]=4 2815 B12R1.308 N#CCN(c1ccccc1C)C Amb17334501 [0,1,0,0,0,0|3,0,0]=4 2816 B12R1.308 N#CCN(c1ccccc1Cl)C Amb17335463 [0,1,0,0,0,0|3,0,0]=4 2817 B12R1.308 N#CCN(c1ccccc1F)C Amb17334602 [0,1,0,0,0,0|3,0,0]=4 2818 B12R1.308 N#CC[C@@H](O)c1ccccc1Br Amb25070680 [0,1,0,0,0,0|3,0,0]=4 2819 B12R1.308 N#CC[C@@H](O)c1ccccc1Cl Amb25058529 [0,1,0,0,0,0|3,0,0]=4 2820 B12R1.308 N#CC[C@H](O)c1ccccc1Cl Amb25215874 [0,1,0,0,0,0|3,0,0]=4 2821 B12R1.308 N#CC[C@H](O)c1ccccc1F Amb25354676 [0,1,0,0,0,0|3,0,0]=4 2822 B12R1.308 NC(CC#N)c1ccccc1Br Amb18066761 [0,1,0,0,0,0|3,0,0]=4 2823 B12R1.308 NC(CC#N)c1ccccc1Cl Amb18564158 [0,1,0,0,0,0|3,0,0]=4 2824 B12R1.308 NC(CC#N)c1ccccc1F Amb18563603 [0,1,0,0,0,0|3,0,0]=4 2825 B12R1.308 NC(CCCl)c1ccccc1Cl Amb25667414 [0,1,0,0,0,0|3,0,0]=4 2826 B12R1.308 NC(CCO)c1ccccc1Br Amb18297962 [0,1,0,0,0,0|3,0,0]=4 2827 B12R1.308 NC(CCO)c1ccccc1Cl Amb19888406 [0,1,0,0,0,0|3,0,0]=4 2828 B12R1.308 NC(CCO)c1ccccc1I Amb25729935 [0,1,0,0,0,0|3,0,0]=4 2829 B12R1.308 NC(CCO)c1ccccc1O Amb24487329 [0,1,0,0,0,0|3,0,0]=4 2830 B12R1.308 NC(CCO)c1ccccc1S Amb24488674 [0,1,0,0,0,0|3,0,0]=4 2831 B12R1.308 NCCC(F)c1ccccc1Cl Amb25083769 [0,1,0,0,0,0|3,0,0]=4 2832 B12R1.308 NCCC(F)c1ccccc1O Amb24742701 [0,1,0,0,0,0|3,0,0]=4 2833 B12R1.308 NCCC(N)c1ccccc1Br Amb25339731 [0,1,0,0,0,0|3,0,0]=4 2834 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [0,1,0,0,0,0|3,0,0]=4 2835 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [0,1,0,0,0,0|3,0,0]=4 2836 B12R1.308 NCCC(c1ccccc1C)C Amb17232447 [0,1,0,0,0,0|2,0,0]=3 2837 B12R1.308 NCCC(c1ccccc1C)O Amb17232539 [0,1,0,0,0,0|3,0,0]=4 2838 B12R1.308 NCCC(c1ccccc1Cl)C Amb17234048 [0,1,0,0,0,0|2,0,0]=3 2839 B12R1.308 NCCC(c1ccccc1Cl)O Amb17234259 [0,1,0,0,0,0|3,0,0]=4 2840 B12R1.308 NCCC(c1ccccc1F)C Amb17232646 [0,1,0,0,0,0|2,0,0]=3 2841 B12R1.308 NCCC(c1ccccc1F)O Amb17232696 [0,1,0,0,0,0|3,0,0]=4 2842 B12R1.308 NCCN(c1ccccc1Br)C Amb17059772 [0,1,0,0,0,0|3,0,0]=4 2843 B12R1.308 NCCN(c1ccccc1C)C Amb17059640 [0,1,0,0,0,0|3,0,0]=4 2844 B12R1.308 NCCN(c1ccccc1Cl)C Amb17059645 [0,1,0,0,0,0|3,0,0]=4 2845 B12R1.308 NCCN(c1ccccc1F)C Amb17059642 [0,1,0,0,0,0|3,0,0]=4 2846 B12R1.308 NCC[C@@H](N)c1ccccc1Br Amb24580692 [0,1,0,0,0,0|3,0,0]=4 2847 B12R1.308 NCC[C@@H](N)c1ccccc1F Amb24744679 [0,1,0,0,0,0|3,0,0]=4 2848 B12R1.308 NCC[C@@H](N)c1ccccc1O Amb24568021 [0,1,0,0,0,0|3,0,0]=4 2849 B12R1.308 NCC[C@H](N)c1ccccc1F Amb25339749 [0,1,0,0,0,0|3,0,0]=4 2850 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [0,1,0,0,0,0|2,0,0]=3 2851 B12R1.308 NNCC(c1ccccc1C)O Amb17232608 [0,1,0,0,0,0|2,0,0]=3 2852 B12R1.308 NNCC(c1ccccc1Cl)O Amb17234360 [0,1,0,0,0,0|2,0,0]=3 2853 B12R1.308 NNCC(c1ccccc1F)O Amb17232742 [0,1,0,0,0,0|2,0,0]=3 2854 B12R1.308 N[C@@H](CC#N)c1ccccc1Cl Amb24580663 [0,1,0,0,0,0|3,0,0]=4 2855 B12R1.308 N[C@@H](CC#N)c1ccccc1S Amb24417746 [0,1,0,0,0,0|3,0,0]=4 2856 B12R1.308 N[C@@H](CCO)c1ccccc1Br Amb25140602 [0,1,0,0,0,0|3,0,0]=4 2857 B12R1.308 N[C@@H](CCO)c1ccccc1Cl Amb19888408 [0,1,0,0,0,0|3,0,0]=4 2858 B12R1.308 N[C@@H](CCO)c1ccccc1S Amb25791527 [0,1,0,0,0,0|3,0,0]=4 2859 B12R1.308 N[C@H](CC#N)c1ccccc1Br Amb24727021 [0,1,0,0,0,0|3,0,0]=4 2860 B12R1.308 N[C@H](CC#N)c1ccccc1I Amb25778122 [0,1,0,0,0,0|3,0,0]=4 2861 B12R1.308 N[C@H](CC#N)c1ccccc1O Amb24588659 [0,1,0,0,0,0|3,0,0]=4 2862 B12R1.308 N[C@H](CC#N)c1ccccc1S Amb24465056 [0,1,0,0,0,0|3,0,0]=4 2863 B12R1.308 N[C@H](CCO)c1ccccc1Br Amb25301240 [0,1,0,0,0,0|3,0,0]=4 2864 B12R1.308 N[C@H](CCO)c1ccccc1Cl Amb19887650 [0,1,0,0,0,0|3,0,0]=4 2865 B12R1.308 N[C@H](CCO)c1ccccc1S Amb25694372 [0,1,0,0,0,0|3,0,0]=4 2866 B12R1.308 Nc1ccccc1C(N)CCO Amb22235813 [0,1,0,0,0,0|3,0,0]=4 2867 B12R1.308 Nc1ccccc1[C@H](N)CC#N Amb25714152 [0,1,0,0,0,0|3,0,0]=4 2868 B12R1.308 Nc1ccccc1[C@H](N)CCO Amb19887576 [0,1,0,0,0,0|3,0,0]=4 2869 B12R1.308 OC(CCCl)c1ccccc1Cl Amb25159575 [0,1,0,0,0,0|3,0,0]=4 2870 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [0,1,0,0,0,0|3,0,0]=4 2871 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [0,1,0,0,0,0|3,0,0]=4 2872 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [0,1,0,0,0,0|3,0,0]=4 2873 B12R1.308 OCCC(c1ccccc1C)C Amb17232499 [0,1,0,0,0,0|2,0,0]=3 2874 B12R1.308 OCCC(c1ccccc1C)N Amb17103953 [0,1,0,0,0,0|3,0,0]=4 2875 B12R1.308 OCCC(c1ccccc1Cl)C Amb17234164 [0,1,0,0,0,0|2,0,0]=3 2876 B12R1.308 OCCC(c1ccccc1Cl)N Amb1993960 [0,1,0,0,0,0|3,0,0]=4 2877 B12R1.308 OCCC(c1ccccc1F)C Amb17232671 [0,1,0,0,0,0|2,0,0]=3 2878 B12R1.308 OCCC(c1ccccc1F)N Amb2408130 [0,1,0,0,0,0|3,0,0]=4 2879 B12R1.308 OCCN(c1ccccc1Br)C Amb17344451 [0,1,0,0,0,0|3,0,0]=4 2880 B12R1.308 OCCN(c1ccccc1C)C Amb17334643 [0,1,0,0,0,0|3,0,0]=4 2881 B12R1.308 OCCN(c1ccccc1Cl)C Amb17335810 [0,1,0,0,0,0|3,0,0]=4 2882 B12R1.308 OCCN(c1ccccc1F)C Amb17334763 [0,1,0,0,0,0|3,0,0]=4 2883 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [0,1,0,0,0,0|3,0,0]=4 2884 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [0,1,0,0,0,0|3,0,0]=4 2885 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [0,1,0,0,0,0|3,0,0]=4 2886 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [0,1,0,0,0,0|3,0,0]=4 2887 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [0,1,0,0,0,0|2,0,0]=3 2888 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [0,1,0,0,0,0|2,0,0]=3 2889 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [0,1,0,0,0,0|2,0,0]=3 2890 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Br Amb24743648 [0,1,0,0,0,0|1,0,2]=4 2891 B12R1.308 [C-]#[N+]CC(F)c1ccccc1Cl Amb25217280 [0,1,0,0,0,0|1,0,2]=4 2892 B12R1.308 [C-]#[N+]CC(F)c1ccccc1O Amb24654120 [0,1,0,0,0,0|1,0,2]=4 2893 B12R2.2 C1=NC(CC1)c2cccnc2 Amb17616205 [0,0,0,1,0,0|3,0,0]=4 2894 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [0,0,0,1,0,0|2,0,1]=4 2895 B12R2.2 C1C=CC=CN1C2CNCC2 Amb24406583 [0,0,0,1,0,0|1,0,1]=3 2896 B12R2.2 C1C=CCP1c2ccccc2 Amb25736369 [0,0,0,1,0,0|2,0,1]=4 2897 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [0,0,0,1,0,0|2,0,1]=4 2898 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [0,0,0,1,0,0|3,0,0]=4 2899 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [0,0,0,1,0,0|3,0,0]=4 2900 B12R2.2 C1CC(ON1)c2cc[n]cc2 Amb24102629 [0,0,0,1,0,0|2,0,0]=3 2901 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb17659140 [0,0,0,1,0,0|3,0,0]=4 2902 B12R2.2 C1CCC(N1)c2c[n]ccc2 Amb22899128 [0,0,0,1,0,0|3,0,0]=4 2903 B12R2.2 C1CCC(N1)c2cc[n]cc2 Amb17659139 [0,0,0,1,0,0|3,0,0]=4 2904 B12R2.2 C1CCC(N1)c2cccc[n]2 Amb21960411 [0,0,0,1,0,0|3,0,0]=4 2905 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [0,0,0,1,0,0|3,0,0]=4 2906 B12R2.2 C1CCC(S1)c2c[n]ccc2 Amb19373816 [0,0,0,1,0,0|3,0,0]=4 2907 B12R2.2 C1CCC(S1)c2cc[n]cc2 Amb19373819 [0,0,0,1,0,0|3,0,0]=4 2908 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [0,0,0,1,0,0|2,0,0]=3 2909 B12R2.2 C1CCCB1c2ccccc2 Amb25240096 [0,0,0,1,0,0|2,0,0]=3 2910 B12R2.2 C1CCCC1c2c[n]c[n]c2 Amb24684970 [0,0,0,1,0,0|3,0,0]=4 2911 B12R2.2 C1CCCC1c2c[n]ccc2 Amb25121665 [0,0,0,1,0,0|2,0,0]=3 2912 B12R2.2 C1CCCC1c2cc[n]cc2 Amb25808119 [0,0,0,1,0,0|2,0,0]=3 2913 B12R2.2 C1CCCC1c2cccc[n]2 Amb23589711 [0,0,0,1,0,0|2,0,0]=3 2914 B12R2.2 C1CCCN1c2cccc[n]2 Amb18269671 [0,0,0,1,0,0|3,0,0]=4 2915 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22748224 [0,0,0,1,0,0|3,0,0]=4 2916 B12R2.2 C1CC[C@@H](N1)c2c[n]ccc2 Amb22899133 [0,0,0,1,0,0|3,0,0]=4 2917 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22747201 [0,0,0,1,0,0|3,0,0]=4 2918 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754028 [0,0,0,1,0,0|3,0,0]=4 2919 B12R2.2 C1CC[C@@H](N1)c2cccc[n]2 Amb22754034 [0,0,0,1,0,0|3,0,0]=4 2920 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [0,0,0,1,0,0|2,0,0]=3 2921 B12R2.2 C1CC[C@H](N1)c2cccc[n]2 Amb22802416 [0,0,0,1,0,0|3,0,0]=4 2922 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [0,0,0,1,0,0|2,0,0]=3 2923 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb10576181 [0,0,0,1,0,0|2,0,0]=3 2924 B12R2.2 C1CC[S+](C1)c2ccccc2 Amb2447150 [0,0,0,1,0,0|2,0,0]=3 2925 B12R2.2 C1CN(C=N1)c2ccccc2 Amb22527125 [0,0,0,1,0,0|1,0,2]=4 2926 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [0,0,0,1,0,0|2,0,0]=3 2927 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [0,0,0,1,0,0|2,0,0]=3 2928 B12R2.2 C1CNC(C1)c2ccccn2 Amb2235736 [0,0,0,1,0,0|3,0,0]=4 2929 B12R2.2 C1CNC(C1)c2cccnc2 Amb10067968 [0,0,0,1,0,0|3,0,0]=4 2930 B12R2.2 C1CNC(C1)c2cccnc2 Amb2234638 [0,0,0,1,0,0|3,0,0]=4 2931 B12R2.2 C1CNC(C1)c2ccncc2 Amb1162826 [0,0,0,1,0,0|3,0,0]=4 2932 B12R2.2 C1CNC(C1)c2ccncc2 Amb2234645 [0,0,0,1,0,0|3,0,0]=4 2933 B12R2.2 C1CNN=C1c2cccc[n]2 Amb22055158 [0,0,0,1,0,0|2,0,1]=4 2934 B12R2.2 C1CNN=C1c2ccccc2 Amb25354740 [0,0,0,1,0,0|1,0,1]=3 2935 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [0,0,0,1,0,0|2,0,0]=3 2936 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [0,0,0,1,0,0|3,0,0]=4 2937 B12R2.2 C1CSC(S1)c2ccccc2 Amb23401446 [0,0,0,1,0,0|3,0,0]=4 2938 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [0,0,0,1,0,0|2,0,0]=3 2939 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [0,0,0,1,0,0|2,0,0]=3 2940 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [0,0,0,1,0,0|0,0,0]=1 2941 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [0,0,0,1,0,0|0,0,0]=1 2942 B12R2.2 C1NCC(C1)c2ccccn2 Amb10808435 [0,0,0,1,0,0|1,0,0]=2 2943 B12R2.2 C1NCC(C1)c2ccncc2 Amb10576618 [0,0,0,1,0,0|1,0,0]=2 2944 B12R2.2 C1NCC(C1)c2cnccn2 Amb10068866 [0,0,0,1,0,0|2,0,0]=3 2945 B12R2.2 C1NCC(C1)c2ncccn2 Amb10068865 [0,0,0,1,0,0|2,0,0]=3 2946 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [0,0,0,1,0,0|2,0,0]=3 2947 B12R2.2 C1NCC(O1)c2cc[n]cc2 Amb18065319 [0,0,0,1,0,0|2,0,0]=3 2948 B12R2.2 C1NCC(O1)c2cccc[n]2 Amb18065316 [0,0,0,1,0,0|2,0,0]=3 2949 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [0,0,0,1,0,0|1,0,0]=2 2950 B12R2.2 C1NCC=C1c2cc[n]cc2 Amb25145919 [0,0,0,1,0,0|1,0,2]=4 2951 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [0,0,0,1,0,0|0,0,2]=3 2952 B12R2.2 C1NCCC1c2c[n]c[n][n]2 Amb25217886 [0,0,0,1,0,0|3,0,0]=4 2953 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb18202037 [0,0,0,1,0,0|2,0,0]=3 2954 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb21961683 [0,0,0,1,0,0|2,0,0]=3 2955 B12R2.2 C1NCCC1c2c[n]c[n]c2 Amb22292101 [0,0,0,1,0,0|2,0,0]=3 2956 B12R2.2 C1NCCC1c2c[n]cc[n]2 Amb22735780 [0,0,0,1,0,0|2,0,0]=3 2957 B12R2.2 C1NCCC1c2c[n]ccc2 Amb19958035 [0,0,0,1,0,0|1,0,0]=2 2958 B12R2.2 C1NCCC1c2c[n]ccc2 Amb22490712 [0,0,0,1,0,0|1,0,0]=2 2959 B12R2.2 C1NCCC1c2cc[n]c[n]2 Amb18831325 [0,0,0,1,0,0|2,0,0]=3 2960 B12R2.2 C1NCCC1c2cc[n]cc2 Amb22233781 [0,0,0,1,0,0|1,0,0]=2 2961 B12R2.2 C1NCCC1c2ccc[n][n]2 Amb24538769 [0,0,0,1,0,0|2,0,0]=3 2962 B12R2.2 C1NCC[C@@H]1c2c[n]ccc2 Amb24673743 [0,0,0,1,0,0|1,0,0]=2 2963 B12R2.2 C1NCC[C@@H]1c2cc[n]cc2 Amb24487080 [0,0,0,1,0,0|1,0,0]=2 2964 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [0,0,0,1,0,0|0,0,0]=1 2965 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [0,0,0,1,0,0|0,0,0]=1 2966 B12R2.2 C1NCC[C@H]1c2c[n]ccc2 Amb24085651 [0,0,0,1,0,0|1,0,0]=2 2967 B12R2.2 C1NCC[C@H]1c2cc[n]cc2 Amb25716776 [0,0,0,1,0,0|1,0,0]=2 2968 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [0,0,0,1,0,0|0,0,0]=1 2969 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [0,0,0,1,0,0|2,0,1]=4 2970 B12R2.2 C1OCCC1c2c[n]ccc2 Amb24320767 [0,0,0,1,0,0|2,0,0]=3 2971 B12R2.2 C1OCCC1c2cc[n]cc2 Amb24320766 [0,0,0,1,0,0|2,0,0]=3 2972 B12R2.2 C1OCCC1c2cccc[n]2 Amb24320768 [0,0,0,1,0,0|2,0,0]=3 2973 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [0,0,0,1,0,0|1,0,0]=2 2974 B12R2.2 C1OCOC1c2cc[n]cc2 Amb24102637 [0,0,0,1,0,0|3,0,0]=4 2975 B12R2.2 C1OCOC1c2cccc[n]2 Amb24069912 [0,0,0,1,0,0|3,0,0]=4 2976 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [0,0,0,1,0,0|2,0,0]=3 2977 B12R2.2 N1=CN(CC1)c2ccccc2 Amb16226120 [0,0,0,1,0,0|1,0,2]=4 2978 B12R2.2 c1ccc(cc1)C2=NCCC2 Amb1106418 [0,0,0,1,0,0|2,0,1]=4 2979 B12R2.22 Br[C@@H]1C[C@H](C1)c2ccccc2 Amb25119213 [0,0,0,1,0,0|2,0,0]=3 2980 B12R2.22 C=C1CC(C1)c2cc[n]cc2 Amb24102821 [0,0,0,1,0,0|2,0,1]=4 2981 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb24178936 [0,0,0,1,0,0|3,0,0]=4 2982 B12R2.22 NC1CC(C1)c2ccc[n]c2 Amb25313817 [0,0,0,1,0,0|3,0,0]=4 2983 B12R2.22 NC1CC(C1)c2ccccc2 Amb19514746 [0,0,0,1,0,0|2,0,0]=3 2984 B12R2.22 NC1CN(C1)c2ccccc2 Amb23598844 [0,0,0,1,0,0|3,0,0]=4 2985 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24178917 [0,0,0,1,0,0|3,0,0]=4 2986 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24667710 [0,0,0,1,0,0|3,0,0]=4 2987 B12R2.22 N[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb24410945 [0,0,0,1,0,0|3,0,0]=4 2988 B12R2.22 N[C@@H]1C[C@@H](C1)c2ccccc2 Amb23439754 [0,0,0,1,0,0|2,0,0]=3 2989 B12R2.22 N[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb24178920 [0,0,0,1,0,0|3,0,0]=4 2990 B12R2.22 N[C@@H]1C[C@H](C1)c2ccccc2 Amb23439755 [0,0,0,1,0,0|2,0,0]=3 2991 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [0,0,0,1,0,0|3,0,0]=4 2992 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [0,0,0,1,0,0|3,0,0]=4 2993 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [0,0,0,1,0,0|3,0,0]=4 2994 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [0,0,0,1,0,0|3,0,0]=4 2995 B12R2.22 OC1CC(C1)c2cc[n]cc2 Amb25737321 [0,0,0,1,0,0|3,0,0]=4 2996 B12R2.22 OC1CC(C1)c2ccc[n]c2 Amb25063552 [0,0,0,1,0,0|3,0,0]=4 2997 B12R2.22 OC1CC(C1)c2cccc[n]2 Amb24759509 [0,0,0,1,0,0|3,0,0]=4 2998 B12R2.22 OC1CC(C1)c2ccccc2 Amb20627950 [0,0,0,1,0,0|2,0,0]=3 2999 B12R2.22 OC1CN(C1)c2ccccc2 Amb23598700 [0,0,0,1,0,0|3,0,0]=4 3000 B12R2.22 O[C@@H]1C[C@@H](C1)c2ccc[n]c2 Amb24729402 [0,0,0,1,0,0|3,0,0]=4 3001 B12R2.22 O[C@@H]1C[C@@H](C1)c2cccc[n]2 Amb25082461 [0,0,0,1,0,0|3,0,0]=4 3002 B12R2.22 O[C@@H]1C[C@H](C1)c2ccc[n]c2 Amb25081533 [0,0,0,1,0,0|3,0,0]=4 3003 B12R2.22 O[C@@H]1C[C@H](C1)c2ccccc2 Amb25749083 [0,0,0,1,0,0|2,0,0]=3 3004 B12R2.22 SC1CC(C1)c2ccccc2 Amb24690234 [0,0,0,1,0,0|2,0,0]=3 3005 B12R2.27 BrCC1CC1c2c[n]ccc2 Amb24720135 [0,0,0,1,0,0|3,0,0]=4 3006 B12R2.27 BrCC1CC1c2ccccc2 Amb25099525 [0,0,0,1,0,0|2,0,0]=3 3007 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [0,0,0,1,0,0|3,0,0]=4 3008 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [0,0,0,1,0,0|3,0,0]=4 3009 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [0,0,0,1,0,0|3,0,0]=4 3010 B12R2.27 C#CC1CC1c2ccccc2 Amb22002424 [0,0,0,1,0,0|1,0,1]=3 3011 B12R2.27 C=CC1CC1c2cc[n]cc2 Amb24102778 [0,0,0,1,0,0|2,0,1]=4 3012 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [0,0,0,1,0,0|2,0,1]=4 3013 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [0,0,0,1,0,0|0,0,0]=1 3014 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [0,0,0,1,0,0|0,0,0]=1 3015 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [0,0,0,1,0,0|2,0,0]=3 3016 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [0,0,0,1,0,0|1,0,0]=2 3017 B12R2.27 ClCC1CC1c2c[n]ccc2 Amb25820771 [0,0,0,1,0,0|3,0,0]=4 3018 B12R2.27 ClCC1CC1c2cccc[n]2 Amb24340524 [0,0,0,1,0,0|3,0,0]=4 3019 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [0,0,0,1,0,0|3,0,0]=4 3020 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [0,0,0,1,0,0|3,0,0]=4 3021 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [0,0,0,1,0,0|3,0,0]=4 3022 B12R2.27 N#CC1CC1c2ccccc2 Amb17231961 [0,0,0,1,0,0|2,0,0]=3 3023 B12R2.27 N#CC1CC1c2cccnc2 Amb17231984 [0,0,0,1,0,0|3,0,0]=4 3024 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [0,0,0,1,0,0|3,0,0]=4 3025 B12R2.27 N#C[C@@H]1C[C@H]1c2ccccc2 Amb25309014 [0,0,0,1,0,0|2,0,0]=3 3026 B12R2.27 N#C[C@H]1CC1c2ccccc2 Amb24544864 [0,0,0,1,0,0|2,0,0]=3 3027 B12R2.27 NCC1CC1c2cc[n]cc2 Amb18963616 [0,0,0,1,0,0|3,0,0]=4 3028 B12R2.27 NCC1CC1c2cccc[n]2 Amb18963618 [0,0,0,1,0,0|3,0,0]=4 3029 B12R2.27 NCC1CC1c2ccccc2 Amb17232030 [0,0,0,1,0,0|2,0,0]=3 3030 B12R2.27 NCC1CC1c2ccccc2 Amb19515036 [0,0,0,1,0,0|2,0,0]=3 3031 B12R2.27 NCC1CC1c2cccnc2 Amb17232044 [0,0,0,1,0,0|3,0,0]=4 3032 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [0,0,0,1,0,0|3,0,0]=4 3033 B12R2.27 NC[C@@H]1CC1c2ccccc2 Amb17605571 [0,0,0,1,0,0|2,0,0]=3 3034 B12R2.27 NC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25168891 [0,0,0,1,0,0|3,0,0]=4 3035 B12R2.27 NC[C@@H]1C[C@H]1c2cc[n]cc2 Amb25271512 [0,0,0,1,0,0|3,0,0]=4 3036 B12R2.27 NC[C@@H]1C[C@H]1c2ccccc2 Amb24514797 [0,0,0,1,0,0|2,0,0]=3 3037 B12R2.27 NC[C@H]1C[C@@H]1c2ccccc2 Amb24606663 [0,0,0,1,0,0|2,0,0]=3 3038 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [0,0,0,1,0,0|1,0,0]=2 3039 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [0,0,0,1,0,0|2,0,0]=3 3040 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [0,0,0,1,0,0|2,0,0]=3 3041 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [0,0,0,1,0,0|3,0,0]=4 3042 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [0,0,0,1,0,0|2,0,0]=3 3043 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [0,0,0,1,0,0|3,0,0]=4 3044 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [0,0,0,1,0,0|2,0,0]=3 3045 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [0,0,0,1,0,0|2,0,0]=3 3046 B12R2.27 OCC1CC1c2c[n]ccc2 Amb23442765 [0,0,0,1,0,0|3,0,0]=4 3047 B12R2.27 OCC1CC1c2cc[n]cc2 Amb23536862 [0,0,0,1,0,0|3,0,0]=4 3048 B12R2.27 OCC1CC1c2cccc[n]2 Amb23536863 [0,0,0,1,0,0|3,0,0]=4 3049 B12R2.27 OCC1CC1c2ccccc2 Amb17605543 [0,0,0,1,0,0|2,0,0]=3 3050 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [0,0,0,1,0,0|3,0,0]=4 3051 B12R2.27 OC[C@@H]1C[C@@H]1c2c[n]ccc2 Amb22744875 [0,0,0,1,0,0|3,0,0]=4 3052 B12R2.27 OC[C@@H]1C[C@H]1c2c[n]ccc2 Amb25339316 [0,0,0,1,0,0|3,0,0]=4 3053 B12R2.27 OC[C@H]1C[C@@H]1c2c[n]ccc2 Amb24632610 [0,0,0,1,0,0|3,0,0]=4 3054 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [0,0,0,1,0,0|3,0,0]=4 3055 B12R2.116 CC1(CCN1)c2c[n]ccc2 Amb24436088 [0,0,0,1,0,0|3,0,0]=4 3056 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [0,0,0,1,0,0|2,0,0]=3 3057 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [0,0,0,1,0,0|0,0,0]=1 3058 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [0,0,0,1,0,0|0,0,0]=1 3059 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [0,0,0,1,0,0|1,0,0]=2 3060 B12R2.116 FC1(CNC1)c2c[n]cc[n]2 Amb24394130 [0,0,0,1,0,0|3,0,0]=4 3061 B12R2.116 FC1(CNC1)c2c[n]ccc2 Amb25151802 [0,0,0,1,0,0|2,0,0]=3 3062 B12R2.116 FC1(COC1)c2ccccc2 Amb22738854 [0,0,0,1,0,0|2,0,0]=3 3063 B12R2.116 NC1(CCC1)c2c[n]ccc2 Amb22498055 [0,0,0,1,0,0|3,0,0]=4 3064 B12R2.116 NC1(CCC1)c2cc[n]cc2 Amb22500386 [0,0,0,1,0,0|3,0,0]=4 3065 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [0,0,0,1,0,0|2,0,0]=3 3066 B12R2.116 NC1(CNC1)c2ccccc2 Amb24120649 [0,0,0,1,0,0|1,0,0]=2 3067 B12R2.116 NC1(COC1)c2c[n]ccc2 Amb24716676 [0,0,0,1,0,0|3,0,0]=4 3068 B12R2.116 NC1(COC1)c2cc[n]cc2 Amb24395259 [0,0,0,1,0,0|3,0,0]=4 3069 B12R2.116 NC1(COC1)c2ccccc2 Amb19892665 [0,0,0,1,0,0|2,0,0]=3 3070 B12R2.116 NC1(COC1)c2ccccc2 Amb22386882 [0,0,0,1,0,0|2,0,0]=3 3071 B12R2.116 OC1(CCC1)c2c[n]ccc2 Amb25123095 [0,0,0,1,0,0|3,0,0]=4 3072 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [0,0,0,1,0,0|2,0,0]=3 3073 B12R2.116 OC1(CNC1)c2c[n]c[n]c2 Amb25756768 [0,0,0,1,0,0|3,0,0]=4 3074 B12R2.116 OC1(CNC1)c2c[n]cc[n]2 Amb25791772 [0,0,0,1,0,0|3,0,0]=4 3075 B12R2.116 OC1(CNC1)c2cccc[n]2 Amb24486814 [0,0,0,1,0,0|2,0,0]=3 3076 B12R2.116 OC1(CNC1)c2ccccc2 Amb22406135 [0,0,0,1,0,0|1,0,0]=2 3077 B12R2.116 OC1(CNC1)c2ccccc2 Amb22496452 [0,0,0,1,0,0|1,0,0]=2 3078 B12R2.116 OC1(COC1)c2c[n]ccc2 Amb22737297 [0,0,0,1,0,0|3,0,0]=4 3079 B12R2.116 OC1(COC1)c2cc[n]cc2 Amb22897030 [0,0,0,1,0,0|3,0,0]=4 3080 B12R2.116 OC1(COC1)c2cccc[n]2 Amb22897031 [0,0,0,1,0,0|3,0,0]=4 3081 B12R2.116 OC1(COC1)c2ccccc2 Amb21960821 [0,0,0,1,0,0|2,0,0]=3 3082 B12R2.116 OC1(CSC1)c2ccccc2 Amb22386890 [0,0,0,1,0,0|2,0,0]=3 3083 B12R2.235 CC1(CC1Cl)c2ccccc2 Amb25275063 [0,0,0,1,0,0|2,0,0]=3 3084 B12R2.235 CC1(CC1N)c2c[n]ccc2 Amb18947383 [0,0,0,1,0,0|3,0,0]=4 3085 B12R2.235 CC1(CC1N)c2cc[n]cc2 Amb18280066 [0,0,0,1,0,0|3,0,0]=4 3086 B12R2.235 CC1(CC1N)c2cccc[n]2 Amb18280087 [0,0,0,1,0,0|3,0,0]=4 3087 B12R2.235 CC1(CC1N)c2ccccc2 Amb18947391 [0,0,0,1,0,0|2,0,0]=3 3088 B12R2.235 CC1(CC1N)c2ccccc2 Amb19148136 [0,0,0,1,0,0|2,0,0]=3 3089 B12R2.235 CC1CC1(N)c2c[n]ccc2 Amb25194514 [0,0,0,1,0,0|3,0,0]=4 3090 B12R2.235 CC1CC1(N)c2cccc[n]2 Amb25799468 [0,0,0,1,0,0|3,0,0]=4 3091 B12R2.235 CC1CC1(O)c2c[n]ccc2 Amb24653327 [0,0,0,1,0,0|3,0,0]=4 3092 B12R2.235 CC1CC1(O)c2cccc[n]2 Amb25149270 [0,0,0,1,0,0|3,0,0]=4 3093 B12R2.235 C[C@@H]1C[C@@]1(O)c2cccc[n]2 Amb25163570 [0,0,0,1,0,0|3,0,0]=4 3094 B12R2.235 C[C@@H]1C[C@]1(O)c2cccc[n]2 Amb25044984 [0,0,0,1,0,0|3,0,0]=4 3095 B12R2.235 C[C@@]1(C[C@@H]1Br)c2ccccc2 Amb25176508 [0,0,0,1,0,0|2,0,0]=3 3096 B12R2.235 C[C@H]1C[C@]1(O)c2cccc[n]2 Amb24515105 [0,0,0,1,0,0|3,0,0]=4 3097 B12R2.235 C[C@]1(C[C@@H]1Cl)c2ccccc2 Amb24557815 [0,0,0,1,0,0|2,0,0]=3 3098 B12R2.235 NC1(CC1F)c2ccccc2 Amb25194668 [0,0,0,1,0,0|3,0,0]=4 3099 B12R2.235 N[C@@H]1C[C@@]1(F)c2ccccc2 Amb24100224 [0,0,0,1,0,0|3,0,0]=4 3100 B12R2.235 N[C@@H]1C[C@]1(F)c2ccccc2 Amb24100239 [0,0,0,1,0,0|3,0,0]=4 3101 B12R2.235 N[C@@]1(C[C@H]1F)c2ccccc2 Amb24655079 [0,0,0,1,0,0|3,0,0]=4 3102 B12R2.235 N[C@H]1C[C@]1(F)c2ccccc2 Amb24539890 [0,0,0,1,0,0|3,0,0]=4 3103 B12R2.235 N[C@]1(C[C@@H]1F)c2ccccc2 Amb24100238 [0,0,0,1,0,0|3,0,0]=4 3104 B12R2.235 N[C@]1(C[C@H]1F)c2ccccc2 Amb24744741 [0,0,0,1,0,0|3,0,0]=4 3105 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [0,0,0,1,0,0|0,0,0]=1 3106 B12R2.931 NCCC1Cc2ccccc21 Amb24600610 [0,0,0,1,0,0|2,0,0]=3 3107 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [0,0,0,1,0,0|1,0,0]=2 3108 B12R2.931 NOCC1Cc2ccccc21 Amb24340346 [0,0,0,1,0,0|2,0,0]=3 3109 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [0,0,0,1,0,0|3,0,0]=4 3110 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [0,0,0,1,0,0|2,0,0]=3 3111 B12R2.1081 BrC1CCCc2c[n]ccc21 Amb23402580 [0,0,0,1,0,0|3,0,0]=4 3112 B12R2.1081 BrC1CCCc2ccc[n]c21 Amb24680202 [0,0,0,1,0,0|3,0,0]=4 3113 B12R2.1081 BrC1COCc2ccccc21 Amb25095651 [0,0,0,1,0,0|2,0,0]=3 3114 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [0,0,0,1,0,0|3,0,0]=4 3115 B12R2.1081 C=C1CCCc2ccccc21 Amb25736652 [0,0,0,1,0,0|1,0,2]=4 3116 B12R2.1081 C=C1COCc2ccccc21 Amb24486797 [0,0,0,1,0,0|1,0,2]=4 3117 B12R2.1081 CC1=CCCc2c1cccc2 Amb2439915 [0,0,0,1,0,0|1,0,2]=4 3118 B12R2.1081 CC1=COCc2ccccc21 Amb24436497 [0,0,0,1,0,0|1,0,2]=4 3119 B12R2.1081 CC1=NCCc2ccccc12 Amb17940779 [0,0,0,1,0,0|2,0,1]=4 3120 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [0,0,0,1,0,0|1,0,0]=2 3121 B12R2.1081 CC1CCOc2ccc[n]c21 Amb25320654 [0,0,0,1,0,0|3,0,0]=4 3122 B12R2.1081 CC1CCSc2ccccc21 Amb24104681 [0,0,0,1,0,0|2,0,0]=3 3123 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [0,0,0,1,0,0|0,0,0]=1 3124 B12R2.1081 CC1CNCc2ccc[n]c21 Amb18124939 [0,0,0,1,0,0|1,0,0]=2 3125 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [0,0,0,1,0,0|0,0,0]=1 3126 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [0,0,0,1,0,0|1,0,0]=2 3127 B12R2.1081 CC1NC=Nc2ccccc21 Amb24582943 [0,0,0,1,0,0|3,0,0]=4 3128 B12R2.1081 CC1NCCc2[n]cccc21 Amb18124938 [0,0,0,1,0,0|3,0,0]=4 3129 B12R2.1081 CC1NCCc2[n]cccc21 Amb22899141 [0,0,0,1,0,0|3,0,0]=4 3130 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [0,0,0,1,0,0|2,0,0]=3 3131 B12R2.1081 CC1NCOc2ccccc21 Amb24637522 [0,0,0,1,0,0|3,0,0]=4 3132 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [0,0,0,1,0,0|2,0,0]=3 3133 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [0,0,0,1,0,0|3,0,0]=4 3134 B12R2.1081 CC1SC=Cc2ccccc21 Amb24485795 [0,0,0,1,0,0|2,0,1]=4 3135 B12R2.1081 CN1CCCc2c1cccc2 Amb15692645 [0,0,0,1,0,0|2,0,0]=3 3136 B12R2.1081 CN1CCCc2c[n]ccc12 Amb24089175 [0,0,0,1,0,0|3,0,0]=4 3137 B12R2.1081 CN1CCCc2ccc[n]c12 Amb24538105 [0,0,0,1,0,0|3,0,0]=4 3138 B12R2.1081 CN1CCNc2c1cccc2 Amb2383679 [0,0,0,1,0,0|3,0,0]=4 3139 B12R2.1081 CN1CCNc2ccccc12 Amb19957895 [0,0,0,1,0,0|3,0,0]=4 3140 B12R2.1081 CN1CCNc2ccccc12 Amb22490719 [0,0,0,1,0,0|3,0,0]=4 3141 B12R2.1081 CN1CCOc2c1cccc2 Amb10569245 [0,0,0,1,0,0|3,0,0]=4 3142 B12R2.1081 CN1CCSc2ccccc12 Amb25220195 [0,0,0,1,0,0|3,0,0]=4 3143 B12R2.1081 C[C@@H]1CCCc2[n]c[n]cc21 Amb24068653 [0,0,0,1,0,0|3,0,0]=4 3144 B12R2.1081 C[C@@H]1CCNc2ccccc21 Amb25281259 [0,0,0,1,0,0|2,0,0]=3 3145 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [0,0,0,1,0,0|0,0,0]=1 3146 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [0,0,0,1,0,0|2,0,0]=3 3147 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [0,0,0,1,0,0|2,0,0]=3 3148 B12R2.1081 C[C@H]1CCNc2ccccc21 Amb24375115 [0,0,0,1,0,0|2,0,0]=3 3149 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [0,0,0,1,0,0|0,0,0]=1 3150 B12R2.1081 ClC1CCCc2[n]cccc21 Amb25152726 [0,0,0,1,0,0|3,0,0]=4 3151 B12R2.1081 ClC1CCCc2c1nccc2 Amb16234115 [0,0,0,1,0,0|3,0,0]=4 3152 B12R2.1081 ClC1CCCc2c[n]ccc21 Amb23412277 [0,0,0,1,0,0|3,0,0]=4 3153 B12R2.1081 ClC1CCCc2cc[n]cc21 Amb25053398 [0,0,0,1,0,0|3,0,0]=4 3154 B12R2.1081 ClC1CCNc2ccccc21 Amb24636938 [0,0,0,1,0,0|3,0,0]=4 3155 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [0,0,0,1,0,0|2,0,0]=3 3156 B12R2.1081 ClC1SCCc2ccccc21 Amb24634203 [0,0,0,1,0,0|3,0,0]=4 3157 B12R2.1081 FC1CCOc2ccccc21 Amb24396221 [0,0,0,1,0,0|3,0,0]=4 3158 B12R2.1081 FC1CCSc2ccccc21 Amb25249840 [0,0,0,1,0,0|3,0,0]=4 3159 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [0,0,0,1,0,0|1,0,0]=2 3160 B12R2.1081 FC1COCc2ccccc21 Amb25768367 [0,0,0,1,0,0|2,0,0]=3 3161 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [0,0,0,1,0,0|3,0,0]=4 3162 B12R2.1081 IC1CCNc2ccccc21 Amb24754405 [0,0,0,1,0,0|3,0,0]=4 3163 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [0,0,0,1,0,0|3,0,0]=4 3164 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [0,0,0,1,0,0|2,0,1]=4 3165 B12R2.1081 NC1CC=Cc2ccccc21 Amb24385870 [0,0,0,1,0,0|2,0,1]=4 3166 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499722 [0,0,0,1,0,0|3,0,0]=4 3167 B12R2.1081 NC1CCCc2[n]cccc21 Amb22499726 [0,0,0,1,0,0|3,0,0]=4 3168 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [0,0,0,1,0,0|2,0,0]=3 3169 B12R2.1081 NC1CCCc2c[n]ccc21 Amb20622033 [0,0,0,1,0,0|3,0,0]=4 3170 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23399856 [0,0,0,1,0,0|3,0,0]=4 3171 B12R2.1081 NC1CCCc2c[n]ccc21 Amb23412279 [0,0,0,1,0,0|3,0,0]=4 3172 B12R2.1081 NC1CCCc2cc[n]cc21 Amb22751608 [0,0,0,1,0,0|3,0,0]=4 3173 B12R2.1081 NC1CCCc2ccc[n]c21 Amb22371548 [0,0,0,1,0,0|3,0,0]=4 3174 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [0,0,0,1,0,0|2,0,0]=3 3175 B12R2.1081 NC1CCNc2ccccc21 Amb22233827 [0,0,0,1,0,0|3,0,0]=4 3176 B12R2.1081 NC1CCNc2ccccc21 Amb22757242 [0,0,0,1,0,0|3,0,0]=4 3177 B12R2.1081 NC1CCOc2c1cccc2 Amb1107562 [0,0,0,1,0,0|3,0,0]=4 3178 B12R2.1081 NC1CCSc2c1cccc2 Amb1107564 [0,0,0,1,0,0|3,0,0]=4 3179 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [0,0,0,1,0,0|1,0,0]=2 3180 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [0,0,0,1,0,0|1,0,0]=2 3181 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [0,0,0,1,0,0|1,0,0]=2 3182 B12R2.1081 NC1COCc2c1cccc2 Amb10067658 [0,0,0,1,0,0|2,0,0]=3 3183 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [0,0,0,1,0,0|2,0,0]=3 3184 B12R2.1081 NC1CSCc2c1cccc2 Amb10067686 [0,0,0,1,0,0|2,0,0]=3 3185 B12R2.1081 NC1NCCc2ccccc21 Amb22491370 [0,0,0,1,0,0|3,0,0]=4 3186 B12R2.1081 NC1NCCc2ccccc21 Amb25798402 [0,0,0,1,0,0|3,0,0]=4 3187 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [0,0,0,1,0,0|2,0,0]=3 3188 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748844 [0,0,0,1,0,0|3,0,0]=4 3189 B12R2.1081 N[C@@H]1CCCc2ccc[n]c21 Amb22748845 [0,0,0,1,0,0|3,0,0]=4 3190 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [0,0,0,1,0,0|2,0,0]=3 3191 B12R2.1081 N[C@@H]1CCOc2c1cccc2 Amb13953038 [0,0,0,1,0,0|3,0,0]=4 3192 B12R2.1081 N[C@@H]1CCOc2ccccc21 Amb19515762 [0,0,0,1,0,0|3,0,0]=4 3193 B12R2.1081 N[C@@H]1CCSc2c1cccc2 Amb13952927 [0,0,0,1,0,0|3,0,0]=4 3194 B12R2.1081 N[C@H]1CCCc2[n]cccc21 Amb24068676 [0,0,0,1,0,0|3,0,0]=4 3195 B12R2.1081 N[C@H]1CCCc2cc[n]cc21 Amb25326344 [0,0,0,1,0,0|3,0,0]=4 3196 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [0,0,0,1,0,0|2,0,0]=3 3197 B12R2.1081 N[C@H]1CCNc2ccccc21 Amb25697589 [0,0,0,1,0,0|3,0,0]=4 3198 B12R2.1081 N[C@H]1CCOc2c1cccc2 Amb13953039 [0,0,0,1,0,0|3,0,0]=4 3199 B12R2.1081 N[C@H]1CCOc2ccccc21 Amb24052964 [0,0,0,1,0,0|3,0,0]=4 3200 B12R2.1081 N[C@H]1CCSc2c1cccc2 Amb13952928 [0,0,0,1,0,0|3,0,0]=4 3201 B12R2.1081 O=C1CCC[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22056230 [0,0,0,1,0,0|2,0,1]=4 3202 B12R2.1081 O=C1CNCc2[n]cccc21 Amb18202251 [0,0,0,1,0,0|2,0,1]=4 3203 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [0,0,0,1,0,0|1,0,1]=3 3204 B12R2.1081 O=C1CNNc2ccccc21 Amb22057606 [0,0,0,1,0,0|2,0,1]=4 3205 B12R2.1081 O=C1CNNc2ccccc21 Amb22494235 [0,0,0,1,0,0|2,0,1]=4 3206 B12R2.1081 O=C1CNOc2ccccc21 Amb25086617 [0,0,0,1,0,0|2,0,1]=4 3207 B12R2.1081 O=C1COCc2c1cccc2 Amb10067824 [0,0,0,1,0,0|2,0,1]=4 3208 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [0,0,0,1,0,0|2,0,1]=4 3209 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [0,0,0,1,0,0|2,0,0]=3 3210 B12R2.1081 OC1CCCc2c[n]ccc21 Amb23399822 [0,0,0,1,0,0|3,0,0]=4 3211 B12R2.1081 OC1CCCc2cc[n]cc21 Amb24070835 [0,0,0,1,0,0|3,0,0]=4 3212 B12R2.1081 OC1CCCc2cccnc12 Amb17935812 [0,0,0,1,0,0|3,0,0]=4 3213 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [0,0,0,1,0,0|3,0,0]=4 3214 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [0,0,0,1,0,0|3,0,0]=4 3215 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [0,0,0,1,0,0|3,0,0]=4 3216 B12R2.1081 OC1CNCc2[n]c[n]cc21 Amb18201680 [0,0,0,1,0,0|3,0,0]=4 3217 B12R2.1081 OC1CNCc2[n]cccc21 Amb18201914 [0,0,0,1,0,0|2,0,0]=3 3218 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [0,0,0,1,0,0|1,0,0]=2 3219 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [0,0,0,1,0,0|1,0,0]=2 3220 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [0,0,0,1,0,0|2,0,0]=3 3221 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [0,0,0,1,0,0|3,0,0]=4 3222 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [0,0,0,1,0,0|2,0,1]=4 3223 B12R2.1081 O[C@@H]1CCCc2cc[n]cc21 Amb25357624 [0,0,0,1,0,0|3,0,0]=4 3224 B12R2.1081 O[C@@H]1CCCc2ccc[n]c21 Amb24062853 [0,0,0,1,0,0|3,0,0]=4 3225 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [0,0,0,1,0,0|2,0,0]=3 3226 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [0,0,0,1,0,0|3,0,0]=4 3227 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [0,0,0,1,0,0|1,0,0]=2 3228 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [0,0,0,1,0,0|2,0,0]=3 3229 B12R2.1081 O[C@H]1CCCc2[n]cccc21 Amb24386952 [0,0,0,1,0,0|3,0,0]=4 3230 B12R2.1081 O[C@H]1CCCc2cc[n]cc21 Amb24340473 [0,0,0,1,0,0|3,0,0]=4 3231 B12R2.1081 O[C@H]1CCCc2ccc[n]c21 Amb24083650 [0,0,0,1,0,0|3,0,0]=4 3232 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [0,0,0,1,0,0|2,0,0]=3 3233 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [0,0,0,1,0,0|3,0,0]=4 3234 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [0,0,0,1,0,0|1,0,0]=2 3235 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [0,0,0,1,0,0|2,0,0]=3 3236 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [0,0,0,1,0,0|2,0,0]=3 3237 B12R2.1081 [NH3+]C1CCOc2ccccc21 Amb21862674 [0,0,0,1,0,0|3,0,0]=4 3238 B12R2.2028 C=C1CC(Cl)c2ccccc21 Amb24513606 [0,0,0,1,0,0|2,0,1]=4 3239 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [0,0,0,1,0,0|2,0,1]=4 3240 B12R2.2028 CC1=CC(C)c2ccccc12 Amb24641446 [0,0,0,1,0,0|1,0,1]=3 3241 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [0,0,0,1,0,0|2,0,1]=4 3242 B12R2.2028 CC1=C[C@@H](Br)c2ccccc21 Amb25827191 [0,0,0,1,0,0|2,0,1]=4 3243 B12R2.2028 CC1=NC(C)c2ccccc12 Amb25223537 [0,0,0,1,0,0|2,0,0]=3 3244 B12R2.2028 CC1C=C(Cl)c2ccccc12 Amb17778911 [0,0,0,1,0,0|2,0,1]=4 3245 B12R2.2028 CC1CC(=O)c2cc[n]cc21 Amb24071420 [0,0,0,1,0,0|3,0,0]=4 3246 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [0,0,0,1,0,0|2,0,0]=3 3247 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [0,0,0,1,0,0|2,0,0]=3 3248 B12R2.2028 CC1CC(O)c2cc[n]cc21 Amb25129412 [0,0,0,1,0,0|3,0,0]=4 3249 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [0,0,0,1,0,0|2,0,0]=3 3250 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [0,0,0,1,0,0|2,0,0]=3 3251 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [0,0,0,1,0,0|1,0,0]=2 3252 B12R2.2028 CC1N=C(N)c2ccccc21 Amb24426364 [0,0,0,1,0,0|3,0,0]=4 3253 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [0,0,0,1,0,0|3,0,0]=4 3254 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [0,0,0,1,0,0|2,0,0]=3 3255 B12R2.2028 CC1OC(=O)c2ccccc21 Amb24060113 [0,0,0,1,0,0|3,0,0]=4 3256 B12R2.2028 CC1OC(=S)c2ccccc21 Amb25115999 [0,0,0,1,0,0|3,0,0]=4 3257 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [0,0,0,1,0,0|1,0,0]=2 3258 B12R2.2028 CN1CN(C)c2ccccc12 Amb24092822 [0,0,0,1,0,0|1,0,0]=2 3259 B12R2.2028 CN1NC(=O)c2ccccc12 Amb22372319 [0,0,0,1,0,0|2,0,1]=4 3260 B12R2.2028 CN1OC(=O)c2ccccc12 Amb24528970 [0,0,0,1,0,0|2,0,1]=4 3261 B12R2.2028 CN1SC(=O)c2ccccc12 Amb19664923 [0,0,0,1,0,0|2,0,1]=4 3262 B12R2.2028 CN1SC(=S)c2ccccc12 Amb20661436 [0,0,0,1,0,0|2,0,1]=4 3263 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [0,0,0,1,0,0|2,0,0]=3 3264 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [0,0,0,1,0,0|2,0,0]=3 3265 B12R2.2028 C[C@@H]1C[C@@H](O)c2cc[n]cc21 Amb25102087 [0,0,0,1,0,0|3,0,0]=4 3266 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [0,0,0,1,0,0|2,0,0]=3 3267 B12R2.2028 C[C@@H]1C[C@H](O)c2cc[n]cc21 Amb24694361 [0,0,0,1,0,0|3,0,0]=4 3268 B12R2.2028 C[C@@H]1NC(=O)c2ccccc21 Amb22754730 [0,0,0,1,0,0|3,0,0]=4 3269 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [0,0,0,1,0,0|2,0,0]=3 3270 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [0,0,0,1,0,0|2,0,0]=3 3271 B12R2.2028 C[C@H]1C[C@@H](O)c2cc[n]cc21 Amb24601331 [0,0,0,1,0,0|3,0,0]=4 3272 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [0,0,0,1,0,0|2,0,0]=3 3273 B12R2.2028 C[C@H]1OC(=O)c2ccccc21 Amb24060118 [0,0,0,1,0,0|3,0,0]=4 3274 B12R2.2028 C[n+]1nn(c2c1cccc2)C Amb10553006 [0,0,0,1,0,0|2,0,0]=3 3275 B12R2.2028 C[n]1[n]c(Cl)c2ccccc12 Amb25327391 [0,0,0,1,0,0|2,0,1]=4 3276 B12R2.2028 C[n]1c[n+](C)c2ccccc12 Amb19895221 [0,0,0,1,0,0|1,0,1]=3 3277 B12R2.2028 C[n]1cc(I)c2ccccc12 Amb24067581 [0,0,0,1,0,0|1,0,2]=4 3278 B12R2.2028 C[n]1cc(N)c2ccccc12 Amb18064415 [0,0,0,1,0,0|1,0,2]=4 3279 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [0,0,0,1,0,0|1,0,2]=4 3280 B12R2.2028 C[n]1cc(S)c2ccccc12 Amb25721189 [0,0,0,1,0,0|1,0,2]=4 3281 B12R2.2028 Cc1[n][n](C)c2c[n]ccc12 Amb22741024 [0,0,0,1,0,0|2,0,1]=4 3282 B12R2.2028 Cc1[n][n](C)c2ccccc12 Amb22491231 [0,0,0,1,0,0|1,0,1]=3 3283 B12R2.2028 Cc1c[n](N)c2ccccc21 Amb24608862 [0,0,0,1,0,0|1,0,2]=4 3284 B12R2.2028 Cc1cn(c2c1cccn2)C Amb13884969 [0,0,0,1,0,0|1,0,2]=4 3285 B12R2.2028 Cc1oc(C)c2ccccc12 Amb25702226 [0,0,0,1,0,0|2,0,1]=4 3286 B12R2.2028 Cn1nc(c2c1cccc2)Br Amb10604243 [0,0,0,1,0,0|2,0,1]=4 3287 B12R2.2028 Cn1nc(c2c1cccc2)I Amb10608014 [0,0,0,1,0,0|2,0,1]=4 3288 B12R2.2028 N=C1CN(O)c2ccccc21 Amb24078909 [0,0,0,1,0,0|2,0,1]=4 3289 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [0,0,0,1,0,0|3,0,0]=4 3290 B12R2.2028 NC1CC(F)c2ccccc21 Amb24117897 [0,0,0,1,0,0|3,0,0]=4 3291 B12R2.2028 NC1CC(F)c2ccccc21 Amb24361429 [0,0,0,1,0,0|3,0,0]=4 3292 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [0,0,0,1,0,0|3,0,0]=4 3293 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [0,0,0,1,0,0|3,0,0]=4 3294 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [0,0,0,1,0,0|3,0,0]=4 3295 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [0,0,0,1,0,0|3,0,0]=4 3296 B12R2.2028 N[n+]1nn(c2c1cccc2)C Amb10570118 [0,0,0,1,0,0|3,0,0]=4 3297 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [0,0,0,1,0,0|3,0,0]=4 3298 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [0,0,0,1,0,0|3,0,0]=4 3299 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [0,0,0,1,0,0|3,0,0]=4 3300 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [0,0,0,1,0,0|3,0,0]=4 3301 B12R2.2028 ON1CC(=O)c2ccccc12 Amb24078911 [0,0,0,1,0,0|2,0,1]=4 3302 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [0,0,0,1,0,0|3,0,0]=4 3303 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [0,0,0,1,0,0|3,0,0]=4 3304 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [0,0,0,1,0,0|3,0,0]=4 3305 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [0,0,0,1,0,0|3,0,0]=4 3306 B12R2.2028 [O-][n+]1cn(c2c1cccc2)C Amb10552961 [0,0,0,1,0,0|2,0,1]=4 3307 B12R2.2028 [O-][n+]1cn(c2c1cccc2)C Amb10552964 [0,0,0,1,0,0|2,0,1]=4 3308 B12R2.2028 [O-][n+]1nn(c2c1cccc2)C Amb10570488 [0,0,0,1,0,0|3,0,0]=4 3309 B12R2.2047 CC1C(CO)c2ccccc21 Amb24541544 [0,0,0,1,0,0|2,0,0]=3 3310 B12R2.2047 CO[C@@H]1[C@@H](Br)c2[n]cccc21 Amb25240094 [0,0,0,1,0,0|3,0,0]=4 3311 B12R2.2047 N#CC1C(Cl)c2ccccc21 Amb25257929 [0,0,0,1,0,0|3,0,0]=4 3312 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [0,0,0,1,0,0|2,0,0]=3 3313 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [0,0,0,1,0,0|2,0,0]=3 3314 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [0,0,0,1,0,0|2,0,0]=3 3315 B12R2.2075 NC(C1CC1)c2cc[n]cc2 Amb22497035 [0,0,0,1,0,0|3,0,0]=4 3316 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [0,0,0,1,0,0|2,0,0]=3 3317 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [0,0,0,1,0,0|2,0,0]=3 3318 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [0,0,0,1,0,0|2,0,0]=3 3319 B12R2.2075 N[C@H](C1CC1)c2cc[n]cc2 Amb25145869 [0,0,0,1,0,0|3,0,0]=4 3320 B12R2.2075 N[C@H](C1CC1)c2ccc[n]c2 Amb25265270 [0,0,0,1,0,0|3,0,0]=4 3321 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [0,0,0,1,0,0|2,0,0]=3 3322 B12R2.2075 O=C(C1CO1)c2ccccc2 Amb24376086 [0,0,0,1,0,0|2,0,1]=4 3323 B12R2.2075 O=C([C@@H]1CO1)c2ccccc2 Amb25735777 [0,0,0,1,0,0|2,0,1]=4 3324 B12R2.2075 OC(C1CC1)c2cc[n]cc2 Amb24486009 [0,0,0,1,0,0|3,0,0]=4 3325 B12R2.2075 OC(C1CC1)c2ccc[n]c2 Amb22497231 [0,0,0,1,0,0|3,0,0]=4 3326 B12R2.2075 O[C@@H](C1CC1)c2cc[n]cc2 Amb25149640 [0,0,0,1,0,0|3,0,0]=4 3327 B12R2.2075 O[C@@H](C1CC1)c2cccc[n]2 Amb25296893 [0,0,0,1,0,0|3,0,0]=4 3328 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [0,0,0,1,0,0|2,0,0]=3 3329 B12R2.2075 O[C@H](C1CC1)c2cc[n]cc2 Amb24705928 [0,0,0,1,0,0|3,0,0]=4 3330 B12R2.2075 O[C@H](C1CC1)c2cccc[n]2 Amb25205476 [0,0,0,1,0,0|3,0,0]=4 3331 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [0,0,0,1,0,0|2,0,0]=3 3332 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [0,0,0,1,0,0|2,0,0]=3 3333 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [0,0,0,1,0,0|2,0,0]=3 3334 B10R1.11 BrCCC(c1cccs1)C Amb17243542 [0,0,0,0,1,0|3,0,0]=4 3335 B10R1.11 CC(CC#C)[n]1cccc1 Amb24384411 [0,0,0,0,1,0|2,0,1]=4 3336 B10R1.11 CC(CC#N)[n]1cccc1 Amb18124431 [0,0,0,0,1,0|3,0,0]=4 3337 B10R1.11 CC(CC=C)[n]1cccc1 Amb25268830 [0,0,0,0,1,0|2,0,1]=4 3338 B10R1.11 CC(CC=C)c1ccc[s]1 Amb24480842 [0,0,0,0,1,0|2,0,1]=4 3339 B10R1.11 CC(CC=O)c1c[s]cc1 Amb18644679 [0,0,0,0,1,0|3,0,0]=4 3340 B10R1.11 CC(CC=O)c1ccc[s]1 Amb18644676 [0,0,0,0,1,0|3,0,0]=4 3341 B10R1.11 CC(CCN)[n]1cccc1 Amb18985726 [0,0,0,0,1,0|3,0,0]=4 3342 B10R1.11 CC(CCN)c1c[nH]cc1 Amb18893407 [0,0,0,0,1,0|3,0,0]=4 3343 B10R1.11 CC(CCO)=C1C=CC=C1 Amb25050337 [0,0,0,0,1,0|2,0,1]=4 3344 B10R1.11 CC(CCO)[n]1cccc1 Amb24703202 [0,0,0,0,1,0|3,0,0]=4 3345 B10R1.11 CC(CCO)c1c[s]cc1 Amb25676863 [0,0,0,0,1,0|3,0,0]=4 3346 B10R1.11 CC(CCO)c1ccc[nH]1 Amb24753765 [0,0,0,0,1,0|3,0,0]=4 3347 B10R1.11 CC(CCS)c1ccc[s]1 Amb25694227 [0,0,0,0,1,0|3,0,0]=4 3348 B10R1.11 CC(CNC)[n]1c[n]c[n]1 Amb18992878 [0,0,0,0,1,0|3,0,0]=4 3349 B10R1.11 CCCC(Br)c1ccc[s]1 Amb24513708 [0,0,0,0,1,0|3,0,0]=4 3350 B10R1.11 CCCC(Cl)c1c[s]cc1 Amb24758359 [0,0,0,0,1,0|3,0,0]=4 3351 B10R1.11 CCCC(Cl)c1ccc[nH]1 Amb25104421 [0,0,0,0,1,0|3,0,0]=4 3352 B10R1.11 CCCC(N)c1c[s]cc1 Amb18294779 [0,0,0,0,1,0|3,0,0]=4 3353 B10R1.11 CCCC(N)c1ccc[nH]1 Amb18203001 [0,0,0,0,1,0|3,0,0]=4 3354 B10R1.11 CCCC(N)c1ccco1 Amb18991109 [0,0,0,0,1,0|3,0,0]=4 3355 B10R1.11 CCCC(N)c1cocc1 Amb18832008 [0,0,0,0,1,0|3,0,0]=4 3356 B10R1.11 CCCC(O)c1c[nH]cc1 Amb24476783 [0,0,0,0,1,0|3,0,0]=4 3357 B10R1.11 CCCC(O)c1c[s]cc1 Amb18791762 [0,0,0,0,1,0|3,0,0]=4 3358 B10R1.11 CCCC(O)c1ccc[nH]1 Amb24679736 [0,0,0,0,1,0|3,0,0]=4 3359 B10R1.11 CCCC(O)c1cocc1 Amb24418353 [0,0,0,0,1,0|3,0,0]=4 3360 B10R1.11 CCCC(c1ccco1)Cl Amb17138479 [0,0,0,0,1,0|3,0,0]=4 3361 B10R1.11 CCCC(c1cccs1)Cl Amb17138753 [0,0,0,0,1,0|3,0,0]=4 3362 B10R1.11 CCCC(c1cccs1)N Amb17622125 [0,0,0,0,1,0|3,0,0]=4 3363 B10R1.11 CCC[C@@H](N)c1c[nH]cc1 Amb24478487 [0,0,0,0,1,0|3,0,0]=4 3364 B10R1.11 CCC[C@@H](N)c1ccc[s]1 Amb24446604 [0,0,0,0,1,0|3,0,0]=4 3365 B10R1.11 CCC[C@@H](N)c1cocc1 Amb25083076 [0,0,0,0,1,0|3,0,0]=4 3366 B10R1.11 CCC[C@@H](O)c1c[s]cc1 Amb25043988 [0,0,0,0,1,0|3,0,0]=4 3367 B10R1.11 CCC[C@@H](O)c1ccc[s]1 Amb25226068 [0,0,0,0,1,0|3,0,0]=4 3368 B10R1.11 CCC[C@@H](O)c1ccco1 Amb24371424 [0,0,0,0,1,0|3,0,0]=4 3369 B10R1.11 CCC[C@H](N)c1c[s]cc1 Amb25757407 [0,0,0,0,1,0|3,0,0]=4 3370 B10R1.11 CCC[C@H](N)c1ccc[s]1 Amb25062513 [0,0,0,0,1,0|3,0,0]=4 3371 B10R1.11 CCC[C@H](N)c1ccco1 Amb24627831 [0,0,0,0,1,0|3,0,0]=4 3372 B10R1.11 CCC[C@H](O)c1c[s]cc1 Amb24358455 [0,0,0,0,1,0|3,0,0]=4 3373 B10R1.11 CCC[C@H](O)c1cocc1 Amb24358352 [0,0,0,0,1,0|3,0,0]=4 3374 B10R1.11 CCNC(C)c1c[nH]cc1 Amb21971512 [0,0,0,0,1,0|3,0,0]=4 3375 B10R1.11 CCNC(C)c1c[s]cc1 Amb18984963 [0,0,0,0,1,0|3,0,0]=4 3376 B10R1.11 CCNC(C)c1cocc1 Amb25113909 [0,0,0,0,1,0|3,0,0]=4 3377 B10R1.11 CCSC(C)c1ccc[s]1 Amb24422154 [0,0,0,0,1,0|3,0,0]=4 3378 B10R1.11 CNCC(=C)c1ccc[s]1 Amb24482086 [0,0,0,0,1,0|1,0,2]=4 3379 B10R1.11 CNCC(=O)c1c[nH]cc1 Amb18561865 [0,0,0,0,1,0|2,0,1]=4 3380 B10R1.11 CNCC(=O)c1cc[s]c1 Amb24461147 [0,0,0,0,1,0|2,0,1]=4 3381 B10R1.11 CNCC(=O)c1ccc[nH]1 Amb21862063 [0,0,0,0,1,0|2,0,1]=4 3382 B10R1.11 CNCC(=O)c1ccco1 Amb21862170 [0,0,0,0,1,0|2,0,1]=4 3383 B10R1.11 CNCC(=O)c1cccs1 Amb17232156 [0,0,0,0,1,0|2,0,1]=4 3384 B10R1.11 CNCC(=O)c1ccoc1 Amb25369027 [0,0,0,0,1,0|2,0,1]=4 3385 B10R1.11 CNCC(C)C=1CC=CC1 Amb24478978 [0,0,0,0,1,0|0,0,1]=2 3386 B10R1.11 CNCC(C)[n]1[n]cc[n]1 Amb24656741 [0,0,0,0,1,0|3,0,0]=4 3387 B10R1.11 CNCC(C)[n]1c[n]cc1 Amb18298153 [0,0,0,0,1,0|2,0,0]=3 3388 B10R1.11 CNCC(C)[n]1cc[n][n]1 Amb24518940 [0,0,0,0,1,0|3,0,0]=4 3389 B10R1.11 CNCC(C)[n]1ccc[n]1 Amb18992877 [0,0,0,0,1,0|2,0,0]=3 3390 B10R1.11 CNCC(C)c1[n]c[nH][n]1 Amb25184633 [0,0,0,0,1,0|3,0,0]=4 3391 B10R1.11 CNCC(O)c1[n]cc[s]1 Amb24334731 [0,0,0,0,1,0|3,0,0]=4 3392 B10R1.11 CNCC(O)c1c[nH]c[n]1 Amb18831733 [0,0,0,0,1,0|3,0,0]=4 3393 B10R1.11 CNCC(O)c1c[nH]cc1 Amb18563135 [0,0,0,0,1,0|2,0,0]=3 3394 B10R1.11 CNCC(O)c1c[n]c[s]1 Amb24478439 [0,0,0,0,1,0|3,0,0]=4 3395 B10R1.11 CNCC(O)c1c[s]c[n]1 Amb24371861 [0,0,0,0,1,0|3,0,0]=4 3396 B10R1.11 CNCC(O)c1c[s]cc1 Amb18997460 [0,0,0,0,1,0|2,0,0]=3 3397 B10R1.11 CNCC(O)c1cc[n][nH]1 Amb24540313 [0,0,0,0,1,0|3,0,0]=4 3398 B10R1.11 CNCC(O)c1cc[n][s]1 Amb25281123 [0,0,0,0,1,0|3,0,0]=4 3399 B10R1.11 CNCC(O)c1cc[n]o1 Amb24741960 [0,0,0,0,1,0|3,0,0]=4 3400 B10R1.11 CNCC(c1cccs1)C Amb17232163 [0,0,0,0,1,0|1,0,0]=2 3401 B10R1.11 CNCC(c1nccs1)C Amb17232178 [0,0,0,0,1,0|2,0,0]=3 3402 B10R1.11 CNC[C@@H](O)c1c[s]cc1 Amb25322154 [0,0,0,0,1,0|2,0,0]=3 3403 B10R1.11 CNC[C@H](O)c1[n]cc[s]1 Amb24355929 [0,0,0,0,1,0|3,0,0]=4 3404 B10R1.11 CNC[C@H](O)c1ccc[s]1 Amb25065288 [0,0,0,0,1,0|2,0,0]=3 3405 B10R1.11 CNC[C@H](O)c1ccco1 Amb24409577 [0,0,0,0,1,0|2,0,0]=3 3406 B10R1.11 COCC(C)[n]1c[n]cc1 Amb24554670 [0,0,0,0,1,0|3,0,0]=4 3407 B10R1.11 COCC(N)c1c[nH]cc1 Amb18065247 [0,0,0,0,1,0|3,0,0]=4 3408 B10R1.11 COCC(N)c1c[s]cc1 Amb25791177 [0,0,0,0,1,0|3,0,0]=4 3409 B10R1.11 COCC(N)c1ccc[s]1 Amb18979038 [0,0,0,0,1,0|3,0,0]=4 3410 B10R1.11 COCC(O)c1c[s]cc1 Amb25135510 [0,0,0,0,1,0|3,0,0]=4 3411 B10R1.11 COCC(O)c1ccc[s]1 Amb18791923 [0,0,0,0,1,0|3,0,0]=4 3412 B10R1.11 COCC(c1ccco1)N Amb1126956 [0,0,0,0,1,0|3,0,0]=4 3413 B10R1.11 COC[C@@H](N)c1ccc[nH]1 Amb24446998 [0,0,0,0,1,0|3,0,0]=4 3414 B10R1.11 COC[C@@H](N)c1ccco1 Amb25378787 [0,0,0,0,1,0|3,0,0]=4 3415 B10R1.11 COC[C@@H](N)c1cocc1 Amb24680958 [0,0,0,0,1,0|3,0,0]=4 3416 B10R1.11 COC[C@H](N)c1cocc1 Amb25127964 [0,0,0,0,1,0|3,0,0]=4 3417 B10R1.11 CONC(C)c1c[s]cc1 Amb25273806 [0,0,0,0,1,0|3,0,0]=4 3418 B10R1.11 CONC(C)c1cocc1 Amb25309324 [0,0,0,0,1,0|3,0,0]=4 3419 B10R1.11 CSCC(C)[n]1cccc1 Amb24432207 [0,0,0,0,1,0|2,0,0]=3 3420 B10R1.11 CSCC(Cl)c1ccc[s]1 Amb25337589 [0,0,0,0,1,0|3,0,0]=4 3421 B10R1.11 CSCC(N)c1ccc[s]1 Amb18300357 [0,0,0,0,1,0|3,0,0]=4 3422 B10R1.11 CSCC(N)c1ccco1 Amb24502407 [0,0,0,0,1,0|3,0,0]=4 3423 B10R1.11 CSCC(O)c1c[s]cc1 Amb24429312 [0,0,0,0,1,0|3,0,0]=4 3424 B10R1.11 CSCC(O)c1ccc[nH]1 Amb25744397 [0,0,0,0,1,0|3,0,0]=4 3425 B10R1.11 CSCC(O)c1ccc[s]1 Amb18183876 [0,0,0,0,1,0|3,0,0]=4 3426 B10R1.11 CSCC(O)c1ccco1 Amb25703539 [0,0,0,0,1,0|3,0,0]=4 3427 B10R1.11 C[C@@H](CC=O)c1c[s]cc1 Amb24633645 [0,0,0,0,1,0|3,0,0]=4 3428 B10R1.11 C[C@H](CCO)c1ccco1 Amb25788895 [0,0,0,0,1,0|3,0,0]=4 3429 B10R1.11 ClCCC(c1cccs1)C Amb17233057 [0,0,0,0,1,0|3,0,0]=4 3430 B10R1.11 NCCC(c1ccco1)C Amb17226683 [0,0,0,0,1,0|3,0,0]=4 3431 B10R1.11 NNCC(O)c1c[nH]cc1 Amb18563436 [0,0,0,0,1,0|3,0,0]=4 3432 B10R1.11 NNCC(c1ccco1)O Amb17231941 [0,0,0,0,1,0|3,0,0]=4 3433 B10R1.11 NNCC(c1cccs1)O Amb17232256 [0,0,0,0,1,0|3,0,0]=4 3434 B10R1.11 O=CCC(c1ccco1)C Amb17593491 [0,0,0,0,1,0|3,0,0]=4 3435 B10R1.11 OCCC(c1cccs1)C Amb17232175 [0,0,0,0,1,0|3,0,0]=4 3436 B10R1.11 ONCC(c1ccco1)O Amb17334210 [0,0,0,0,1,0|3,0,0]=4 3437 B10R1.11 ONCC(c1cccs1)O Amb17334462 [0,0,0,0,1,0|3,0,0]=4 3438 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [0,0,0,0,0,1|3,0,0]=4 3439 B12R1.32 C#CCC(N)Cc1ccccc1 Amb18296094 [0,0,0,0,0,1|2,0,1]=4 3440 B12R1.32 C#CCC(O)Cc1ccccc1 Amb18800362 [0,0,0,0,0,1|2,0,1]=4 3441 B12R1.32 C#CC[C@@H](O)Cc1ccccc1 Amb24497745 [0,0,0,0,0,1|2,0,1]=4 3442 B12R1.32 C=CCC(N)Cc1ccccc1 Amb19015820 [0,0,0,0,0,1|2,0,1]=4 3443 B12R1.32 C=CCC(Nc1ccccn1)C Amb10554010 [0,0,0,0,0,1|2,0,1]=4 3444 B12R1.32 CC#CC(C)Nc1ccccc1 Amb25040061 [0,0,0,0,0,1|1,0,1]=3 3445 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [0,0,0,0,0,1|2,0,1]=4 3446 B12R1.32 CC#C[C@@H](C)Oc1ccccc1 Amb24068913 [0,0,0,0,0,1|1,0,1]=3 3447 B12R1.32 CC(CC#C)Nc1cc[n]cc1 Amb24341969 [0,0,0,0,0,1|2,0,1]=4 3448 B12R1.32 CC(CC#N)Sc1cc[n]cc1 Amb24673376 [0,0,0,0,0,1|3,0,0]=4 3449 B12R1.32 CC(CC#N)Sc1cccc[n]1 Amb18180844 [0,0,0,0,0,1|3,0,0]=4 3450 B12R1.32 CC(CC#N)Sc1ccccc1 Amb18795942 [0,0,0,0,0,1|2,0,0]=3 3451 B12R1.32 CC(CC=C)Nc1cc[n]cc1 Amb24585041 [0,0,0,0,0,1|2,0,1]=4 3452 B12R1.32 CC(CCCl)Nc1cc[n]cc1 Amb24524799 [0,0,0,0,0,1|3,0,0]=4 3453 B12R1.32 CC(CCN)Nc1cc[n]cc1 Amb25081324 [0,0,0,0,0,1|3,0,0]=4 3454 B12R1.32 CC(CCO)Nc1c[n]ccc1 Amb25153319 [0,0,0,0,0,1|3,0,0]=4 3455 B12R1.32 CC(CNC)=Cc1c[n]c[n]c1 Amb24590401 [0,0,0,0,0,1|2,0,1]=4 3456 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [0,0,0,0,0,1|1,0,0]=2 3457 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [0,0,0,0,0,1|1,0,0]=2 3458 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [0,0,0,0,0,1|3,0,0]=4 3459 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [0,0,0,0,0,1|3,0,0]=4 3460 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [0,0,0,0,0,1|2,0,1]=4 3461 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [0,0,0,0,0,1|3,0,0]=4 3462 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [0,0,0,0,0,1|3,0,0]=4 3463 B12R1.32 CC(Nc1ccccc1)CC#N Amb17138511 [0,0,0,0,0,1|2,0,0]=3 3464 B12R1.32 CC(Oc1ccccc1)CC#N Amb17232369 [0,0,0,0,0,1|2,0,0]=3 3465 B12R1.32 CCCC(=N)Nc1ccccc1 Amb24096810 [0,0,0,0,0,1|2,0,1]=4 3466 B12R1.32 CCCC(C)Cc1c[n]ccc1 Amb24094032 [0,0,0,0,0,1|2,0,0]=3 3467 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [0,0,0,0,0,1|1,0,0]=2 3468 B12R1.32 CCCC(C)Nc1cc[n]c[n]1 Amb18305872 [0,0,0,0,0,1|3,0,0]=4 3469 B12R1.32 CCCC(C)Nc1ccc[n][n]1 Amb18311424 [0,0,0,0,0,1|3,0,0]=4 3470 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [0,0,0,0,0,1|2,0,0]=3 3471 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [0,0,0,0,0,1|2,0,0]=3 3472 B12R1.32 CCC\C(\I)=C/c1ccccc1 Amb22546627 [0,0,0,0,0,1|2,0,1]=4 3473 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [0,0,0,0,0,1|2,0,0]=3 3474 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [0,0,0,0,0,1|2,0,0]=3 3475 B12R1.32 CCNC(Cc1ccccn1)C Amb1995151 [0,0,0,0,0,1|3,0,0]=4 3476 B12R1.32 CCO/C(C)=N/c1ccccc1 Amb17939699 [0,0,0,0,0,1|2,0,1]=4 3477 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [0,0,0,0,0,1|2,0,0]=3 3478 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [0,0,0,0,0,1|3,0,0]=4 3479 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [0,0,0,0,0,1|3,0,0]=4 3480 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [0,0,0,0,0,1|3,0,0]=4 3481 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [0,0,0,0,0,1|3,0,0]=4 3482 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [0,0,0,0,0,1|3,0,0]=4 3483 B12R1.32 CNCC(=O)Nc1cccnc1 Amb15740831 [0,0,0,0,0,1|2,0,1]=4 3484 B12R1.32 CNCC(C)Oc1c[n]c[n]c1 Amb24082122 [0,0,0,0,0,1|2,0,0]=3 3485 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [0,0,0,0,0,1|0,0,0]=1 3486 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [0,0,0,0,0,1|1,0,0]=2 3487 B12R1.32 CNCC(Cc1cccnc1)O Amb17232605 [0,0,0,0,0,1|2,0,0]=3 3488 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [0,0,0,0,0,1|1,0,0]=2 3489 B12R1.32 CNC\C(=C\c1ccccc1)\C Amb17100030 [0,0,0,0,0,1|0,0,1]=2 3490 B12R1.32 CNNC(=S)Nc1ccccc1 Amb25119287 [0,0,0,0,0,1|2,0,1]=4 3491 B12R1.32 COCC(C)Nc1c[n]ccc1 Amb19024143 [0,0,0,0,0,1|2,0,0]=3 3492 B12R1.32 COCC(C)Nc1cc[n]c[n]1 Amb19011498 [0,0,0,0,0,1|3,0,0]=4 3493 B12R1.32 COCC(C)Nc1ccc[n][n]1 Amb18311434 [0,0,0,0,0,1|3,0,0]=4 3494 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [0,0,0,0,0,1|1,0,0]=2 3495 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [0,0,0,0,0,1|2,0,0]=3 3496 B12R1.32 COC[C@@H](C)Nc1c[n]cc[n]1 Amb24705383 [0,0,0,0,0,1|3,0,0]=4 3497 B12R1.32 COC[C@@H](C)Nc1cc[n]cc1 Amb25220804 [0,0,0,0,0,1|2,0,0]=3 3498 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,0,0,0,0,1|2,0,1]=4 3499 B12R1.32 CSCC(C)Nc1c[n]cc[n]1 Amb24424408 [0,0,0,0,0,1|3,0,0]=4 3500 B12R1.32 CSCC(C)Nc1cc[n]c[n]1 Amb25691353 [0,0,0,0,0,1|3,0,0]=4 3501 B12R1.32 CSCC(C)Nc1cccc[n]1 Amb24565099 [0,0,0,0,0,1|2,0,0]=3 3502 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [0,0,0,0,0,1|1,0,0]=2 3503 B12R1.32 C[C@@H](CC#N)Nc1ccccc1 Amb25301483 [0,0,0,0,0,1|2,0,0]=3 3504 B12R1.32 C[C@@H](CCO)Nc1cccc[n]1 Amb24722354 [0,0,0,0,0,1|3,0,0]=4 3505 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [0,0,0,0,0,1|2,0,0]=3 3506 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [0,0,0,0,0,1|2,0,1]=4 3507 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [0,0,0,0,0,1|3,0,0]=4 3508 B12R1.32 C[C@H](CC#N)Nc1ccccc1 Amb24459585 [0,0,0,0,0,1|2,0,0]=3 3509 B12R1.32 C[C@H](CCO)Nc1cc[n]cc1 Amb24722224 [0,0,0,0,0,1|3,0,0]=4 3510 B12R1.32 C[C@H](CCO)Nc1cccc[n]1 Amb25160516 [0,0,0,0,0,1|3,0,0]=4 3511 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [0,0,0,0,0,1|2,0,0]=3 3512 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [0,0,0,0,0,1|2,0,1]=4 3513 B12R1.32 C\C(=C\CC)\Nc1ccccc1 Amb25678437 [0,0,0,0,0,1|1,0,2]=4 3514 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [0,0,0,0,0,1|2,0,1]=4 3515 B12R1.32 C\C(\CCBr)=C/c1ccccc1 Amb18063581 [0,0,0,0,0,1|2,0,1]=4 3516 B12R1.32 C\C(\CCN)=C/c1ccccc1 Amb18063553 [0,0,0,0,0,1|2,0,1]=4 3517 B12R1.32 C\C(\CCO)=C\c1ccccc1 Amb24576953 [0,0,0,0,0,1|2,0,1]=4 3518 B12R1.32 C\C(\CNC)=C/c1cc[n]c[n]1 Amb24643582 [0,0,0,0,0,1|2,0,1]=4 3519 B12R1.32 C\C(\CNC)=C/c1cccc[n]1 Amb24438138 [0,0,0,0,0,1|1,0,1]=3 3520 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [0,0,0,0,0,1|2,0,1]=4 3521 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [0,0,0,0,0,1|2,0,1]=4 3522 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [0,0,0,0,0,1|2,0,1]=4 3523 B12R1.32 N#CCC(Cl)Sc1ccccc1 Amb24373160 [0,0,0,0,0,1|3,0,0]=4 3524 B12R1.32 N#CCC(F)Cc1ccccc1 Amb25079148 [0,0,0,0,0,1|3,0,0]=4 3525 B12R1.32 N#CC[C@H](O)Cc1ccccc1 Amb24386953 [0,0,0,0,0,1|3,0,0]=4 3526 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [0,0,0,0,0,1|2,0,0]=3 3527 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [0,0,0,0,0,1|3,0,0]=4 3528 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [0,0,0,0,0,1|2,0,0]=3 3529 B12R1.32 N[C@@H](CC#N)Cc1ccccc1 Amb24483888 [0,0,0,0,0,1|3,0,0]=4 3530 B12R1.32 OC(CCCl)Nc1ccccc1 Amb24635759 [0,0,0,0,0,1|3,0,0]=4 3531 B12R1.32 OC(Cc1ccccc1)CC#N Amb17232368 [0,0,0,0,0,1|3,0,0]=4 3532 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [0,0,0,0,0,1|2,0,0]=3 3533 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [0,0,0,0,0,1|3,0,0]=4 3534 B12R1.32 OCCC(O)Nc1ccccc1 Amb25060097 [0,0,0,0,0,1|3,0,0]=4 3535 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [0,0,0,0,0,1|2,0,0]=3 3536 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [0,0,0,0,0,1|2,0,1]=4 3537 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [0,0,0,0,0,1|3,0,0]=4 3538 B12R1.32 [BH3]N(CCC)Cc1ccccc1 Amb24678772 [0,0,0,0,0,1|3,0,0]=4 3539 B12R1.1564 CC(N=C=O)C=1CC=CC=CC1 Amb25690250 [0,0,0,0,0,1|3,0,0]=4 3540 B9R0.45 CCCC\C=C/C=C/C=O Amb25770096 [1,0,1,0,0,0|2,0,0]=4 3541 B9R0.46 CC(CN)\C=C\C=CCO Amb24340227 [1,0,1,0,0,0|1,0,1]=4 3542 B9R0.46 CCC(C)\C=C\C=C/C=O Amb18643327 [1,0,1,0,0,0|1,0,0]=3 3543 B9R0.46 CCC(C)\C=C\C=CCO Amb25129701 [1,0,1,0,0,0|1,0,1]=4 3544 B9R0.46 CC[C@H](C)\C=C\C=CCO Amb25788130 [1,0,1,0,0,0|1,0,1]=4 3545 B9R0.46 C[C@@H](CN)\C=C\C=C\CO Amb24761334 [1,0,1,0,0,0|1,0,1]=4 3546 B9R0.18 CCCCC(=C)\C=C\C=O Amb18124519 [1,0,1,0,0,0|2,0,0]=4 3547 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [1,0,1,0,0,0|2,0,0]=4 3548 B9R0.35 CNCC(C)C(=O)CC=C Amb24578699 [1,0,1,0,0,0|1,0,1]=4 3549 B9R1.6 CB(C)c1c[n]ccc1 Amb25359854 [2,0,0,0,0,0|2,0,0]=4 3550 B9R1.6 CC(=C)c1ccccc1 Amb22338342 [2,0,0,0,0,0|0,0,2]=4 3551 B9R1.6 CC(=C)c1ccccc1 Amb22338444 [2,0,0,0,0,0|0,0,2]=4 3552 B9R1.6 CC(C)C1=CCC=CN1 Amb25146142 [2,0,0,0,0,0|1,0,1]=4 3553 B9R1.6 CC(C)C1C=CNC=C1 Amb25125845 [2,0,0,0,0,0|1,0,1]=4 3554 B9R1.6 CC(C)c1[n]ccc[n]1 Amb24084521 [2,0,0,0,0,0|2,0,0]=4 3555 B9R1.6 CC(C)c1c[n][n]cc1 Amb24697122 [2,0,0,0,0,0|2,0,0]=4 3556 B9R1.6 CC(C)c1c[n]c[n]c1 Amb24071492 [2,0,0,0,0,0|2,0,0]=4 3557 B9R1.6 CC(C)c1c[n]ccc1 Amb24320774 [2,0,0,0,0,0|1,0,0]=3 3558 B9R1.6 CC(C)c1cc[n]c[n]1 Amb24070425 [2,0,0,0,0,0|2,0,0]=4 3559 B9R1.6 CC(C)c1ccccc1 Amb24052959 [2,0,0,0,0,0|0,0,0]=2 3560 B9R1.6 CC(Cl)c1cc[n]cc1 Amb19514972 [2,0,0,0,0,0|2,0,0]=4 3561 B9R1.6 CC(F)c1ccccc1 Amb24555504 [2,0,0,0,0,0|1,0,0]=3 3562 B9R1.6 CC(I)c1ccccc1 Amb24064714 [2,0,0,0,0,0|1,0,0]=3 3563 B9R1.6 CC(N)C1C=CC=C=C1 Amb25346953 [2,0,0,0,0,0|0,0,2]=4 3564 B9R1.6 CC(N)C=1C=CCC=C1 Amb24480325 [2,0,0,0,0,0|0,0,2]=4 3565 B9R1.6 CC(N)c1[n]ccc[n]1 Amb22757229 [2,0,0,0,0,0|2,0,0]=4 3566 B9R1.6 CC(N)c1c[n][n]cc1 Amb21964416 [2,0,0,0,0,0|2,0,0]=4 3567 B9R1.6 CC(N)c1c[n][n]cc1 Amb22757188 [2,0,0,0,0,0|2,0,0]=4 3568 B9R1.6 CC(N)c1c[n]cc[n]1 Amb18278310 [2,0,0,0,0,0|2,0,0]=4 3569 B9R1.6 CC(N)c1c[n]ccc1 Amb22754521 [2,0,0,0,0,0|1,0,0]=3 3570 B9R1.6 CC(N)c1cc[n]c[n]1 Amb22587681 [2,0,0,0,0,0|2,0,0]=4 3571 B9R1.6 CC(N)c1cc[n]cc1 Amb19958395 [2,0,0,0,0,0|1,0,0]=3 3572 B9R1.6 CC(N)c1cccc[n]1 Amb22265614 [2,0,0,0,0,0|1,0,0]=3 3573 B9R1.6 CC(N)c1cccc[n]1 Amb24064899 [2,0,0,0,0,0|1,0,0]=3 3574 B9R1.6 CC(c1ccccc1)[NH3+] Amb10560245 [2,0,0,0,0,0|0,0,1]=3 3575 B9R1.6 CC(c1ccccn1)Cl Amb10610197 [2,0,0,0,0,0|2,0,0]=4 3576 B9R1.6 CC(c1ccccn1)N Amb1102610 [2,0,0,0,0,0|1,0,0]=3 3577 B9R1.6 CC(c1cccnc1)Br Amb10610142 [2,0,0,0,0,0|2,0,0]=4 3578 B9R1.6 CC(c1cccnc1)Cl Amb13952205 [2,0,0,0,0,0|2,0,0]=4 3579 B9R1.6 CC(c1cccnc1)N Amb1214297 [2,0,0,0,0,0|1,0,0]=3 3580 B9R1.6 CC(c1ccncc1)Br Amb10610143 [2,0,0,0,0,0|2,0,0]=4 3581 B9R1.6 CC(c1ccncc1)N Amb1152976 [2,0,0,0,0,0|1,0,0]=3 3582 B9R1.6 CC(c1ccncn1)N Amb10608543 [2,0,0,0,0,0|2,0,0]=4 3583 B9R1.6 CN(C)[n+]1ccccc1 Amb24382519 [2,0,0,0,0,0|2,0,0]=4 3584 B9R1.6 CN(C)c1cc[nH+]cc1 Amb22411615 [2,0,0,0,0,0|2,0,0]=4 3585 B9R1.6 CN(C)c1cc[nH+]cc1 Amb22734568 [2,0,0,0,0,0|2,0,0]=4 3586 B9R1.6 CN(C)c1cc[n]cc1 Amb22349204 [2,0,0,0,0,0|2,0,0]=4 3587 B9R1.6 CN(C)c1cccc[o+]1 Amb25095281 [2,0,0,0,0,0|2,0,0]=4 3588 B9R1.6 CN(C)c1ccccc1 Amb22040069 [2,0,0,0,0,0|1,0,0]=3 3589 B9R1.6 CN(N)c1c[n]ccc1 Amb24085137 [2,0,0,0,0,0|2,0,0]=4 3590 B9R1.6 CN(N)c1cccc[n]1 Amb18642128 [2,0,0,0,0,0|2,0,0]=4 3591 B9R1.6 CN(N)c1ccccc1 Amb22346095 [2,0,0,0,0,0|1,0,0]=3 3592 B9R1.6 CN(N)c1ccccc1 Amb22754142 [2,0,0,0,0,0|1,0,0]=3 3593 B9R1.6 CN(c1cc[nH+]cc1)C Amb10552846 [2,0,0,0,0,0|2,0,0]=4 3594 B9R1.6 CN(c1cc[nH+]cc1)C Amb10552850 [2,0,0,0,0,0|2,0,0]=4 3595 B9R1.6 CN(c1ccccc1)N Amb1153615 [2,0,0,0,0,0|1,0,0]=3 3596 B9R1.6 CP(=O)c1ccccc1 Amb21858071 [2,0,0,0,0,0|2,0,0]=4 3597 B9R1.6 CP(C)c1ccccc1 Amb22369673 [2,0,0,0,0,0|1,0,0]=3 3598 B9R1.6 CP(C)c1ccccc1 Amb24325382 [2,0,0,0,0,0|1,0,0]=3 3599 B9R1.6 CP(Cl)c1ccccc1 Amb25837553 [2,0,0,0,0,0|2,0,0]=4 3600 B9R1.6 C[13C](=O)c1ccccc1 Amb22337854 [2,0,0,0,0,0|1,0,1]=4 3601 B9R1.6 C[C@@H](Br)c1cccc[n]1 Amb25725731 [2,0,0,0,0,0|2,0,0]=4 3602 B9R1.6 C[C@@H](Br)c1ccccc1 Amb25055693 [2,0,0,0,0,0|1,0,0]=3 3603 B9R1.6 C[C@@H](Cl)c1ccccc1 Amb25772789 [2,0,0,0,0,0|1,0,0]=3 3604 B9R1.6 C[C@@H](N)c1c[n]c[n]c1 Amb23439227 [2,0,0,0,0,0|2,0,0]=4 3605 B9R1.6 C[C@@H](N)c1c[n]c[n]c1 Amb25727204 [2,0,0,0,0,0|2,0,0]=4 3606 B9R1.6 C[C@@H](N)c1c[n]cc[n]1 Amb22747093 [2,0,0,0,0,0|2,0,0]=4 3607 B9R1.6 C[C@@H](N)c1cc[n]c[n]1 Amb18832953 [2,0,0,0,0,0|2,0,0]=4 3608 B9R1.6 C[C@@H](N)c1cccc[n]1 Amb19514583 [2,0,0,0,0,0|1,0,0]=3 3609 B9R1.6 C[C@@H](N)c1ccccc1 Amb22168000 [2,0,0,0,0,0|0,0,0]=2 3610 B9R1.6 C[C@@H](O)c1cccc[n]1 Amb24087444 [2,0,0,0,0,0|2,0,0]=4 3611 B9R1.6 C[C@@H](S)c1cccc[n]1 Amb25346958 [2,0,0,0,0,0|2,0,0]=4 3612 B9R1.6 C[C@@H](c1ccccn1)O Amb13951167 [2,0,0,0,0,0|2,0,0]=4 3613 B9R1.6 C[C@H](Br)c1ccccc1 Amb24355307 [2,0,0,0,0,0|1,0,0]=3 3614 B9R1.6 C[C@H](Cl)c1ccccc1 Amb24391406 [2,0,0,0,0,0|1,0,0]=3 3615 B9R1.6 C[C@H](N)c1c[n]c[n]c1 Amb25691811 [2,0,0,0,0,0|2,0,0]=4 3616 B9R1.6 C[C@H](N)c1cc[n]c[n]1 Amb24099656 [2,0,0,0,0,0|2,0,0]=4 3617 B9R1.6 C[C@H](c1cccnc1)N Amb13951181 [2,0,0,0,0,0|1,0,0]=3 3618 B9R1.6 C[C@H](c1ccncc1)N Amb13952719 [2,0,0,0,0,0|1,0,0]=3 3619 B9R1.6 C[N+](C)=C1C=CNC=C1 Amb25364040 [2,0,0,0,0,0|2,0,0]=4 3620 B9R1.6 C[S@@](=O)c1ccccc1 Amb22747474 [2,0,0,0,0,0|2,0,0]=4 3621 B9R1.6 C[SiH](C)c1c[n]ccc1 Amb24085368 [2,0,0,0,0,0|1,1,0]=4 3622 B9R1.6 C[SiH](C)c1cc[n]cc1 Amb24102972 [2,0,0,0,0,0|1,1,0]=4 3623 B9R1.6 C[SiH](C)c1cccc[n]1 Amb22336977 [2,0,0,0,0,0|1,1,0]=4 3624 B9R1.6 C[SiH](C)c1ccccc1 Amb19894005 [2,0,0,0,0,0|0,1,0]=3 3625 B9R1.6 C[Si](=O)c1ccccc1 Amb22053625 [2,0,0,0,0,0|1,1,0]=4 3626 B9R1.6 C[Te+](C)c1ccccc1 Amb22345602 [2,0,0,0,0,0|1,0,0]=3 3627 B9R1.6 FC(c1ccccc1)Cl Amb10838337 [2,0,0,0,0,0|2,0,0]=4 3628 B9R1.6 FC(c1ccccc1)F Amb10606272 [2,0,0,0,0,0|2,0,0]=4 3629 B9R1.6 NC(=N)c1ccccc1 Amb10068704 [2,0,0,0,0,0|1,0,1]=4 3630 B9R1.6 NC(=N)c1ccccc1 Amb2371546 [2,0,0,0,0,0|1,0,1]=4 3631 B9R1.6 NC(F)c1ccccc1 Amb25059400 [2,0,0,0,0,0|1,0,0]=3 3632 B9R1.6 NC(N)c1cc[n]cc1 Amb24079161 [2,0,0,0,0,0|2,0,0]=4 3633 B9R1.6 NC(N)c1cccc[n]1 Amb24430144 [2,0,0,0,0,0|2,0,0]=4 3634 B9R1.6 NC(O)c1c[n]ccc1 Amb25251813 [2,0,0,0,0,0|2,0,0]=4 3635 B9R1.6 NC(O)c1cc[n]cc1 Amb25744601 [2,0,0,0,0,0|2,0,0]=4 3636 B9R1.6 N[13C](=O)c1ccccc1 Amb22351604 [2,0,0,0,0,0|1,0,1]=4 3637 B9R1.6 OC(Br)c1ccccc1 Amb24693764 [2,0,0,0,0,0|2,0,0]=4 3638 B9R1.6 OC(Cl)c1ccccc1 Amb24480238 [2,0,0,0,0,0|2,0,0]=4 3639 B9R1.6 OC(P)c1ccccc1 Amb24448419 [2,0,0,0,0,0|1,1,0]=4 3640 B9R1.6 O[C@H](Br)c1ccccc1 Amb25114797 [2,0,0,0,0,0|2,0,0]=4 3641 B9R1.6 SC(S)c1ccccc1 Amb25716873 [2,0,0,0,0,0|2,0,0]=4 3642 B9R1.6 [13CH3]C(=O)c1ccccc1 Amb22353264 [2,0,0,0,0,0|1,0,1]=4 3643 B9R1.6 [13CH3][13CH](O)c1ccccc1 Amb22363197 [2,0,0,0,0,0|1,0,0]=3 3644 B9R1.6 [13CH3][13C](=O)c1ccccc1 Amb22366852 [2,0,0,0,0,0|1,0,1]=4 3645 B9R1.6 [15NH2]C(=O)c1ccccc1 Amb22366901 [2,0,0,0,0,0|1,0,1]=4 3646 B9R1.8 BrCCc1c[n]ccc1 Amb19069960 [2,0,0,0,0,0|2,0,0]=4 3647 B9R1.8 BrCCc1c[n]ccc1 Amb19372982 [2,0,0,0,0,0|2,0,0]=4 3648 B9R1.8 BrCCc1cc[n]cc1 Amb18326675 [2,0,0,0,0,0|2,0,0]=4 3649 B9R1.8 BrCCc1ccccn1 Amb1102303 [2,0,0,0,0,0|2,0,0]=4 3650 B9R1.8 BrCCc1ccccn1 Amb17935743 [2,0,0,0,0,0|2,0,0]=4 3651 B9R1.8 BrCNc1ccccc1 Amb25758335 [2,0,0,0,0,0|2,0,0]=4 3652 B9R1.8 Br[Mg]Cc1ccccc1 Amb20240676 [2,0,0,0,0,0|2,0,0]=4 3653 B9R1.8 Br[Zn]Cc1ccccc1 Amb22000396 [2,0,0,0,0,0|2,0,0]=4 3654 B9R1.8 CCC[n+]1ccccc1 Amb24325390 [2,0,0,0,0,0|1,0,0]=3 3655 B9R1.8 CCCc1[n]ccc[n]1 Amb24084965 [2,0,0,0,0,0|2,0,0]=4 3656 B9R1.8 CCCc1c[n]c[n]c1 Amb24071652 [2,0,0,0,0,0|2,0,0]=4 3657 B9R1.8 CCCc1cc[n]c[n]1 Amb24070638 [2,0,0,0,0,0|2,0,0]=4 3658 B9R1.8 CCCc1ccc[n][n]1 Amb24447402 [2,0,0,0,0,0|2,0,0]=4 3659 B9R1.8 CCCc1ccccc1 Amb2447143 [2,0,0,0,0,0|0,0,0]=2 3660 B9R1.8 CCNc1ccccc1 Amb22731692 [2,0,0,0,0,0|1,0,0]=3 3661 B9R1.8 CCOc1cccnc1 Amb10573342 [2,0,0,0,0,0|2,0,0]=4 3662 B9R1.8 CNCc1[n]ccc[n]1 Amb22886406 [2,0,0,0,0,0|2,0,0]=4 3663 B9R1.8 CNCc1c[n][n]cc1 Amb24183593 [2,0,0,0,0,0|2,0,0]=4 3664 B9R1.8 CNCc1c[n]cc[n]1 Amb21959600 [2,0,0,0,0,0|2,0,0]=4 3665 B9R1.8 CNCc1c[n]cc[n]1 Amb22498352 [2,0,0,0,0,0|2,0,0]=4 3666 B9R1.8 CNCc1cc[n]c[n]1 Amb21962059 [2,0,0,0,0,0|2,0,0]=4 3667 B9R1.8 CNCc1cc[n]c[n]1 Amb22587684 [2,0,0,0,0,0|2,0,0]=4 3668 B9R1.8 CNCc1ccccn1 Amb10068750 [2,0,0,0,0,0|1,0,0]=3 3669 B9R1.8 CNCc1ccccn1 Amb10576408 [2,0,0,0,0,0|1,0,0]=3 3670 B9R1.8 CNCc1cccnc1 Amb10066918 [2,0,0,0,0,0|1,0,0]=3 3671 B9R1.8 CNCc1cccnc1 Amb10576409 [2,0,0,0,0,0|1,0,0]=3 3672 B9R1.8 CNCc1cccnc1 Amb1648828 [2,0,0,0,0,0|1,0,0]=3 3673 B9R1.8 CNCc1ccncc1 Amb10068773 [2,0,0,0,0,0|1,0,0]=3 3674 B9R1.8 CNCc1ccncc1 Amb10576211 [2,0,0,0,0,0|1,0,0]=3 3675 B9R1.8 CNCc1ccncc1 Amb1115812 [2,0,0,0,0,0|1,0,0]=3 3676 B9R1.8 CNCc1cnccn1 Amb1094140 [2,0,0,0,0,0|2,0,0]=4 3677 B9R1.8 CNNc1cccc[n]1 Amb25146742 [2,0,0,0,0,0|2,0,0]=4 3678 B9R1.8 CNNc1ccccc1 Amb20242875 [2,0,0,0,0,0|1,0,0]=3 3679 B9R1.8 CNSc1ccccc1 Amb25811332 [2,0,0,0,0,0|1,0,0]=3 3680 B9R1.8 COC[n+]1ccccc1 Amb25309455 [2,0,0,0,0,0|2,0,0]=4 3681 B9R1.8 COCc1c[n]ccc1 Amb24106446 [2,0,0,0,0,0|2,0,0]=4 3682 B9R1.8 COCc1cc[n]cc1 Amb24075931 [2,0,0,0,0,0|2,0,0]=4 3683 B9R1.8 COPc1ccccc1 Amb22729661 [2,0,0,0,0,0|2,0,0]=4 3684 B9R1.8 CSCc1c[n]ccc1 Amb24523080 [2,0,0,0,0,0|2,0,0]=4 3685 B9R1.8 C[NH2+]Cc1ccccc1 Amb20648430 [2,0,0,0,0,0|0,0,1]=3 3686 B9R1.8 ClCCc1c[n]ccc1 Amb20241066 [2,0,0,0,0,0|2,0,0]=4 3687 B9R1.8 ClCCc1c[n]ccc1 Amb24061504 [2,0,0,0,0,0|2,0,0]=4 3688 B9R1.8 ClCCc1cc[n]cc1 Amb23400891 [2,0,0,0,0,0|2,0,0]=4 3689 B9R1.8 ClCCc1cccc[n]1 Amb19892295 [2,0,0,0,0,0|2,0,0]=4 3690 B9R1.8 ClCCc1ccccn1 Amb1102254 [2,0,0,0,0,0|2,0,0]=4 3691 B9R1.8 ClCNc1ccccc1 Amb25836772 [2,0,0,0,0,0|2,0,0]=4 3692 B9R1.8 ClCOc1ccccc1 Amb22059503 [2,0,0,0,0,0|2,0,0]=4 3693 B9R1.8 ClCPc1ccccc1 Amb25294535 [2,0,0,0,0,0|2,0,0]=4 3694 B9R1.8 ClC[SiH2]c1ccccc1 Amb22230170 [2,0,0,0,0,0|1,1,0]=4 3695 B9R1.8 Cl[Hg]Cc1ccccc1 Amb22360147 [2,0,0,0,0,0|2,0,0]=4 3696 B9R1.8 FCCc1c[n]ccc1 Amb24085191 [2,0,0,0,0,0|2,0,0]=4 3697 B9R1.8 FCCc1cc[n]cc1 Amb24102730 [2,0,0,0,0,0|2,0,0]=4 3698 B9R1.8 FCCc1cccc[n]1 Amb24070130 [2,0,0,0,0,0|2,0,0]=4 3699 B9R1.8 FCOc1ccccc1 Amb24099991 [2,0,0,0,0,0|2,0,0]=4 3700 B9R1.8 ICCc1cccc[n]1 Amb24573930 [2,0,0,0,0,0|2,0,0]=4 3701 B9R1.8 I[Hg]Cc1ccccc1 Amb22347189 [2,0,0,0,0,0|2,0,0]=4 3702 B9R1.8 N#C[13CH2]c1ccccc1 Amb22337751 [2,0,0,0,0,0|0,0,2]=4 3703 B9R1.8 N#[13C]Cc1ccccc1 Amb22363279 [2,0,0,0,0,0|0,0,2]=4 3704 B9R1.8 N#[13C][13CH2]c1ccccc1 Amb22367491 [2,0,0,0,0,0|0,0,2]=4 3705 B9R1.8 NCCc1[n]ccc[n]1 Amb18199432 [2,0,0,0,0,0|2,0,0]=4 3706 B9R1.8 NCCc1[n]ccc[n]1 Amb23399636 [2,0,0,0,0,0|2,0,0]=4 3707 B9R1.8 NCCc1[n]ccc[n]1 Amb24066982 [2,0,0,0,0,0|2,0,0]=4 3708 B9R1.8 NCCc1c[n]cc[n]1 Amb22756001 [2,0,0,0,0,0|2,0,0]=4 3709 B9R1.8 NCCc1c[n]cc[n]1 Amb24066949 [2,0,0,0,0,0|2,0,0]=4 3710 B9R1.8 NCCc1c[n]ccc1 Amb20241523 [2,0,0,0,0,0|1,0,0]=3 3711 B9R1.8 NCCc1cc[n]c[n]1 Amb22899210 [2,0,0,0,0,0|2,0,0]=4 3712 B9R1.8 NCCc1cc[n]cc1 Amb20240779 [2,0,0,0,0,0|1,0,0]=3 3713 B9R1.8 NCCc1ccc[n][n]1 Amb23592188 [2,0,0,0,0,0|2,0,0]=4 3714 B9R1.8 NCCc1cccc[n]1 Amb24065228 [2,0,0,0,0,0|1,0,0]=3 3715 B9R1.8 NCCc1cccc[n]1 Amb24066975 [2,0,0,0,0,0|1,0,0]=3 3716 B9R1.8 NCCc1ccccc1 Amb17772283 [2,0,0,0,0,0|0,0,0]=2 3717 B9R1.8 NCCc1ccccc1 Amb17843439 [2,0,0,0,0,0|0,0,0]=2 3718 B9R1.8 NCCc1ccccc1 Amb22360716 [2,0,0,0,0,0|0,0,0]=2 3719 B9R1.8 NCCc1ccccc1 Amb24325112 [2,0,0,0,0,0|0,0,0]=2 3720 B9R1.8 NCCc1ccccc1 Amb24325408 [2,0,0,0,0,0|0,0,0]=2 3721 B9R1.8 NCCc1ccccn1 Amb1156071 [2,0,0,0,0,0|1,0,0]=3 3722 B9R1.8 NCCc1cccnc1 Amb1134784 [2,0,0,0,0,0|1,0,0]=3 3723 B9R1.8 NCCc1cccnc1 Amb16230500 [2,0,0,0,0,0|1,0,0]=3 3724 B9R1.8 NCCc1ccncc1 Amb1102164 [2,0,0,0,0,0|1,0,0]=3 3725 B9R1.8 NCCc1cnccn1 Amb10067912 [2,0,0,0,0,0|2,0,0]=4 3726 B9R1.8 NCCc1cnccn1 Amb1995199 [2,0,0,0,0,0|2,0,0]=4 3727 B9R1.8 NCCc1ncccn1 Amb17074351 [2,0,0,0,0,0|2,0,0]=4 3728 B9R1.8 NCNc1ccccc1 Amb17117015 [2,0,0,0,0,0|1,0,0]=3 3729 B9R1.8 NCOc1ccccc1 Amb25128781 [2,0,0,0,0,0|1,0,0]=3 3730 B9R1.8 NCSc1ccccc1 Amb25128061 [2,0,0,0,0,0|1,0,0]=3 3731 B9R1.8 NC[13CH2]c1ccccc1 Amb22367506 [2,0,0,0,0,0|0,0,0]=2 3732 B9R1.8 NNCc1c[n]ccc1 Amb19893243 [2,0,0,0,0,0|2,0,0]=4 3733 B9R1.8 NNCc1c[n]ccc1 Amb22491471 [2,0,0,0,0,0|2,0,0]=4 3734 B9R1.8 NNCc1cc[n]cc1 Amb19893255 [2,0,0,0,0,0|2,0,0]=4 3735 B9R1.8 NNCc1cccc[n]1 Amb19893254 [2,0,0,0,0,0|2,0,0]=4 3736 B9R1.8 NNCc1ccccc1 Amb1105200 [2,0,0,0,0,0|1,0,0]=3 3737 B9R1.8 NNCc1ccccc1 Amb16231890 [2,0,0,0,0,0|1,0,0]=3 3738 B9R1.8 NNCc1ccccc1 Amb22492438 [2,0,0,0,0,0|1,0,0]=3 3739 B9R1.8 NNCc1ccccn1 Amb1117330 [2,0,0,0,0,0|2,0,0]=4 3740 B9R1.8 NNCc1cccnc1 Amb1121062 [2,0,0,0,0,0|2,0,0]=4 3741 B9R1.8 NNCc1ccncc1 Amb1118337 [2,0,0,0,0,0|2,0,0]=4 3742 B9R1.8 NOCc1c[n]ccc1 Amb22059440 [2,0,0,0,0,0|2,0,0]=4 3743 B9R1.8 NOCc1c[n]ccc1 Amb24074265 [2,0,0,0,0,0|2,0,0]=4 3744 B9R1.8 NOCc1cc[n]cc1 Amb22397036 [2,0,0,0,0,0|2,0,0]=4 3745 B9R1.8 NOCc1cccc[n]1 Amb18642195 [2,0,0,0,0,0|2,0,0]=4 3746 B9R1.8 NOCc1ccccc1 Amb1154307 [2,0,0,0,0,0|1,0,0]=3 3747 B9R1.8 NOCc1ccccc1 Amb16204809 [2,0,0,0,0,0|1,0,0]=3 3748 B9R1.8 NOCc1ccccc1 Amb22489499 [2,0,0,0,0,0|1,0,0]=3 3749 B9R1.8 N[13CH2][13CH2]c1ccccc1 Amb22367507 [2,0,0,0,0,0|0,0,0]=2 3750 B9R1.8 N\C=N\c1ccccc1 Amb10552787 [2,0,0,0,0,0|1,0,1]=4 3751 B9R1.8 N\N=C\c1ccccc1 Amb2539422 [2,0,0,0,0,0|1,0,1]=4 3752 B9R1.8 OCC[n+]1ccccc1 Amb22364462 [2,0,0,0,0,0|2,0,0]=4 3753 B9R1.8 OCCc1cc[n]cc1 Amb24325389 [2,0,0,0,0,0|2,0,0]=4 3754 B9R1.8 OCOc1ccccc1 Amb25847006 [2,0,0,0,0,0|2,0,0]=4 3755 B9R1.8 ONCc1c[n]ccc1 Amb25147084 [2,0,0,0,0,0|2,0,0]=4 3756 B9R1.8 ONCc1cc[n]cc1 Amb25851052 [2,0,0,0,0,0|2,0,0]=4 3757 B9R1.8 ONCc1ccccc1 Amb22001943 [2,0,0,0,0,0|1,0,0]=3 3758 B9R1.8 SCCc1c[n]ccc1 Amb22008806 [2,0,0,0,0,0|2,0,0]=4 3759 B9R1.8 SCCc1ccccn1 Amb17619707 [2,0,0,0,0,0|2,0,0]=4 3760 B9R1.8 SCCc1ccncc1 Amb10552830 [2,0,0,0,0,0|2,0,0]=4 3761 B9R1.8 [C-]#[N+]Cc1ccccc1 Amb2234859 [2,0,0,0,0,0|0,0,2]=4 3762 B9R1.8 [NH3+]CCc1cc[nH+]cc1 Amb10553712 [2,0,0,0,0,0|1,0,1]=4 3763 B9R1.8 [NH3+]CCc1ccccc1 Amb17843435 [2,0,0,0,0,0|0,0,1]=3 3764 B11R1.7 BrCC(c1ccccc1)(C)C Amb17140754 [1,1,0,0,0,0|1,0,0]=3 3765 B11R1.7 BrCC(c1ccccc1)(F)F Amb10839191 [1,1,0,0,0,0|2,0,0]=4 3766 B11R1.7 C#CC(c1ccccc1)(O)C Amb1088912 [1,1,0,0,0,0|0,0,2]=4 3767 B11R1.7 CC(C)(C#C)c1ccccc1 Amb24106606 [1,1,0,0,0,0|0,0,2]=4 3768 B11R1.7 CC(C)(C=C)c1ccccc1 Amb24476101 [1,1,0,0,0,0|0,0,2]=4 3769 B11R1.7 CC(C)(CCl)c1cc[n]cc1 Amb24102653 [1,1,0,0,0,0|2,0,0]=4 3770 B11R1.7 CC(C)(CCl)c1cccc[n]1 Amb24523051 [1,1,0,0,0,0|2,0,0]=4 3771 B11R1.7 CC(C)(CN)c1c[n]c[n]c1 Amb18908421 [1,1,0,0,0,0|2,0,0]=4 3772 B11R1.7 CC(C)(CN)c1cc[n]c[n]1 Amb25064128 [1,1,0,0,0,0|2,0,0]=4 3773 B11R1.7 CC(C)(CN)c1ccc[n][n]1 Amb24681748 [1,1,0,0,0,0|2,0,0]=4 3774 B11R1.7 CC(C)(CN)c1ccncc1 Amb17748503 [1,1,0,0,0,0|1,0,0]=3 3775 B11R1.7 CC(C)(CN)c1cnccn1 Amb17779860 [1,1,0,0,0,0|2,0,0]=4 3776 B11R1.7 CC(C)(CO)c1cc[n]cc1 Amb22372285 [1,1,0,0,0,0|2,0,0]=4 3777 B11R1.7 CC(C)(NN)c1ccccc1 Amb18644446 [1,1,0,0,0,0|1,0,0]=3 3778 B11R1.7 CC(C)(NO)c1ccccc1 Amb25786374 [1,1,0,0,0,0|1,0,0]=3 3779 B11R1.7 CC(Cl)(C#N)c1ccccc1 Amb18126433 [1,1,0,0,0,0|0,0,2]=4 3780 B11R1.7 CC(Cl)(C=O)c1ccccc1 Amb18126588 [1,1,0,0,0,0|1,0,1]=4 3781 B11R1.7 CC(Cl)(CN)c1ccccc1 Amb22360715 [1,1,0,0,0,0|0,0,0]=2 3782 B11R1.7 CC(F)(C#N)c1ccccc1 Amb22546815 [1,1,0,0,0,0|0,0,2]=4 3783 B11R1.7 CC(F)(CBr)c1ccccc1 Amb24064673 [1,1,0,0,0,0|1,0,0]=3 3784 B11R1.7 CC(F)(CN)c1c[n]cc[n]1 Amb24439038 [1,1,0,0,0,0|2,0,0]=4 3785 B11R1.7 CC(F)(CO)c1ccccc1 Amb24592102 [1,1,0,0,0,0|1,0,0]=3 3786 B11R1.7 CC(N)(C#C)c1ccccc1 Amb24432861 [1,1,0,0,0,0|0,0,2]=4 3787 B11R1.7 CC(N)(C=C)c1ccccc1 Amb18124851 [1,1,0,0,0,0|0,0,2]=4 3788 B11R1.7 CC(N)(CN)c1cc[n]cc1 Amb23538716 [1,1,0,0,0,0|1,0,0]=3 3789 B11R1.7 CC(N)(CN)c1ccccc1 Amb18286210 [1,1,0,0,0,0|0,0,0]=2 3790 B11R1.7 CC(N)(CO)c1c[n]ccc1 Amb18951182 [1,1,0,0,0,0|2,0,0]=4 3791 B11R1.7 CC(N)(CO)c1cc[n]cc1 Amb18281689 [1,1,0,0,0,0|2,0,0]=4 3792 B11R1.7 CC(N)(CO)c1cccc[n]1 Amb18951181 [1,1,0,0,0,0|2,0,0]=4 3793 B11R1.7 CC(N)(CS)c1ccccc1 Amb25049325 [1,1,0,0,0,0|1,0,0]=3 3794 B11R1.7 CC(O)(CCl)c1cc[n]cc1 Amb24487912 [1,1,0,0,0,0|2,0,0]=4 3795 B11R1.7 CC(O)(CCl)c1ccccc1 Amb25053941 [1,1,0,0,0,0|1,0,0]=3 3796 B11R1.7 CC(O)(CN)c1c[n]ccc1 Amb18062788 [1,1,0,0,0,0|1,0,0]=3 3797 B11R1.7 CC(O)(CN)c1cc[n]cc1 Amb18562952 [1,1,0,0,0,0|1,0,0]=3 3798 B11R1.7 CC(O)(CN)c1cccc[n]1 Amb18064991 [1,1,0,0,0,0|1,0,0]=3 3799 B11R1.7 CCC(C)(C)c1cccc[n]1 Amb24742288 [1,1,0,0,0,0|1,0,0]=3 3800 B11R1.7 CCC(C)(N)c1c[n]c[n]c1 Amb18962177 [1,1,0,0,0,0|2,0,0]=4 3801 B11R1.7 CCC(C)(N)c1c[n]ccc1 Amb18950468 [1,1,0,0,0,0|1,0,0]=3 3802 B11R1.7 CCC(C)(N)c1ccc[n][n]1 Amb25694636 [1,1,0,0,0,0|2,0,0]=4 3803 B11R1.7 CCC(C)(O)c1c[n]c[n]c1 Amb18182802 [1,1,0,0,0,0|2,0,0]=4 3804 B11R1.7 CCC(F)(F)c1c[n]ccc1 Amb20669751 [1,1,0,0,0,0|2,0,0]=4 3805 B11R1.7 CCC(F)(F)c1cc[n]cc1 Amb20669846 [1,1,0,0,0,0|2,0,0]=4 3806 B11R1.7 CCC(F)(F)c1ccccc1 Amb20670157 [1,1,0,0,0,0|1,0,0]=3 3807 B11R1.7 CCC(N)(O)c1ccccc1 Amb24756540 [1,1,0,0,0,0|1,0,0]=3 3808 B11R1.7 CC[C@@](C)(N)c1c[n]ccc1 Amb24472245 [1,1,0,0,0,0|1,0,0]=3 3809 B11R1.7 CC[C@@](C)(N)c1cccc[n]1 Amb24637758 [1,1,0,0,0,0|1,0,0]=3 3810 B11R1.7 CC[C@](C)(N)c1c[n]ccc1 Amb24447529 [1,1,0,0,0,0|1,0,0]=3 3811 B11R1.7 CC[C@](C)(N)c1cccc[n]1 Amb24486026 [1,1,0,0,0,0|1,0,0]=3 3812 B11R1.7 CC[Si](Cl)(Cl)c1ccccc1 Amb19893874 [1,1,0,0,0,0|1,1,0]=4 3813 B11R1.7 CN=[S@@](C)(=O)c1ccccc1 Amb22800519 [1,1,0,0,0,0|1,0,1]=4 3814 B11R1.7 CNS(=O)(=O)c1ccccc1 Amb1152097 [1,1,0,0,0,0|2,0,0]=4 3815 B11R1.7 CNS(C)(=O)c1ccccc1 Amb17836794 [1,1,0,0,0,0|1,0,0]=3 3816 B11R1.7 COC(O)(O)c1ccccc1 Amb22749915 [1,1,0,0,0,0|2,0,0]=4 3817 B11R1.7 CO[Si](C)(C)c1ccccc1 Amb22047319 [1,1,0,0,0,0|1,1,0]=4 3818 B11R1.7 CP(=O)(CO)c1ccccc1 Amb24675382 [1,1,0,0,0,0|2,0,0]=4 3819 B11R1.7 CP(=O)(NN)c1ccccc1 Amb24606114 [1,1,0,0,0,0|2,0,0]=4 3820 B11R1.7 CSC(C)(C)c1ccccc1 Amb24752047 [1,1,0,0,0,0|1,0,0]=3 3821 B11R1.7 C[C@@](F)(CO)c1ccccc1 Amb25800819 [1,1,0,0,0,0|1,0,0]=3 3822 B11R1.7 C[C@@](N)(CF)c1ccccc1 Amb25151853 [1,1,0,0,0,0|1,0,0]=3 3823 B11R1.7 C[C@@](N)(CO)c1ccccc1 Amb25743559 [1,1,0,0,0,0|1,0,0]=3 3824 B11R1.7 C[C@](Cl)(C=O)c1ccccc1 Amb24379023 [1,1,0,0,0,0|1,0,1]=4 3825 B11R1.7 C[C@](F)(C=O)c1ccccc1 Amb25695327 [1,1,0,0,0,0|1,0,1]=4 3826 B11R1.7 C[C@](N)(C#N)c1ccccc1 Amb25151854 [1,1,0,0,0,0|0,0,2]=4 3827 B11R1.7 C[C@](N)(C=C)c1ccccc1 Amb25140300 [1,1,0,0,0,0|0,0,2]=4 3828 B11R1.7 C[C@](N)(CO)c1cc[n]cc1 Amb25840870 [1,1,0,0,0,0|2,0,0]=4 3829 B11R1.7 C[C@](N)(CO)c1ccccc1 Amb25119372 [1,1,0,0,0,0|1,0,0]=3 3830 B11R1.7 C[C@](O)(CCl)c1ccccc1 Amb24711473 [1,1,0,0,0,0|1,0,0]=3 3831 B11R1.7 C[C@](S)(CO)c1ccccc1 Amb25032597 [1,1,0,0,0,0|1,0,0]=3 3832 B11R1.7 C[Si](C)(CBr)c1ccccc1 Amb24382689 [1,1,0,0,0,0|1,1,0]=4 3833 B11R1.7 C[Si](C)(CO)c1ccccc1 Amb22347007 [1,1,0,0,0,0|1,1,0]=4 3834 B11R1.7 ClCC(Cl)(Cl)c1ccccc1 Amb24753856 [1,1,0,0,0,0|2,0,0]=4 3835 B11R1.7 FC(F)(CCl)c1ccccc1 Amb20670164 [1,1,0,0,0,0|2,0,0]=4 3836 B11R1.7 FC(F)(CS)c1ccccc1 Amb24382777 [1,1,0,0,0,0|2,0,0]=4 3837 B11R1.7 N#CC(c1ccccc1)(N)C Amb1126393 [1,1,0,0,0,0|0,0,2]=4 3838 B11R1.7 NCC(F)(F)c1c[n]ccc1 Amb20247961 [1,1,0,0,0,0|2,0,0]=4 3839 B11R1.7 NCC(F)(F)c1cc[n]cc1 Amb25194771 [1,1,0,0,0,0|2,0,0]=4 3840 B11R1.7 NCC(F)(F)c1cccc[n]1 Amb24074639 [1,1,0,0,0,0|2,0,0]=4 3841 B11R1.7 NCC(F)(F)c1ccccc1 Amb20247960 [1,1,0,0,0,0|1,0,0]=3 3842 B11R1.7 NCC(c1ccccc1)(O)C Amb1993837 [1,1,0,0,0,0|0,0,0]=2 3843 B11R1.7 NCC(c1ccccc1)(O)C Amb1993963 [1,1,0,0,0,0|0,0,0]=2 3844 B11R1.7 NCC(c1ccccn1)(C)C Amb17106798 [1,1,0,0,0,0|1,0,0]=3 3845 B11R1.7 NCC(c1cccnc1)(C)C Amb17106797 [1,1,0,0,0,0|1,0,0]=3 3846 B11R1.7 O=CC(c1ccccc1)(C)C Amb17232040 [1,1,0,0,0,0|1,0,1]=4 3847 B11R1.7 O=CC(c1ccccc1)(O)C Amb17593726 [1,1,0,0,0,0|1,0,1]=4 3848 B11R1.7 OCC(F)(F)c1ccccc1 Amb24105388 [1,1,0,0,0,0|2,0,0]=4 3849 B11R1.7 OCC(O)(O)c1ccccc1 Amb25149757 [1,1,0,0,0,0|2,0,0]=4 3850 B11R1.7 OCC(c1ccccc1)(N)C Amb13951678 [1,1,0,0,0,0|1,0,0]=3 3851 B11R1.7 OC[C@@](F)(Cl)c1ccccc1 Amb25092081 [1,1,0,0,0,0|2,0,0]=4 3852 B11R1.7 [2H]C(C)(OC)c1ccccc1 Amb22365991 [1,1,0,0,0,0|1,0,0]=3 3853 B11R1.7 [BH3-][P+](C)(CO)c1ccccc1 Amb25846843 [1,1,0,0,0,0|2,0,0]=4 3854 B11R1.7 [BH3-][P@@+](C)(CO)c1ccccc1 Amb24363633 [1,1,0,0,0,0|2,0,0]=4 3855 B11R1.12 C#CC(CN)c1ccccc1 Amb25843210 [1,1,0,0,0,0|0,0,1]=3 3856 B11R1.12 C=C=C(CN)c1ccccc1 Amb25791349 [1,1,0,0,0,0|0,0,2]=4 3857 B11R1.12 C=CC(CBr)c1ccccc1 Amb25258851 [1,1,0,0,0,0|0,0,2]=4 3858 B11R1.12 C=CC(CCl)c1ccccc1 Amb24411551 [1,1,0,0,0,0|0,0,2]=4 3859 B11R1.12 C=CC(CN)c1ccccc1 Amb18644344 [1,1,0,0,0,0|0,0,1]=3 3860 B11R1.12 C=CC(NN)c1ccccc1 Amb25287533 [1,1,0,0,0,0|1,0,1]=4 3861 B11R1.12 C=C[C@@H](CO)c1ccccc1 Amb25694117 [1,1,0,0,0,0|0,0,2]=4 3862 B11R1.12 C=C[C@H](CO)c1ccccc1 Amb25711439 [1,1,0,0,0,0|0,0,2]=4 3863 B11R1.12 CCC(C#N)c1c[n]ccc1 Amb18124802 [1,1,0,0,0,0|1,0,1]=4 3864 B11R1.12 CCC(C=C)c1cc[n]cc1 Amb24102690 [1,1,0,0,0,0|1,0,1]=4 3865 B11R1.12 CCC(C=C)c1ccccc1 Amb24485761 [1,1,0,0,0,0|0,0,1]=3 3866 B11R1.12 CCC(CC)c1[n]ccc[n]1 Amb24100572 [1,1,0,0,0,0|2,0,0]=4 3867 B11R1.12 CCC(CN)c1c[n]c[n]c1 Amb18201509 [1,1,0,0,0,0|2,0,0]=4 3868 B11R1.12 CCC(CN)c1c[n]cc[n]1 Amb25100461 [1,1,0,0,0,0|2,0,0]=4 3869 B11R1.12 CCC(CN)c1c[n]ccc1 Amb18251338 [1,1,0,0,0,0|1,0,0]=3 3870 B11R1.12 CCC(CN)c1cccc[n]1 Amb25785396 [1,1,0,0,0,0|1,0,0]=3 3871 B11R1.12 CCC(CO)c1c[n]ccc1 Amb25043708 [1,1,0,0,0,0|1,0,0]=3 3872 B11R1.12 CCC(NC)c1[n]ccc[n]1 Amb18302289 [1,1,0,0,0,0|2,0,0]=4 3873 B11R1.12 CCC(NC)c1c[n]c[n]c1 Amb18298659 [1,1,0,0,0,0|2,0,0]=4 3874 B11R1.12 CCC(NC)c1c[n]cc[n]1 Amb18301460 [1,1,0,0,0,0|2,0,0]=4 3875 B11R1.12 CCC(NC)c1cc[n]cc1 Amb18301849 [1,1,0,0,0,0|1,0,0]=3 3876 B11R1.12 CCC(NC)c1ccccc1 Amb22492401 [1,1,0,0,0,0|0,0,0]=2 3877 B11R1.12 CCC(NN)c1c[n]ccc1 Amb24484404 [1,1,0,0,0,0|2,0,0]=4 3878 B11R1.12 CCC(NN)c1cc[n]cc1 Amb25324261 [1,1,0,0,0,0|2,0,0]=4 3879 B11R1.12 CCC(NO)c1c[n]ccc1 Amb25344867 [1,1,0,0,0,0|2,0,0]=4 3880 B11R1.12 CCC(NO)c1cc[n]cc1 Amb25150373 [1,1,0,0,0,0|2,0,0]=4 3881 B11R1.12 CCC(SC)c1ccccc1 Amb24484978 [1,1,0,0,0,0|0,0,0]=2 3882 B11R1.12 CCC(c1ccccc1)C=O Amb17138422 [1,1,0,0,0,0|0,0,1]=3 3883 B11R1.12 CCC(c1ccccc1)CBr Amb17241352 [1,1,0,0,0,0|0,0,0]=2 3884 B11R1.12 CCC(c1ccccc1)CN Amb2371100 [1,1,0,0,0,0|0,0,0]=2 3885 B11R1.12 CCC(c1ccccc1)NC Amb1116786 [1,1,0,0,0,0|0,0,0]=2 3886 B11R1.12 CCC(c1ccccc1)NO Amb10605010 [1,1,0,0,0,0|1,0,0]=3 3887 B11R1.12 CCC(c1ccccn1)NC Amb10607918 [1,1,0,0,0,0|1,0,0]=3 3888 B11R1.12 CCC(c1cccnc1)NC Amb10607958 [1,1,0,0,0,0|1,0,0]=3 3889 B11R1.12 CCN(C#N)c1ccccc1 Amb25759456 [1,1,0,0,0,0|1,0,1]=4 3890 B11R1.12 CCN(C=O)c1ccccc1 Amb17672982 [1,1,0,0,0,0|1,0,1]=4 3891 B11R1.12 CCN(CC)c1c[n]ccc1 Amb18268930 [1,1,0,0,0,0|2,0,0]=4 3892 B11R1.12 CCN(CC)c1cc[n]cc1 Amb18931830 [1,1,0,0,0,0|2,0,0]=4 3893 B11R1.12 CCN(CC)c1cccc[n]1 Amb18268946 [1,1,0,0,0,0|2,0,0]=4 3894 B11R1.12 CCN(CO)c1ccccc1 Amb20621228 [1,1,0,0,0,0|1,0,0]=3 3895 B11R1.12 CCN(c1ccccc1)CC Amb10072363 [1,1,0,0,0,0|1,0,0]=3 3896 B11R1.12 CCN(c1ccccc1)N=O Amb17618581 [1,1,0,0,0,0|2,0,0]=4 3897 B11R1.12 CCP(CO)c1ccccc1 Amb25822323 [1,1,0,0,0,0|1,0,0]=3 3898 B11R1.12 CC[C@@H](CCl)c1ccccc1 Amb25250668 [1,1,0,0,0,0|0,0,0]=2 3899 B11R1.12 CC[C@@H](CN)c1ccccc1 Amb22746798 [1,1,0,0,0,0|0,0,0]=2 3900 B11R1.12 CC[C@@H](NO)c1c[n]ccc1 Amb24486823 [1,1,0,0,0,0|2,0,0]=4 3901 B11R1.12 CC[C@@H](NO)c1cc[n]cc1 Amb24445169 [1,1,0,0,0,0|2,0,0]=4 3902 B11R1.12 CC[C@@H](NO)c1ccccc1 Amb25303906 [1,1,0,0,0,0|1,0,0]=3 3903 B11R1.12 CC[C@H](C=O)c1ccccc1 Amb25731916 [1,1,0,0,0,0|0,0,1]=3 3904 B11R1.12 CC[C@H](CO)c1ccccc1 Amb25684561 [1,1,0,0,0,0|0,0,0]=2 3905 B11R1.12 CC[C@H](NO)c1cc[n]cc1 Amb25775891 [1,1,0,0,0,0|2,0,0]=4 3906 B11R1.12 CC\C(=C/Cl)\c1ccccc1 Amb24373905 [1,1,0,0,0,0|0,0,2]=4 3907 B11R1.12 CC\C(=C\Cl)\c1ccccc1 Amb25227191 [1,1,0,0,0,0|0,0,2]=4 3908 B11R1.12 CC\C(=N\N)\c1ccccc1 Amb24396664 [1,1,0,0,0,0|1,0,1]=4 3909 B11R1.12 CN=C(NN)c1ccccc1 Amb22447540 [1,1,0,0,0,0|1,0,1]=4 3910 B11R1.12 CNC(C#C)c1cc[n]cc1 Amb24367596 [1,1,0,0,0,0|1,0,1]=4 3911 B11R1.12 CNC(C#N)c1c[n]ccc1 Amb22551064 [1,1,0,0,0,0|1,0,1]=4 3912 B11R1.12 CNC(C=C)c1cccc[n]1 Amb25341977 [1,1,0,0,0,0|1,0,1]=4 3913 B11R1.12 CNC(C=C)c1ccccc1 Amb18124852 [1,1,0,0,0,0|0,0,1]=3 3914 B11R1.12 CNC(CBr)c1ccccc1 Amb25095723 [1,1,0,0,0,0|0,0,0]=2 3915 B11R1.12 CNC(CF)c1c[n]ccc1 Amb25270473 [1,1,0,0,0,0|1,0,0]=3 3916 B11R1.12 CNC(CF)c1ccccc1 Amb23443830 [1,1,0,0,0,0|0,0,0]=2 3917 B11R1.12 CNC(CN)c1c[n]c[n]c1 Amb24636225 [1,1,0,0,0,0|2,0,0]=4 3918 B11R1.12 CNC(CN)c1c[n]ccc1 Amb18985333 [1,1,0,0,0,0|1,0,0]=3 3919 B11R1.12 CNC(CN)c1cc[n]cc1 Amb18065359 [1,1,0,0,0,0|1,0,0]=3 3920 B11R1.12 CNC(CO)c1cc[n]cc1 Amb18065364 [1,1,0,0,0,0|1,0,0]=3 3921 B11R1.12 CNC(CO)c1cccc[n]1 Amb18065363 [1,1,0,0,0,0|1,0,0]=3 3922 B11R1.12 CNC(CO)c1ccccc1 Amb18035932 [1,1,0,0,0,0|0,0,0]=2 3923 B11R1.12 CNC(c1ccccc1)C#N Amb17621643 [1,1,0,0,0,0|0,0,1]=3 3924 B11R1.12 CNC(c1ccccn1)C#N Amb17043382 [1,1,0,0,0,0|1,0,1]=4 3925 B11R1.12 CNC(c1cccnc1)CO Amb17232101 [1,1,0,0,0,0|1,0,0]=3 3926 B11R1.12 CNC(c1ccncc1)C#N Amb17043489 [1,1,0,0,0,0|1,0,1]=4 3927 B11R1.12 CN[C@@H](CO)c1c[n]cc[n]1 Amb25808073 [1,1,0,0,0,0|2,0,0]=4 3928 B11R1.12 CN[C@@H](CO)c1cccc[n]1 Amb25858487 [1,1,0,0,0,0|1,0,0]=3 3929 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb22746483 [1,1,0,0,0,0|0,0,0]=2 3930 B11R1.12 CN[C@@H](CO)c1ccccc1 Amb23400921 [1,1,0,0,0,0|0,0,0]=2 3931 B11R1.12 CN[C@H](CO)c1c[n]ccc1 Amb24745307 [1,1,0,0,0,0|1,0,0]=3 3932 B11R1.12 CN[C@H](CO)c1cc[n]cc1 Amb24376255 [1,1,0,0,0,0|1,0,0]=3 3933 B11R1.12 CN\C(=N\O)\c1ccccc1 Amb25293329 [1,1,0,0,0,0|1,0,1]=4 3934 B11R1.12 COB(OC)c1ccccc1 Amb24103414 [1,1,0,0,0,0|2,0,0]=4 3935 B11R1.12 COC(C#C)c1ccccc1 Amb25242698 [1,1,0,0,0,0|0,0,2]=4 3936 B11R1.12 COC(C=C)c1ccccc1 Amb22002227 [1,1,0,0,0,0|0,0,2]=4 3937 B11R1.12 COC(C=O)c1ccccc1 Amb18125121 [1,1,0,0,0,0|1,0,1]=4 3938 B11R1.12 COC(CBr)c1ccccc1 Amb24079930 [1,1,0,0,0,0|1,0,0]=3 3939 B11R1.12 COC(CCl)c1ccccc1 Amb17674030 [1,1,0,0,0,0|1,0,0]=3 3940 B11R1.12 COC(CN)c1c[n]ccc1 Amb18980565 [1,1,0,0,0,0|1,0,0]=3 3941 B11R1.12 COC(CN)c1cc[n]cc1 Amb18980589 [1,1,0,0,0,0|1,0,0]=3 3942 B11R1.12 COC(CN)c1cccc[n]1 Amb18980548 [1,1,0,0,0,0|1,0,0]=3 3943 B11R1.12 COC(OC)c1cc[n]cc1 Amb24487039 [1,1,0,0,0,0|2,0,0]=4 3944 B11R1.12 COC(OC)c1cccc[n]1 Amb25676282 [1,1,0,0,0,0|2,0,0]=4 3945 B11R1.12 CO[C+](OC)c1ccccc1 Amb25369960 [1,1,0,0,0,0|1,0,1]=4 3946 B11R1.12 CO[C@@H](C=O)c1ccccc1 Amb25252891 [1,1,0,0,0,0|1,0,1]=4 3947 B11R1.12 CO[C@@H](CO)c1ccccc1 Amb21617903 [1,1,0,0,0,0|1,0,0]=3 3948 B11R1.12 CO[C@H](CBr)c1ccccc1 Amb24760200 [1,1,0,0,0,0|1,0,0]=3 3949 B11R1.12 CSC(C=O)c1ccccc1 Amb18646623 [1,1,0,0,0,0|1,0,1]=4 3950 B11R1.12 CSC(CCl)c1ccccc1 Amb25701729 [1,1,0,0,0,0|1,0,0]=3 3951 B11R1.12 CSC(CN)c1c[n]ccc1 Amb18293257 [1,1,0,0,0,0|1,0,0]=3 3952 B11R1.12 CSC(CN)c1cc[n]cc1 Amb18980591 [1,1,0,0,0,0|1,0,0]=3 3953 B11R1.12 CSC(CN)c1cccc[n]1 Amb18293248 [1,1,0,0,0,0|1,0,0]=3 3954 B11R1.12 CSC(CN)c1ccccc1 Amb18979448 [1,1,0,0,0,0|0,0,0]=2 3955 B11R1.12 CSC(CO)c1ccccc1 Amb25854289 [1,1,0,0,0,0|1,0,0]=3 3956 B11R1.12 C\C=C(/CBr)\c1ccccc1 Amb24356608 [1,1,0,0,0,0|0,0,2]=4 3957 B11R1.12 C\C=C(/CC)\c1cccc[n]1 Amb24101962 [1,1,0,0,0,0|1,0,1]=4 3958 B11R1.12 C\C=C(\CC)/c1cccc[n]1 Amb25152130 [1,1,0,0,0,0|1,0,1]=4 3959 B11R1.12 C\C=C(\CO)/c1ccccc1 Amb25084503 [1,1,0,0,0,0|0,0,2]=4 3960 B11R1.12 ClCC(CCl)c1ccccc1 Amb25284727 [1,1,0,0,0,0|1,0,0]=3 3961 B11R1.12 N#CC(CCl)c1ccccc1 Amb24453755 [1,1,0,0,0,0|0,0,2]=4 3962 B11R1.12 N=CC(CO)c1ccccc1 Amb24361896 [1,1,0,0,0,0|0,0,2]=4 3963 B11R1.12 NCC(C#N)c1ccccc1 Amb18251298 [1,1,0,0,0,0|0,0,1]=3 3964 B11R1.12 NCC(CF)c1cccc[n]1 Amb25248780 [1,1,0,0,0,0|1,0,0]=3 3965 B11R1.12 NCC(CN)c1c[n]ccc1 Amb18065357 [1,1,0,0,0,0|1,0,0]=3 3966 B11R1.12 NCC(CN)c1cc[n]cc1 Amb18065358 [1,1,0,0,0,0|1,0,0]=3 3967 B11R1.12 NCC(CN)c1cccc[n]1 Amb18065356 [1,1,0,0,0,0|1,0,0]=3 3968 B11R1.12 NCC(CN)c1ccccc1 Amb18301720 [1,1,0,0,0,0|0,0,0]=2 3969 B11R1.12 NCC(CN)c1ccccc1 Amb22487374 [1,1,0,0,0,0|0,0,0]=2 3970 B11R1.12 NCC(CO)c1[n]ccc[n]1 Amb24454756 [1,1,0,0,0,0|2,0,0]=4 3971 B11R1.12 NCC(CO)c1c[n]ccc1 Amb18644523 [1,1,0,0,0,0|1,0,0]=3 3972 B11R1.12 NCC(CO)c1cc[n]c[n]1 Amb25285866 [1,1,0,0,0,0|2,0,0]=4 3973 B11R1.12 NCC(CO)c1cccc[n]1 Amb25265702 [1,1,0,0,0,0|1,0,0]=3 3974 B11R1.12 NCC(c1ccccc1)NC Amb10879686 [1,1,0,0,0,0|0,0,0]=2 3975 B11R1.12 NCC(c1ccccc1)OC Amb10609834 [1,1,0,0,0,0|0,0,0]=2 3976 B11R1.12 NC[C@H](CO)c1ccccc1 Amb22802423 [1,1,0,0,0,0|0,0,0]=2 3977 B11R1.12 NC\C(=C/Br)\c1ccccc1 Amb24401627 [1,1,0,0,0,0|0,0,2]=4 3978 B11R1.12 NC\C(=C\F)\c1ccccc1 Amb24538168 [1,1,0,0,0,0|0,0,2]=4 3979 B11R1.12 NC\C(=N/O)\c1ccccc1 Amb10606191 [1,1,0,0,0,0|1,0,1]=4 3980 B11R1.12 NC\C(=N\O)\c1ccccc1 Amb25368564 [1,1,0,0,0,0|1,0,1]=4 3981 B11R1.12 NNC(c1ccccc1)C#N Amb17399905 [1,1,0,0,0,0|1,0,1]=4 3982 B11R1.12 N\N=C(\CO)/c1ccccc1 Amb25032443 [1,1,0,0,0,0|1,0,1]=4 3983 B11R1.12 O=CC(CF)c1ccccc1 Amb25243376 [1,1,0,0,0,0|1,0,1]=4 3984 B11R1.12 OCB(CO)c1ccccc1 Amb25149604 [1,1,0,0,0,0|2,0,0]=4 3985 B11R1.12 OCC(CF)c1ccccc1 Amb25149698 [1,1,0,0,0,0|1,0,0]=3 3986 B11R1.12 OCC(NO)c1c[n]ccc1 Amb25344594 [1,1,0,0,0,0|2,0,0]=4 3987 B11R1.12 OCC(NO)c1cc[n]cc1 Amb25801814 [1,1,0,0,0,0|2,0,0]=4 3988 B11R1.12 OCC(SO)c1ccccc1 Amb25740560 [1,1,0,0,0,0|2,0,0]=4 3989 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22231741 [1,1,0,0,0,0|1,0,1]=4 3990 B11R1.12 OCC([C+]=O)c1ccccc1 Amb22232765 [1,1,0,0,0,0|1,0,1]=4 3991 B11R1.12 OCC(c1ccccc1)C#C Amb16185451 [1,1,0,0,0,0|0,0,2]=4 3992 B11R1.12 OCP(CO)c1ccccc1 Amb22733968 [1,1,0,0,0,0|2,0,0]=4 3993 B11R1.12 OC[C@@H](CBr)c1ccccc1 Amb25737363 [1,1,0,0,0,0|1,0,0]=3 3994 B11R1.12 OC[C@@H](NO)c1c[n]ccc1 Amb25704259 [1,1,0,0,0,0|2,0,0]=4 3995 B11R1.12 OC[C@@H](NO)c1cc[n]cc1 Amb24405000 [1,1,0,0,0,0|2,0,0]=4 3996 B11R1.12 OC[C@H](CBr)c1ccccc1 Amb25063645 [1,1,0,0,0,0|1,0,0]=3 3997 B11R1.12 OC[C@H](NO)c1cc[n]cc1 Amb25032385 [1,1,0,0,0,0|2,0,0]=4 3998 B11R1.12 OC[C@H](NO)c1ccccc1 Amb24340402 [1,1,0,0,0,0|1,0,0]=3 3999 B11R1.12 OC[C@H](c1ccccc1)OC Amb10807423 [1,1,0,0,0,0|1,0,0]=3 4000 B11R1.12 [BH3-]NC(CO)c1ccccc1 Amb25343642 [1,1,0,0,0,0|1,0,0]=3 4001 B11R1.12 [BH3-]N[C@H](CO)c1ccccc1 Amb25149655 [1,1,0,0,0,0|1,0,0]=3 4002 B11R1.12 [C-]#[N+]C(CF)c1ccccc1 Amb25208024 [1,1,0,0,0,0|0,0,2]=4 4003 B11R1.12 [C-]#[N+]C(CO)c1ccccc1 Amb24475007 [1,1,0,0,0,0|0,0,2]=4 4004 B11R1.12 [C-]#[N+][C@H](CO)c1ccccc1 Amb25831880 [1,1,0,0,0,0|0,0,2]=4 4005 B11R1.22 BrCC(c1ccc(cc1)Br)C Amb17280742 [1,1,0,0,0,0|1,0,0]=3 4006 B11R1.22 BrCC(c1ccc(cc1)Br)O Amb17206111 [1,1,0,0,0,0|2,0,0]=4 4007 B11R1.22 BrCC(c1ccc(cc1)C)C Amb17241353 [1,1,0,0,0,0|1,0,0]=3 4008 B11R1.22 BrCC(c1ccc(cc1)C)O Amb17206106 [1,1,0,0,0,0|2,0,0]=4 4009 B11R1.22 BrCC(c1ccc(cc1)Cl)C Amb17251213 [1,1,0,0,0,0|1,0,0]=3 4010 B11R1.22 BrCC(c1ccc(cc1)Cl)O Amb17206112 [1,1,0,0,0,0|2,0,0]=4 4011 B11R1.22 BrCC(c1ccc(cc1)F)C Amb17242467 [1,1,0,0,0,0|1,0,0]=3 4012 B11R1.22 BrCC(c1ccc(cc1)F)O Amb17206113 [1,1,0,0,0,0|2,0,0]=4 4013 B11R1.22 Brc1ccc(cc1)C(Br)CBr Amb22359843 [1,1,0,0,0,0|2,0,0]=4 4014 B11R1.22 C=C(CN)c1ccc(Br)cc1 Amb25121108 [1,1,0,0,0,0|0,0,2]=4 4015 B11R1.22 C=C(CN)c1ccc(Cl)cc1 Amb18908725 [1,1,0,0,0,0|0,0,2]=4 4016 B11R1.22 C=C(CN)c1ccc(F)cc1 Amb18125278 [1,1,0,0,0,0|0,0,2]=4 4017 B11R1.22 C=C(CN)c1ccc(I)cc1 Amb25163247 [1,1,0,0,0,0|0,0,2]=4 4018 B11R1.22 CC(C=C)c1ccc(O)cc1 Amb18124918 [1,1,0,0,0,0|0,0,2]=4 4019 B11R1.22 CC(C=O)c1ccc(O)cc1 Amb18125109 [1,1,0,0,0,0|1,0,1]=4 4020 B11R1.22 CC(CC)C=1C=CC(=O)NN1 Amb18181745 [1,1,0,0,0,0|2,0,0]=4 4021 B11R1.22 CC(CC)c1ccc(Br)[n][n]1 Amb24319733 [1,1,0,0,0,0|2,0,0]=4 4022 B11R1.22 CC(CC)c1ccc(Br)[n]c1 Amb24320464 [1,1,0,0,0,0|1,0,0]=3 4023 B11R1.22 CC(CC)c1ccc(Cl)[n][n]1 Amb18183630 [1,1,0,0,0,0|2,0,0]=4 4024 B11R1.22 CC(CC)c1ccc(Cl)[n]c1 Amb24558910 [1,1,0,0,0,0|1,0,0]=3 4025 B11R1.22 CC(CC)c1ccc(N)[n][n]1 Amb18287222 [1,1,0,0,0,0|2,0,0]=4 4026 B11R1.22 CC(CC)c1ccc(N)[n]c1 Amb18831286 [1,1,0,0,0,0|1,0,0]=3 4027 B11R1.22 CC(CCl)c1ccc(I)cc1 Amb25032418 [1,1,0,0,0,0|1,0,0]=3 4028 B11R1.22 CC(CN)c1[n]cc(F)c[n]1 Amb25774383 [1,1,0,0,0,0|2,0,0]=4 4029 B11R1.22 CC(CN)c1ccc(Br)cc1 Amb24183885 [1,1,0,0,0,0|0,0,0]=2 4030 B11R1.22 CC(CN)c1ccc(Cl)[n]c1 Amb25187594 [1,1,0,0,0,0|1,0,0]=3 4031 B11R1.22 CC(CN)c1ccc(Cl)cc1 Amb22234779 [1,1,0,0,0,0|0,0,0]=2 4032 B11R1.22 CC(CN)c1ccc(F)c[n]1 Amb25151891 [1,1,0,0,0,0|1,0,0]=3 4033 B11R1.22 CC(CN)c1ccc(I)cc1 Amb25092171 [1,1,0,0,0,0|0,0,0]=2 4034 B11R1.22 CC(CN)c1ccc(N)cc1 Amb18251327 [1,1,0,0,0,0|0,0,0]=2 4035 B11R1.22 CC(CN)c1ccc(O)[n]c1 Amb25374046 [1,1,0,0,0,0|1,0,0]=3 4036 B11R1.22 CC(CN)c1ccc(O)cc1 Amb19957319 [1,1,0,0,0,0|0,0,0]=2 4037 B11R1.22 CC(CN)c1ccc(S)cc1 Amb25124018 [1,1,0,0,0,0|0,0,0]=2 4038 B11R1.22 CC(CO)c1ccc(Br)c[n]1 Amb25678479 [1,1,0,0,0,0|2,0,0]=4 4039 B11R1.22 CC(CO)c1ccc(Cl)[n]c1 Amb25201855 [1,1,0,0,0,0|2,0,0]=4 4040 B11R1.22 CC(CO)c1ccc(F)c[n]1 Amb25129979 [1,1,0,0,0,0|2,0,0]=4 4041 B11R1.22 CC(CO)c1ccc(N)cc1 Amb24740868 [1,1,0,0,0,0|1,0,0]=3 4042 B11R1.22 CC(CO)c1ccc(O)cc1 Amb18125400 [1,1,0,0,0,0|1,0,0]=3 4043 B11R1.22 CC(CO)c1ccc(cc1)[*] Amb22045258 [1,1,0,0,0,0|1,0,0]=3 4044 B11R1.22 CC(NN)c1ccc(Br)c[n]1 Amb25703500 [1,1,0,0,0,0|2,0,0]=4 4045 B11R1.22 CC(NN)c1ccc(F)c[n]1 Amb25226426 [1,1,0,0,0,0|2,0,0]=4 4046 B11R1.22 CC(NO)c1ccc(F)c[n]1 Amb25847153 [1,1,0,0,0,0|2,0,0]=4 4047 B11R1.22 CC(c1ccc(cc1)Br)C#N Amb17089240 [1,1,0,0,0,0|0,0,2]=4 4048 B11R1.22 CC(c1ccc(cc1)Cl)C#N Amb17089239 [1,1,0,0,0,0|0,0,2]=4 4049 B11R1.22 CC(c1ccc(cc1)Cl)[N+]#[C-] Amb2235817 [1,1,0,0,0,0|0,0,2]=4 4050 B11R1.22 CC(c1ccc(cc1)O)C#N Amb17593672 [1,1,0,0,0,0|0,0,2]=4 4051 B11R1.22 CCC(=C)c1ccc(Br)cc1 Amb20668394 [1,1,0,0,0,0|0,0,2]=4 4052 B11R1.22 CCC(=O)c1ccc(S)cc1 Amb25273108 [1,1,0,0,0,0|1,0,1]=4 4053 B11R1.22 CCC(=O)c1ccc(cc1)O Amb1336085 [1,1,0,0,0,0|1,0,1]=4 4054 B11R1.22 CCC(=S)c1ccc(O)cc1 Amb25258595 [1,1,0,0,0,0|1,0,1]=4 4055 B11R1.22 CCC(Br)c1ccc(Cl)[n]c1 Amb24475134 [1,1,0,0,0,0|2,0,0]=4 4056 B11R1.22 CCC(Br)c1ccc(Cl)c[n]1 Amb25098642 [1,1,0,0,0,0|2,0,0]=4 4057 B11R1.22 CCC(Br)c1ccc(F)c[n]1 Amb24384711 [1,1,0,0,0,0|2,0,0]=4 4058 B11R1.22 CCC(C)c1[n]cc(Br)c[n]1 Amb24319100 [1,1,0,0,0,0|2,0,0]=4 4059 B11R1.22 CCC(C)c1[n]cc(N)c[n]1 Amb18960087 [1,1,0,0,0,0|2,0,0]=4 4060 B11R1.22 CCC(C)c1c[n]c(Br)[n]c1 Amb24320198 [1,1,0,0,0,0|2,0,0]=4 4061 B11R1.22 CCC(C)c1c[n]c(Cl)[n]c1 Amb24320199 [1,1,0,0,0,0|2,0,0]=4 4062 B11R1.22 CCC(C)c1c[n]c(N)[n]c1 Amb25246670 [1,1,0,0,0,0|2,0,0]=4 4063 B11R1.22 CCC(C)c1ccc(Br)c[n]1 Amb24320381 [1,1,0,0,0,0|1,0,0]=3 4064 B11R1.22 CCC(C)c1ccc(Cl)cc1 Amb25715889 [1,1,0,0,0,0|0,0,0]=2 4065 B11R1.22 CCC(C)c1ccc(N)c[n]1 Amb18831279 [1,1,0,0,0,0|1,0,0]=3 4066 B11R1.22 CCC(C)c1ccc(O)c[n]1 Amb24475935 [1,1,0,0,0,0|1,0,0]=3 4067 B11R1.22 CCC(N)c1ccc(Br)[n]c1 Amb23446257 [1,1,0,0,0,0|2,0,0]=4 4068 B11R1.22 CCC(N)c1ccc(Cl)[n]c1 Amb23446918 [1,1,0,0,0,0|2,0,0]=4 4069 B11R1.22 CCC(N)c1ccc(Cl)cc1 Amb22904363 [1,1,0,0,0,0|1,0,0]=3 4070 B11R1.22 CCC(N)c1ccc(F)c[n]1 Amb25064315 [1,1,0,0,0,0|2,0,0]=4 4071 B11R1.22 CCC(N)c1ccc(F)cc1 Amb21955200 [1,1,0,0,0,0|1,0,0]=3 4072 B11R1.22 CCC(N)c1ccc(I)[n]c1 Amb23446983 [1,1,0,0,0,0|2,0,0]=4 4073 B11R1.22 CCC(N)c1ccc(I)cc1 Amb24695228 [1,1,0,0,0,0|1,0,0]=3 4074 B11R1.22 CCC(N)c1ccc(N)[n]c1 Amb23446328 [1,1,0,0,0,0|2,0,0]=4 4075 B11R1.22 CCC(N)c1ccc(N)cc1 Amb24102643 [1,1,0,0,0,0|1,0,0]=3 4076 B11R1.22 CCC(N)c1ccc(O)[n]c1 Amb23446714 [1,1,0,0,0,0|2,0,0]=4 4077 B11R1.22 CCC(N)c1ccc(S)[n]c1 Amb23446727 [1,1,0,0,0,0|2,0,0]=4 4078 B11R1.22 CCC(O)c1ccc(Br)[n]c1 Amb23446254 [1,1,0,0,0,0|2,0,0]=4 4079 B11R1.22 CCC(O)c1ccc(Br)c[n]1 Amb24439298 [1,1,0,0,0,0|2,0,0]=4 4080 B11R1.22 CCC(O)c1ccc(Cl)[n]c1 Amb23446915 [1,1,0,0,0,0|2,0,0]=4 4081 B11R1.22 CCC(O)c1ccc(I)[n]c1 Amb23446980 [1,1,0,0,0,0|2,0,0]=4 4082 B11R1.22 CCC(O)c1ccc(N)[n]c1 Amb23446326 [1,1,0,0,0,0|2,0,0]=4 4083 B11R1.22 CCC(O)c1ccc(O)[n]c1 Amb23446711 [1,1,0,0,0,0|2,0,0]=4 4084 B11R1.22 CCC(O)c1ccc(S)[n]c1 Amb23446724 [1,1,0,0,0,0|2,0,0]=4 4085 B11R1.22 CCC(S)c1ccc(F)c[n]1 Amb25710915 [1,1,0,0,0,0|2,0,0]=4 4086 B11R1.22 CCC(c1ccc(cc1)Br)N Amb1106008 [1,1,0,0,0,0|1,0,0]=3 4087 B11R1.22 CCC(c1ccc(cc1)Br)O Amb1110057 [1,1,0,0,0,0|1,0,0]=3 4088 B11R1.22 CCC(c1ccc(cc1)C)N Amb10778749 [1,1,0,0,0,0|1,0,0]=3 4089 B11R1.22 CCC(c1ccc(cc1)C)O Amb1110039 [1,1,0,0,0,0|1,0,0]=3 4090 B11R1.22 CCC(c1ccc(cc1)Cl)N Amb1995281 [1,1,0,0,0,0|1,0,0]=3 4091 B11R1.22 CCC(c1ccc(cc1)Cl)O Amb1109844 [1,1,0,0,0,0|1,0,0]=3 4092 B11R1.22 CCC(c1ccc(cc1)F)N Amb1108504 [1,1,0,0,0,0|1,0,0]=3 4093 B11R1.22 CCC(c1ccc(cc1)F)O Amb1111265 [1,1,0,0,0,0|1,0,0]=3 4094 B11R1.22 CCC(c1ccc(cc1)O)N Amb1117697 [1,1,0,0,0,0|1,0,0]=3 4095 B11R1.22 CCC(c1ccc(cc1)O)N Amb17622108 [1,1,0,0,0,0|1,0,0]=3 4096 B11R1.22 CCC(c1ccc(cc1)O)O Amb1111179 [1,1,0,0,0,0|1,0,0]=3 4097 B11R1.22 CCC(c1ccc(cn1)C)N Amb10608373 [1,1,0,0,0,0|2,0,0]=4 4098 B11R1.22 CCC(c1ccc(cn1)C)N Amb17622203 [1,1,0,0,0,0|2,0,0]=4 4099 B11R1.22 CCN(O)c1ccc(N)cc1 Amb24538174 [1,1,0,0,0,0|2,0,0]=4 4100 B11R1.22 CCS(=O)c1ccc(F)cc1 Amb25771877 [1,1,0,0,0,0|2,0,0]=4 4101 B11R1.22 CCS(=O)c1ccc(N)cc1 Amb18284277 [1,1,0,0,0,0|2,0,0]=4 4102 B11R1.22 CC[C@@H](C)c1ccc(N)cc1 Amb24103200 [1,1,0,0,0,0|0,0,0]=2 4103 B11R1.22 CC[C@@H](N)c1ccc(Br)[n]c1 Amb25691609 [1,1,0,0,0,0|2,0,0]=4 4104 B11R1.22 CC[C@@H](N)c1ccc(Br)c[n]1 Amb25715800 [1,1,0,0,0,0|2,0,0]=4 4105 B11R1.22 CC[C@@H](N)c1ccc(Br)cc1 Amb23440385 [1,1,0,0,0,0|1,0,0]=3 4106 B11R1.22 CC[C@@H](N)c1ccc(Cl)c[n]1 Amb25719374 [1,1,0,0,0,0|2,0,0]=4 4107 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22288632 [1,1,0,0,0,0|1,0,0]=3 4108 B11R1.22 CC[C@@H](N)c1ccc(Cl)cc1 Amb22747472 [1,1,0,0,0,0|1,0,0]=3 4109 B11R1.22 CC[C@@H](N)c1ccc(F)[n]c1 Amb24379447 [1,1,0,0,0,0|2,0,0]=4 4110 B11R1.22 CC[C@@H](N)c1ccc(F)cc1 Amb22298536 [1,1,0,0,0,0|1,0,0]=3 4111 B11R1.22 CC[C@@H](N)c1ccc(I)[n]c1 Amb25117305 [1,1,0,0,0,0|2,0,0]=4 4112 B11R1.22 CC[C@@H](N)c1ccc(I)cc1 Amb25364125 [1,1,0,0,0,0|1,0,0]=3 4113 B11R1.22 CC[C@@H](N)c1ccc(O)c[n]1 Amb24349852 [1,1,0,0,0,0|2,0,0]=4 4114 B11R1.22 CC[C@@H](N)c1ccc(O)cc1 Amb25247808 [1,1,0,0,0,0|1,0,0]=3 4115 B11R1.22 CC[C@@H](N)c1ccc(S)cc1 Amb25295395 [1,1,0,0,0,0|1,0,0]=3 4116 B11R1.22 CC[C@@H](O)c1ccc(Br)c[n]1 Amb24488092 [1,1,0,0,0,0|2,0,0]=4 4117 B11R1.22 CC[C@@H](O)c1ccc(Br)cc1 Amb20241514 [1,1,0,0,0,0|1,0,0]=3 4118 B11R1.22 CC[C@@H](O)c1ccc(Cl)c[n]1 Amb25280650 [1,1,0,0,0,0|2,0,0]=4 4119 B11R1.22 CC[C@@H](O)c1ccc(Cl)cc1 Amb20240761 [1,1,0,0,0,0|1,0,0]=3 4120 B11R1.22 CC[C@@H](O)c1ccc(F)c[n]1 Amb25032372 [1,1,0,0,0,0|2,0,0]=4 4121 B11R1.22 CC[C@@H](O)c1ccc(F)cc1 Amb20240757 [1,1,0,0,0,0|1,0,0]=3 4122 B11R1.22 CC[C@@H](O)c1ccc(I)cc1 Amb25204389 [1,1,0,0,0,0|1,0,0]=3 4123 B11R1.22 CC[C@@H](O)c1ccc(O)cc1 Amb25345214 [1,1,0,0,0,0|1,0,0]=3 4124 B11R1.22 CC[C@H](N)c1ccc(Br)[n]c1 Amb24682447 [1,1,0,0,0,0|2,0,0]=4 4125 B11R1.22 CC[C@H](N)c1ccc(Br)cc1 Amb24718653 [1,1,0,0,0,0|1,0,0]=3 4126 B11R1.22 CC[C@H](N)c1ccc(Cl)[n]c1 Amb25278632 [1,1,0,0,0,0|2,0,0]=4 4127 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb22288689 [1,1,0,0,0,0|1,0,0]=3 4128 B11R1.22 CC[C@H](N)c1ccc(Cl)cc1 Amb25848651 [1,1,0,0,0,0|1,0,0]=3 4129 B11R1.22 CC[C@H](N)c1ccc(F)[n]c1 Amb25145712 [1,1,0,0,0,0|2,0,0]=4 4130 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb22298579 [1,1,0,0,0,0|1,0,0]=3 4131 B11R1.22 CC[C@H](N)c1ccc(F)cc1 Amb24477560 [1,1,0,0,0,0|1,0,0]=3 4132 B11R1.22 CC[C@H](N)c1ccc(I)[n]c1 Amb25799698 [1,1,0,0,0,0|2,0,0]=4 4133 B11R1.22 CC[C@H](N)c1ccc(I)c[n]1 Amb25827089 [1,1,0,0,0,0|2,0,0]=4 4134 B11R1.22 CC[C@H](N)c1ccc(N)[n]c1 Amb24746627 [1,1,0,0,0,0|2,0,0]=4 4135 B11R1.22 CC[C@H](N)c1ccc(N)cc1 Amb25368363 [1,1,0,0,0,0|1,0,0]=3 4136 B11R1.22 CC[C@H](N)c1ccc(O)[n]c1 Amb25692566 [1,1,0,0,0,0|2,0,0]=4 4137 B11R1.22 CC[C@H](N)c1ccc(O)c[n]1 Amb24386057 [1,1,0,0,0,0|2,0,0]=4 4138 B11R1.22 CC[C@H](N)c1ccc(O)cc1 Amb24758224 [1,1,0,0,0,0|1,0,0]=3 4139 B11R1.22 CC[C@H](O)c1ccc(Br)c[n]1 Amb25138257 [1,1,0,0,0,0|2,0,0]=4 4140 B11R1.22 CC[C@H](O)c1ccc(Cl)c[n]1 Amb25150220 [1,1,0,0,0,0|2,0,0]=4 4141 B11R1.22 CC[C@H](O)c1ccc(Cl)cc1 Amb19889432 [1,1,0,0,0,0|1,0,0]=3 4142 B11R1.22 CC[C@H](O)c1ccc(F)c[n]1 Amb24383730 [1,1,0,0,0,0|2,0,0]=4 4143 B11R1.22 CC[C@H](O)c1ccc(I)cc1 Amb25732463 [1,1,0,0,0,0|1,0,0]=3 4144 B11R1.22 CN(CC)c1ccc(Br)[n]c1 Amb20617665 [1,1,0,0,0,0|2,0,0]=4 4145 B11R1.22 CN(CC)c1ccc(Br)c[n]1 Amb20617695 [1,1,0,0,0,0|2,0,0]=4 4146 B11R1.22 CN(CC)c1ccc(Cl)cc1 Amb24066026 [1,1,0,0,0,0|1,0,0]=3 4147 B11R1.22 CN(CC)c1ccc(F)cc1 Amb25163174 [1,1,0,0,0,0|1,0,0]=3 4148 B11R1.22 CN(CC)c1ccc(I)cc1 Amb25681250 [1,1,0,0,0,0|1,0,0]=3 4149 B11R1.22 CN(CO)c1ccc(Cl)cc1 Amb24618646 [1,1,0,0,0,0|2,0,0]=4 4150 B11R1.22 CNC(=N)c1ccc(Cl)cc1 Amb24415099 [1,1,0,0,0,0|1,0,1]=4 4151 B11R1.22 CNC(=N)c1ccc(O)cc1 Amb18125142 [1,1,0,0,0,0|1,0,1]=4 4152 B11R1.22 CNC(=O)c1ccc(S)cc1 Amb24486099 [1,1,0,0,0,0|1,0,1]=4 4153 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1232931 [1,1,0,0,0,0|1,0,1]=4 4154 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774478 [1,1,0,0,0,0|1,0,1]=4 4155 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1774979 [1,1,0,0,0,0|1,0,1]=4 4156 B11R1.22 CNC(=O)c1ccc(cc1)Br Amb1797209 [1,1,0,0,0,0|1,0,1]=4 4157 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1771439 [1,1,0,0,0,0|1,0,1]=4 4158 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1796878 [1,1,0,0,0,0|1,0,1]=4 4159 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1806248 [1,1,0,0,0,0|1,0,1]=4 4160 B11R1.22 CNC(=O)c1ccc(cc1)C Amb1814728 [1,1,0,0,0,0|1,0,1]=4 4161 B11R1.22 CNC(=O)c1ccc(cc1)I Amb1230427 [1,1,0,0,0,0|1,0,1]=4 4162 B11R1.22 CNC(=S)c1ccc(Br)cc1 Amb24528870 [1,1,0,0,0,0|1,0,1]=4 4163 B11R1.22 CNC(C)c1ccc(Cl)[n]c1 Amb24419929 [1,1,0,0,0,0|1,0,0]=3 4164 B11R1.22 CNC(C)c1ccc(Cl)c[n]1 Amb25141809 [1,1,0,0,0,0|1,0,0]=3 4165 B11R1.22 CNC(C)c1ccc(Cl)cc1 Amb22587853 [1,1,0,0,0,0|0,0,0]=2 4166 B11R1.22 CNC(C)c1ccc(F)[n]c1 Amb24443751 [1,1,0,0,0,0|1,0,0]=3 4167 B11R1.22 CNC(c1ccc(cc1)Br)C Amb1128441 [1,1,0,0,0,0|0,0,0]=2 4168 B11R1.22 CNC(c1ccc(cc1)C)C Amb1120227 [1,1,0,0,0,0|0,0,0]=2 4169 B11R1.22 CNC(c1ccc(cc1)Cl)C Amb1136258 [1,1,0,0,0,0|0,0,0]=2 4170 B11R1.22 CNC(c1ccc(cc1)F)C Amb2371534 [1,1,0,0,0,0|0,0,0]=2 4171 B11R1.22 CNC(c1ccc(cc1)O)C Amb1118673 [1,1,0,0,0,0|0,0,0]=2 4172 B11R1.22 CNS(=O)c1ccc(N)cc1 Amb18862841 [1,1,0,0,0,0|2,0,0]=4 4173 B11R1.22 CN[C@@H](C)c1ccc(Br)c[n]1 Amb25691471 [1,1,0,0,0,0|1,0,0]=3 4174 B11R1.22 CN[C@@H](C)c1ccc(Br)cc1 Amb23440431 [1,1,0,0,0,0|0,0,0]=2 4175 B11R1.22 CN[C@@H](C)c1ccc(Cl)[n]c1 Amb24572867 [1,1,0,0,0,0|1,0,0]=3 4176 B11R1.22 CN[C@@H](C)c1ccc(Cl)c[n]1 Amb25697042 [1,1,0,0,0,0|1,0,0]=3 4177 B11R1.22 CN[C@@H](C)c1ccc(Cl)cc1 Amb24487722 [1,1,0,0,0,0|0,0,0]=2 4178 B11R1.22 CN[C@@H](C)c1ccc(N)[n]c1 Amb25152737 [1,1,0,0,0,0|1,0,0]=3 4179 B11R1.22 CN[C@@H](C)c1ccc(S)cc1 Amb25074093 [1,1,0,0,0,0|0,0,0]=2 4180 B11R1.22 CN[C@@H](c1ccc(cc1)F)C Amb10839225 [1,1,0,0,0,0|0,0,0]=2 4181 B11R1.22 CN[C@H](C)c1ccc(Br)cc1 Amb25055666 [1,1,0,0,0,0|0,0,0]=2 4182 B11R1.22 CN[C@H](C)c1ccc(Cl)c[n]1 Amb24487660 [1,1,0,0,0,0|1,0,0]=3 4183 B11R1.22 CN[C@H](C)c1ccc(Cl)cc1 Amb24657259 [1,1,0,0,0,0|0,0,0]=2 4184 B11R1.22 CN[C@H](C)c1ccc(F)c[n]1 Amb24364678 [1,1,0,0,0,0|1,0,0]=3 4185 B11R1.22 CN[C@H](C)c1ccc(N)[n]c1 Amb25839756 [1,1,0,0,0,0|1,0,0]=3 4186 B11R1.22 CN[C@H](C)c1ccc(N)c[n]1 Amb24408910 [1,1,0,0,0,0|1,0,0]=3 4187 B11R1.22 CN[C@H](C)c1ccc(O)[n]c1 Amb25151173 [1,1,0,0,0,0|1,0,0]=3 4188 B11R1.22 CN[C@H](c1ccc(cc1)F)C Amb10841308 [1,1,0,0,0,0|0,0,0]=2 4189 B11R1.22 COC(C)c1ccc(F)cc1 Amb18633172 [1,1,0,0,0,0|1,0,0]=3 4190 B11R1.22 COC(C)c1ccc(I)cc1 Amb23568516 [1,1,0,0,0,0|1,0,0]=3 4191 B11R1.22 COC(C)c1ccc(N)cc1 Amb18952191 [1,1,0,0,0,0|1,0,0]=3 4192 B11R1.22 COC(C)c1ccc(O)cc1 Amb18644512 [1,1,0,0,0,0|1,0,0]=3 4193 B11R1.22 COC(C)c1ccc(S)cc1 Amb23568715 [1,1,0,0,0,0|1,0,0]=3 4194 B11R1.22 COC(O)c1ccc(O)cc1 Amb25714240 [1,1,0,0,0,0|2,0,0]=4 4195 B11R1.22 CO[C@H](C)c1ccc(Br)cc1 Amb25739065 [1,1,0,0,0,0|1,0,0]=3 4196 B11R1.22 CSC(C)c1ccc(Br)cc1 Amb25145250 [1,1,0,0,0,0|1,0,0]=3 4197 B11R1.22 CSC(C)c1ccc(F)cc1 Amb25848053 [1,1,0,0,0,0|1,0,0]=3 4198 B11R1.22 CSC(C)c1ccc(N)cc1 Amb18282128 [1,1,0,0,0,0|1,0,0]=3 4199 B11R1.22 C[C@@H](C=O)c1ccc(F)cc1 Amb24374733 [1,1,0,0,0,0|1,0,1]=4 4200 B11R1.22 C[C@@H](CN)c1ccc(Cl)cc1 Amb24372884 [1,1,0,0,0,0|0,0,0]=2 4201 B11R1.22 C[C@@H](CO)c1ccc(F)cc1 Amb24068206 [1,1,0,0,0,0|1,0,0]=3 4202 B11R1.22 C[C@@H](NO)c1ccc(Cl)cc1 Amb24543655 [1,1,0,0,0,0|1,0,0]=3 4203 B11R1.22 C[C@@H](NO)c1ccc(O)cc1 Amb25151826 [1,1,0,0,0,0|1,0,0]=3 4204 B11R1.22 C[C@H](C#N)c1ccc(F)cc1 Amb24068261 [1,1,0,0,0,0|0,0,2]=4 4205 B11R1.22 C[C@H](C=O)c1ccc(F)cc1 Amb24486078 [1,1,0,0,0,0|1,0,1]=4 4206 B11R1.22 C[C@H](CN)c1ccc(Br)cc1 Amb25313073 [1,1,0,0,0,0|0,0,0]=2 4207 B11R1.22 C[C@H](CN)c1ccc(Cl)cc1 Amb25360662 [1,1,0,0,0,0|0,0,0]=2 4208 B11R1.22 C[C@H](CN)c1ccc(O)cc1 Amb24486024 [1,1,0,0,0,0|0,0,0]=2 4209 B11R1.22 C[C@H](CO)c1ccc(Cl)cc1 Amb25149776 [1,1,0,0,0,0|1,0,0]=3 4210 B11R1.22 C[C@H](CO)c1ccc(F)cc1 Amb24068260 [1,1,0,0,0,0|1,0,0]=3 4211 B11R1.22 C[C@H](NO)c1ccc(Cl)cc1 Amb25089385 [1,1,0,0,0,0|1,0,0]=3 4212 B11R1.22 C[C@H](NO)c1ccc(F)cc1 Amb24455607 [1,1,0,0,0,0|1,0,0]=3 4213 B11R1.22 C\C(=C/C)\c1ccc(N)cc1 Amb25834627 [1,1,0,0,0,0|0,0,2]=4 4214 B11R1.22 C\C(=C/C)\c1ccc(O)cc1 Amb25807631 [1,1,0,0,0,0|0,0,2]=4 4215 B11R1.22 C\C(=C\C)\c1ccc(N)cc1 Amb24574842 [1,1,0,0,0,0|0,0,2]=4 4216 B11R1.22 C\C(=N/N)\c1ccc(O)cc1 Amb24378459 [1,1,0,0,0,0|1,0,1]=4 4217 B11R1.22 C\C(=N\N)\c1ccc(Cl)cc1 Amb25130298 [1,1,0,0,0,0|1,0,1]=4 4218 B11R1.22 C\C(=N\N)\c1ccc(F)cc1 Amb25306186 [1,1,0,0,0,0|1,0,1]=4 4219 B11R1.22 C\C(=N\N)\c1ccc(N)cc1 Amb25687644 [1,1,0,0,0,0|1,0,1]=4 4220 B11R1.22 Cc1c[n]c([n]c1)C(C)CN Amb24477619 [1,1,0,0,0,0|2,0,0]=4 4221 B11R1.22 Cc1c[n]c([n]c1)C(C)NC Amb25830620 [1,1,0,0,0,0|2,0,0]=4 4222 B11R1.22 Cc1ccc([n]c1)C(C)CO Amb25357671 [1,1,0,0,0,0|2,0,0]=4 4223 B11R1.22 Cc1ccc([n]c1)[C@@H](C)NC Amb25268944 [1,1,0,0,0,0|1,0,0]=3 4224 B11R1.22 Cc1ccc([n]c1)[C@@H](N)CN Amb25228466 [1,1,0,0,0,0|2,0,0]=4 4225 B11R1.22 Cc1ccc(c[n]1)C(C)NC Amb25740903 [1,1,0,0,0,0|1,0,0]=3 4226 B11R1.22 Cc1ccc(c[n]1)C(N)CC Amb18201829 [1,1,0,0,0,0|2,0,0]=4 4227 B11R1.22 Cc1ccc(c[n]1)C(O)CC Amb25357987 [1,1,0,0,0,0|2,0,0]=4 4228 B11R1.22 Cc1ccc(c[n]1)[C@H](N)CC Amb24670253 [1,1,0,0,0,0|2,0,0]=4 4229 B11R1.22 Cc1ccc(c[n]1)[C@H](N)CN Amb24460727 [1,1,0,0,0,0|2,0,0]=4 4230 B11R1.22 Cc1ccc(cc1)C(=C)CN Amb18124857 [1,1,0,0,0,0|0,0,2]=4 4231 B11R1.22 Cc1ccc(cc1)C(=O)CN Amb22490690 [1,1,0,0,0,0|1,0,1]=4 4232 B11R1.22 Cc1ccc(cc1)C(=S)NC Amb24739783 [1,1,0,0,0,0|1,0,1]=4 4233 B11R1.22 Cc1ccc(cc1)C(Br)CO Amb25857366 [1,1,0,0,0,0|2,0,0]=4 4234 B11R1.22 Cc1ccc(cc1)C(C)CC Amb24064768 [1,1,0,0,0,0|0,0,0]=2 4235 B11R1.22 Cc1ccc(cc1)C(N)CF Amb25326298 [1,1,0,0,0,0|2,0,0]=4 4236 B11R1.22 Cc1ccc(cc1)C(O)CN Amb20668083 [1,1,0,0,0,0|1,0,0]=3 4237 B11R1.22 Cc1ccc(cc1)C(O)CO Amb18563446 [1,1,0,0,0,0|2,0,0]=4 4238 B11R1.22 Cc1ccc(cc1)N(C)CC Amb25189550 [1,1,0,0,0,0|1,0,0]=3 4239 B11R1.22 Cc1ccc(cc1)N(C)CO Amb25792347 [1,1,0,0,0,0|2,0,0]=4 4240 B11R1.22 Cc1ccc(cc1)N(N)CC Amb18799372 [1,1,0,0,0,0|2,0,0]=4 4241 B11R1.22 Cc1ccc(cc1)N(O)CC Amb24096604 [1,1,0,0,0,0|2,0,0]=4 4242 B11R1.22 Cc1ccc(cc1)[C@@H](C)CO Amb25847636 [1,1,0,0,0,0|1,0,0]=3 4243 B11R1.22 Cc1ccc(cc1)[C@@H](C)NO Amb25715423 [1,1,0,0,0,0|1,0,0]=3 4244 B11R1.22 Cc1ccc(cc1)[C@@H](N)CC Amb22288701 [1,1,0,0,0,0|1,0,0]=3 4245 B11R1.22 Cc1ccc(cc1)[C@@H](N)CO Amb22756871 [1,1,0,0,0,0|2,0,0]=4 4246 B11R1.22 Cc1ccc(cc1)[C@@H](O)CC Amb25289840 [1,1,0,0,0,0|1,0,0]=3 4247 B11R1.22 Cc1ccc(cc1)[C@@H](O)CN Amb24700467 [1,1,0,0,0,0|1,0,0]=3 4248 B11R1.22 Cc1ccc(cc1)[C@@H](O)CO Amb24486772 [1,1,0,0,0,0|2,0,0]=4 4249 B11R1.22 Cc1ccc(cc1)[C@H](C)CN Amb24622476 [1,1,0,0,0,0|0,0,0]=2 4250 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22284758 [1,1,0,0,0,0|1,0,0]=3 4251 B11R1.22 Cc1ccc(cc1)[C@H](N)CC Amb22288651 [1,1,0,0,0,0|1,0,0]=3 4252 B11R1.22 Cc1ccc(cc1)[C@H](N)CF Amb25121578 [1,1,0,0,0,0|2,0,0]=4 4253 B11R1.22 Cc1ccc(cc1)[C@H](N)CN Amb24674173 [1,1,0,0,0,0|1,0,0]=3 4254 B11R1.22 Cc1ccc(cc1)[C@H](N)CO Amb24453198 [1,1,0,0,0,0|2,0,0]=4 4255 B11R1.22 Cc1ccc(cc1)[C@H](O)CBr Amb25276421 [1,1,0,0,0,0|2,0,0]=4 4256 B11R1.22 Cc1ccc(cc1)[C@H](O)CN Amb20241479 [1,1,0,0,0,0|1,0,0]=3 4257 B11R1.22 Cc1ccc(cc1)[C@H](O)CO Amb25140042 [1,1,0,0,0,0|2,0,0]=4 4258 B11R1.22 ClCC(c1ccc(cc1)Br)C Amb17251214 [1,1,0,0,0,0|1,0,0]=3 4259 B11R1.22 ClCC(c1ccc(cc1)Br)O Amb17196014 [1,1,0,0,0,0|2,0,0]=4 4260 B11R1.22 ClCC(c1ccc(cc1)C)C Amb17232692 [1,1,0,0,0,0|1,0,0]=3 4261 B11R1.22 ClCC(c1ccc(cc1)C)O Amb17194483 [1,1,0,0,0,0|2,0,0]=4 4262 B11R1.22 ClCC(c1ccc(cc1)Cl)C Amb17234620 [1,1,0,0,0,0|1,0,0]=3 4263 B11R1.22 ClCC(c1ccc(cc1)Cl)O Amb17194627 [1,1,0,0,0,0|2,0,0]=4 4264 B11R1.22 ClCC(c1ccc(cc1)F)C Amb17232923 [1,1,0,0,0,0|1,0,0]=3 4265 B11R1.22 ClCC(c1ccc(cc1)F)O Amb17194492 [1,1,0,0,0,0|2,0,0]=4 4266 B11R1.22 ClCC(c1ccc(cc1)O)O Amb17594337 [1,1,0,0,0,0|2,0,0]=4 4267 B11R1.22 ClC[C@@H](c1ccc(cc1)F)O Amb16231704 [1,1,0,0,0,0|2,0,0]=4 4268 B11R1.22 Clc1ccc(cc1)C(Br)CBr Amb22336834 [1,1,0,0,0,0|2,0,0]=4 4269 B11R1.22 Clc1ccc(cc1)C(Cl)CCl Amb24714666 [1,1,0,0,0,0|2,0,0]=4 4270 B11R1.22 FC(CBr)c1ccc(Cl)cc1 Amb22325255 [1,1,0,0,0,0|2,0,0]=4 4271 B11R1.22 FC(CCl)c1ccc(Cl)cc1 Amb24487860 [1,1,0,0,0,0|2,0,0]=4 4272 B11R1.22 FCC(c1ccc(cc1)F)N Amb2372602 [1,1,0,0,0,0|2,0,0]=4 4273 B11R1.22 Fc1ccc(cc1)C(Cl)CF Amb25138804 [1,1,0,0,0,0|2,0,0]=4 4274 B11R1.22 Fc1ccc(cc1)C(F)CBr Amb24053884 [1,1,0,0,0,0|2,0,0]=4 4275 B11R1.22 Fc1ccc(cc1)C(F)CCl Amb24487865 [1,1,0,0,0,0|2,0,0]=4 4276 B11R1.22 NC(CF)c1ccc(Br)cc1 Amb20247218 [1,1,0,0,0,0|2,0,0]=4 4277 B11R1.22 NC(CN)c1ccc(Br)[n]c1 Amb25223148 [1,1,0,0,0,0|2,0,0]=4 4278 B11R1.22 NC(CN)c1ccc(O)[n]c1 Amb25789547 [1,1,0,0,0,0|2,0,0]=4 4279 B11R1.22 NC(CO)c1ccc(F)cc1 Amb19279201 [1,1,0,0,0,0|2,0,0]=4 4280 B11R1.22 NC(CO)c1ccc(I)cc1 Amb25696543 [1,1,0,0,0,0|2,0,0]=4 4281 B11R1.22 NC(CO)c1ccc(O)cc1 Amb18951204 [1,1,0,0,0,0|2,0,0]=4 4282 B11R1.22 NC(NO)c1ccc(F)cc1 Amb25351640 [1,1,0,0,0,0|2,0,0]=4 4283 B11R1.22 NCC(=N)c1ccc(O)cc1 Amb24102720 [1,1,0,0,0,0|1,0,1]=4 4284 B11R1.22 NCC(=O)c1ccc(Cl)cc1 Amb19884070 [1,1,0,0,0,0|1,0,1]=4 4285 B11R1.22 NCC(=O)c1ccc(I)cc1 Amb21962789 [1,1,0,0,0,0|1,0,1]=4 4286 B11R1.22 NCC(=O)c1ccc(O)cc1 Amb22001575 [1,1,0,0,0,0|1,0,1]=4 4287 B11R1.22 NCC(=O)c1ccc(S)cc1 Amb25082898 [1,1,0,0,0,0|1,0,1]=4 4288 B11R1.22 NCC(=O)c1ccc(cc1)Br Amb1811968 [1,1,0,0,0,0|1,0,1]=4 4289 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb1208662 [1,1,0,0,0,0|1,0,1]=4 4290 B11R1.22 NCC(=O)c1ccc(cc1)Cl Amb2370537 [1,1,0,0,0,0|1,0,1]=4 4291 B11R1.22 NCC(=O)c1ccc(cc1)F Amb1419069 [1,1,0,0,0,0|1,0,1]=4 4292 B11R1.22 NCC(=O)c1ccc(cc1)O Amb17593762 [1,1,0,0,0,0|1,0,1]=4 4293 B11R1.22 NCC(F)c1ccc(Br)cc1 Amb23454846 [1,1,0,0,0,0|1,0,0]=3 4294 B11R1.22 NCC(F)c1ccc(F)cc1 Amb24084159 [1,1,0,0,0,0|1,0,0]=3 4295 B11R1.22 NCC(N)c1ccc(Br)c[n]1 Amb25824227 [1,1,0,0,0,0|2,0,0]=4 4296 B11R1.22 NCC(N)c1ccc(Cl)c[n]1 Amb24472336 [1,1,0,0,0,0|2,0,0]=4 4297 B11R1.22 NCC(N)c1ccc(F)c[n]1 Amb24350908 [1,1,0,0,0,0|2,0,0]=4 4298 B11R1.22 NCC(N)c1ccc(O)cc1 Amb24102625 [1,1,0,0,0,0|1,0,0]=3 4299 B11R1.22 NCC(O)C=1C=CC(=O)NC1 Amb25061021 [1,1,0,0,0,0|2,0,0]=4 4300 B11R1.22 NCC(O)c1ccc(Br)c[n]1 Amb23586102 [1,1,0,0,0,0|2,0,0]=4 4301 B11R1.22 NCC(O)c1ccc(Br)cc1 Amb22234871 [1,1,0,0,0,0|1,0,0]=3 4302 B11R1.22 NCC(O)c1ccc(F)c[n]1 Amb25151889 [1,1,0,0,0,0|2,0,0]=4 4303 B11R1.22 NCC(O)c1ccc(I)cc1 Amb25098773 [1,1,0,0,0,0|1,0,0]=3 4304 B11R1.22 NCC(c1ccc(cc1)Br)C Amb17087284 [1,1,0,0,0,0|0,0,0]=2 4305 B11R1.22 NCC(c1ccc(cc1)C)O Amb1108558 [1,1,0,0,0,0|1,0,0]=3 4306 B11R1.22 NCC(c1ccc(cc1)Cl)O Amb1108621 [1,1,0,0,0,0|1,0,0]=3 4307 B11R1.22 NCC(c1ccc(cc1)F)C Amb10610291 [1,1,0,0,0,0|0,0,0]=2 4308 B11R1.22 NCC(c1ccc(cc1)F)O Amb10808445 [1,1,0,0,0,0|1,0,0]=3 4309 B11R1.22 NCC(c1ccc(cc1)F)O Amb1108388 [1,1,0,0,0,0|1,0,0]=3 4310 B11R1.22 NCC(c1ccc(cc1)O)O Amb1108209 [1,1,0,0,0,0|1,0,0]=3 4311 B11R1.22 NC[C@@H](N)c1ccc(Br)c[n]1 Amb25041036 [1,1,0,0,0,0|2,0,0]=4 4312 B11R1.22 NC[C@@H](N)c1ccc(Cl)c[n]1 Amb25259213 [1,1,0,0,0,0|2,0,0]=4 4313 B11R1.22 NC[C@@H](N)c1ccc(F)c[n]1 Amb25111543 [1,1,0,0,0,0|2,0,0]=4 4314 B11R1.22 NC[C@@H](N)c1ccc(F)cc1 Amb25145726 [1,1,0,0,0,0|1,0,0]=3 4315 B11R1.22 NC[C@@H](N)c1ccc(O)c[n]1 Amb24484450 [1,1,0,0,0,0|2,0,0]=4 4316 B11R1.22 NC[C@@H](O)c1ccc(Br)cc1 Amb24486093 [1,1,0,0,0,0|1,0,0]=3 4317 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb20241481 [1,1,0,0,0,0|1,0,0]=3 4318 B11R1.22 NC[C@@H](O)c1ccc(Cl)cc1 Amb24092980 [1,1,0,0,0,0|1,0,0]=3 4319 B11R1.22 NC[C@@H](O)c1ccc(F)c[n]1 Amb25769555 [1,1,0,0,0,0|2,0,0]=4 4320 B11R1.22 NC[C@@H](O)c1ccc(F)cc1 Amb24092981 [1,1,0,0,0,0|1,0,0]=3 4321 B11R1.22 NC[C@@H](O)c1ccc(I)cc1 Amb25058833 [1,1,0,0,0,0|1,0,0]=3 4322 B11R1.22 NC[C@@H](O)c1ccc(O)cc1 Amb25027908 [1,1,0,0,0,0|1,0,0]=3 4323 B11R1.22 NC[C@H](Cl)c1ccc(F)cc1 Amb24629251 [1,1,0,0,0,0|1,0,0]=3 4324 B11R1.22 NC[C@H](N)c1ccc(Br)cc1 Amb25195303 [1,1,0,0,0,0|1,0,0]=3 4325 B11R1.22 NC[C@H](N)c1ccc(Cl)c[n]1 Amb25368262 [1,1,0,0,0,0|2,0,0]=4 4326 B11R1.22 NC[C@H](N)c1ccc(Cl)cc1 Amb24357703 [1,1,0,0,0,0|1,0,0]=3 4327 B11R1.22 NC[C@H](N)c1ccc(I)c[n]1 Amb24636841 [1,1,0,0,0,0|2,0,0]=4 4328 B11R1.22 NC[C@H](N)c1ccc(I)cc1 Amb25738672 [1,1,0,0,0,0|1,0,0]=3 4329 B11R1.22 NC[C@H](N)c1ccc(O)cc1 Amb24411422 [1,1,0,0,0,0|1,0,0]=3 4330 B11R1.22 NC[C@H](O)c1ccc(F)c[n]1 Amb25346474 [1,1,0,0,0,0|2,0,0]=4 4331 B11R1.22 NNC(c1ccc(cc1)Br)C Amb13951417 [1,1,0,0,0,0|1,0,0]=3 4332 B11R1.22 NNC(c1ccc(cc1)Cl)C Amb13952413 [1,1,0,0,0,0|1,0,0]=3 4333 B11R1.22 NOC(c1ccc(cc1)Br)C Amb17089195 [1,1,0,0,0,0|1,0,0]=3 4334 B11R1.22 NOC(c1ccc(cc1)C)C Amb17089186 [1,1,0,0,0,0|1,0,0]=3 4335 B11R1.22 NOC(c1ccc(cc1)Cl)C Amb17089194 [1,1,0,0,0,0|1,0,0]=3 4336 B11R1.22 NOC(c1ccc(cc1)F)C Amb17089193 [1,1,0,0,0,0|1,0,0]=3 4337 B11R1.22 N[C@@H](CF)c1ccc(Cl)cc1 Amb25687523 [1,1,0,0,0,0|2,0,0]=4 4338 B11R1.22 N[C@@H](CF)c1ccc(I)cc1 Amb25139932 [1,1,0,0,0,0|2,0,0]=4 4339 B11R1.22 N[C@@H](CN)c1ccc(Br)[n]c1 Amb24538312 [1,1,0,0,0,0|2,0,0]=4 4340 B11R1.22 N[C@@H](CN)c1ccc(F)[n]c1 Amb24744508 [1,1,0,0,0,0|2,0,0]=4 4341 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb23440363 [1,1,0,0,0,0|2,0,0]=4 4342 B11R1.22 N[C@@H](CO)c1ccc(Br)cc1 Amb24469233 [1,1,0,0,0,0|2,0,0]=4 4343 B11R1.22 N[C@@H](CO)c1ccc(Cl)cc1 Amb22756882 [1,1,0,0,0,0|2,0,0]=4 4344 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22745476 [1,1,0,0,0,0|2,0,0]=4 4345 B11R1.22 N[C@@H](CO)c1ccc(F)cc1 Amb22746546 [1,1,0,0,0,0|2,0,0]=4 4346 B11R1.22 N[C@@H](CO)c1ccc(O)cc1 Amb24103158 [1,1,0,0,0,0|2,0,0]=4 4347 B11R1.22 N[C@@H](CO)c1ccc(S)cc1 Amb24433405 [1,1,0,0,0,0|2,0,0]=4 4348 B11R1.22 N[C@H](CF)c1ccc(O)cc1 Amb25049371 [1,1,0,0,0,0|2,0,0]=4 4349 B11R1.22 N[C@H](CN)c1ccc(I)[n]c1 Amb25703346 [1,1,0,0,0,0|2,0,0]=4 4350 B11R1.22 N[C@H](CN)c1ccc(O)[n]c1 Amb25757533 [1,1,0,0,0,0|2,0,0]=4 4351 B11R1.22 N[C@H](CO)c1ccc(Br)cc1 Amb25844082 [1,1,0,0,0,0|2,0,0]=4 4352 B11R1.22 N[C@H](CO)c1ccc(F)cc1 Amb24569357 [1,1,0,0,0,0|2,0,0]=4 4353 B11R1.22 N[C@H](CO)c1ccc(O)cc1 Amb24103172 [1,1,0,0,0,0|2,0,0]=4 4354 B11R1.22 N\N=C(/c1ccc(cc1)Br)\C Amb10552972 [1,1,0,0,0,0|1,0,1]=4 4355 B11R1.22 Nc1ccc(c[n]1)C(N)CN Amb24484455 [1,1,0,0,0,0|2,0,0]=4 4356 B11R1.22 Nc1ccc(cc1)C(=O)CN Amb24106018 [1,1,0,0,0,0|1,0,1]=4 4357 B11R1.22 Nc1ccc(cc1)C(F)CN Amb24679205 [1,1,0,0,0,0|1,0,0]=3 4358 B11R1.22 Nc1ccc(cc1)C(N)CN Amb23556416 [1,1,0,0,0,0|1,0,0]=3 4359 B11R1.22 Nc1ccc(cc1)C(O)CN Amb25052395 [1,1,0,0,0,0|1,0,0]=3 4360 B11R1.22 Nc1ccc(cc1)C(O)CO Amb18959900 [1,1,0,0,0,0|2,0,0]=4 4361 B11R1.22 Nc1ccc(cc1)[C@@H](N)CN Amb25840302 [1,1,0,0,0,0|1,0,0]=3 4362 B11R1.22 Nc1ccc(cc1)[C@H](N)CN Amb24485780 [1,1,0,0,0,0|1,0,0]=3 4363 B11R1.22 Nc1ccc(cc1)[C@H](N)CO Amb24587066 [1,1,0,0,0,0|2,0,0]=4 4364 B11R1.22 Nc1ccc(cc1)[C@H](O)CO Amb25288972 [1,1,0,0,0,0|2,0,0]=4 4365 B11R1.22 O=CC(c1ccc(cc1)Br)C Amb17140753 [1,1,0,0,0,0|1,0,1]=4 4366 B11R1.22 O=CC(c1ccc(cc1)C)C Amb10844730 [1,1,0,0,0,0|1,0,1]=4 4367 B11R1.22 O=CC(c1ccc(cc1)Cl)C Amb17138645 [1,1,0,0,0,0|1,0,1]=4 4368 B11R1.22 O=CC(c1ccc(cc1)F)C Amb17138438 [1,1,0,0,0,0|1,0,1]=4 4369 B11R1.22 OC(CBr)c1ccc(I)cc1 Amb24675806 [1,1,0,0,0,0|2,0,0]=4 4370 B11R1.22 OC(CCl)c1ccc(I)cc1 Amb25148100 [1,1,0,0,0,0|2,0,0]=4 4371 B11R1.22 OC(CF)c1ccc(Br)cc1 Amb24654008 [1,1,0,0,0,0|2,0,0]=4 4372 B11R1.22 OC(CF)c1ccc(F)cc1 Amb25682730 [1,1,0,0,0,0|2,0,0]=4 4373 B11R1.22 OC(CI)c1ccc(Br)cc1 Amb25725604 [1,1,0,0,0,0|2,0,0]=4 4374 B11R1.22 OCC(Cl)c1ccc(Cl)cc1 Amb19888410 [1,1,0,0,0,0|2,0,0]=4 4375 B11R1.22 OCC(F)c1ccc(Cl)cc1 Amb24340475 [1,1,0,0,0,0|2,0,0]=4 4376 B11R1.22 OCC(F)c1ccc(F)cc1 Amb24387742 [1,1,0,0,0,0|2,0,0]=4 4377 B11R1.22 OCC(O)c1ccc(Br)cc1 Amb18570007 [1,1,0,0,0,0|2,0,0]=4 4378 B11R1.22 OCC(O)c1ccc(Cl)cc1 Amb18563992 [1,1,0,0,0,0|2,0,0]=4 4379 B11R1.22 OCC(O)c1ccc(F)cc1 Amb18065446 [1,1,0,0,0,0|2,0,0]=4 4380 B11R1.22 OCC(c1ccc(cc1)Br)C Amb17241865 [1,1,0,0,0,0|1,0,0]=3 4381 B11R1.22 OCC(c1ccc(cc1)Br)N Amb17242181 [1,1,0,0,0,0|2,0,0]=4 4382 B11R1.22 OCC(c1ccc(cc1)Br)N Amb2236272 [1,1,0,0,0,0|2,0,0]=4 4383 B11R1.22 OCC(c1ccc(cc1)C)C Amb17232071 [1,1,0,0,0,0|1,0,0]=3 4384 B11R1.22 OCC(c1ccc(cc1)C)N Amb2236213 [1,1,0,0,0,0|2,0,0]=4 4385 B11R1.22 OCC(c1ccc(cc1)Cl)C Amb17232795 [1,1,0,0,0,0|1,0,0]=3 4386 B11R1.22 OCC(c1ccc(cc1)Cl)N Amb17232854 [1,1,0,0,0,0|2,0,0]=4 4387 B11R1.22 OCC(c1ccc(cc1)Cl)N Amb2236321 [1,1,0,0,0,0|2,0,0]=4 4388 B11R1.22 OCC(c1ccc(cc1)F)C Amb17232131 [1,1,0,0,0,0|1,0,0]=3 4389 B11R1.22 OC[C@@H](F)c1ccc(Br)cc1 Amb25789468 [1,1,0,0,0,0|2,0,0]=4 4390 B11R1.22 OC[C@@H](F)c1ccc(Cl)cc1 Amb24387743 [1,1,0,0,0,0|2,0,0]=4 4391 B11R1.22 OC[C@@H](O)c1ccc(Cl)cc1 Amb22745594 [1,1,0,0,0,0|2,0,0]=4 4392 B11R1.22 OC[C@H](F)c1ccc(F)cc1 Amb24407567 [1,1,0,0,0,0|2,0,0]=4 4393 B11R1.22 ONC(c1ccc(cc1)Br)C Amb17089212 [1,1,0,0,0,0|1,0,0]=3 4394 B11R1.22 ONC(c1ccc(cc1)C)C Amb17089203 [1,1,0,0,0,0|1,0,0]=3 4395 B11R1.22 ONC(c1ccc(cc1)Cl)C Amb17089211 [1,1,0,0,0,0|1,0,0]=3 4396 B11R1.22 ONC(c1ccc(cc1)F)C Amb17089210 [1,1,0,0,0,0|1,0,0]=3 4397 B11R1.22 O[C@@H](CBr)c1ccc(Cl)cc1 Amb25856283 [1,1,0,0,0,0|2,0,0]=4 4398 B11R1.22 O[C@@H](CBr)c1ccc(F)cc1 Amb25695505 [1,1,0,0,0,0|2,0,0]=4 4399 B11R1.22 O[C@@H](CCl)c1ccc(I)cc1 Amb25115222 [1,1,0,0,0,0|2,0,0]=4 4400 B11R1.22 O[C@H](CBr)c1ccc(Br)cc1 Amb24719506 [1,1,0,0,0,0|2,0,0]=4 4401 B11R1.22 O[C@H](CBr)c1ccc(Cl)cc1 Amb25151783 [1,1,0,0,0,0|2,0,0]=4 4402 B11R1.22 O[C@H](CBr)c1ccc(F)cc1 Amb25835098 [1,1,0,0,0,0|2,0,0]=4 4403 B11R1.22 O[C@H](CF)c1ccc(F)cc1 Amb25714715 [1,1,0,0,0,0|2,0,0]=4 4404 B11R1.22 Oc1ccc(cc1)C(O)CF Amb24564100 [1,1,0,0,0,0|2,0,0]=4 4405 B11R1.22 Oc1ccc(cc1)C(O)CO Amb18644612 [1,1,0,0,0,0|2,0,0]=4 4406 B11R1.22 Oc1ccc(cc1)[C@H](O)CO Amb25335306 [1,1,0,0,0,0|2,0,0]=4 4407 B11R1.22 [15NH2][13CH2][13CH](c1ccc(cc1)O)O Amb17618816 [1,1,0,0,0,0|1,0,0]=3 4408 B11R1.23 BrCC(c1cccc(c1)Cl)O Amb16231782 [1,1,0,0,0,0|2,0,0]=4 4409 B11R1.23 BrC[C@H](c1cccc(c1)F)O Amb16233175 [1,1,0,0,0,0|2,0,0]=4 4410 B11R1.23 C=C(CN)c1cccc(O)c1 Amb25326353 [1,1,0,0,0,0|0,0,2]=4 4411 B11R1.23 CC(=NN)c1cccc(O)c1 Amb20668066 [1,1,0,0,0,0|1,0,1]=4 4412 B11R1.23 CC(C#N)c1cccc(Br)c1 Amb18130624 [1,1,0,0,0,0|0,0,2]=4 4413 B11R1.23 CC(C#N)c1cccc(N)c1 Amb18124791 [1,1,0,0,0,0|0,0,2]=4 4414 B11R1.23 CC(C#N)c1cccc(O)c1 Amb25807604 [1,1,0,0,0,0|0,0,2]=4 4415 B11R1.23 CC(C=O)c1cccc(Br)c1 Amb18657407 [1,1,0,0,0,0|1,0,1]=4 4416 B11R1.23 CC(C=O)c1cccc(Cl)c1 Amb22059526 [1,1,0,0,0,0|1,0,1]=4 4417 B11R1.23 CC(C=O)c1cccc(F)c1 Amb24100538 [1,1,0,0,0,0|1,0,1]=4 4418 B11R1.23 CC(CBr)c1cc(Br)ccc1 Amb25717190 [1,1,0,0,0,0|1,0,0]=3 4419 B11R1.23 CC(CBr)c1cccc(Cl)c1 Amb24682607 [1,1,0,0,0,0|1,0,0]=3 4420 B11R1.23 CC(CBr)c1cccc(F)c1 Amb25678488 [1,1,0,0,0,0|1,0,0]=3 4421 B11R1.23 CC(CC)c1c[n]cc(Br)c1 Amb24320780 [1,1,0,0,0,0|1,0,0]=3 4422 B11R1.23 CC(CC)c1c[n]cc(N)c1 Amb18201843 [1,1,0,0,0,0|1,0,0]=3 4423 B11R1.23 CC(CC)c1c[n]cc(O)c1 Amb24320785 [1,1,0,0,0,0|1,0,0]=3 4424 B11R1.23 CC(CC)c1cc[n]c(Br)c1 Amb24320456 [1,1,0,0,0,0|1,0,0]=3 4425 B11R1.23 CC(CC)c1cc[n]c(Cl)[n]1 Amb24544664 [1,1,0,0,0,0|2,0,0]=4 4426 B11R1.23 CC(CC)c1cc[n]c(N)[n]1 Amb25100860 [1,1,0,0,0,0|2,0,0]=4 4427 B11R1.23 CC(CC)c1cc[n]c(N)c1 Amb18125183 [1,1,0,0,0,0|1,0,0]=3 4428 B11R1.23 CC(CCl)c1cc(Cl)ccc1 Amb24389754 [1,1,0,0,0,0|1,0,0]=3 4429 B11R1.23 CC(CCl)c1cccc(F)c1 Amb24485968 [1,1,0,0,0,0|1,0,0]=3 4430 B11R1.23 CC(CN)C=1NC(=O)C=CN1 Amb25288822 [1,1,0,0,0,0|2,0,0]=4 4431 B11R1.23 CC(CN)c1[n]c(N)cc[n]1 Amb24640916 [1,1,0,0,0,0|2,0,0]=4 4432 B11R1.23 CC(CN)c1c[n]cc(F)c1 Amb18251435 [1,1,0,0,0,0|1,0,0]=3 4433 B11R1.23 CC(CN)c1cc(N)[n]c[n]1 Amb25377232 [1,1,0,0,0,0|2,0,0]=4 4434 B11R1.23 CC(CN)c1cccc(Br)c1 Amb18174810 [1,1,0,0,0,0|0,0,0]=2 4435 B11R1.23 CC(CO)C=1CC(=O)C=CC1 Amb19958939 [1,1,0,0,0,0|1,0,1]=4 4436 B11R1.23 CC(CO)c1cccc(Br)c1 Amb25377089 [1,1,0,0,0,0|1,0,0]=3 4437 B11R1.23 CC(CO)c1cccc(Cl)c1 Amb22059525 [1,1,0,0,0,0|1,0,0]=3 4438 B11R1.23 CC(CO)c1cccc(F)c1 Amb24485967 [1,1,0,0,0,0|1,0,0]=3 4439 B11R1.23 CC(NN)c1cc[n]c(Cl)c1 Amb25292151 [1,1,0,0,0,0|2,0,0]=4 4440 B11R1.23 CC(NN)c1cccc(O)c1 Amb22751722 [1,1,0,0,0,0|1,0,0]=3 4441 B11R1.23 CC(NO)c1cc(O)ccc1 Amb25122376 [1,1,0,0,0,0|1,0,0]=3 4442 B11R1.23 CC(NO)c1cccc(Br)c1 Amb25700249 [1,1,0,0,0,0|1,0,0]=3 4443 B11R1.23 CC(c1cc(Br)ncn1)CC Amb10600042 [1,1,0,0,0,0|2,0,0]=4 4444 B11R1.23 CC(c1cccc(n1)Br)CC Amb10600437 [1,1,0,0,0,0|1,0,0]=3 4445 B11R1.23 CC(c1cncc(n1)Br)CC Amb10600321 [1,1,0,0,0,0|2,0,0]=4 4446 B11R1.23 CCC(=O)c1cccc(S)c1 Amb24549290 [1,1,0,0,0,0|1,0,1]=4 4447 B11R1.23 CCC(=O)c1cccc(c1)Br Amb1233199 [1,1,0,0,0,0|1,0,1]=4 4448 B11R1.23 CCC(Br)c1c[n]cc(F)c1 Amb25189571 [1,1,0,0,0,0|2,0,0]=4 4449 B11R1.23 CCC(Br)c1cc(Br)c[n]c1 Amb25801340 [1,1,0,0,0,0|2,0,0]=4 4450 B11R1.23 CCC(Br)c1cc(Br)ccc1 Amb25330622 [1,1,0,0,0,0|1,0,0]=3 4451 B11R1.23 CCC(Br)c1cc[n]c(Cl)c1 Amb25284576 [1,1,0,0,0,0|2,0,0]=4 4452 B11R1.23 CCC(Br)c1cccc(Br)[n]1 Amb25700057 [1,1,0,0,0,0|2,0,0]=4 4453 B11R1.23 CCC(Br)c1cccc(Cl)[n]1 Amb24733775 [1,1,0,0,0,0|2,0,0]=4 4454 B11R1.23 CCC(Br)c1cccc(F)c1 Amb25116208 [1,1,0,0,0,0|1,0,0]=3 4455 B11R1.23 CCC(C)C=1NC(=O)C=CN1 Amb18181729 [1,1,0,0,0,0|2,0,0]=4 4456 B11R1.23 CCC(C)c1[n]c(Cl)cc[n]1 Amb18802170 [1,1,0,0,0,0|2,0,0]=4 4457 B11R1.23 CCC(C)c1[n]c(N)cc[n]1 Amb18285140 [1,1,0,0,0,0|2,0,0]=4 4458 B11R1.23 CCC(C)c1cc(Br)cc[n]1 Amb24320477 [1,1,0,0,0,0|1,0,0]=3 4459 B11R1.23 CCC(C)c1cc(F)cc[n]1 Amb24319241 [1,1,0,0,0,0|1,0,0]=3 4460 B11R1.23 CCC(C)c1cc(N)cc[n]1 Amb24320479 [1,1,0,0,0,0|1,0,0]=3 4461 B11R1.23 CCC(C)c1cccc(Br)c1 Amb24321311 [1,1,0,0,0,0|0,0,0]=2 4462 B11R1.23 CCC(C)c1cccc(F)[n]1 Amb24319193 [1,1,0,0,0,0|1,0,0]=3 4463 B11R1.23 CCC(C)c1cccc(I)c1 Amb25217267 [1,1,0,0,0,0|0,0,0]=2 4464 B11R1.23 CCC(C)c1cccc(N)[n]1 Amb18201878 [1,1,0,0,0,0|1,0,0]=3 4465 B11R1.23 CCC(C)c1cccc(O)c1 Amb18644439 [1,1,0,0,0,0|0,0,0]=2 4466 B11R1.23 CCC(Cl)c1c[n]cc(F)c1 Amb25306994 [1,1,0,0,0,0|2,0,0]=4 4467 B11R1.23 CCC(Cl)c1cccc(Br)c1 Amb25698929 [1,1,0,0,0,0|1,0,0]=3 4468 B11R1.23 CCC(N)C1=CC=CC(=O)N1 Amb18201296 [1,1,0,0,0,0|2,0,0]=4 4469 B11R1.23 CCC(N)c1c[n]cc(Br)c1 Amb23450056 [1,1,0,0,0,0|2,0,0]=4 4470 B11R1.23 CCC(N)c1c[n]cc(F)c1 Amb18283040 [1,1,0,0,0,0|2,0,0]=4 4471 B11R1.23 CCC(N)c1c[n]cc(I)c1 Amb24412337 [1,1,0,0,0,0|2,0,0]=4 4472 B11R1.23 CCC(N)c1cc(Cl)cc[n]1 Amb24377064 [1,1,0,0,0,0|2,0,0]=4 4473 B11R1.23 CCC(N)c1cc(I)cc[n]1 Amb25836287 [1,1,0,0,0,0|2,0,0]=4 4474 B11R1.23 CCC(N)c1cc(N)[n]cc1 Amb24484438 [1,1,0,0,0,0|2,0,0]=4 4475 B11R1.23 CCC(N)c1cc(N)c[n]c1 Amb24484518 [1,1,0,0,0,0|2,0,0]=4 4476 B11R1.23 CCC(N)c1cc(N)cc[n]1 Amb24484495 [1,1,0,0,0,0|2,0,0]=4 4477 B11R1.23 CCC(N)c1cc(N)ccc1 Amb22754502 [1,1,0,0,0,0|1,0,0]=3 4478 B11R1.23 CCC(N)c1cc[n]c(Cl)c1 Amb25133089 [1,1,0,0,0,0|2,0,0]=4 4479 B11R1.23 CCC(N)c1cc[n]c(F)c1 Amb25378839 [1,1,0,0,0,0|2,0,0]=4 4480 B11R1.23 CCC(N)c1cc[n]c(O)c1 Amb24532928 [1,1,0,0,0,0|2,0,0]=4 4481 B11R1.23 CCC(N)c1cccc(F)[n]1 Amb24375141 [1,1,0,0,0,0|2,0,0]=4 4482 B11R1.23 CCC(N)c1cccc(I)[n]1 Amb24712518 [1,1,0,0,0,0|2,0,0]=4 4483 B11R1.23 CCC(N)c1cccc(N)[n]1 Amb25824615 [1,1,0,0,0,0|2,0,0]=4 4484 B11R1.23 CCC(N)c1cccc(S)c1 Amb25716248 [1,1,0,0,0,0|1,0,0]=3 4485 B11R1.23 CCC(O)c1c[n]cc(Br)c1 Amb23450053 [1,1,0,0,0,0|2,0,0]=4 4486 B11R1.23 CCC(O)c1c[n]cc(Cl)c1 Amb25843330 [1,1,0,0,0,0|2,0,0]=4 4487 B11R1.23 CCC(O)c1c[n]cc(F)c1 Amb18791630 [1,1,0,0,0,0|2,0,0]=4 4488 B11R1.23 CCC(O)c1cc(O)ccc1 Amb18125404 [1,1,0,0,0,0|1,0,0]=3 4489 B11R1.23 CCC(O)c1cc[n]c(Cl)c1 Amb24721891 [1,1,0,0,0,0|2,0,0]=4 4490 B11R1.23 CCC(O)c1cccc(F)c1 Amb18035934 [1,1,0,0,0,0|1,0,0]=3 4491 B11R1.23 CCC(O)c1cccc(I)c1 Amb25841716 [1,1,0,0,0,0|1,0,0]=3 4492 B11R1.23 CCC(O)c1cccc(N)[n]1 Amb24459479 [1,1,0,0,0,0|2,0,0]=4 4493 B11R1.23 CCC(O)c1cccc(N)c1 Amb18644476 [1,1,0,0,0,0|1,0,0]=3 4494 B11R1.23 CCC(S)c1cccc(Br)c1 Amb25853905 [1,1,0,0,0,0|1,0,0]=3 4495 B11R1.23 CCC(c1cccc(c1)Br)O Amb1111136 [1,1,0,0,0,0|1,0,0]=3 4496 B11R1.23 CCC(c1cccc(c1)C)N Amb17232059 [1,1,0,0,0,0|1,0,0]=3 4497 B11R1.23 CCC(c1cccc(c1)C)O Amb17232070 [1,1,0,0,0,0|1,0,0]=3 4498 B11R1.23 CCC(c1cccc(c1)Cl)N Amb1126296 [1,1,0,0,0,0|1,0,0]=3 4499 B11R1.23 CCC(c1cccc(c1)F)N Amb10839631 [1,1,0,0,0,0|1,0,0]=3 4500 B11R1.23 CCC(c1cccc(n1)C)N Amb10608330 [1,1,0,0,0,0|2,0,0]=4 4501 B11R1.23 CCC(c1nccc(c1)C)N Amb10608272 [1,1,0,0,0,0|2,0,0]=4 4502 B11R1.23 CCN(c1cccc(c1)C)N Amb17232077 [1,1,0,0,0,0|2,0,0]=4 4503 B11R1.23 CCN(c1ccnc(c1)Br)C Amb10599872 [1,1,0,0,0,0|2,0,0]=4 4504 B11R1.23 CCS(=O)c1cccc(F)c1 Amb24689196 [1,1,0,0,0,0|2,0,0]=4 4505 B11R1.23 CCS(=O)c1cccc(N)c1 Amb25363005 [1,1,0,0,0,0|2,0,0]=4 4506 B11R1.23 CCS(=O)c1cccc(O)c1 Amb25085240 [1,1,0,0,0,0|2,0,0]=4 4507 B11R1.23 CC[C@@H](N)c1c[n]cc(Cl)c1 Amb24643342 [1,1,0,0,0,0|2,0,0]=4 4508 B11R1.23 CC[C@@H](N)c1c[n]cc(O)c1 Amb25727197 [1,1,0,0,0,0|2,0,0]=4 4509 B11R1.23 CC[C@@H](N)c1cc(I)cc[n]1 Amb25149030 [1,1,0,0,0,0|2,0,0]=4 4510 B11R1.23 CC[C@@H](N)c1cc(N)[n]cc1 Amb24484446 [1,1,0,0,0,0|2,0,0]=4 4511 B11R1.23 CC[C@@H](N)c1cc(N)c[n]c1 Amb24484445 [1,1,0,0,0,0|2,0,0]=4 4512 B11R1.23 CC[C@@H](N)c1cc(N)cc[n]1 Amb24484428 [1,1,0,0,0,0|2,0,0]=4 4513 B11R1.23 CC[C@@H](N)c1cc(N)ccc1 Amb25707453 [1,1,0,0,0,0|1,0,0]=3 4514 B11R1.23 CC[C@@H](N)c1cc(O)cc[n]1 Amb24744325 [1,1,0,0,0,0|2,0,0]=4 4515 B11R1.23 CC[C@@H](N)c1cc[n]c(F)c1 Amb25113374 [1,1,0,0,0,0|2,0,0]=4 4516 B11R1.23 CC[C@@H](N)c1cccc(Br)[n]1 Amb25798720 [1,1,0,0,0,0|2,0,0]=4 4517 B11R1.23 CC[C@@H](N)c1cccc(Br)c1 Amb24533197 [1,1,0,0,0,0|1,0,0]=3 4518 B11R1.23 CC[C@@H](N)c1cccc(Cl)[n]1 Amb19889634 [1,1,0,0,0,0|2,0,0]=4 4519 B11R1.23 CC[C@@H](N)c1cccc(Cl)[n]1 Amb25140355 [1,1,0,0,0,0|2,0,0]=4 4520 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22232293 [1,1,0,0,0,0|1,0,0]=3 4521 B11R1.23 CC[C@@H](N)c1cccc(Cl)c1 Amb22288625 [1,1,0,0,0,0|1,0,0]=3 4522 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb22288627 [1,1,0,0,0,0|1,0,0]=3 4523 B11R1.23 CC[C@@H](N)c1cccc(F)c1 Amb24426877 [1,1,0,0,0,0|1,0,0]=3 4524 B11R1.23 CC[C@@H](N)c1cccc(I)[n]1 Amb25222603 [1,1,0,0,0,0|2,0,0]=4 4525 B11R1.23 CC[C@@H](N)c1cccc(O)[n]1 Amb25234095 [1,1,0,0,0,0|2,0,0]=4 4526 B11R1.23 CC[C@@H](N)c1cccc(O)c1 Amb25074061 [1,1,0,0,0,0|1,0,0]=3 4527 B11R1.23 CC[C@@H](O)c1c[n]cc(Br)c1 Amb24429372 [1,1,0,0,0,0|2,0,0]=4 4528 B11R1.23 CC[C@@H](O)c1cccc(Br)c1 Amb25048807 [1,1,0,0,0,0|1,0,0]=3 4529 B11R1.23 CC[C@@H](O)c1cccc(Cl)c1 Amb24477555 [1,1,0,0,0,0|1,0,0]=3 4530 B11R1.23 CC[C@H](N)c1c[n]cc(Cl)c1 Amb24455837 [1,1,0,0,0,0|2,0,0]=4 4531 B11R1.23 CC[C@H](N)c1c[n]cc(O)c1 Amb25265209 [1,1,0,0,0,0|2,0,0]=4 4532 B11R1.23 CC[C@H](N)c1cc(N)[n]cc1 Amb24744484 [1,1,0,0,0,0|2,0,0]=4 4533 B11R1.23 CC[C@H](N)c1cc(N)c[n]c1 Amb25131722 [1,1,0,0,0,0|2,0,0]=4 4534 B11R1.23 CC[C@H](N)c1cc(N)cc[n]1 Amb25789522 [1,1,0,0,0,0|2,0,0]=4 4535 B11R1.23 CC[C@H](N)c1cc(N)ccc1 Amb25169299 [1,1,0,0,0,0|1,0,0]=3 4536 B11R1.23 CC[C@H](N)c1cc(O)cc[n]1 Amb24713636 [1,1,0,0,0,0|2,0,0]=4 4537 B11R1.23 CC[C@H](N)c1cc[n]c(Br)c1 Amb25314199 [1,1,0,0,0,0|2,0,0]=4 4538 B11R1.23 CC[C@H](N)c1cc[n]c(Cl)c1 Amb25230296 [1,1,0,0,0,0|2,0,0]=4 4539 B11R1.23 CC[C@H](N)c1cc[n]c(F)c1 Amb25789505 [1,1,0,0,0,0|2,0,0]=4 4540 B11R1.23 CC[C@H](N)c1cc[n]c(O)c1 Amb25151356 [1,1,0,0,0,0|2,0,0]=4 4541 B11R1.23 CC[C@H](N)c1cccc(Cl)[n]1 Amb19889635 [1,1,0,0,0,0|2,0,0]=4 4542 B11R1.23 CC[C@H](N)c1cccc(Cl)[n]1 Amb25354202 [1,1,0,0,0,0|2,0,0]=4 4543 B11R1.23 CC[C@H](N)c1cccc(Cl)c1 Amb22232288 [1,1,0,0,0,0|1,0,0]=3 4544 B11R1.23 CC[C@H](N)c1cccc(F)c1 Amb22288686 [1,1,0,0,0,0|1,0,0]=3 4545 B11R1.23 CC[C@H](N)c1cccc(I)c1 Amb25288823 [1,1,0,0,0,0|1,0,0]=3 4546 B11R1.23 CC[C@H](N)c1cccc(O)c1 Amb24460783 [1,1,0,0,0,0|1,0,0]=3 4547 B11R1.23 CC[C@H](N)c1cccc(S)c1 Amb25726439 [1,1,0,0,0,0|1,0,0]=3 4548 B11R1.23 CC[C@H](O)c1c[n]cc(Br)c1 Amb25126359 [1,1,0,0,0,0|2,0,0]=4 4549 B11R1.23 CC[C@H](O)c1cc(Cl)cc[n]1 Amb25172793 [1,1,0,0,0,0|2,0,0]=4 4550 B11R1.23 CC[C@H](O)c1cc(O)ccc1 Amb24484509 [1,1,0,0,0,0|1,0,0]=3 4551 B11R1.23 CC[C@H](O)c1cccc(F)c1 Amb24447234 [1,1,0,0,0,0|1,0,0]=3 4552 B11R1.23 CN(CC)c1c[n]cc(Br)c1 Amb20617815 [1,1,0,0,0,0|2,0,0]=4 4553 B11R1.23 CN(CC)c1c[n]cc(N)c1 Amb20617816 [1,1,0,0,0,0|2,0,0]=4 4554 B11R1.23 CN(CC)c1c[n]cc(O)c1 Amb20617804 [1,1,0,0,0,0|2,0,0]=4 4555 B11R1.23 CN(CC)c1cc(N)cc[n]1 Amb18956385 [1,1,0,0,0,0|2,0,0]=4 4556 B11R1.23 CN(CC)c1cc[n]c(N)c1 Amb24320230 [1,1,0,0,0,0|2,0,0]=4 4557 B11R1.23 CN(CC)c1cccc(Br)c1 Amb25711222 [1,1,0,0,0,0|1,0,0]=3 4558 B11R1.23 CN(CC)c1cccc(Cl)c1 Amb25332688 [1,1,0,0,0,0|1,0,0]=3 4559 B11R1.23 CN(CC)c1cccc(F)[n]1 Amb18177332 [1,1,0,0,0,0|2,0,0]=4 4560 B11R1.23 CN(CC)c1cccc(F)c1 Amb25163175 [1,1,0,0,0,0|1,0,0]=3 4561 B11R1.23 CN(CC)c1cccc(N)[n]1 Amb24319260 [1,1,0,0,0,0|2,0,0]=4 4562 B11R1.23 CN(CC)c1cccc(O)c1 Amb18125288 [1,1,0,0,0,0|1,0,0]=3 4563 B11R1.23 CN(OC)c1cccc(Cl)c1 Amb20620735 [1,1,0,0,0,0|2,0,0]=4 4564 B11R1.23 CN(c1cc(Br)ccn1)CC Amb10599808 [1,1,0,0,0,0|2,0,0]=4 4565 B11R1.23 CN(c1cccc(n1)Br)CC Amb10599617 [1,1,0,0,0,0|2,0,0]=4 4566 B11R1.23 CNC(=N)c1cccc(Cl)c1 Amb24533036 [1,1,0,0,0,0|1,0,1]=4 4567 B11R1.23 CNC(=O)c1cccc(N)c1 Amb24053079 [1,1,0,0,0,0|1,0,1]=4 4568 B11R1.23 CNC(=O)c1cccc(S)c1 Amb25188808 [1,1,0,0,0,0|1,0,1]=4 4569 B11R1.23 CNC(=O)c1cccc(c1)N Amb1212262 [1,1,0,0,0,0|1,0,1]=4 4570 B11R1.23 CNC(C)c1c[n]cc(Cl)c1 Amb24743368 [1,1,0,0,0,0|1,0,0]=3 4571 B11R1.23 CNC(C)c1c[n]cc(F)c1 Amb18283046 [1,1,0,0,0,0|1,0,0]=3 4572 B11R1.23 CNC(C)c1c[n]cc(I)c1 Amb24375948 [1,1,0,0,0,0|1,0,0]=3 4573 B11R1.23 CNC(C)c1cc(Cl)cc[n]1 Amb25053435 [1,1,0,0,0,0|1,0,0]=3 4574 B11R1.23 CNC(C)c1cc[n]c(Br)c1 Amb25117656 [1,1,0,0,0,0|1,0,0]=3 4575 B11R1.23 CNC(C)c1cc[n]c(Cl)c1 Amb25124839 [1,1,0,0,0,0|1,0,0]=3 4576 B11R1.23 CNC(C)c1cc[n]c(N)c1 Amb24484674 [1,1,0,0,0,0|1,0,0]=3 4577 B11R1.23 CNC(C)c1cc[n]c(O)c1 Amb25731283 [1,1,0,0,0,0|1,0,0]=3 4578 B11R1.23 CNC(C)c1cccc(Cl)[n]1 Amb24484672 [1,1,0,0,0,0|1,0,0]=3 4579 B11R1.23 CNC(C)c1cccc(O)c1 Amb19514938 [1,1,0,0,0,0|0,0,0]=2 4580 B11R1.23 CNC(C)c1cccc(S)c1 Amb24465363 [1,1,0,0,0,0|0,0,0]=2 4581 B11R1.23 CNC(O)c1cc(O)ccc1 Amb24466291 [1,1,0,0,0,0|1,0,0]=3 4582 B11R1.23 CNC(c1cccc(c1)Br)C Amb1131184 [1,1,0,0,0,0|0,0,0]=2 4583 B11R1.23 CNC(c1cccc(c1)Cl)C Amb1135714 [1,1,0,0,0,0|0,0,0]=2 4584 B11R1.23 CNC(c1cccc(c1)O)C Amb1112055 [1,1,0,0,0,0|0,0,0]=2 4585 B11R1.23 CN[C@@H](C)c1c[n]cc(Cl)c1 Amb25226803 [1,1,0,0,0,0|1,0,0]=3 4586 B11R1.23 CN[C@@H](C)c1c[n]cc(I)c1 Amb25826444 [1,1,0,0,0,0|1,0,0]=3 4587 B11R1.23 CN[C@@H](C)c1cc(Br)cc[n]1 Amb24417885 [1,1,0,0,0,0|1,0,0]=3 4588 B11R1.23 CN[C@@H](C)c1cc(I)cc[n]1 Amb25040517 [1,1,0,0,0,0|1,0,0]=3 4589 B11R1.23 CN[C@@H](C)c1cc(N)cc[n]1 Amb25675972 [1,1,0,0,0,0|1,0,0]=3 4590 B11R1.23 CN[C@@H](C)c1cc[n]c(F)c1 Amb25064662 [1,1,0,0,0,0|1,0,0]=3 4591 B11R1.23 CN[C@@H](C)c1cc[n]c(O)c1 Amb25736294 [1,1,0,0,0,0|1,0,0]=3 4592 B11R1.23 CN[C@@H](C)c1cccc(Br)[n]1 Amb24538314 [1,1,0,0,0,0|1,0,0]=3 4593 B11R1.23 CN[C@@H](C)c1cccc(Br)c1 Amb25147856 [1,1,0,0,0,0|0,0,0]=2 4594 B11R1.23 CN[C@@H](C)c1cccc(I)c1 Amb24716589 [1,1,0,0,0,0|0,0,0]=2 4595 B11R1.23 CN[C@@H](C)c1cccc(N)c1 Amb25100891 [1,1,0,0,0,0|0,0,0]=2 4596 B11R1.23 CN[C@@H](C)c1cccc(O)[n]1 Amb25172787 [1,1,0,0,0,0|1,0,0]=3 4597 B11R1.23 CN[C@@H](C)c1cccc(S)c1 Amb24486636 [1,1,0,0,0,0|0,0,0]=2 4598 B11R1.23 CN[C@@H](c1cccc(c1)F)C Amb10840583 [1,1,0,0,0,0|0,0,0]=2 4599 B11R1.23 CN[C@H](C)c1c[n]cc(F)c1 Amb25835867 [1,1,0,0,0,0|1,0,0]=3 4600 B11R1.23 CN[C@H](C)c1cc(Cl)cc[n]1 Amb24553825 [1,1,0,0,0,0|1,0,0]=3 4601 B11R1.23 CN[C@H](C)c1cc(I)cc[n]1 Amb25270699 [1,1,0,0,0,0|1,0,0]=3 4602 B11R1.23 CN[C@H](C)c1cc(N)cc[n]1 Amb25172778 [1,1,0,0,0,0|1,0,0]=3 4603 B11R1.23 CN[C@H](C)c1cc[n]c(F)c1 Amb25774340 [1,1,0,0,0,0|1,0,0]=3 4604 B11R1.23 CN[C@H](C)c1cccc(Br)[n]1 Amb25828948 [1,1,0,0,0,0|1,0,0]=3 4605 B11R1.23 CN[C@H](C)c1cccc(Br)c1 Amb25056176 [1,1,0,0,0,0|0,0,0]=2 4606 B11R1.23 CN[C@H](C)c1cccc(Cl)[n]1 Amb24678337 [1,1,0,0,0,0|1,0,0]=3 4607 B11R1.23 CN[C@H](C)c1cccc(I)[n]1 Amb24551671 [1,1,0,0,0,0|1,0,0]=3 4608 B11R1.23 CN[C@H](C)c1cccc(I)c1 Amb24468187 [1,1,0,0,0,0|0,0,0]=2 4609 B11R1.23 CN[C@H](C)c1cccc(N)c1 Amb25794176 [1,1,0,0,0,0|0,0,0]=2 4610 B11R1.23 CN[C@H](C)c1cccc(O)[n]1 Amb24625694 [1,1,0,0,0,0|1,0,0]=3 4611 B11R1.23 CN[C@H](c1cccc(c1)F)C Amb10838861 [1,1,0,0,0,0|0,0,0]=2 4612 B11R1.23 COC(C)c1cc(Cl)cc[n]1 Amb25196040 [1,1,0,0,0,0|2,0,0]=4 4613 B11R1.23 COC(C)c1cccc(Br)c1 Amb25242655 [1,1,0,0,0,0|1,0,0]=3 4614 B11R1.23 COC(c1cccc(c1)N)C Amb13952800 [1,1,0,0,0,0|1,0,0]=3 4615 B11R1.23 CSC(C)c1cccc(N)c1 Amb18282127 [1,1,0,0,0,0|1,0,0]=3 4616 B11R1.23 C[C@@H](CN)c1cccc(Br)c1 Amb24642637 [1,1,0,0,0,0|0,0,0]=2 4617 B11R1.23 C[C@@H](CN)c1cccc(Cl)c1 Amb24749885 [1,1,0,0,0,0|0,0,0]=2 4618 B11R1.23 C[C@@H](NO)c1cccc(Br)c1 Amb25775914 [1,1,0,0,0,0|1,0,0]=3 4619 B11R1.23 C[C@@H](NO)c1cccc(Cl)c1 Amb24488035 [1,1,0,0,0,0|1,0,0]=3 4620 B11R1.23 C[C@@H](NO)c1cccc(F)c1 Amb25125912 [1,1,0,0,0,0|1,0,0]=3 4621 B11R1.23 C[C@H](CO)c1cccc(F)c1 Amb25341759 [1,1,0,0,0,0|1,0,0]=3 4622 B11R1.23 C[C@H](NO)c1cccc(Cl)c1 Amb25304262 [1,1,0,0,0,0|1,0,0]=3 4623 B11R1.23 C[C@H](NO)c1cccc(F)c1 Amb24686588 [1,1,0,0,0,0|1,0,0]=3 4624 B11R1.23 C\C(=C/C)\c1cc(F)ccc1 Amb25837290 [1,1,0,0,0,0|0,0,2]=4 4625 B11R1.23 C\C(=C\C)\c1cc(Br)ccc1 Amb25674836 [1,1,0,0,0,0|0,0,2]=4 4626 B11R1.23 C\C(=N/N)\c1cccc(O)c1 Amb24484530 [1,1,0,0,0,0|1,0,1]=4 4627 B11R1.23 C\C(=N\N)\c1cc(N)ccc1 Amb25138243 [1,1,0,0,0,0|1,0,1]=4 4628 B11R1.23 C\C(=N\N)\c1cccc(F)c1 Amb25667632 [1,1,0,0,0,0|1,0,1]=4 4629 B11R1.23 Cc1c[n]cc(c1)C(C)CN Amb25260685 [1,1,0,0,0,0|1,0,0]=3 4630 B11R1.23 Cc1c[n]cc(c1)C(Cl)CC Amb25789008 [1,1,0,0,0,0|2,0,0]=4 4631 B11R1.23 Cc1cc([n]cc1)[C@@H](N)CN Amb25757491 [1,1,0,0,0,0|2,0,0]=4 4632 B11R1.23 Cc1cc([n]cc1)[C@H](N)CN Amb25111518 [1,1,0,0,0,0|2,0,0]=4 4633 B11R1.23 Cc1cc(c[n]c1)C(F)CN Amb25151834 [1,1,0,0,0,0|2,0,0]=4 4634 B11R1.23 Cc1cc(c[n]c1)C(O)CN Amb24702062 [1,1,0,0,0,0|2,0,0]=4 4635 B11R1.23 Cc1cc(c[n]c1)[C@@H](N)CN Amb25169251 [1,1,0,0,0,0|2,0,0]=4 4636 B11R1.23 Cc1cc(cc[n]1)C(C)CN Amb18201826 [1,1,0,0,0,0|1,0,0]=3 4637 B11R1.23 Cc1cc(cc[n]1)C(N)CC Amb25219977 [1,1,0,0,0,0|2,0,0]=4 4638 B11R1.23 Cc1cc(cc[n]1)C(N)CN Amb24484418 [1,1,0,0,0,0|2,0,0]=4 4639 B11R1.23 Cc1cc(cc[n]1)C(O)CC Amb25148255 [1,1,0,0,0,0|2,0,0]=4 4640 B11R1.23 Cc1cc(cc[n]1)[C@@H](N)CC Amb25680089 [1,1,0,0,0,0|2,0,0]=4 4641 B11R1.23 Cc1cc(cc[n]1)[C@@H](N)CN Amb25679885 [1,1,0,0,0,0|2,0,0]=4 4642 B11R1.23 Cc1cc(cc[n]1)[C@H](C)NC Amb24509272 [1,1,0,0,0,0|1,0,0]=3 4643 B11R1.23 Cc1cc(cc[n]1)[C@H](N)CN Amb24351269 [1,1,0,0,0,0|2,0,0]=4 4644 B11R1.23 Cc1cc(ccc1)C(=C)CC Amb25151911 [1,1,0,0,0,0|0,0,2]=4 4645 B11R1.23 Cc1cc(ccc1)C(=N)NC Amb24520876 [1,1,0,0,0,0|1,0,1]=4 4646 B11R1.23 Cc1cc(ccc1)C(=O)CN Amb20171473 [1,1,0,0,0,0|1,0,1]=4 4647 B11R1.23 Cc1cc(ccc1)C(=S)NC Amb24635576 [1,1,0,0,0,0|1,0,1]=4 4648 B11R1.23 Cc1cc(ccc1)C(Cl)CCl Amb24487933 [1,1,0,0,0,0|2,0,0]=4 4649 B11R1.23 Cc1cc(ccc1)C(F)CN Amb25151821 [1,1,0,0,0,0|1,0,0]=3 4650 B11R1.23 Cc1cc(ccc1)C(F)CO Amb25788942 [1,1,0,0,0,0|2,0,0]=4 4651 B11R1.23 Cc1cc(ccc1)C(N)CF Amb25103802 [1,1,0,0,0,0|2,0,0]=4 4652 B11R1.23 Cc1cc(ccc1)C(N)CN Amb22585672 [1,1,0,0,0,0|1,0,0]=3 4653 B11R1.23 Cc1cc(ccc1)C(O)CCl Amb25059095 [1,1,0,0,0,0|2,0,0]=4 4654 B11R1.23 Cc1cc(ccc1)C(O)CF Amb25228079 [1,1,0,0,0,0|2,0,0]=4 4655 B11R1.23 Cc1cc(ccc1)C(O)CN Amb22235050 [1,1,0,0,0,0|1,0,0]=3 4656 B11R1.23 Cc1cc(ccc1)C(O)CO Amb24116522 [1,1,0,0,0,0|2,0,0]=4 4657 B11R1.23 Cc1cc(ccc1)[C@@H](F)CO Amb25190296 [1,1,0,0,0,0|2,0,0]=4 4658 B11R1.23 Cc1cc(ccc1)[C@@H](N)CF Amb25251606 [1,1,0,0,0,0|2,0,0]=4 4659 B11R1.23 Cc1cc(ccc1)[C@@H](N)CO Amb22756883 [1,1,0,0,0,0|2,0,0]=4 4660 B11R1.23 Cc1cc(ccc1)[C@H](N)CF Amb24472618 [1,1,0,0,0,0|2,0,0]=4 4661 B11R1.23 Cc1cc(ccc1)[C@H](N)CN Amb24710735 [1,1,0,0,0,0|1,0,0]=3 4662 B11R1.23 Cc1cc(ccc1)[C@H](O)CCl Amb25765754 [1,1,0,0,0,0|2,0,0]=4 4663 B11R1.23 Cc1cc(ccc1)\C(\C)=N/N Amb25052007 [1,1,0,0,0,0|1,0,1]=4 4664 B11R1.23 Cc1cc[n]c([n]1)C(C)CN Amb25307857 [1,1,0,0,0,0|2,0,0]=4 4665 B11R1.23 Cc1cc[n]c(c1)C(C)NC Amb25772996 [1,1,0,0,0,0|1,0,0]=3 4666 B11R1.23 Cc1cc[n]c(c1)C(C)NN Amb25742047 [1,1,0,0,0,0|2,0,0]=4 4667 B11R1.23 Cc1cc[n]c(c1)C(N)CC Amb21959651 [1,1,0,0,0,0|2,0,0]=4 4668 B11R1.23 Cc1cc[n]c(c1)C(O)CC Amb25789789 [1,1,0,0,0,0|2,0,0]=4 4669 B11R1.23 Cc1cc[n]c(c1)[C@@H](C)NC Amb25373994 [1,1,0,0,0,0|1,0,0]=3 4670 B11R1.23 Cc1cc[n]c(c1)[C@@H](O)CC Amb25150221 [1,1,0,0,0,0|2,0,0]=4 4671 B11R1.23 Cc1cc[n]c(c1)[C@H](N)CC Amb24712723 [1,1,0,0,0,0|2,0,0]=4 4672 B11R1.23 Cc1cccc([n]1)C(C)CC Amb24085060 [1,1,0,0,0,0|1,0,0]=3 4673 B11R1.23 Cc1cccc([n]1)C(C)NC Amb24477620 [1,1,0,0,0,0|1,0,0]=3 4674 B11R1.23 Cc1cccc([n]1)C(C)NN Amb25728319 [1,1,0,0,0,0|2,0,0]=4 4675 B11R1.23 Cc1cccc([n]1)C(C)ON Amb25130503 [1,1,0,0,0,0|2,0,0]=4 4676 B11R1.23 Cc1cccc([n]1)C(O)CC Amb24082676 [1,1,0,0,0,0|2,0,0]=4 4677 B11R1.23 Cc1cccc([n]1)C(O)CN Amb24707811 [1,1,0,0,0,0|2,0,0]=4 4678 B11R1.23 Cc1cccc([n]1)N(C)CC Amb25052313 [1,1,0,0,0,0|2,0,0]=4 4679 B11R1.23 Cc1cccc([n]1)[C@@H](C)NC Amb25063333 [1,1,0,0,0,0|1,0,0]=3 4680 B11R1.23 Cc1cccc([n]1)[C@@H](O)CC Amb24386406 [1,1,0,0,0,0|2,0,0]=4 4681 B11R1.23 Cc1cccc([n]1)[C@H](N)CC Amb25145711 [1,1,0,0,0,0|2,0,0]=4 4682 B11R1.23 Cc1cccc([n]1)[C@H](O)CN Amb24378058 [1,1,0,0,0,0|2,0,0]=4 4683 B11R1.23 Cc1cccc(c1)C(Br)CC Amb25131128 [1,1,0,0,0,0|1,0,0]=3 4684 B11R1.23 Cc1cccc(c1)C(C)C=O Amb24380067 [1,1,0,0,0,0|1,0,1]=4 4685 B11R1.23 Cc1cccc(c1)C(C)CBr Amb25694936 [1,1,0,0,0,0|1,0,0]=3 4686 B11R1.23 Cc1cccc(c1)C(C)CC Amb22755118 [1,1,0,0,0,0|0,0,0]=2 4687 B11R1.23 Cc1cccc(c1)C(C)CO Amb24674558 [1,1,0,0,0,0|1,0,0]=3 4688 B11R1.23 Cc1cccc(c1)C(C)NN Amb18787419 [1,1,0,0,0,0|1,0,0]=3 4689 B11R1.23 Cc1cccc(c1)C(Cl)CC Amb24739513 [1,1,0,0,0,0|1,0,0]=3 4690 B11R1.23 Cc1cccc(c1)C(O)OC Amb24661117 [1,1,0,0,0,0|2,0,0]=4 4691 B11R1.23 Cc1cccc(c1)C(S)CC Amb25703808 [1,1,0,0,0,0|1,0,0]=3 4692 B11R1.23 Cc1cccc(c1)N(C)CC Amb24689118 [1,1,0,0,0,0|1,0,0]=3 4693 B11R1.23 Cc1cccc(c1)[C@@H](C)NC Amb24377657 [1,1,0,0,0,0|0,0,0]=2 4694 B11R1.23 Cc1cccc(c1)[C@@H](N)CC Amb22298573 [1,1,0,0,0,0|1,0,0]=3 4695 B11R1.23 Cc1cccc(c1)[C@@H](O)CC Amb25794428 [1,1,0,0,0,0|1,0,0]=3 4696 B11R1.23 Cc1cccc(c1)[C@H](C)CO Amb25220127 [1,1,0,0,0,0|1,0,0]=3 4697 B11R1.23 Cc1cccc(c1)[C@H](C)NO Amb25126106 [1,1,0,0,0,0|1,0,0]=3 4698 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb22298529 [1,1,0,0,0,0|1,0,0]=3 4699 B11R1.23 Cc1cccc(c1)[C@H](N)CC Amb25145723 [1,1,0,0,0,0|1,0,0]=3 4700 B11R1.23 Cc1cccc(c1)[C@H](O)CC Amb25151427 [1,1,0,0,0,0|1,0,0]=3 4701 B11R1.23 ClC[C@@H](c1cccc(c1)Cl)O Amb16231706 [1,1,0,0,0,0|2,0,0]=4 4702 B11R1.23 FCC(Cl)c1cc(Cl)ccc1 Amb24373155 [1,1,0,0,0,0|2,0,0]=4 4703 B11R1.23 FCC(c1cccc(c1)Br)N Amb2372610 [1,1,0,0,0,0|2,0,0]=4 4704 B11R1.23 FCC(c1cccc(c1)Cl)N Amb2372608 [1,1,0,0,0,0|2,0,0]=4 4705 B11R1.23 Fc1cccc(c1)C(Cl)CF Amb24487867 [1,1,0,0,0,0|2,0,0]=4 4706 B11R1.23 NC(CF)c1cccc(Cl)c1 Amb22270179 [1,1,0,0,0,0|2,0,0]=4 4707 B11R1.23 NC(CF)c1cccc(I)c1 Amb25687298 [1,1,0,0,0,0|2,0,0]=4 4708 B11R1.23 NC(CF)c1cccc(O)c1 Amb24488065 [1,1,0,0,0,0|2,0,0]=4 4709 B11R1.23 NC(CN)c1c[n]cc(Br)c1 Amb24419045 [1,1,0,0,0,0|2,0,0]=4 4710 B11R1.23 NC(CN)c1c[n]cc(F)c1 Amb25152779 [1,1,0,0,0,0|2,0,0]=4 4711 B11R1.23 NC(CN)c1cc[n]c(Br)c1 Amb25055767 [1,1,0,0,0,0|2,0,0]=4 4712 B11R1.23 NC(CN)c1cc[n]c(Cl)c1 Amb25191173 [1,1,0,0,0,0|2,0,0]=4 4713 B11R1.23 NC(CO)c1cc(O)ccc1 Amb18281703 [1,1,0,0,0,0|2,0,0]=4 4714 B11R1.23 NC(CO)c1cccc(Br)c1 Amb20668144 [1,1,0,0,0,0|2,0,0]=4 4715 B11R1.23 NC(CO)c1cccc(Cl)c1 Amb19374550 [1,1,0,0,0,0|2,0,0]=4 4716 B11R1.23 NC(CO)c1cccc(F)c1 Amb19374122 [1,1,0,0,0,0|2,0,0]=4 4717 B11R1.23 NC(CO)c1cccc(I)c1 Amb25147935 [1,1,0,0,0,0|2,0,0]=4 4718 B11R1.23 NC(CO)c1cccc(S)c1 Amb24485787 [1,1,0,0,0,0|2,0,0]=4 4719 B11R1.23 NCC(=O)c1cccc(Br)c1 Amb18281391 [1,1,0,0,0,0|1,0,1]=4 4720 B11R1.23 NCC(=O)c1cccc(Cl)c1 Amb18951219 [1,1,0,0,0,0|1,0,1]=4 4721 B11R1.23 NCC(=O)c1cccc(F)c1 Amb18951218 [1,1,0,0,0,0|1,0,1]=4 4722 B11R1.23 NCC(=O)c1cccc(c1)C Amb10976904 [1,1,0,0,0,0|1,0,1]=4 4723 B11R1.23 NCC(=O)c1cccc(c1)F Amb10840040 [1,1,0,0,0,0|1,0,1]=4 4724 B11R1.23 NCC(=O)c1cccc(c1)O Amb17593761 [1,1,0,0,0,0|1,0,1]=4 4725 B11R1.23 NCC(Cl)c1cc(Cl)ccc1 Amb25741499 [1,1,0,0,0,0|1,0,0]=3 4726 B11R1.23 NCC(F)c1cc(F)ccc1 Amb24084158 [1,1,0,0,0,0|1,0,0]=3 4727 B11R1.23 NCC(F)c1cccc(Br)c1 Amb23454841 [1,1,0,0,0,0|1,0,0]=3 4728 B11R1.23 NCC(F)c1cccc(Cl)c1 Amb25151836 [1,1,0,0,0,0|1,0,0]=3 4729 B11R1.23 NCC(N)c1cc(Br)cc[n]1 Amb24741680 [1,1,0,0,0,0|2,0,0]=4 4730 B11R1.23 NCC(N)c1cccc(Br)c1 Amb22585480 [1,1,0,0,0,0|1,0,0]=3 4731 B11R1.23 NCC(N)c1cccc(Cl)[n]1 Amb25076815 [1,1,0,0,0,0|2,0,0]=4 4732 B11R1.23 NCC(N)c1cccc(Cl)c1 Amb22585493 [1,1,0,0,0,0|1,0,0]=3 4733 B11R1.23 NCC(N)c1cccc(F)[n]1 Amb24484484 [1,1,0,0,0,0|2,0,0]=4 4734 B11R1.23 NCC(N)c1cccc(F)c1 Amb22585496 [1,1,0,0,0,0|1,0,0]=3 4735 B11R1.23 NCC(N)c1cccc(I)c1 Amb22585497 [1,1,0,0,0,0|1,0,0]=3 4736 B11R1.23 NCC(N)c1cccc(O)c1 Amb25680093 [1,1,0,0,0,0|1,0,0]=3 4737 B11R1.23 NCC(O)c1c[n]cc(Br)c1 Amb23586013 [1,1,0,0,0,0|2,0,0]=4 4738 B11R1.23 NCC(O)c1cc[n]c(Br)c1 Amb24484858 [1,1,0,0,0,0|2,0,0]=4 4739 B11R1.23 NCC(O)c1cccc(Br)[n]1 Amb24380697 [1,1,0,0,0,0|2,0,0]=4 4740 B11R1.23 NCC(O)c1cccc(Br)c1 Amb19515816 [1,1,0,0,0,0|1,0,0]=3 4741 B11R1.23 NCC(O)c1cccc(I)c1 Amb22585763 [1,1,0,0,0,0|1,0,0]=3 4742 B11R1.23 NCC(O)c1cccc(I)c1 Amb25116809 [1,1,0,0,0,0|1,0,0]=3 4743 B11R1.23 NCC(c1cccc(c1)C)C Amb17232058 [1,1,0,0,0,0|0,0,0]=2 4744 B11R1.23 NCC(c1cccc(c1)C)O Amb1108715 [1,1,0,0,0,0|1,0,0]=3 4745 B11R1.23 NCC(c1cccc(c1)Cl)C Amb17079281 [1,1,0,0,0,0|0,0,0]=2 4746 B11R1.23 NCC(c1cccc(c1)Cl)O Amb1108889 [1,1,0,0,0,0|1,0,0]=3 4747 B11R1.23 NCC(c1cccc(c1)F)C Amb13951272 [1,1,0,0,0,0|0,0,0]=2 4748 B11R1.23 NCC(c1cccc(c1)F)O Amb1108497 [1,1,0,0,0,0|1,0,0]=3 4749 B11R1.23 NC[C@@H](N)c1cccc(Br)[n]1 Amb24459911 [1,1,0,0,0,0|2,0,0]=4 4750 B11R1.23 NC[C@@H](N)c1cccc(Br)c1 Amb22406459 [1,1,0,0,0,0|1,0,0]=3 4751 B11R1.23 NC[C@@H](N)c1cccc(F)c1 Amb25300278 [1,1,0,0,0,0|1,0,0]=3 4752 B11R1.23 NC[C@@H](N)c1cccc(I)c1 Amb25189321 [1,1,0,0,0,0|1,0,0]=3 4753 B11R1.23 NC[C@@H](N)c1cccc(O)c1 Amb24693568 [1,1,0,0,0,0|1,0,0]=3 4754 B11R1.23 NC[C@@H](O)c1c[n]cc(F)c1 Amb25202772 [1,1,0,0,0,0|2,0,0]=4 4755 B11R1.23 NC[C@@H](O)c1cc(O)ccc1 Amb22800805 [1,1,0,0,0,0|1,0,0]=3 4756 B11R1.23 NC[C@@H](O)c1cccc(Br)c1 Amb25362852 [1,1,0,0,0,0|1,0,0]=3 4757 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241268 [1,1,0,0,0,0|1,0,0]=3 4758 B11R1.23 NC[C@@H](O)c1cccc(Cl)c1 Amb20241482 [1,1,0,0,0,0|1,0,0]=3 4759 B11R1.23 NC[C@@H](O)c1cccc(F)c1 Amb24651917 [1,1,0,0,0,0|1,0,0]=3 4760 B11R1.23 NC[C@H](N)c1cccc(Br)[n]1 Amb25766605 [1,1,0,0,0,0|2,0,0]=4 4761 B11R1.23 NC[C@H](N)c1cccc(Br)c1 Amb22406446 [1,1,0,0,0,0|1,0,0]=3 4762 B11R1.23 NC[C@H](N)c1cccc(Cl)[n]1 Amb24377628 [1,1,0,0,0,0|2,0,0]=4 4763 B11R1.23 NC[C@H](N)c1cccc(F)[n]1 Amb24426883 [1,1,0,0,0,0|2,0,0]=4 4764 B11R1.23 NC[C@H](N)c1cccc(I)c1 Amb24399298 [1,1,0,0,0,0|1,0,0]=3 4765 B11R1.23 NC[C@H](N)c1cccc(O)[n]1 Amb25704755 [1,1,0,0,0,0|2,0,0]=4 4766 B11R1.23 NC[C@H](N)c1cccc(O)c1 Amb25145725 [1,1,0,0,0,0|1,0,0]=3 4767 B11R1.23 NC[C@H](O)c1cccc(Br)c1 Amb25306093 [1,1,0,0,0,0|1,0,0]=3 4768 B11R1.23 NC[C@H](O)c1cccc(F)c1 Amb25306092 [1,1,0,0,0,0|1,0,0]=3 4769 B11R1.23 N[C@@H](CF)c1cccc(Br)c1 Amb25151825 [1,1,0,0,0,0|2,0,0]=4 4770 B11R1.23 N[C@@H](CF)c1cccc(Cl)c1 Amb25214549 [1,1,0,0,0,0|2,0,0]=4 4771 B11R1.23 N[C@@H](CF)c1cccc(O)c1 Amb24554182 [1,1,0,0,0,0|2,0,0]=4 4772 B11R1.23 N[C@@H](CN)c1c[n]cc(Br)c1 Amb25147841 [1,1,0,0,0,0|2,0,0]=4 4773 B11R1.23 N[C@@H](CN)c1c[n]cc(F)c1 Amb25128012 [1,1,0,0,0,0|2,0,0]=4 4774 B11R1.23 N[C@@H](CO)c1cccc(Br)c1 Amb22756526 [1,1,0,0,0,0|2,0,0]=4 4775 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb20242612 [1,1,0,0,0,0|2,0,0]=4 4776 B11R1.23 N[C@@H](CO)c1cccc(Cl)c1 Amb23440437 [1,1,0,0,0,0|2,0,0]=4 4777 B11R1.23 N[C@@H](CO)c1cccc(F)c1 Amb22756437 [1,1,0,0,0,0|2,0,0]=4 4778 B11R1.23 N[C@@H](CO)c1cccc(I)c1 Amb23439874 [1,1,0,0,0,0|2,0,0]=4 4779 B11R1.23 N[C@@H](CO)c1cccc(I)c1 Amb25784595 [1,1,0,0,0,0|2,0,0]=4 4780 B11R1.23 N[C@H](CF)c1cccc(Br)c1 Amb25151696 [1,1,0,0,0,0|2,0,0]=4 4781 B11R1.23 N[C@H](CF)c1cccc(Cl)c1 Amb24623067 [1,1,0,0,0,0|2,0,0]=4 4782 B11R1.23 N[C@H](CF)c1cccc(O)c1 Amb25341320 [1,1,0,0,0,0|2,0,0]=4 4783 B11R1.23 N[C@H](CN)c1c[n]cc(Br)c1 Amb24382956 [1,1,0,0,0,0|2,0,0]=4 4784 B11R1.23 N[C@H](CN)c1c[n]cc(Cl)c1 Amb24484473 [1,1,0,0,0,0|2,0,0]=4 4785 B11R1.23 N[C@H](CO)c1cc(O)ccc1 Amb25028057 [1,1,0,0,0,0|2,0,0]=4 4786 B11R1.23 N[C@H](CO)c1cccc(Cl)c1 Amb25084835 [1,1,0,0,0,0|2,0,0]=4 4787 B11R1.23 Nc1c[n]cc(c1)[C@@H](N)CN Amb25733119 [1,1,0,0,0,0|2,0,0]=4 4788 B11R1.23 Nc1c[n]cc(c1)[C@H](N)CN Amb24484474 [1,1,0,0,0,0|2,0,0]=4 4789 B11R1.23 Nc1cc(cc[n]1)[C@H](N)CN Amb24538254 [1,1,0,0,0,0|2,0,0]=4 4790 B11R1.23 Nc1cc(ccc1)C(O)CO Amb18285028 [1,1,0,0,0,0|2,0,0]=4 4791 B11R1.23 Nc1cc[n]c(c1)[C@@H](N)CN Amb24484449 [1,1,0,0,0,0|2,0,0]=4 4792 B11R1.23 Nc1cccc([n]1)C(N)CN Amb25328273 [1,1,0,0,0,0|2,0,0]=4 4793 B11R1.23 Nc1cccc([n]1)C(O)CN Amb24641584 [1,1,0,0,0,0|2,0,0]=4 4794 B11R1.23 Nc1cccc([n]1)[C@@H](N)CN Amb25131751 [1,1,0,0,0,0|2,0,0]=4 4795 B11R1.23 Nc1cccc([n]1)[C@H](N)CN Amb24460341 [1,1,0,0,0,0|2,0,0]=4 4796 B11R1.23 Nc1cccc(c1)C(N)CN Amb24744365 [1,1,0,0,0,0|1,0,0]=3 4797 B11R1.23 Nc1cccc(c1)C(N)CO Amb25843786 [1,1,0,0,0,0|2,0,0]=4 4798 B11R1.23 Nc1cccc(c1)C(O)CN Amb24106017 [1,1,0,0,0,0|1,0,0]=3 4799 B11R1.23 Nc1cccc(c1)[C@@H](N)CO Amb25064777 [1,1,0,0,0,0|2,0,0]=4 4800 B11R1.23 Nc1cccc(c1)[C@H](N)CN Amb25373857 [1,1,0,0,0,0|1,0,0]=3 4801 B11R1.23 Nc1cccc(c1)[C@H](N)CO Amb24710656 [1,1,0,0,0,0|2,0,0]=4 4802 B11R1.23 OC(CBr)c1cc(Br)ccc1 Amb24757789 [1,1,0,0,0,0|2,0,0]=4 4803 B11R1.23 OC(CBr)c1cccc(F)c1 Amb25737937 [1,1,0,0,0,0|2,0,0]=4 4804 B11R1.23 OC(CCl)c1cc(Cl)ccc1 Amb19888402 [1,1,0,0,0,0|2,0,0]=4 4805 B11R1.23 OC(CF)c1cccc(Cl)c1 Amb24457870 [1,1,0,0,0,0|2,0,0]=4 4806 B11R1.23 OCC(Cl)c1cc(Cl)ccc1 Amb19888392 [1,1,0,0,0,0|2,0,0]=4 4807 B11R1.23 OCC(F)c1cc(F)ccc1 Amb24055411 [1,1,0,0,0,0|2,0,0]=4 4808 B11R1.23 OCC(O)c1cccc(Br)c1 Amb24123027 [1,1,0,0,0,0|2,0,0]=4 4809 B11R1.23 OCC(O)c1cccc(Cl)c1 Amb24116517 [1,1,0,0,0,0|2,0,0]=4 4810 B11R1.23 OCC(O)c1cccc(F)c1 Amb24123033 [1,1,0,0,0,0|2,0,0]=4 4811 B11R1.23 OCC(c1cccc(c1)Br)N Amb17242180 [1,1,0,0,0,0|2,0,0]=4 4812 B11R1.23 OCC(c1cccc(c1)C)N Amb17232091 [1,1,0,0,0,0|2,0,0]=4 4813 B11R1.23 OCC(c1cccc(c1)Cl)N Amb17232853 [1,1,0,0,0,0|2,0,0]=4 4814 B11R1.23 OC[C@@H](F)c1cccc(Cl)c1 Amb25190307 [1,1,0,0,0,0|2,0,0]=4 4815 B11R1.23 OC[C@@H](O)c1cccc(Cl)c1 Amb22745596 [1,1,0,0,0,0|2,0,0]=4 4816 B11R1.23 OC[C@@H](O)c1cccc(F)c1 Amb24486691 [1,1,0,0,0,0|2,0,0]=4 4817 B11R1.23 OC[C@H](F)c1cccc(Cl)c1 Amb24661231 [1,1,0,0,0,0|2,0,0]=4 4818 B11R1.23 OC[C@H](O)c1cccc(Cl)c1 Amb25230571 [1,1,0,0,0,0|2,0,0]=4 4819 B11R1.23 ONC(c1cccc(c1)N)C Amb10606961 [1,1,0,0,0,0|1,0,0]=3 4820 B11R1.23 O[C@@H](CBr)c1cccc(Cl)c1 Amb25261630 [1,1,0,0,0,0|2,0,0]=4 4821 B11R1.23 O[C@@H](CBr)c1cccc(F)c1 Amb25058326 [1,1,0,0,0,0|2,0,0]=4 4822 B11R1.23 O[C@@H](CCl)c1cccc(Br)c1 Amb25151785 [1,1,0,0,0,0|2,0,0]=4 4823 B11R1.23 O[C@@H](CF)c1cc(F)ccc1 Amb25704260 [1,1,0,0,0,0|2,0,0]=4 4824 B11R1.23 O[C@@H](CF)c1cccc(Cl)c1 Amb24682035 [1,1,0,0,0,0|2,0,0]=4 4825 B11R1.23 O[C@H](CBr)c1cccc(Cl)c1 Amb24428258 [1,1,0,0,0,0|2,0,0]=4 4826 B11R1.23 O[C@H](CCl)c1cc(Cl)ccc1 Amb20241519 [1,1,0,0,0,0|2,0,0]=4 4827 B11R1.23 O[C@H](CCl)c1cccc(Br)c1 Amb25782368 [1,1,0,0,0,0|2,0,0]=4 4828 B11R1.23 O[C@H](CCl)c1cccc(F)c1 Amb24433202 [1,1,0,0,0,0|2,0,0]=4 4829 B11R1.23 O[C@H](CF)c1cc(F)ccc1 Amb24486716 [1,1,0,0,0,0|2,0,0]=4 4830 B11R1.23 Oc1cccc(c1)C(O)CCl Amb24433894 [1,1,0,0,0,0|2,0,0]=4 4831 B11R1.23 Oc1cccc(c1)C(O)CF Amb24501864 [1,1,0,0,0,0|2,0,0]=4 4832 B11R1.23 Oc1cccc(c1)C(O)CO Amb25087164 [1,1,0,0,0,0|2,0,0]=4 4833 B11R1.23 Oc1cccc(c1)[C@@H](O)CCl Amb24562223 [1,1,0,0,0,0|2,0,0]=4 4834 B11R1.23 Oc1cccc(c1)[C@H](O)CF Amb24486794 [1,1,0,0,0,0|2,0,0]=4 4835 B11R1.23 [C-]#[N+]C(c1cccc(c1)Cl)C Amb2235818 [1,1,0,0,0,0|0,0,2]=4 4836 B11R1.23 [NH3+]CC(c1cccc(c1)Cl)O Amb10553101 [1,1,0,0,0,0|1,0,1]=4 4837 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [1,1,0,0,0,0|1,0,1]=4 4838 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [1,1,0,0,0,0|1,0,1]=4 4839 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [1,1,0,0,0,0|1,0,1]=4 4840 B11R1.36 CC(=N)N(C)c1ccccc1 Amb24432936 [1,1,0,0,0,0|1,0,1]=4 4841 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,1,0,0,0,0|1,0,1]=4 4842 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [1,1,0,0,0,0|1,0,1]=4 4843 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [1,1,0,0,0,0|1,0,1]=4 4844 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,1,0,0,0,0|1,0,1]=4 4845 B11R1.36 CC(Br)C(=N)c1ccccc1 Amb25770551 [1,1,0,0,0,0|1,0,1]=4 4846 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [1,1,0,0,0,0|1,0,0]=3 4847 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [1,1,0,0,0,0|1,0,0]=3 4848 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [1,1,0,0,0,0|1,0,0]=3 4849 B11R1.36 CC(Br)C(O)c1cc[n]cc1 Amb25325014 [1,1,0,0,0,0|2,0,0]=4 4850 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [1,1,0,0,0,0|1,0,0]=3 4851 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [1,1,0,0,0,0|1,0,0]=3 4852 B11R1.36 CC(C(=O)c1ccccc1)F Amb10603603 [1,1,0,0,0,0|1,0,1]=4 4853 B11R1.36 CC(C(C)Br)c1c[n]c[n]c1 Amb25355525 [1,1,0,0,0,0|2,0,0]=4 4854 B11R1.36 CC(C(C)Br)c1c[n]ccc1 Amb24594038 [1,1,0,0,0,0|1,0,0]=3 4855 B11R1.36 CC(C(C)Br)c1cccc[n]1 Amb24585036 [1,1,0,0,0,0|1,0,0]=3 4856 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [1,1,0,0,0,0|0,0,0]=2 4857 B11R1.36 CC(C(C)Cl)c1c[n]ccc1 Amb24660277 [1,1,0,0,0,0|1,0,0]=3 4858 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [1,1,0,0,0,0|0,0,0]=2 4859 B11R1.36 CC(C(C)N)c1c[n]c[n]c1 Amb25303807 [1,1,0,0,0,0|2,0,0]=4 4860 B11R1.36 CC(C(C)N)c1c[n]cc[n]1 Amb25314844 [1,1,0,0,0,0|2,0,0]=4 4861 B11R1.36 CC(C(C)N)c1c[n]ccc1 Amb18201853 [1,1,0,0,0,0|1,0,0]=3 4862 B11R1.36 CC(C(C)N)c1cc[n]cc1 Amb18201858 [1,1,0,0,0,0|1,0,0]=3 4863 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [1,1,0,0,0,0|0,0,0]=2 4864 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [1,1,0,0,0,0|0,0,0]=2 4865 B11R1.36 CC(C(C)O)c1c[n]cc[n]1 Amb24352493 [1,1,0,0,0,0|2,0,0]=4 4866 B11R1.36 CC(C(Cl)Cl)c1ccccc1 Amb24390914 [1,1,0,0,0,0|1,0,0]=3 4867 B11R1.36 CC(C(F)F)c1ccccc1 Amb20669786 [1,1,0,0,0,0|1,0,0]=3 4868 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [1,1,0,0,0,0|0,0,1]=3 4869 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [1,1,0,0,0,0|1,0,1]=4 4870 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,1,0,0,0,0|0,0,1]=3 4871 B11R1.36 CC(C(N)=S)c1cccc[n]1 Amb22397083 [1,1,0,0,0,0|1,0,1]=4 4872 B11R1.36 CC(C(c1ccccn1)C)C Amb10573727 [1,1,0,0,0,0|1,0,0]=3 4873 B11R1.36 CC(C(c1ccccn1)N)C Amb10607919 [1,1,0,0,0,0|2,0,0]=4 4874 B11R1.36 CC(C(c1ccccn1)N)C Amb13949179 [1,1,0,0,0,0|2,0,0]=4 4875 B11R1.36 CC(C(c1ccccn1)O)C Amb13952167 [1,1,0,0,0,0|2,0,0]=4 4876 B11R1.36 CC(C(c1cccnc1)N)C Amb10607960 [1,1,0,0,0,0|2,0,0]=4 4877 B11R1.36 CC(C(c1cccnc1)N)C Amb13949194 [1,1,0,0,0,0|2,0,0]=4 4878 B11R1.36 CC(C(c1cccnc1)N)O Amb17232102 [1,1,0,0,0,0|2,0,0]=4 4879 B11R1.36 CC(C)C(Br)c1cccc[n]1 Amb24359282 [1,1,0,0,0,0|2,0,0]=4 4880 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,1,0,0,0,0|1,0,0]=3 4881 B11R1.36 CC(C)C(Cl)c1cccc[n]1 Amb25028120 [1,1,0,0,0,0|2,0,0]=4 4882 B11R1.36 CC(C)C(F)c1cc[n]cc1 Amb24102662 [1,1,0,0,0,0|2,0,0]=4 4883 B11R1.36 CC(C)C(N)c1cc[n]cc1 Amb18949710 [1,1,0,0,0,0|2,0,0]=4 4884 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,1,0,0,0,0|1,0,0]=3 4885 B11R1.36 CC(C)C(O)c1cc[n]cc1 Amb18179396 [1,1,0,0,0,0|2,0,0]=4 4886 B11R1.36 CC(C)C(O)c1ccc[n]c1 Amb18179395 [1,1,0,0,0,0|2,0,0]=4 4887 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,1,0,0,0,0|1,0,0]=3 4888 B11R1.36 CC(C)N(C)c1ccccc1 Amb24096678 [1,1,0,0,0,0|1,0,0]=3 4889 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,1,0,0,0,0|2,0,0]=4 4890 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,1,0,0,0,0|2,0,0]=4 4891 B11R1.36 CC(C)[C@@H](N)c1ccc[n]c1 Amb24538246 [1,1,0,0,0,0|2,0,0]=4 4892 B11R1.36 CC(C)[C@@H](N)c1cccc[n]1 Amb24725608 [1,1,0,0,0,0|2,0,0]=4 4893 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,1,0,0,0,0|1,0,0]=3 4894 B11R1.36 CC(C)[C@@H](O)c1ccc[n]c1 Amb25149641 [1,1,0,0,0,0|2,0,0]=4 4895 B11R1.36 CC(C)[C@@H](O)c1cccc[n]1 Amb24412454 [1,1,0,0,0,0|2,0,0]=4 4896 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,1,0,0,0,0|1,0,0]=3 4897 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [1,1,0,0,0,0|1,0,0]=3 4898 B11R1.36 CC(C)[C@H](N)c1ccc[n]c1 Amb24432837 [1,1,0,0,0,0|2,0,0]=4 4899 B11R1.36 CC(C)[C@H](N)c1cccc[n]1 Amb25719548 [1,1,0,0,0,0|2,0,0]=4 4900 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,1,0,0,0,0|1,0,0]=3 4901 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,1,0,0,0,0|1,0,0]=3 4902 B11R1.36 CC(C)[C@H](O)c1ccc[n]c1 Amb25698303 [1,1,0,0,0,0|2,0,0]=4 4903 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [1,1,0,0,0,0|1,0,0]=3 4904 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [1,1,0,0,0,0|1,0,0]=3 4905 B11R1.36 CC(Cl)S(=O)c1ccccc1 Amb25273905 [1,1,0,0,0,0|2,0,0]=4 4906 B11R1.36 CC(N)C(=C)c1ccccc1 Amb23536391 [1,1,0,0,0,0|0,0,2]=4 4907 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [1,1,0,0,0,0|1,0,0]=3 4908 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [1,1,0,0,0,0|1,0,0]=3 4909 B11R1.36 CC(N)C(N)c1cccc[n]1 Amb24670557 [1,1,0,0,0,0|2,0,0]=4 4910 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,1,0,0,0,0|1,0,0]=3 4911 B11R1.36 CC(N)C(O)c1cc[n]cc1 Amb19373096 [1,1,0,0,0,0|2,0,0]=4 4912 B11R1.36 CC(O)C(=C)c1ccccc1 Amb25226435 [1,1,0,0,0,0|0,0,2]=4 4913 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,1,0,0,0,0|1,0,1]=4 4914 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [1,1,0,0,0,0|1,0,0]=3 4915 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [1,1,0,0,0,0|1,0,0]=3 4916 B11R1.36 CC(O)C(O)c1c[n]ccc1 Amb24643547 [1,1,0,0,0,0|2,0,0]=4 4917 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [1,1,0,0,0,0|1,0,0]=3 4918 B11R1.36 CC(O)[C@@H](N)c1ccc[n]c1 Amb24659692 [1,1,0,0,0,0|2,0,0]=4 4919 B11R1.36 CC(O)[C@@H](N)c1cccc[n]1 Amb24470743 [1,1,0,0,0,0|2,0,0]=4 4920 B11R1.36 CC(O)[C@H](N)c1cc[n]cc1 Amb25126570 [1,1,0,0,0,0|2,0,0]=4 4921 B11R1.36 CC(O)[C@H](N)c1cccc[n]1 Amb24486964 [1,1,0,0,0,0|2,0,0]=4 4922 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [1,1,0,0,0,0|1,0,0]=3 4923 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,1,0,0,0,0|1,0,1]=4 4924 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [1,1,0,0,0,0|0,0,1]=3 4925 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [1,1,0,0,0,0|0,0,1]=3 4926 B11R1.36 CN(C(=N)c1ccccc1)N Amb10870953 [1,1,0,0,0,0|1,0,1]=4 4927 B11R1.36 CN(C(N)=N)c1ccccc1 Amb19148904 [1,1,0,0,0,0|1,0,1]=4 4928 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,1,0,0,0,0|1,0,1]=4 4929 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [1,1,0,0,0,0|1,0,0]=3 4930 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [1,1,0,0,0,0|1,0,0]=3 4931 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [1,1,0,0,0,0|1,0,0]=3 4932 B11R1.36 CN(C)P(Cl)c1ccccc1 Amb25308341 [1,1,0,0,0,0|2,0,0]=4 4933 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,1,0,0,0,0|1,0,1]=4 4934 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [1,1,0,0,0,0|1,0,1]=4 4935 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [1,1,0,0,0,0|1,0,1]=4 4936 B11R1.36 CN(c1ccccc1)C(=S)N Amb1132381 [1,1,0,0,0,0|1,0,1]=4 4937 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [1,1,0,0,0,0|2,0,0]=4 4938 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [1,1,0,0,0,0|2,0,0]=4 4939 B11R1.36 C[C@@H](C(=O)c1ccccc1)N Amb17610655 [1,1,0,0,0,0|1,0,1]=4 4940 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [1,1,0,0,0,0|0,0,0]=2 4941 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [1,1,0,0,0,0|0,0,1]=3 4942 B11R1.36 C[C@@H](Cl)C(=O)c1ccccc1 Amb24068213 [1,1,0,0,0,0|1,0,1]=4 4943 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [1,1,0,0,0,0|1,0,0]=3 4944 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [1,1,0,0,0,0|1,0,0]=3 4945 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [1,1,0,0,0,0|1,0,0]=3 4946 B11R1.36 C[C@@H](F)C(=O)c1ccccc1 Amb24068215 [1,1,0,0,0,0|1,0,1]=4 4947 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [1,1,0,0,0,0|1,0,0]=3 4948 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb19131140 [1,1,0,0,0,0|1,0,1]=4 4949 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,1,0,0,0,0|1,0,1]=4 4950 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [1,1,0,0,0,0|1,0,0]=3 4951 B11R1.36 C[C@@H](N)[C@H](O)c1ccc[n]c1 Amb24542154 [1,1,0,0,0,0|2,0,0]=4 4952 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [1,1,0,0,0,0|1,0,0]=3 4953 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [1,1,0,0,0,0|1,0,0]=3 4954 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [1,1,0,0,0,0|1,0,0]=3 4955 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [1,1,0,0,0,0|1,0,0]=3 4956 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [1,1,0,0,0,0|1,0,0]=3 4957 B11R1.36 C[C@@H](O)[C@H](N)c1cc[n]cc1 Amb24665797 [1,1,0,0,0,0|2,0,0]=4 4958 B11R1.36 C[C@@H](O)[C@H](N)c1cccc[n]1 Amb25794058 [1,1,0,0,0,0|2,0,0]=4 4959 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [1,1,0,0,0,0|1,0,0]=3 4960 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [1,1,0,0,0,0|1,0,0]=3 4961 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [1,1,0,0,0,0|0,0,0]=2 4962 B11R1.36 C[C@@H](c1cccc[n]1)N(C)C Amb25858370 [1,1,0,0,0,0|1,0,0]=3 4963 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [1,1,0,0,0,0|0,0,0]=2 4964 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [1,1,0,0,0,0|0,0,0]=2 4965 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,1,0,0,0,0|1,0,1]=4 4966 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [1,1,0,0,0,0|1,0,0]=3 4967 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [1,1,0,0,0,0|1,0,0]=3 4968 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [1,1,0,0,0,0|1,0,0]=3 4969 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [1,1,0,0,0,0|0,0,0]=2 4970 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [1,1,0,0,0,0|0,0,0]=2 4971 B11R1.36 C[C@H](Cl)C(=O)c1ccccc1 Amb24068277 [1,1,0,0,0,0|1,0,1]=4 4972 B11R1.36 C[C@H](Cl)S(=O)c1ccccc1 Amb25111210 [1,1,0,0,0,0|2,0,0]=4 4973 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [1,1,0,0,0,0|1,0,0]=3 4974 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [1,1,0,0,0,0|1,0,0]=3 4975 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [1,1,0,0,0,0|1,0,0]=3 4976 B11R1.36 C[C@H](N)C(=O)c1ccccc1 Amb25853969 [1,1,0,0,0,0|1,0,1]=4 4977 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [1,1,0,0,0,0|1,0,0]=3 4978 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [1,1,0,0,0,0|1,0,0]=3 4979 B11R1.36 C[C@H](N)[C@@H](N)c1cccc[n]1 Amb24711884 [1,1,0,0,0,0|2,0,0]=4 4980 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [1,1,0,0,0,0|1,0,0]=3 4981 B11R1.36 C[C@H](N)[C@@H](O)c1cc[n]cc1 Amb25211095 [1,1,0,0,0,0|2,0,0]=4 4982 B11R1.36 C[C@H](N)[C@@H](O)c1ccc[n]c1 Amb24710764 [1,1,0,0,0,0|2,0,0]=4 4983 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [1,1,0,0,0,0|1,0,0]=3 4984 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [1,1,0,0,0,0|1,0,0]=3 4985 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [1,1,0,0,0,0|1,0,0]=3 4986 B11R1.36 C[C@H](O)C(=C)c1ccccc1 Amb25188700 [1,1,0,0,0,0|0,0,2]=4 4987 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [1,1,0,0,0,0|1,0,1]=4 4988 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [1,1,0,0,0,0|1,0,0]=3 4989 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [1,1,0,0,0,0|1,0,0]=3 4990 B11R1.36 C[C@H](O)[C@@H](N)c1cc[n]cc1 Amb24485782 [1,1,0,0,0,0|2,0,0]=4 4991 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,1,0,0,0,0|1,0,0]=3 4992 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [1,1,0,0,0,0|1,0,0]=3 4993 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [1,1,0,0,0,0|1,0,0]=3 4994 B11R1.36 C[C@H](O)[C@H](N)c1ccc[n]c1 Amb24654822 [1,1,0,0,0,0|2,0,0]=4 4995 B11R1.36 C[C@H](O)[C@H](N)c1cccc[n]1 Amb25189265 [1,1,0,0,0,0|2,0,0]=4 4996 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,1,0,0,0,0|1,0,0]=3 4997 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [1,1,0,0,0,0|0,0,0]=2 4998 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [1,1,0,0,0,0|0,0,2]=4 4999 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [1,1,0,0,0,0|2,0,0]=4 5000 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [1,1,0,0,0,0|1,0,1]=4 5001 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [1,1,0,0,0,0|1,0,0]=3 5002 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [1,1,0,0,0,0|1,0,0]=3 5003 B11R1.36 FC(C(Cl)Cl)c1ccccc1 Amb25362359 [1,1,0,0,0,0|2,0,0]=4 5004 B11R1.36 FC(Cl)C(Cl)c1ccccc1 Amb24470147 [1,1,0,0,0,0|2,0,0]=4 5005 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [1,1,0,0,0,0|2,0,0]=4 5006 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [1,1,0,0,0,0|2,0,0]=4 5007 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [1,1,0,0,0,0|1,0,1]=4 5008 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [1,1,0,0,0,0|1,0,1]=4 5009 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [1,1,0,0,0,0|1,0,1]=4 5010 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [1,1,0,0,0,0|1,0,1]=4 5011 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,1,0,0,0,0|1,0,1]=4 5012 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [1,1,0,0,0,0|1,0,1]=4 5013 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [1,1,0,0,0,0|1,0,1]=4 5014 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,1,0,0,0,0|1,0,1]=4 5015 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,1,0,0,0,0|1,0,1]=4 5016 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [1,1,0,0,0,0|1,0,1]=4 5017 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [1,1,0,0,0,0|1,0,1]=4 5018 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,1,0,0,0,0|1,0,1]=4 5019 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,1,0,0,0,0|1,0,1]=4 5020 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [1,1,0,0,0,0|1,0,1]=4 5021 B11R1.36 NC(C(Cl)Cl)c1ccccc1 Amb25299414 [1,1,0,0,0,0|2,0,0]=4 5022 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [1,1,0,0,0,0|1,0,1]=4 5023 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [1,1,0,0,0,0|1,0,0]=3 5024 B11R1.36 NC(c1ccncc1)C(N)C Amb13953208 [1,1,0,0,0,0|2,0,0]=4 5025 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [1,1,0,0,0,0|1,0,1]=4 5026 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [1,1,0,0,0,0|1,0,0]=3 5027 B11R1.36 N[C@H](C(F)F)c1ccccc1 Amb24485821 [1,1,0,0,0,0|2,0,0]=4 5028 B11R1.36 OC(C(F)Cl)c1ccccc1 Amb24509297 [1,1,0,0,0,0|2,0,0]=4 5029 B11R1.36 OC(C(F)F)c1ccccc1 Amb19895457 [1,1,0,0,0,0|2,0,0]=4 5030 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [1,1,0,0,0,0|1,0,1]=4 5031 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [1,1,0,0,0,0|1,0,1]=4 5032 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [1,1,0,0,0,0|1,0,0]=3 5033 B11R1.36 O[C@@H](C(F)Cl)c1ccccc1 Amb25028097 [1,1,0,0,0,0|2,0,0]=4 5034 B11R1.36 O[C@@H]([C@H](F)Cl)c1ccccc1 Amb24390849 [1,1,0,0,0,0|2,0,0]=4 5035 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [1,1,0,0,0,0|1,0,1]=4 5036 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [1,1,0,0,0,0|1,0,0]=3 5037 B11R1.36 O[C@H](C(F)Cl)c1ccccc1 Amb24487906 [1,1,0,0,0,0|2,0,0]=4 5038 B11R1.36 O[C@H](C(F)F)c1ccccc1 Amb24623094 [1,1,0,0,0,0|2,0,0]=4 5039 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [1,1,0,0,0,0|1,0,0]=3 5040 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [1,1,0,0,0,0|1,0,1]=4 5041 B11R1.222 BrC[C@@H](c1ccccc1F)O Amb16233246 [1,1,0,0,0,0|2,0,0]=4 5042 B11R1.222 CC(C#N)c1ccccc1Br Amb18131118 [1,1,0,0,0,0|0,0,2]=4 5043 B11R1.222 CC(C#N)c1ccccc1Cl Amb18126434 [1,1,0,0,0,0|0,0,2]=4 5044 B11R1.222 CC(C#N)c1ccccc1I Amb24683473 [1,1,0,0,0,0|0,0,2]=4 5045 B11R1.222 CC(C#N)c1ccccc1N Amb25368325 [1,1,0,0,0,0|0,0,2]=4 5046 B11R1.222 CC(C#N)c1ccccc1O Amb25718410 [1,1,0,0,0,0|0,0,2]=4 5047 B11R1.222 CC(C=C)c1ccccc1N Amb18124835 [1,1,0,0,0,0|0,0,2]=4 5048 B11R1.222 CC(C=C)c1ccccc1O Amb18124915 [1,1,0,0,0,0|0,0,2]=4 5049 B11R1.222 CC(C=O)c1ccccc1Br Amb25103832 [1,1,0,0,0,0|1,0,1]=4 5050 B11R1.222 CC(C=O)c1ccccc1F Amb24070131 [1,1,0,0,0,0|1,0,1]=4 5051 B11R1.222 CC(C=O)c1ccccc1O Amb18125106 [1,1,0,0,0,0|1,0,1]=4 5052 B11R1.222 CC(CBr)c1ccccc1Cl Amb25148944 [1,1,0,0,0,0|1,0,0]=3 5053 B11R1.222 CC(CC)c1[n]c[n]cc1N Amb25092831 [1,1,0,0,0,0|2,0,0]=4 5054 B11R1.222 CC(CC)c1[n]c[n]cc1O Amb25354929 [1,1,0,0,0,0|2,0,0]=4 5055 B11R1.222 CC(CC)c1[n]cc[n]c1N Amb25820661 [1,1,0,0,0,0|2,0,0]=4 5056 B11R1.222 CC(CCl)c1ccccc1Br Amb25055326 [1,1,0,0,0,0|1,0,0]=3 5057 B11R1.222 CC(CCl)c1ccccc1F Amb25098050 [1,1,0,0,0,0|1,0,0]=3 5058 B11R1.222 CC(CN)N1C=CC=CC1=O Amb18542686 [1,1,0,0,0,0|1,0,0]=3 5059 B11R1.222 CC(CN)c1[n]c[n]cc1O Amb25786514 [1,1,0,0,0,0|2,0,0]=4 5060 B11R1.222 CC(CN)c1[n]cccc1Br Amb24486134 [1,1,0,0,0,0|1,0,0]=3 5061 B11R1.222 CC(CN)c1cc[n]cc1F Amb25677090 [1,1,0,0,0,0|1,0,0]=3 5062 B11R1.222 CC(CN)c1ccccc1Br Amb18174811 [1,1,0,0,0,0|0,0,0]=2 5063 B11R1.222 CC(CN)c1ccccc1I Amb24558935 [1,1,0,0,0,0|0,0,0]=2 5064 B11R1.222 CC(CN)c1ccccc1N Amb24069931 [1,1,0,0,0,0|0,0,0]=2 5065 B11R1.222 CC(CN)c1ccccc1O Amb25100841 [1,1,0,0,0,0|0,0,0]=2 5066 B11R1.222 CC(CO)c1[n]cccc1Cl Amb24383834 [1,1,0,0,0,0|2,0,0]=4 5067 B11R1.222 CC(CO)c1ccccc1Br Amb24453441 [1,1,0,0,0,0|1,0,0]=3 5068 B11R1.222 CC(CO)c1ccccc1I Amb25140003 [1,1,0,0,0,0|1,0,0]=3 5069 B11R1.222 CC(NN)c1[n]cccc1Br Amb24741357 [1,1,0,0,0,0|2,0,0]=4 5070 B11R1.222 CC(NN)c1[n]cccc1Cl Amb25190529 [1,1,0,0,0,0|2,0,0]=4 5071 B11R1.222 CC(NN)c1cc[n]cc1Br Amb25216749 [1,1,0,0,0,0|2,0,0]=4 5072 B11R1.222 CC(NN)c1ccc[n]c1Cl Amb25843836 [1,1,0,0,0,0|2,0,0]=4 5073 B11R1.222 CC(NN)c1ccccc1N Amb25235230 [1,1,0,0,0,0|1,0,0]=3 5074 B11R1.222 CC(NO)c1ccccc1Br Amb25354525 [1,1,0,0,0,0|1,0,0]=3 5075 B11R1.222 CC(NO)c1ccccc1Cl Amb25782559 [1,1,0,0,0,0|1,0,0]=3 5076 B11R1.222 CC(NO)c1ccccc1O Amb25728343 [1,1,0,0,0,0|1,0,0]=3 5077 B11R1.222 CC(c1ncc[nH]c1=O)CC Amb16192433 [1,1,0,0,0,0|2,0,0]=4 5078 B11R1.222 CCC(=C)c1ccccc1N Amb24069947 [1,1,0,0,0,0|0,0,2]=4 5079 B11R1.222 CCC(=C)c1ccccc1O Amb25718309 [1,1,0,0,0,0|0,0,2]=4 5080 B11R1.222 CCC(=O)c1ccccc1Br Amb17339933 [1,1,0,0,0,0|1,0,1]=4 5081 B11R1.222 CCC(=O)c1ccccc1C Amb16185657 [1,1,0,0,0,0|1,0,1]=4 5082 B11R1.222 CCC(=O)c1ccccc1Cl Amb17198735 [1,1,0,0,0,0|1,0,1]=4 5083 B11R1.222 CCC(=O)c1ccccc1N Amb1772753 [1,1,0,0,0,0|1,0,1]=4 5084 B11R1.222 CCC(=O)c1ccccc1O Amb1210123 [1,1,0,0,0,0|1,0,1]=4 5085 B11R1.222 CCC(Br)c1ccccc1Br Amb25797706 [1,1,0,0,0,0|1,0,0]=3 5086 B11R1.222 CCC(C)c1[n]cccc1Br Amb24320822 [1,1,0,0,0,0|1,0,0]=3 5087 B11R1.222 CCC(C)c1[n]cccc1N Amb18201845 [1,1,0,0,0,0|1,0,0]=3 5088 B11R1.222 CCC(C)c1c[n]ccc1Br Amb24320591 [1,1,0,0,0,0|1,0,0]=3 5089 B11R1.222 CCC(C)c1c[n]ccc1N Amb24320593 [1,1,0,0,0,0|1,0,0]=3 5090 B11R1.222 CCC(C)c1cc[n]cc1Br Amb24321010 [1,1,0,0,0,0|1,0,0]=3 5091 B11R1.222 CCC(C)c1cc[n]cc1N Amb18831281 [1,1,0,0,0,0|1,0,0]=3 5092 B11R1.222 CCC(C)c1ccc[n]c1Br Amb24319292 [1,1,0,0,0,0|1,0,0]=3 5093 B11R1.222 CCC(C)c1ccc[n]c1Cl Amb24319293 [1,1,0,0,0,0|1,0,0]=3 5094 B11R1.222 CCC(C)c1ccc[n]c1N Amb18201848 [1,1,0,0,0,0|1,0,0]=3 5095 B11R1.222 CCC(C)c1ccc[n]c1O Amb24319294 [1,1,0,0,0,0|1,0,0]=3 5096 B11R1.222 CCC(C)c1ccccc1Br Amb20617128 [1,1,0,0,0,0|0,0,0]=2 5097 B11R1.222 CCC(C)c1ccccc1I Amb24564175 [1,1,0,0,0,0|0,0,0]=2 5098 B11R1.222 CCC(Cl)c1cc[n]cc1F Amb25853095 [1,1,0,0,0,0|2,0,0]=4 5099 B11R1.222 CCC(Cl)c1ccccc1Br Amb25028217 [1,1,0,0,0,0|1,0,0]=3 5100 B11R1.222 CCC(Cl)c1ccccc1F Amb24440580 [1,1,0,0,0,0|1,0,0]=3 5101 B11R1.222 CCC(N)c1[n]cccc1Cl Amb25117950 [1,1,0,0,0,0|2,0,0]=4 5102 B11R1.222 CCC(N)c1[n]cccc1F Amb24504921 [1,1,0,0,0,0|2,0,0]=4 5103 B11R1.222 CCC(N)c1[n]cccc1N Amb25063614 [1,1,0,0,0,0|2,0,0]=4 5104 B11R1.222 CCC(N)c1c[n]ccc1Cl Amb24654783 [1,1,0,0,0,0|2,0,0]=4 5105 B11R1.222 CCC(N)c1c[n]ccc1N Amb25756428 [1,1,0,0,0,0|2,0,0]=4 5106 B11R1.222 CCC(N)c1c[n]ccc1O Amb24443815 [1,1,0,0,0,0|2,0,0]=4 5107 B11R1.222 CCC(N)c1cc[n]cc1Cl Amb18198738 [1,1,0,0,0,0|2,0,0]=4 5108 B11R1.222 CCC(N)c1ccc[n]c1F Amb18831021 [1,1,0,0,0,0|2,0,0]=4 5109 B11R1.222 CCC(N)c1ccc[n]c1N Amb24513605 [1,1,0,0,0,0|2,0,0]=4 5110 B11R1.222 CCC(N)c1ccc[n]c1O Amb25185157 [1,1,0,0,0,0|2,0,0]=4 5111 B11R1.222 CCC(N)c1ccc[n]c1S Amb25269926 [1,1,0,0,0,0|2,0,0]=4 5112 B11R1.222 CCC(N)c1ccccc1Br Amb18966096 [1,1,0,0,0,0|1,0,0]=3 5113 B11R1.222 CCC(N)c1ccccc1Cl Amb22276945 [1,1,0,0,0,0|1,0,0]=3 5114 B11R1.222 CCC(N)c1ccccc1N Amb24069932 [1,1,0,0,0,0|1,0,0]=3 5115 B11R1.222 CCC(N)c1ccccc1O Amb19404313 [1,1,0,0,0,0|1,0,0]=3 5116 B11R1.222 CCC(N)c1ccccc1S Amb25225261 [1,1,0,0,0,0|1,0,0]=3 5117 B11R1.222 CCC(O)C1=CC=CNC1=O Amb24487663 [1,1,0,0,0,0|2,0,0]=4 5118 B11R1.222 CCC(O)c1c[n]ccc1Cl Amb25309239 [1,1,0,0,0,0|2,0,0]=4 5119 B11R1.222 CCC(O)c1c[n]ccc1N Amb24436920 [1,1,0,0,0,0|2,0,0]=4 5120 B11R1.222 CCC(O)c1cc[n]cc1Br Amb25216767 [1,1,0,0,0,0|2,0,0]=4 5121 B11R1.222 CCC(O)c1cc[n]cc1Cl Amb24641286 [1,1,0,0,0,0|2,0,0]=4 5122 B11R1.222 CCC(O)c1ccc[n]c1F Amb24575174 [1,1,0,0,0,0|2,0,0]=4 5123 B11R1.222 CCC(O)c1ccccc1I Amb25214528 [1,1,0,0,0,0|1,0,0]=3 5124 B11R1.222 CCC(O)c1ccccc1N Amb18125284 [1,1,0,0,0,0|1,0,0]=3 5125 B11R1.222 CCC(c1ccccc1C)N Amb17232057 [1,1,0,0,0,0|1,0,0]=3 5126 B11R1.222 CCC(c1ccccc1C)O Amb17232069 [1,1,0,0,0,0|1,0,0]=3 5127 B11R1.222 CCC(c1ccccc1Cl)N Amb17232736 [1,1,0,0,0,0|1,0,0]=3 5128 B11R1.222 CCC(c1ccccc1Cl)O Amb17232794 [1,1,0,0,0,0|1,0,0]=3 5129 B11R1.222 CCC(c1ccccc1F)N Amb10840595 [1,1,0,0,0,0|1,0,0]=3 5130 B11R1.222 CCC(c1ccccc1O)N Amb1118100 [1,1,0,0,0,0|1,0,0]=3 5131 B11R1.222 CCC(c1ccccc1O)O Amb1111067 [1,1,0,0,0,0|1,0,0]=3 5132 B11R1.222 CCC(c1ncccc1C)N Amb10608013 [1,1,0,0,0,0|2,0,0]=4 5133 B11R1.222 CCC(c1ncncc1Br)C Amb10068153 [1,1,0,0,0,0|2,0,0]=4 5134 B11R1.222 CCS(=O)c1ccccc1Br Amb24502060 [1,1,0,0,0,0|2,0,0]=4 5135 B11R1.222 CCS(=O)c1ccccc1F Amb25312077 [1,1,0,0,0,0|2,0,0]=4 5136 B11R1.222 CCS(=O)c1ccccc1N Amb18955435 [1,1,0,0,0,0|2,0,0]=4 5137 B11R1.222 CC[C@@H](C)c1ccccc1N Amb24101983 [1,1,0,0,0,0|0,0,0]=2 5138 B11R1.222 CC[C@@H](N)c1[n]cccc1Cl Amb24538255 [1,1,0,0,0,0|2,0,0]=4 5139 B11R1.222 CC[C@@H](N)c1[n]cccc1F Amb25062557 [1,1,0,0,0,0|2,0,0]=4 5140 B11R1.222 CC[C@@H](N)c1[n]cccc1N Amb25280469 [1,1,0,0,0,0|2,0,0]=4 5141 B11R1.222 CC[C@@H](N)c1[n]cccc1O Amb25145710 [1,1,0,0,0,0|2,0,0]=4 5142 B11R1.222 CC[C@@H](N)c1c[n]ccc1Cl Amb24376705 [1,1,0,0,0,0|2,0,0]=4 5143 B11R1.222 CC[C@@H](N)c1c[n]ccc1O Amb25073906 [1,1,0,0,0,0|2,0,0]=4 5144 B11R1.222 CC[C@@H](N)c1cc[n]cc1Br Amb25074121 [1,1,0,0,0,0|2,0,0]=4 5145 B11R1.222 CC[C@@H](N)c1cc[n]cc1Cl Amb25679364 [1,1,0,0,0,0|2,0,0]=4 5146 B11R1.222 CC[C@@H](N)c1cc[n]cc1F Amb25068448 [1,1,0,0,0,0|2,0,0]=4 5147 B11R1.222 CC[C@@H](N)c1cc[n]cc1N Amb25152738 [1,1,0,0,0,0|2,0,0]=4 5148 B11R1.222 CC[C@@H](N)c1cc[n]cc1O Amb25361981 [1,1,0,0,0,0|2,0,0]=4 5149 B11R1.222 CC[C@@H](N)c1ccc[n]c1O Amb24455838 [1,1,0,0,0,0|2,0,0]=4 5150 B11R1.222 CC[C@@H](N)c1ccccc1Br Amb25095650 [1,1,0,0,0,0|1,0,0]=3 5151 B11R1.222 CC[C@@H](N)c1ccccc1Cl Amb22298516 [1,1,0,0,0,0|1,0,0]=3 5152 B11R1.222 CC[C@@H](N)c1ccccc1F Amb22288620 [1,1,0,0,0,0|1,0,0]=3 5153 B11R1.222 CC[C@@H](N)c1ccccc1I Amb24383024 [1,1,0,0,0,0|1,0,0]=3 5154 B11R1.222 CC[C@@H](N)c1ccccc1O Amb24477566 [1,1,0,0,0,0|1,0,0]=3 5155 B11R1.222 CC[C@@H](N)c1ccccc1S Amb24726023 [1,1,0,0,0,0|1,0,0]=3 5156 B11R1.222 CC[C@@H](O)c1cc[n]cc1Cl Amb24677958 [1,1,0,0,0,0|2,0,0]=4 5157 B11R1.222 CC[C@@H](O)c1ccc[n]c1F Amb25709223 [1,1,0,0,0,0|2,0,0]=4 5158 B11R1.222 CC[C@@H](O)c1ccccc1F Amb25719414 [1,1,0,0,0,0|1,0,0]=3 5159 B11R1.222 CC[C@@H](O)c1ccccc1O Amb24477561 [1,1,0,0,0,0|1,0,0]=3 5160 B11R1.222 CC[C@H](N)c1[n]cccc1Br Amb24399824 [1,1,0,0,0,0|2,0,0]=4 5161 B11R1.222 CC[C@H](N)c1[n]cccc1F Amb24487789 [1,1,0,0,0,0|2,0,0]=4 5162 B11R1.222 CC[C@H](N)c1[n]cccc1N Amb24415266 [1,1,0,0,0,0|2,0,0]=4 5163 B11R1.222 CC[C@H](N)c1c[n]ccc1Br Amb25123788 [1,1,0,0,0,0|2,0,0]=4 5164 B11R1.222 CC[C@H](N)c1c[n]ccc1Cl Amb25809398 [1,1,0,0,0,0|2,0,0]=4 5165 B11R1.222 CC[C@H](N)c1ccc[n]c1Cl Amb25103382 [1,1,0,0,0,0|2,0,0]=4 5166 B11R1.222 CC[C@H](N)c1ccc[n]c1F Amb24538107 [1,1,0,0,0,0|2,0,0]=4 5167 B11R1.222 CC[C@H](N)c1ccc[n]c1N Amb24568217 [1,1,0,0,0,0|2,0,0]=4 5168 B11R1.222 CC[C@H](N)c1ccccc1Br Amb25149042 [1,1,0,0,0,0|1,0,0]=3 5169 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb22298557 [1,1,0,0,0,0|1,0,0]=3 5170 B11R1.222 CC[C@H](N)c1ccccc1Cl Amb24616798 [1,1,0,0,0,0|1,0,0]=3 5171 B11R1.222 CC[C@H](N)c1ccccc1F Amb22288682 [1,1,0,0,0,0|1,0,0]=3 5172 B11R1.222 CC[C@H](O)c1[n]cccc1F Amb25070354 [1,1,0,0,0,0|2,0,0]=4 5173 B11R1.222 CC[C@H](O)c1c[n]ccc1Cl Amb24439982 [1,1,0,0,0,0|2,0,0]=4 5174 B11R1.222 CC[C@H](O)c1cc[n]cc1Cl Amb24557957 [1,1,0,0,0,0|2,0,0]=4 5175 B11R1.222 CC[C@H](O)c1ccc[n]c1F Amb24538116 [1,1,0,0,0,0|2,0,0]=4 5176 B11R1.222 CC[C@H](O)c1ccc[n]c1N Amb25757895 [1,1,0,0,0,0|2,0,0]=4 5177 B11R1.222 CC[C@H](O)c1ccccc1Br Amb24447235 [1,1,0,0,0,0|1,0,0]=3 5178 B11R1.222 CC[C@H](O)c1ccccc1Cl Amb25188608 [1,1,0,0,0,0|1,0,0]=3 5179 B11R1.222 CN(CC)c1[n]cccc1Br Amb24320854 [1,1,0,0,0,0|2,0,0]=4 5180 B11R1.222 CN(CC)c1c[n]ccc1Br Amb24320902 [1,1,0,0,0,0|2,0,0]=4 5181 B11R1.222 CN(CC)c1c[n]ccc1N Amb24320958 [1,1,0,0,0,0|2,0,0]=4 5182 B11R1.222 CN(CC)c1cc[n]cc1Br Amb24321027 [1,1,0,0,0,0|2,0,0]=4 5183 B11R1.222 CN(CC)c1ccc[n]c1Br Amb24321076 [1,1,0,0,0,0|2,0,0]=4 5184 B11R1.222 CN(CC)c1ccc[n]c1N Amb24321078 [1,1,0,0,0,0|2,0,0]=4 5185 B11R1.222 CN(CC)c1ccccc1I Amb25226039 [1,1,0,0,0,0|1,0,0]=3 5186 B11R1.222 CN(CC)c1ccccc1O Amb24079727 [1,1,0,0,0,0|1,0,0]=3 5187 B11R1.222 CNC(=N)c1ccccc1Br Amb24458040 [1,1,0,0,0,0|1,0,1]=4 5188 B11R1.222 CNC(=N)c1ccccc1Cl Amb24509222 [1,1,0,0,0,0|1,0,1]=4 5189 B11R1.222 CNC(=N)c1ccccc1S Amb25805303 [1,1,0,0,0,0|1,0,1]=4 5190 B11R1.222 CNC(=O)c1ccccc1F Amb1648925 [1,1,0,0,0,0|1,0,1]=4 5191 B11R1.222 CNC(=S)c1ccccc1Cl Amb22484599 [1,1,0,0,0,0|1,0,1]=4 5192 B11R1.222 CNC(C)c1[n]cccc1Cl Amb25108235 [1,1,0,0,0,0|1,0,0]=3 5193 B11R1.222 CNC(C)c1[n]cccc1N Amb25694718 [1,1,0,0,0,0|1,0,0]=3 5194 B11R1.222 CNC(C)c1c[n]ccc1N Amb24365604 [1,1,0,0,0,0|1,0,0]=3 5195 B11R1.222 CNC(C)c1cc[n]cc1Br Amb24670146 [1,1,0,0,0,0|1,0,0]=3 5196 B11R1.222 CNC(C)c1cc[n]cc1Cl Amb25350499 [1,1,0,0,0,0|1,0,0]=3 5197 B11R1.222 CNC(C)c1cc[n]cc1O Amb25329720 [1,1,0,0,0,0|1,0,0]=3 5198 B11R1.222 CNC(C)c1ccc[n]c1N Amb25088680 [1,1,0,0,0,0|1,0,0]=3 5199 B11R1.222 CNC(C)c1ccccc1N Amb23557762 [1,1,0,0,0,0|0,0,0]=2 5200 B11R1.222 CNC(c1ccccc1Br)C Amb1138040 [1,1,0,0,0,0|0,0,0]=2 5201 B11R1.222 CNC(c1ccccc1C)C Amb1112420 [1,1,0,0,0,0|0,0,0]=2 5202 B11R1.222 CNC(c1ccccc1Cl)C Amb1127237 [1,1,0,0,0,0|0,0,0]=2 5203 B11R1.222 CNC(c1ccccc1F)C Amb1116429 [1,1,0,0,0,0|0,0,0]=2 5204 B11R1.222 CNC(c1ccccc1O)C Amb1118530 [1,1,0,0,0,0|0,0,0]=2 5205 B11R1.222 CN[C@@H](C)c1[n]cccc1Cl Amb25808769 [1,1,0,0,0,0|1,0,0]=3 5206 B11R1.222 CN[C@@H](C)c1[n]cccc1F Amb24601411 [1,1,0,0,0,0|1,0,0]=3 5207 B11R1.222 CN[C@@H](C)c1[n]cccc1N Amb24648687 [1,1,0,0,0,0|1,0,0]=3 5208 B11R1.222 CN[C@@H](C)c1c[n]ccc1Br Amb25147950 [1,1,0,0,0,0|1,0,0]=3 5209 B11R1.222 CN[C@@H](C)c1c[n]ccc1Cl Amb24467504 [1,1,0,0,0,0|1,0,0]=3 5210 B11R1.222 CN[C@@H](C)c1c[n]ccc1N Amb25279342 [1,1,0,0,0,0|1,0,0]=3 5211 B11R1.222 CN[C@@H](C)c1c[n]ccc1O Amb24699146 [1,1,0,0,0,0|1,0,0]=3 5212 B11R1.222 CN[C@@H](C)c1cc[n]cc1Cl Amb25104695 [1,1,0,0,0,0|1,0,0]=3 5213 B11R1.222 CN[C@@H](C)c1cc[n]cc1N Amb24417704 [1,1,0,0,0,0|1,0,0]=3 5214 B11R1.222 CN[C@@H](C)c1ccc[n]c1N Amb25738329 [1,1,0,0,0,0|1,0,0]=3 5215 B11R1.222 CN[C@@H](C)c1ccccc1Br Amb25147831 [1,1,0,0,0,0|0,0,0]=2 5216 B11R1.222 CN[C@@H](C)c1ccccc1O Amb24365222 [1,1,0,0,0,0|0,0,0]=2 5217 B11R1.222 CN[C@@H](C)c1ccccc1S Amb25335644 [1,1,0,0,0,0|0,0,0]=2 5218 B11R1.222 CN[C@@H](c1ccccc1F)C Amb10840582 [1,1,0,0,0,0|0,0,0]=2 5219 B11R1.222 CN[C@H](C)c1[n]cccc1F Amb25072817 [1,1,0,0,0,0|1,0,0]=3 5220 B11R1.222 CN[C@H](C)c1[n]cccc1O Amb25743565 [1,1,0,0,0,0|1,0,0]=3 5221 B11R1.222 CN[C@H](C)c1c[n]ccc1N Amb25028087 [1,1,0,0,0,0|1,0,0]=3 5222 B11R1.222 CN[C@H](C)c1c[n]ccc1O Amb24665784 [1,1,0,0,0,0|1,0,0]=3 5223 B11R1.222 CN[C@H](C)c1cc[n]cc1Cl Amb25339445 [1,1,0,0,0,0|1,0,0]=3 5224 B11R1.222 CN[C@H](C)c1cc[n]cc1F Amb25169443 [1,1,0,0,0,0|1,0,0]=3 5225 B11R1.222 CN[C@H](C)c1ccc[n]c1N Amb25803699 [1,1,0,0,0,0|1,0,0]=3 5226 B11R1.222 CN[C@H](C)c1ccccc1O Amb25214643 [1,1,0,0,0,0|0,0,0]=2 5227 B11R1.222 CN[C@H](C)c1ccccc1S Amb25152711 [1,1,0,0,0,0|0,0,0]=2 5228 B11R1.222 CN[C@H](c1ccccc1F)C Amb10838815 [1,1,0,0,0,0|0,0,0]=2 5229 B11R1.222 CN\C(\F)=C/1\C=CC=CC1=O Amb24440975 [1,1,0,0,0,0|1,0,1]=4 5230 B11R1.222 CN\C(\N)=C/1\C=CC=CC1=O Amb24681966 [1,1,0,0,0,0|1,0,1]=4 5231 B11R1.222 COC(C)c1c[n]ccc1Br Amb25369505 [1,1,0,0,0,0|2,0,0]=4 5232 B11R1.222 COC(C)c1cc[n]cc1Br Amb24614184 [1,1,0,0,0,0|2,0,0]=4 5233 B11R1.222 COC(C)c1ccccc1N Amb24468018 [1,1,0,0,0,0|1,0,0]=3 5234 B11R1.222 COC(C)c1ccccc1O Amb18125398 [1,1,0,0,0,0|1,0,0]=3 5235 B11R1.222 CSC(C)c1ccccc1Br Amb25706771 [1,1,0,0,0,0|1,0,0]=3 5236 B11R1.222 C[C@@H](C=C)c1ccccc1N Amb24377049 [1,1,0,0,0,0|0,0,2]=4 5237 B11R1.222 C[C@H](C=O)c1ccccc1F Amb24068258 [1,1,0,0,0,0|1,0,1]=4 5238 B11R1.222 C[C@H](NO)c1ccccc1F Amb25841617 [1,1,0,0,0,0|1,0,0]=3 5239 B11R1.222 C\C(=C/C)\c1ccccc1N Amb18124838 [1,1,0,0,0,0|0,0,2]=4 5240 B11R1.222 C\C(=C/C)\c1ccccc1O Amb18124922 [1,1,0,0,0,0|0,0,2]=4 5241 B11R1.222 C\C(=C\C)\c1ccccc1O Amb25707041 [1,1,0,0,0,0|0,0,2]=4 5242 B11R1.222 C\C(=N\N)\c1ccccc1Br Amb24475633 [1,1,0,0,0,0|1,0,1]=4 5243 B11R1.222 C\C(=N\N)\c1ccccc1Cl Amb25136727 [1,1,0,0,0,0|1,0,1]=4 5244 B11R1.222 C\C(=N\N)\c1ccccc1I Amb25847489 [1,1,0,0,0,0|1,0,1]=4 5245 B11R1.222 C\C(=N\N)\c1ccccc1N Amb25680036 [1,1,0,0,0,0|1,0,1]=4 5246 B11R1.222 Cc1[n]c[n]cc1C(C)NC Amb18964383 [1,1,0,0,0,0|2,0,0]=4 5247 B11R1.222 Cc1[n]cccc1C(N)CC Amb24485797 [1,1,0,0,0,0|2,0,0]=4 5248 B11R1.222 Cc1[n]cccc1[C@@H](C)NC Amb24707790 [1,1,0,0,0,0|1,0,0]=3 5249 B11R1.222 Cc1[n]cccc1[C@H](N)CC Amb24687105 [1,1,0,0,0,0|2,0,0]=4 5250 B11R1.222 Cc1[n]cccc1[C@H](N)CN Amb25123696 [1,1,0,0,0,0|2,0,0]=4 5251 B11R1.222 Cc1c[n]ccc1C(C)CO Amb25092078 [1,1,0,0,0,0|2,0,0]=4 5252 B11R1.222 Cc1c[n]ccc1C(C)NC Amb25766466 [1,1,0,0,0,0|1,0,0]=3 5253 B11R1.222 Cc1c[n]ccc1C(N)CC Amb25823610 [1,1,0,0,0,0|2,0,0]=4 5254 B11R1.222 Cc1c[n]ccc1C(O)CC Amb24725487 [1,1,0,0,0,0|2,0,0]=4 5255 B11R1.222 Cc1c[n]ccc1[C@@H](C)CC Amb24103204 [1,1,0,0,0,0|1,0,0]=3 5256 B11R1.222 Cc1c[n]ccc1[C@@H](N)CC Amb25068446 [1,1,0,0,0,0|2,0,0]=4 5257 B11R1.222 Cc1c[n]ccc1[C@H](N)CC Amb24654812 [1,1,0,0,0,0|2,0,0]=4 5258 B11R1.222 Cc1cc[n]cc1C(Br)CC Amb25045751 [1,1,0,0,0,0|2,0,0]=4 5259 B11R1.222 Cc1cc[n]cc1C(C)CN Amb18201825 [1,1,0,0,0,0|1,0,0]=3 5260 B11R1.222 Cc1cc[n]cc1C(Cl)CC Amb24458710 [1,1,0,0,0,0|2,0,0]=4 5261 B11R1.222 Cc1cc[n]cc1C(N)CN Amb25367347 [1,1,0,0,0,0|2,0,0]=4 5262 B11R1.222 Cc1cc[n]cc1[C@@H](C)NC Amb24487511 [1,1,0,0,0,0|1,0,0]=3 5263 B11R1.222 Cc1cc[n]cc1[C@@H](N)CC Amb25104690 [1,1,0,0,0,0|2,0,0]=4 5264 B11R1.222 Cc1cc[n]cc1[C@@H](N)CN Amb25809439 [1,1,0,0,0,0|2,0,0]=4 5265 B11R1.222 Cc1cc[n]cc1[C@@H](O)CC Amb25683891 [1,1,0,0,0,0|2,0,0]=4 5266 B11R1.222 Cc1cc[n]cc1[C@H](N)CN Amb25709184 [1,1,0,0,0,0|2,0,0]=4 5267 B11R1.222 Cc1cc[n]cc1[C@H](O)CC Amb24467132 [1,1,0,0,0,0|2,0,0]=4 5268 B11R1.222 Cc1ccc[n]c1C(Br)CC Amb24467726 [1,1,0,0,0,0|2,0,0]=4 5269 B11R1.222 Cc1ccc[n]c1C(C)NC Amb18283561 [1,1,0,0,0,0|1,0,0]=3 5270 B11R1.222 Cc1ccc[n]c1C(C)NN Amb25241710 [1,1,0,0,0,0|2,0,0]=4 5271 B11R1.222 Cc1ccc[n]c1C(N)CN Amb24442185 [1,1,0,0,0,0|2,0,0]=4 5272 B11R1.222 Cc1ccc[n]c1C(O)CC Amb18181692 [1,1,0,0,0,0|2,0,0]=4 5273 B11R1.222 Cc1ccc[n]c1[C@H](N)CC Amb25250463 [1,1,0,0,0,0|2,0,0]=4 5274 B11R1.222 Cc1ccc[n]c1[C@H](O)CC Amb25043154 [1,1,0,0,0,0|2,0,0]=4 5275 B11R1.222 Cc1ccccc1C(=O)CN Amb18281552 [1,1,0,0,0,0|1,0,1]=4 5276 B11R1.222 Cc1ccccc1C(=S)NC Amb25775044 [1,1,0,0,0,0|1,0,1]=4 5277 B11R1.222 Cc1ccccc1C(C)C=O Amb18124932 [1,1,0,0,0,0|1,0,1]=4 5278 B11R1.222 Cc1ccccc1C(C)CBr Amb25148992 [1,1,0,0,0,0|1,0,0]=3 5279 B11R1.222 Cc1ccccc1C(C)CO Amb25129854 [1,1,0,0,0,0|1,0,0]=3 5280 B11R1.222 Cc1ccccc1C(C)NO Amb24405514 [1,1,0,0,0,0|1,0,0]=3 5281 B11R1.222 Cc1ccccc1C(C)SC Amb24676514 [1,1,0,0,0,0|1,0,0]=3 5282 B11R1.222 Cc1ccccc1C(Cl)CC Amb24388659 [1,1,0,0,0,0|1,0,0]=3 5283 B11R1.222 Cc1ccccc1C(F)CN Amb25151822 [1,1,0,0,0,0|1,0,0]=3 5284 B11R1.222 Cc1ccccc1C(N)CF Amb24603875 [1,1,0,0,0,0|2,0,0]=4 5285 B11R1.222 Cc1ccccc1C(O)CBr Amb24106267 [1,1,0,0,0,0|2,0,0]=4 5286 B11R1.222 Cc1ccccc1C(O)CCl Amb24104159 [1,1,0,0,0,0|2,0,0]=4 5287 B11R1.222 Cc1ccccc1C(O)CF Amb24661131 [1,1,0,0,0,0|2,0,0]=4 5288 B11R1.222 Cc1ccccc1N(N)CC Amb18125192 [1,1,0,0,0,0|2,0,0]=4 5289 B11R1.222 Cc1ccccc1[C@@H](C)NC Amb24746717 [1,1,0,0,0,0|0,0,0]=2 5290 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb22298563 [1,1,0,0,0,0|1,0,0]=3 5291 B11R1.222 Cc1ccccc1[C@@H](N)CC Amb25145851 [1,1,0,0,0,0|1,0,0]=3 5292 B11R1.222 Cc1ccccc1[C@@H](O)CN Amb24100213 [1,1,0,0,0,0|1,0,0]=3 5293 B11R1.222 Cc1ccccc1[C@H](C)NO Amb24436797 [1,1,0,0,0,0|1,0,0]=3 5294 B11R1.222 Cc1ccccc1[C@H](N)CC Amb22298520 [1,1,0,0,0,0|1,0,0]=3 5295 B11R1.222 Cc1ccccc1[C@H](N)CC Amb25335271 [1,1,0,0,0,0|1,0,0]=3 5296 B11R1.222 Cc1ccccc1[C@H](N)CF Amb24659258 [1,1,0,0,0,0|2,0,0]=4 5297 B11R1.222 Cc1ccccc1\C(\C)=N/N Amb25831938 [1,1,0,0,0,0|1,0,1]=4 5298 B11R1.222 Clc1ccccc1C(Br)CBr Amb25377170 [1,1,0,0,0,0|2,0,0]=4 5299 B11R1.222 Clc1ccccc1C(Br)CCl Amb25721011 [1,1,0,0,0,0|2,0,0]=4 5300 B11R1.222 FCC(c1ccccc1F)N Amb2372611 [1,1,0,0,0,0|2,0,0]=4 5301 B11R1.222 NC(CBr)c1ccccc1F Amb25095798 [1,1,0,0,0,0|2,0,0]=4 5302 B11R1.222 NC(CF)c1ccccc1I Amb25825371 [1,1,0,0,0,0|2,0,0]=4 5303 B11R1.222 NC(CF)c1ccccc1O Amb24488040 [1,1,0,0,0,0|2,0,0]=4 5304 B11R1.222 NC(CO)c1ccccc1Br Amb23596558 [1,1,0,0,0,0|2,0,0]=4 5305 B11R1.222 NC(CO)c1ccccc1F Amb19374114 [1,1,0,0,0,0|2,0,0]=4 5306 B11R1.222 NC(CO)c1ccccc1I Amb25738482 [1,1,0,0,0,0|2,0,0]=4 5307 B11R1.222 NC(CO)c1ccccc1O Amb24069930 [1,1,0,0,0,0|2,0,0]=4 5308 B11R1.222 NC(CO)c1ccccc1S Amb25828013 [1,1,0,0,0,0|2,0,0]=4 5309 B11R1.222 NCC(=O)c1ccccc1Br Amb10069326 [1,1,0,0,0,0|1,0,1]=4 5310 B11R1.222 NCC(=O)c1ccccc1Cl Amb10069325 [1,1,0,0,0,0|1,0,1]=4 5311 B11R1.222 NCC(=O)c1ccccc1F Amb10840039 [1,1,0,0,0,0|1,0,1]=4 5312 B11R1.222 NCC(=O)c1ccccc1I Amb25172792 [1,1,0,0,0,0|1,0,1]=4 5313 B11R1.222 NCC(=O)c1ccccc1O Amb18125235 [1,1,0,0,0,0|1,0,1]=4 5314 B11R1.222 NCC(F)c1cc[n]cc1F Amb25321024 [1,1,0,0,0,0|2,0,0]=4 5315 B11R1.222 NCC(F)c1ccccc1Br Amb23454845 [1,1,0,0,0,0|1,0,0]=3 5316 B11R1.222 NCC(F)c1ccccc1Cl Amb24392618 [1,1,0,0,0,0|1,0,0]=3 5317 B11R1.222 NCC(N)c1[n]cccc1Br Amb25351714 [1,1,0,0,0,0|2,0,0]=4 5318 B11R1.222 NCC(N)c1[n]cccc1Cl Amb25324360 [1,1,0,0,0,0|2,0,0]=4 5319 B11R1.222 NCC(N)c1ccc[n]c1O Amb25111576 [1,1,0,0,0,0|2,0,0]=4 5320 B11R1.222 NCC(N)c1ccccc1O Amb24746712 [1,1,0,0,0,0|1,0,0]=3 5321 B11R1.222 NCC(N)c1ccccc1S Amb25207598 [1,1,0,0,0,0|1,0,0]=3 5322 B11R1.222 NCC(O)c1[n]cccc1Br Amb23586110 [1,1,0,0,0,0|2,0,0]=4 5323 B11R1.222 NCC(O)c1[n]cccc1O Amb25808983 [1,1,0,0,0,0|2,0,0]=4 5324 B11R1.222 NCC(O)c1cc[n]cc1O Amb24695816 [1,1,0,0,0,0|2,0,0]=4 5325 B11R1.222 NCC(O)c1ccccc1Br Amb22587182 [1,1,0,0,0,0|1,0,0]=3 5326 B11R1.222 NCC(O)c1ccccc1I Amb22234793 [1,1,0,0,0,0|1,0,0]=3 5327 B11R1.222 NCC(c1ccccc1Br)O Amb2383122 [1,1,0,0,0,0|1,0,0]=3 5328 B11R1.222 NCC(c1ccccc1C)O Amb10068895 [1,1,0,0,0,0|1,0,0]=3 5329 B11R1.222 NCC(c1ccccc1C)O Amb1108095 [1,1,0,0,0,0|1,0,0]=3 5330 B11R1.222 NCC(c1ccccc1Cl)C Amb17232735 [1,1,0,0,0,0|0,0,0]=2 5331 B11R1.222 NCC(c1ccccc1Cl)O Amb1108010 [1,1,0,0,0,0|1,0,0]=3 5332 B11R1.222 NCC(c1ccccc1F)O Amb1108863 [1,1,0,0,0,0|1,0,0]=3 5333 B11R1.222 NCC(c1ccccc1I)O Amb2383126 [1,1,0,0,0,0|1,0,0]=3 5334 B11R1.222 NCC(c1ccccc1O)O Amb1108822 [1,1,0,0,0,0|1,0,0]=3 5335 B11R1.222 NC[C@@H](N)c1[n]cccc1Br Amb25289002 [1,1,0,0,0,0|2,0,0]=4 5336 B11R1.222 NC[C@@H](N)c1c[n]ccc1Cl Amb24484475 [1,1,0,0,0,0|2,0,0]=4 5337 B11R1.222 NC[C@@H](N)c1cc[n]cc1Br Amb24696359 [1,1,0,0,0,0|2,0,0]=4 5338 B11R1.222 NC[C@@H](N)c1cc[n]cc1F Amb24693322 [1,1,0,0,0,0|2,0,0]=4 5339 B11R1.222 NC[C@@H](N)c1ccc[n]c1Br Amb25732503 [1,1,0,0,0,0|2,0,0]=4 5340 B11R1.222 NC[C@@H](N)c1ccc[n]c1Cl Amb25145781 [1,1,0,0,0,0|2,0,0]=4 5341 B11R1.222 NC[C@@H](N)c1ccccc1I Amb25149025 [1,1,0,0,0,0|1,0,0]=3 5342 B11R1.222 NC[C@@H](N)c1ccccc1S Amb25169297 [1,1,0,0,0,0|1,0,0]=3 5343 B11R1.222 NC[C@@H](O)c1ccccc1Br Amb24415174 [1,1,0,0,0,0|1,0,0]=3 5344 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241478 [1,1,0,0,0,0|1,0,0]=3 5345 B11R1.222 NC[C@@H](O)c1ccccc1Cl Amb20241480 [1,1,0,0,0,0|1,0,0]=3 5346 B11R1.222 NC[C@H](N)c1[n]cccc1F Amb25111621 [1,1,0,0,0,0|2,0,0]=4 5347 B11R1.222 NC[C@H](N)c1[n]cccc1O Amb25062997 [1,1,0,0,0,0|2,0,0]=4 5348 B11R1.222 NC[C@H](N)c1cc[n]cc1Br Amb25800128 [1,1,0,0,0,0|2,0,0]=4 5349 B11R1.222 NC[C@H](N)c1cc[n]cc1O Amb24484441 [1,1,0,0,0,0|2,0,0]=4 5350 B11R1.222 NC[C@H](N)c1ccc[n]c1Br Amb25055214 [1,1,0,0,0,0|2,0,0]=4 5351 B11R1.222 NC[C@H](N)c1ccc[n]c1Cl Amb25367215 [1,1,0,0,0,0|2,0,0]=4 5352 B11R1.222 NC[C@H](N)c1ccccc1Cl Amb25189262 [1,1,0,0,0,0|1,0,0]=3 5353 B11R1.222 NC[C@H](N)c1ccccc1F Amb25145861 [1,1,0,0,0,0|1,0,0]=3 5354 B11R1.222 NC[C@H](N)c1ccccc1S Amb25152768 [1,1,0,0,0,0|1,0,0]=3 5355 B11R1.222 NC[C@H](O)c1ccccc1Br Amb25686880 [1,1,0,0,0,0|1,0,0]=3 5356 B11R1.222 N[C@@H](CF)c1ccccc1Br Amb25085243 [1,1,0,0,0,0|2,0,0]=4 5357 B11R1.222 N[C@@H](CF)c1ccccc1F Amb24487040 [1,1,0,0,0,0|2,0,0]=4 5358 B11R1.222 N[C@@H](CF)c1ccccc1I Amb25341316 [1,1,0,0,0,0|2,0,0]=4 5359 B11R1.222 N[C@@H](CO)c1ccccc1Cl Amb22756886 [1,1,0,0,0,0|2,0,0]=4 5360 B11R1.222 N[C@@H](CO)c1ccccc1F Amb22756438 [1,1,0,0,0,0|2,0,0]=4 5361 B11R1.222 N[C@@H](CO)c1ccccc1I Amb24640454 [1,1,0,0,0,0|2,0,0]=4 5362 B11R1.222 N[C@@H](CO)c1ccccc1S Amb25348434 [1,1,0,0,0,0|2,0,0]=4 5363 B11R1.222 N[C@H](CF)c1ccccc1F Amb25125365 [1,1,0,0,0,0|2,0,0]=4 5364 B11R1.222 N[C@H](CF)c1ccccc1I Amb25089289 [1,1,0,0,0,0|2,0,0]=4 5365 B11R1.222 N[C@H](CF)c1ccccc1O Amb24369522 [1,1,0,0,0,0|2,0,0]=4 5366 B11R1.222 N[C@H](CO)c1ccccc1Cl Amb25228430 [1,1,0,0,0,0|2,0,0]=4 5367 B11R1.222 N[C@H](CO)c1ccccc1F Amb24349743 [1,1,0,0,0,0|2,0,0]=4 5368 B11R1.222 N[C@H](CO)c1ccccc1I Amb25314281 [1,1,0,0,0,0|2,0,0]=4 5369 B11R1.222 N[C@H](CO)c1ccccc1O Amb24383657 [1,1,0,0,0,0|2,0,0]=4 5370 B11R1.222 Nc1[n]cccc1C(N)CN Amb24655924 [1,1,0,0,0,0|2,0,0]=4 5371 B11R1.222 Nc1[n]cccc1C(O)CN Amb25069900 [1,1,0,0,0,0|2,0,0]=4 5372 B11R1.222 Nc1[n]cccc1[C@H](N)CN Amb25857223 [1,1,0,0,0,0|2,0,0]=4 5373 B11R1.222 Nc1c[n]ccc1[C@@H](N)CN Amb25840884 [1,1,0,0,0,0|2,0,0]=4 5374 B11R1.222 Nc1c[n]ccc1[C@H](N)CN Amb24386008 [1,1,0,0,0,0|2,0,0]=4 5375 B11R1.222 Nc1cc[n]cc1C(F)CN Amb24731741 [1,1,0,0,0,0|2,0,0]=4 5376 B11R1.222 Nc1cc[n]cc1C(O)CN Amb24354513 [1,1,0,0,0,0|2,0,0]=4 5377 B11R1.222 Nc1cc[n]cc1[C@@H](N)CN Amb24425349 [1,1,0,0,0,0|2,0,0]=4 5378 B11R1.222 Nc1cc[n]cc1[C@H](N)CN Amb25756946 [1,1,0,0,0,0|2,0,0]=4 5379 B11R1.222 Nc1ccc[n]c1[C@@H](N)CN Amb25807949 [1,1,0,0,0,0|2,0,0]=4 5380 B11R1.222 Nc1ccc[n]c1[C@H](N)CN Amb24406704 [1,1,0,0,0,0|2,0,0]=4 5381 B11R1.222 Nc1ccccc1C(=O)CN Amb18125141 [1,1,0,0,0,0|1,0,1]=4 5382 B11R1.222 Nc1ccccc1C(O)CN Amb24400559 [1,1,0,0,0,0|1,0,0]=3 5383 B11R1.222 Nc1ccccc1C(O)CO Amb18959890 [1,1,0,0,0,0|2,0,0]=4 5384 B11R1.222 Nc1ccccc1[C@@H](N)CN Amb25151189 [1,1,0,0,0,0|1,0,0]=3 5385 B11R1.222 Nc1ccccc1[C@H](N)CN Amb25027869 [1,1,0,0,0,0|1,0,0]=3 5386 B11R1.222 Nc1ccccc1[C@H](N)CO Amb25063331 [1,1,0,0,0,0|2,0,0]=4 5387 B11R1.222 OC(CBr)c1ccccc1Br Amb25741136 [1,1,0,0,0,0|2,0,0]=4 5388 B11R1.222 OC(CBr)c1ccccc1Cl Amb24081185 [1,1,0,0,0,0|2,0,0]=4 5389 B11R1.222 OC(CCl)c1ccccc1Cl Amb25726431 [1,1,0,0,0,0|2,0,0]=4 5390 B11R1.222 OC(CCl)c1ccccc1F Amb25306094 [1,1,0,0,0,0|2,0,0]=4 5391 B11R1.222 OC(CF)c1ccccc1F Amb24688002 [1,1,0,0,0,0|2,0,0]=4 5392 B11R1.222 OC(CI)c1ccccc1Br Amb24555966 [1,1,0,0,0,0|2,0,0]=4 5393 B11R1.222 OCC(F)c1ccccc1Cl Amb25145452 [1,1,0,0,0,0|2,0,0]=4 5394 B11R1.222 OCC(O)c1ccccc1Br Amb24123020 [1,1,0,0,0,0|2,0,0]=4 5395 B11R1.222 OCC(O)c1ccccc1Cl Amb24123046 [1,1,0,0,0,0|2,0,0]=4 5396 B11R1.222 OCC(O)c1ccccc1F Amb24123031 [1,1,0,0,0,0|2,0,0]=4 5397 B11R1.222 OCC(c1ccccc1Cl)N Amb17232852 [1,1,0,0,0,0|2,0,0]=4 5398 B11R1.222 OCC(c1ccccc1F)N Amb2236319 [1,1,0,0,0,0|2,0,0]=4 5399 B11R1.222 OCC(c1ccccc1F)N Amb2236915 [1,1,0,0,0,0|2,0,0]=4 5400 B11R1.222 OC[C@@H](O)c1ccccc1F Amb24402438 [1,1,0,0,0,0|2,0,0]=4 5401 B11R1.222 OC[C@H](F)c1ccccc1Cl Amb25292140 [1,1,0,0,0,0|2,0,0]=4 5402 B11R1.222 OC[C@H](O)c1ccccc1Cl Amb25776080 [1,1,0,0,0,0|2,0,0]=4 5403 B11R1.222 OC[C@H](O)c1ccccc1F Amb25720140 [1,1,0,0,0,0|2,0,0]=4 5404 B11R1.222 O[C@@H](CBr)c1ccccc1Br Amb25357117 [1,1,0,0,0,0|2,0,0]=4 5405 B11R1.222 O[C@@H](CCl)c1ccccc1Cl Amb25060772 [1,1,0,0,0,0|2,0,0]=4 5406 B11R1.222 O[C@H](CBr)c1ccccc1Br Amb25272153 [1,1,0,0,0,0|2,0,0]=4 5407 B11R1.222 O[C@H](CCl)c1ccccc1Cl Amb24509305 [1,1,0,0,0,0|2,0,0]=4 5408 B11R1.222 O[C@H](CCl)c1ccccc1F Amb25361770 [1,1,0,0,0,0|2,0,0]=4 5409 B11R1.222 O[C@H](CF)c1ccccc1Br Amb25151841 [1,1,0,0,0,0|2,0,0]=4 5410 B11R1.222 O[C@H](CF)c1ccccc1F Amb24454550 [1,1,0,0,0,0|2,0,0]=4 5411 B11R1.222 Oc1ccccc1C(O)CO Amb24646646 [1,1,0,0,0,0|2,0,0]=4 5412 B11R1.222 Oc1ccccc1[C@H](O)CO Amb25830555 [1,1,0,0,0,0|2,0,0]=4 5413 B11R1.1 BrCCCc1ccc(I)cc1 Amb25083701 [1,1,0,0,0,0|2,0,0]=4 5414 B11R1.1 BrCCCc1ccc(cc1)Br Amb17104577 [1,1,0,0,0,0|2,0,0]=4 5415 B11R1.1 BrCCCc1ccc(cc1)C Amb17104554 [1,1,0,0,0,0|2,0,0]=4 5416 B11R1.1 BrCCCc1ccc(cc1)Cl Amb17104562 [1,1,0,0,0,0|2,0,0]=4 5417 B11R1.1 BrCCCc1ccc(cc1)F Amb17104556 [1,1,0,0,0,0|2,0,0]=4 5418 B11R1.1 Br[Zn]CCc1ccc(cc1)Br Amb13890855 [1,1,0,0,0,0|2,0,0]=4 5419 B11R1.1 C#CCCc1ccc(Br)cc1 Amb18116967 [1,1,0,0,0,0|1,0,1]=4 5420 B11R1.1 C#CCCc1ccc(Cl)cc1 Amb18116815 [1,1,0,0,0,0|1,0,1]=4 5421 B11R1.1 C#CCCc1ccc(F)cc1 Amb18116891 [1,1,0,0,0,0|1,0,1]=4 5422 B11R1.1 C=CCCc1ccc(I)cc1 Amb25349986 [1,1,0,0,0,0|1,0,1]=4 5423 B11R1.1 C=CCCc1ccc(N)cc1 Amb18124837 [1,1,0,0,0,0|1,0,1]=4 5424 B11R1.1 C=CCCc1ccc(O)cc1 Amb25249578 [1,1,0,0,0,0|1,0,1]=4 5425 B11R1.1 C=NCCc1ccc(O)cc1 Amb25327788 [1,1,0,0,0,0|0,0,2]=4 5426 B11R1.1 CC=CCc1ccc(O)cc1 Amb24094301 [1,1,0,0,0,0|1,0,1]=4 5427 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb19805017 [1,1,0,0,0,0|2,0,0]=4 5428 B11R1.1 CCCCN1C=CC(=N)C=C1 Amb21922071 [1,1,0,0,0,0|2,0,0]=4 5429 B11R1.1 CCCCN1C=CC(=[NH2+])C=C1 Amb22555482 [1,1,0,0,0,0|2,0,0]=4 5430 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350531 [1,1,0,0,0,0|2,0,0]=4 5431 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22350545 [1,1,0,0,0,0|2,0,0]=4 5432 B11R1.1 CCCC[n+]1ccc(C)cc1 Amb22353653 [1,1,0,0,0,0|2,0,0]=4 5433 B11R1.1 CCCCc1ccc(Br)c[n]1 Amb24483961 [1,1,0,0,0,0|2,0,0]=4 5434 B11R1.1 CCCCc1ccc(Cl)[n]c1 Amb21963887 [1,1,0,0,0,0|2,0,0]=4 5435 B11R1.1 CCCCc1ccc(F)cc1 Amb22730516 [1,1,0,0,0,0|1,0,0]=3 5436 B11R1.1 CCCCc1ccc(O)c[n]1 Amb25831110 [1,1,0,0,0,0|2,0,0]=4 5437 B11R1.1 CCCNc1ccc(Cl)cc1 Amb19407162 [1,1,0,0,0,0|2,0,0]=4 5438 B11R1.1 CCCOc1ccc(Cl)cc1 Amb25126411 [1,1,0,0,0,0|2,0,0]=4 5439 B11R1.1 CCCOc1ccc(F)cc1 Amb24105714 [1,1,0,0,0,0|2,0,0]=4 5440 B11R1.1 CCCOc1ccc(I)cc1 Amb24064716 [1,1,0,0,0,0|2,0,0]=4 5441 B11R1.1 CCCOc1ccc(S)cc1 Amb25225762 [1,1,0,0,0,0|2,0,0]=4 5442 B11R1.1 CCCOc1ccc(cc1)N Amb1125044 [1,1,0,0,0,0|2,0,0]=4 5443 B11R1.1 CCCOc1ccc(cc1)O Amb1810008 [1,1,0,0,0,0|2,0,0]=4 5444 B11R1.1 CCCSc1ccc(N)cc1 Amb22588114 [1,1,0,0,0,0|2,0,0]=4 5445 B11R1.1 CCCSc1ccc(O)cc1 Amb18180159 [1,1,0,0,0,0|2,0,0]=4 5446 B11R1.1 CCCSc1ccc(S)cc1 Amb24362640 [1,1,0,0,0,0|2,0,0]=4 5447 B11R1.1 CCNCc1ccc(I)cc1 Amb25050868 [1,1,0,0,0,0|2,0,0]=4 5448 B11R1.1 CCNCc1ccc(cc1)O Amb13952053 [1,1,0,0,0,0|2,0,0]=4 5449 B11R1.1 CCOCc1ccc(Br)cc1 Amb19415022 [1,1,0,0,0,0|2,0,0]=4 5450 B11R1.1 CCOCc1ccc(O)cc1 Amb18125402 [1,1,0,0,0,0|2,0,0]=4 5451 B11R1.1 CCOCc1ccc(cc1)N Amb1125782 [1,1,0,0,0,0|2,0,0]=4 5452 B11R1.1 CCSCc1ccc(Br)cc1 Amb25684606 [1,1,0,0,0,0|2,0,0]=4 5453 B11R1.1 CCSCc1ccc(Cl)cc1 Amb24402210 [1,1,0,0,0,0|2,0,0]=4 5454 B11R1.1 CCSCc1ccc(F)cc1 Amb24486978 [1,1,0,0,0,0|2,0,0]=4 5455 B11R1.1 CCSCc1ccc(O)cc1 Amb18126551 [1,1,0,0,0,0|2,0,0]=4 5456 B11R1.1 CN/N=C/c1ccc(F)cc1 Amb17805862 [1,1,0,0,0,0|1,0,1]=4 5457 B11R1.1 CN/N=C/c1ccc(O)cc1 Amb17696985 [1,1,0,0,0,0|1,0,1]=4 5458 B11R1.1 CNCCN1C=CC(=O)C=C1 Amb18999197 [1,1,0,0,0,0|1,0,0]=3 5459 B11R1.1 CNCC[n+]1ccc(C)cc1 Amb25289045 [1,1,0,0,0,0|1,0,0]=3 5460 B11R1.1 CNCCc1[n]cc(Br)c[n]1 Amb25189084 [1,1,0,0,0,0|2,0,0]=4 5461 B11R1.1 CNCCc1ccc(N)c[n]1 Amb24387854 [1,1,0,0,0,0|1,0,0]=3 5462 B11R1.1 CNCCc1ccc(N)cc1 Amb18290354 [1,1,0,0,0,0|0,0,0]=2 5463 B11R1.1 CNCCc1ccc(cc1)O Amb15690577 [1,1,0,0,0,0|0,0,0]=2 5464 B11R1.1 CNN=Nc1ccc(Cl)cc1 Amb24064378 [1,1,0,0,0,0|2,0,0]=4 5465 B11R1.1 CN\N=C/c1ccc(F)cc1 Amb24100277 [1,1,0,0,0,0|1,0,1]=4 5466 B11R1.1 CN\N=C\c1ccc(cc1)Br Amb16842488 [1,1,0,0,0,0|1,0,1]=4 5467 B11R1.1 COCCN1C=CC(=O)C=C1 Amb24460542 [1,1,0,0,0,0|2,0,0]=4 5468 B11R1.1 COCCc1ccc(Cl)cc1 Amb24118075 [1,1,0,0,0,0|1,0,0]=3 5469 B11R1.1 COCCc1ccc(I)cc1 Amb25360538 [1,1,0,0,0,0|1,0,0]=3 5470 B11R1.1 COCCc1ccc(cc1)N Amb1139224 [1,1,0,0,0,0|1,0,0]=3 5471 B11R1.1 COCNc1ccc(F)cc1 Amb24070274 [1,1,0,0,0,0|2,0,0]=4 5472 B11R1.1 COCOc1ccc(Br)cc1 Amb22001005 [1,1,0,0,0,0|2,0,0]=4 5473 B11R1.1 COCOc1ccc(F)cc1 Amb22546791 [1,1,0,0,0,0|2,0,0]=4 5474 B11R1.1 COCOc1ccc(N)cc1 Amb24092674 [1,1,0,0,0,0|2,0,0]=4 5475 B11R1.1 COCOc1ccc(O)cc1 Amb25268752 [1,1,0,0,0,0|2,0,0]=4 5476 B11R1.1 COCSc1ccc(Br)cc1 Amb24473100 [1,1,0,0,0,0|2,0,0]=4 5477 B11R1.1 COCSc1ccc(Cl)cc1 Amb24393521 [1,1,0,0,0,0|2,0,0]=4 5478 B11R1.1 COCSc1ccc(N)cc1 Amb25714979 [1,1,0,0,0,0|2,0,0]=4 5479 B11R1.1 CONCc1ccc(Br)cc1 Amb25151171 [1,1,0,0,0,0|2,0,0]=4 5480 B11R1.1 CONCc1ccc(O)cc1 Amb24383951 [1,1,0,0,0,0|2,0,0]=4 5481 B11R1.1 CSCCN1C=CC(=O)C=C1 Amb24376848 [1,1,0,0,0,0|2,0,0]=4 5482 B11R1.1 CSCCc1ccc(N)cc1 Amb18971649 [1,1,0,0,0,0|1,0,0]=3 5483 B11R1.1 CSCOc1ccc(Cl)cc1 Amb24553356 [1,1,0,0,0,0|2,0,0]=4 5484 B11R1.1 CSCOc1ccc(F)cc1 Amb24645973 [1,1,0,0,0,0|2,0,0]=4 5485 B11R1.1 CSCSc1ccc(Br)cc1 Amb25162619 [1,1,0,0,0,0|2,0,0]=4 5486 B11R1.1 CSCSc1ccc(F)cc1 Amb25768258 [1,1,0,0,0,0|2,0,0]=4 5487 B11R1.1 C\C=C\Cc1ccc(N)cc1 Amb22751067 [1,1,0,0,0,0|1,0,1]=4 5488 B11R1.1 C\C=C\Cc1ccc(O)cc1 Amb18124917 [1,1,0,0,0,0|1,0,1]=4 5489 B11R1.1 Cc1ccc(CCC#C)cc1 Amb18634818 [1,1,0,0,0,0|1,0,1]=4 5490 B11R1.1 Cc1ccc(CCCC)[n]c1 Amb24676615 [1,1,0,0,0,0|2,0,0]=4 5491 B11R1.1 Cc1ccc(CCCC)cc1 Amb22002059 [1,1,0,0,0,0|1,0,0]=3 5492 B11R1.1 Cc1ccc(CCNC)[n]c1 Amb18125195 [1,1,0,0,0,0|1,0,0]=3 5493 B11R1.1 Cc1ccc(CCNN)c[n]1 Amb24666011 [1,1,0,0,0,0|2,0,0]=4 5494 B11R1.1 Cc1ccc(CSCC)cc1 Amb24536616 [1,1,0,0,0,0|2,0,0]=4 5495 B11R1.1 Cc1ccc(\C=N\NC)cc1 Amb25333383 [1,1,0,0,0,0|1,0,1]=4 5496 B11R1.1 Cc1ccc(cc1)NCOC Amb25301269 [1,1,0,0,0,0|2,0,0]=4 5497 B11R1.1 Cc1ccc(cc1)OCOC Amb20241783 [1,1,0,0,0,0|2,0,0]=4 5498 B11R1.1 Cc1ccc(cc1)SCOC Amb25032720 [1,1,0,0,0,0|2,0,0]=4 5499 B11R1.1 ClCCCc1ccc(cc1)Br Amb17104549 [1,1,0,0,0,0|2,0,0]=4 5500 B11R1.1 ClCCCc1ccc(cc1)C Amb17104527 [1,1,0,0,0,0|2,0,0]=4 5501 B11R1.1 ClCCCc1ccc(cc1)F Amb17104529 [1,1,0,0,0,0|2,0,0]=4 5502 B11R1.1 ClCCCc1ccc(cc1)N Amb17477708 [1,1,0,0,0,0|2,0,0]=4 5503 B11R1.1 ClCCCc1ccc(cc1)O Amb17477722 [1,1,0,0,0,0|2,0,0]=4 5504 B11R1.1 Clc1ccc(CC[Mg]Cl)cc1 Amb22897275 [1,1,0,0,0,0|2,0,0]=4 5505 B11R1.1 Clc1ccc(CC[Zn]Br)cc1 Amb22000488 [1,1,0,0,0,0|2,0,0]=4 5506 B11R1.1 Clc1ccc(CC[Zn]Cl)cc1 Amb22897728 [1,1,0,0,0,0|2,0,0]=4 5507 B11R1.1 Fc1ccc(CC[Zn]Br)cc1 Amb22000495 [1,1,0,0,0,0|2,0,0]=4 5508 B11R1.1 N#CCCc1ccc(I)cc1 Amb25785381 [1,1,0,0,0,0|2,0,0]=4 5509 B11R1.1 N#CCCc1ccc(cc1)C Amb17204297 [1,1,0,0,0,0|2,0,0]=4 5510 B11R1.1 N#CCCc1ccc(cc1)F Amb17204299 [1,1,0,0,0,0|2,0,0]=4 5511 B11R1.1 NCCCc1ccc(I)cc1 Amb25172834 [1,1,0,0,0,0|2,0,0]=4 5512 B11R1.1 NCCCc1ccc(S)cc1 Amb25228495 [1,1,0,0,0,0|2,0,0]=4 5513 B11R1.1 NCCCc1ccc(cc1)Cl Amb1092541 [1,1,0,0,0,0|2,0,0]=4 5514 B11R1.1 NCCCc1ccc(cc1)Cl Amb13952055 [1,1,0,0,0,0|2,0,0]=4 5515 B11R1.1 NCCCc1ccc(cc1)N Amb17477693 [1,1,0,0,0,0|2,0,0]=4 5516 B11R1.1 NCCCc1ccc(cc1)O Amb10066893 [1,1,0,0,0,0|2,0,0]=4 5517 B11R1.1 NCCCc1ccc(cc1)O Amb17598403 [1,1,0,0,0,0|2,0,0]=4 5518 B11R1.1 NNCCc1ccc(Br)c[n]1 Amb25300628 [1,1,0,0,0,0|2,0,0]=4 5519 B11R1.1 NOCCc1ccc(F)cc1 Amb22896631 [1,1,0,0,0,0|2,0,0]=4 5520 B11R1.1 NOCCc1ccc(O)cc1 Amb25053130 [1,1,0,0,0,0|2,0,0]=4 5521 B11R1.1 Nc1ccc(CCCBr)cc1 Amb22229466 [1,1,0,0,0,0|2,0,0]=4 5522 B11R1.1 Nc1ccc(CCCF)cc1 Amb25697152 [1,1,0,0,0,0|2,0,0]=4 5523 B11R1.1 Nc1ccc(CCCO)cc1 Amb21964655 [1,1,0,0,0,0|2,0,0]=4 5524 B11R1.1 O=CCCc1ccc(cc1)Br Amb10602155 [1,1,0,0,0,0|2,0,0]=4 5525 B11R1.1 O=CCCc1ccc(cc1)F Amb10602156 [1,1,0,0,0,0|2,0,0]=4 5526 B11R1.1 O=CCCc1ccc(cc1)O Amb17081693 [1,1,0,0,0,0|2,0,0]=4 5527 B11R1.1 OCCCc1ccc(I)cc1 Amb24406298 [1,1,0,0,0,0|2,0,0]=4 5528 B11R1.1 OCCCc1ccc(cc1)Br Amb13883587 [1,1,0,0,0,0|2,0,0]=4 5529 B11R1.1 OCCCc1ccc(cc1)F Amb17089497 [1,1,0,0,0,0|2,0,0]=4 5530 B11R1.1 OCCCc1ccc(cc1)N Amb17477700 [1,1,0,0,0,0|2,0,0]=4 5531 B11R1.1 Oc1ccc(CCCBr)cc1 Amb25703932 [1,1,0,0,0,0|2,0,0]=4 5532 B11R1.1 SCCCc1ccc(cc1)Br Amb17407562 [1,1,0,0,0,0|2,0,0]=4 5533 B11R1.1 SCCCc1ccc(cc1)C Amb17400220 [1,1,0,0,0,0|2,0,0]=4 5534 B11R1.1 SCCCc1ccc(cc1)Cl Amb17401097 [1,1,0,0,0,0|2,0,0]=4 5535 B11R1.1 SCCCc1ccc(cc1)F Amb17400333 [1,1,0,0,0,0|2,0,0]=4 5536 B11R1.1 [C-]#[N+]CCc1ccc(O)cc1 Amb25730088 [1,1,0,0,0,0|0,0,2]=4 5537 B11R1.17 BrCCCc1ccccc1C Amb17104552 [1,1,0,0,0,0|2,0,0]=4 5538 B11R1.17 BrCCCc1ccccc1Cl Amb17104560 [1,1,0,0,0,0|2,0,0]=4 5539 B11R1.17 BrCCCc1ccccc1F Amb17104555 [1,1,0,0,0,0|2,0,0]=4 5540 B11R1.17 Br[Mg]CCc1ccccc1F Amb13890864 [1,1,0,0,0,0|2,0,0]=4 5541 B11R1.17 Br[Zn]CCc1ccccc1F Amb13890853 [1,1,0,0,0,0|2,0,0]=4 5542 B11R1.17 Brc1ccccc1CCCI Amb25329656 [1,1,0,0,0,0|2,0,0]=4 5543 B11R1.17 C#CCCc1ccccc1Cl Amb18116938 [1,1,0,0,0,0|1,0,1]=4 5544 B11R1.17 C#CCCc1ccccc1F Amb18636110 [1,1,0,0,0,0|1,0,1]=4 5545 B11R1.17 C=CCCc1ccccc1N Amb18124836 [1,1,0,0,0,0|1,0,1]=4 5546 B11R1.17 C=CCCc1ccccc1O Amb18124913 [1,1,0,0,0,0|1,0,1]=4 5547 B11R1.17 CC=CCc1ccccc1O Amb24089583 [1,1,0,0,0,0|1,0,1]=4 5548 B11R1.17 CCCCC1=CC=CNC1=O Amb25270944 [1,1,0,0,0,0|2,0,0]=4 5549 B11R1.17 CCCCN1C=CC=CC1=O Amb22739996 [1,1,0,0,0,0|2,0,0]=4 5550 B11R1.17 CCCCN1C=CC=CC1=S Amb24415294 [1,1,0,0,0,0|2,0,0]=4 5551 B11R1.17 CCCC[n+]1ccccc1C Amb25794246 [1,1,0,0,0,0|2,0,0]=4 5552 B11R1.17 CCCCc1c[n]ccc1N Amb25785815 [1,1,0,0,0,0|2,0,0]=4 5553 B11R1.17 CCCCc1cc[n]cc1Cl Amb24086569 [1,1,0,0,0,0|2,0,0]=4 5554 B11R1.17 CCCCc1ccc[n]c1Cl Amb24538109 [1,1,0,0,0,0|2,0,0]=4 5555 B11R1.17 CCCCc1ccccc1Br Amb15690808 [1,1,0,0,0,0|1,0,0]=3 5556 B11R1.17 CCCCc1ccccc1F Amb24426932 [1,1,0,0,0,0|1,0,0]=3 5557 B11R1.17 CCCCc1ccccc1O Amb25744605 [1,1,0,0,0,0|1,0,0]=3 5558 B11R1.17 CCCCn1ccccc1=O Amb10553753 [1,1,0,0,0,0|2,0,0]=4 5559 B11R1.17 CCCNc1ccccc1O Amb18644480 [1,1,0,0,0,0|2,0,0]=4 5560 B11R1.17 CCCOc1ccccc1Cl Amb25216415 [1,1,0,0,0,0|2,0,0]=4 5561 B11R1.17 CCCOc1ccccc1F Amb21856719 [1,1,0,0,0,0|2,0,0]=4 5562 B11R1.17 CCCOc1ccccc1N Amb1210617 [1,1,0,0,0,0|2,0,0]=4 5563 B11R1.17 CCCSc1ccccc1N Amb22588094 [1,1,0,0,0,0|2,0,0]=4 5564 B11R1.17 CCCSc1ccccc1O Amb18177881 [1,1,0,0,0,0|2,0,0]=4 5565 B11R1.17 CCNCc1ccccc1I Amb21861742 [1,1,0,0,0,0|2,0,0]=4 5566 B11R1.17 CCOCc1ccccc1Br Amb22227882 [1,1,0,0,0,0|2,0,0]=4 5567 B11R1.17 CCOCc1ccccc1O Amb10560038 [1,1,0,0,0,0|2,0,0]=4 5568 B11R1.17 CCSCc1ccccc1Br Amb22228180 [1,1,0,0,0,0|2,0,0]=4 5569 B11R1.17 CCSCc1ccccc1Cl Amb25676288 [1,1,0,0,0,0|2,0,0]=4 5570 B11R1.17 CCSCc1ccccc1O Amb18126550 [1,1,0,0,0,0|2,0,0]=4 5571 B11R1.17 CN/N=C/c1ccccc1Cl Amb17866944 [1,1,0,0,0,0|1,0,1]=4 5572 B11R1.17 CN/N=C/c1ccccc1F Amb17704011 [1,1,0,0,0,0|1,0,1]=4 5573 B11R1.17 CN/N=C/c1ccccc1O Amb17705197 [1,1,0,0,0,0|1,0,1]=4 5574 B11R1.17 CNCCN1C=CC=CC1=O Amb18299423 [1,1,0,0,0,0|1,0,0]=3 5575 B11R1.17 CNCCN1C=CC=NC1=O Amb18992761 [1,1,0,0,0,0|2,0,0]=4 5576 B11R1.17 CNCCN1C=CN=CC1=O Amb25360229 [1,1,0,0,0,0|2,0,0]=4 5577 B11R1.17 CNCCN1N=CC=CC1=O Amb18301680 [1,1,0,0,0,0|2,0,0]=4 5578 B11R1.17 CNCCc1[n]cccc1Br Amb18657771 [1,1,0,0,0,0|1,0,0]=3 5579 B11R1.17 CNCCc1[n]cccc1Cl Amb18126745 [1,1,0,0,0,0|1,0,0]=3 5580 B11R1.17 CNCCc1[n]cccc1F Amb24636895 [1,1,0,0,0,0|1,0,0]=3 5581 B11R1.17 CNCCc1c[n]ccc1Br Amb25804895 [1,1,0,0,0,0|1,0,0]=3 5582 B11R1.17 CNCCc1c[n]ccc1N Amb24436455 [1,1,0,0,0,0|1,0,0]=3 5583 B11R1.17 CNCCc1cc[n]cc1F Amb24593125 [1,1,0,0,0,0|1,0,0]=3 5584 B11R1.17 CNCCc1ccccc1Br Amb18299468 [1,1,0,0,0,0|0,0,0]=2 5585 B11R1.17 CNCCc1ccccc1N Amb24106838 [1,1,0,0,0,0|0,0,0]=2 5586 B11R1.17 CNCCc1ccccc1O Amb18560895 [1,1,0,0,0,0|0,0,0]=2 5587 B11R1.17 CN\N=C/c1ccccc1F Amb24100270 [1,1,0,0,0,0|1,0,1]=4 5588 B11R1.17 CN\N=C\c1ccccc1Br Amb16842474 [1,1,0,0,0,0|1,0,1]=4 5589 B11R1.17 COCC[n+]1ccccc1Br Amb25072030 [1,1,0,0,0,0|2,0,0]=4 5590 B11R1.17 COCC[n+]1ccccc1C Amb24685943 [1,1,0,0,0,0|2,0,0]=4 5591 B11R1.17 COCCc1c[n]ccc1N Amb25209393 [1,1,0,0,0,0|2,0,0]=4 5592 B11R1.17 COCCc1cccc[n+]1[O-] Amb10573566 [1,1,0,0,0,0|2,0,0]=4 5593 B11R1.17 COCCc1ccccc1Cl Amb24518157 [1,1,0,0,0,0|1,0,0]=3 5594 B11R1.17 COCCc1ccccc1I Amb24483388 [1,1,0,0,0,0|1,0,0]=3 5595 B11R1.17 COCCc1ccccc1N Amb18992153 [1,1,0,0,0,0|1,0,0]=3 5596 B11R1.17 COCCc1ccccc1O Amb22055702 [1,1,0,0,0,0|1,0,0]=3 5597 B11R1.17 COCCn1ccccc1=O Amb10707822 [1,1,0,0,0,0|2,0,0]=4 5598 B11R1.17 COCNc1ccccc1F Amb24084241 [1,1,0,0,0,0|2,0,0]=4 5599 B11R1.17 COCOc1ccccc1Br Amb21912438 [1,1,0,0,0,0|2,0,0]=4 5600 B11R1.17 COCOc1ccccc1C Amb10559613 [1,1,0,0,0,0|2,0,0]=4 5601 B11R1.17 COCOc1ccccc1Cl Amb25840223 [1,1,0,0,0,0|2,0,0]=4 5602 B11R1.17 COCOc1ccccc1F Amb22546792 [1,1,0,0,0,0|2,0,0]=4 5603 B11R1.17 COCOc1ccccc1I Amb22284514 [1,1,0,0,0,0|2,0,0]=4 5604 B11R1.17 COCOc1ccccc1N Amb23599107 [1,1,0,0,0,0|2,0,0]=4 5605 B11R1.17 COCOc1ccccc1O Amb24486480 [1,1,0,0,0,0|2,0,0]=4 5606 B11R1.17 COCSc1ccccc1N Amb17305638 [1,1,0,0,0,0|2,0,0]=4 5607 B11R1.17 CONCc1ccccc1F Amb24725975 [1,1,0,0,0,0|2,0,0]=4 5608 B11R1.17 CONCc1ccccc1O Amb24432475 [1,1,0,0,0,0|2,0,0]=4 5609 B11R1.17 CSCCN1C=CC=CC1=O Amb24488179 [1,1,0,0,0,0|2,0,0]=4 5610 B11R1.17 CSCCc1c[n]ccc1N Amb25839494 [1,1,0,0,0,0|2,0,0]=4 5611 B11R1.17 CSCCc1ccccc1Cl Amb25222784 [1,1,0,0,0,0|1,0,0]=3 5612 B11R1.17 CSCCc1ccccc1N Amb18299122 [1,1,0,0,0,0|1,0,0]=3 5613 B11R1.17 CSCOc1ccccc1Br Amb25358756 [1,1,0,0,0,0|2,0,0]=4 5614 B11R1.17 CSCOc1ccccc1Cl Amb24459326 [1,1,0,0,0,0|2,0,0]=4 5615 B11R1.17 CSCSc1ccccc1Br Amb24516501 [1,1,0,0,0,0|2,0,0]=4 5616 B11R1.17 C\C=C/Cc1ccccc1O Amb25345359 [1,1,0,0,0,0|1,0,1]=4 5617 B11R1.17 C\C=C\Cc1ccccc1N Amb18644343 [1,1,0,0,0,0|1,0,1]=4 5618 B11R1.17 C\N=C\Cc1ccccc1O Amb25844316 [1,1,0,0,0,0|0,0,2]=4 5619 B11R1.17 Cc1[n]cccc1CCNC Amb24635443 [1,1,0,0,0,0|1,0,0]=3 5620 B11R1.17 Cc1c[n]ccc1CCOC Amb24577461 [1,1,0,0,0,0|2,0,0]=4 5621 B11R1.17 Cc1cc[n]cc1CCCC Amb25075221 [1,1,0,0,0,0|2,0,0]=4 5622 B11R1.17 Cc1ccc[n]c1CCCC Amb24062201 [1,1,0,0,0,0|2,0,0]=4 5623 B11R1.17 Cc1ccc[n]c1CCNC Amb18125193 [1,1,0,0,0,0|1,0,0]=3 5624 B11R1.17 Cc1ccccc1CCC#C Amb18636111 [1,1,0,0,0,0|1,0,1]=4 5625 B11R1.17 Cc1ccccc1CCCC Amb25825024 [1,1,0,0,0,0|1,0,0]=3 5626 B11R1.17 Cc1ccccc1CCNC Amb19959980 [1,1,0,0,0,0|0,0,0]=2 5627 B11R1.17 Cc1ccccc1CC[Zn]Br Amb22000497 [1,1,0,0,0,0|2,0,0]=4 5628 B11R1.17 Cc1ccccc1CSCC Amb24690023 [1,1,0,0,0,0|2,0,0]=4 5629 B11R1.17 Cc1ccccc1NCOC Amb25690923 [1,1,0,0,0,0|2,0,0]=4 5630 B11R1.17 Cc1ccccc1SCCC Amb24674923 [1,1,0,0,0,0|2,0,0]=4 5631 B11R1.17 Cc1ccccc1SCSC Amb24631994 [1,1,0,0,0,0|2,0,0]=4 5632 B11R1.17 Cc1ccccc1\N=C\NC Amb25312744 [1,1,0,0,0,0|1,0,1]=4 5633 B11R1.17 ClCCCc1ccccc1C Amb17104525 [1,1,0,0,0,0|2,0,0]=4 5634 B11R1.17 ClCCCc1ccccc1Cl Amb17104533 [1,1,0,0,0,0|2,0,0]=4 5635 B11R1.17 ClCCCc1ccccc1F Amb17104528 [1,1,0,0,0,0|2,0,0]=4 5636 B11R1.17 ClCCCc1ccccc1N Amb17477710 [1,1,0,0,0,0|2,0,0]=4 5637 B11R1.17 ClCCCc1ccccc1O Amb17477721 [1,1,0,0,0,0|2,0,0]=4 5638 B11R1.17 Clc1ccccc1CC[Zn]Br Amb22898141 [1,1,0,0,0,0|2,0,0]=4 5639 B11R1.17 Clc1ccccc1CC[Zn]Cl Amb22897727 [1,1,0,0,0,0|2,0,0]=4 5640 B11R1.17 N#CCCc1ccccc1Br Amb17204424 [1,1,0,0,0,0|2,0,0]=4 5641 B11R1.17 N#CCCc1ccccc1C Amb17204295 [1,1,0,0,0,0|2,0,0]=4 5642 B11R1.17 N#CCCc1ccccc1F Amb17204298 [1,1,0,0,0,0|2,0,0]=4 5643 B11R1.17 N#CCCc1ccccc1O Amb17509008 [1,1,0,0,0,0|2,0,0]=4 5644 B11R1.17 NCCCc1ccccc1Cl Amb1090913 [1,1,0,0,0,0|2,0,0]=4 5645 B11R1.17 NCCCc1ccccc1Cl Amb19373405 [1,1,0,0,0,0|2,0,0]=4 5646 B11R1.17 NCCCc1ccccc1F Amb13949158 [1,1,0,0,0,0|2,0,0]=4 5647 B11R1.17 NCCCc1ccccc1N Amb17477695 [1,1,0,0,0,0|2,0,0]=4 5648 B11R1.17 NNCCN1C=CC=CC1=O Amb24421929 [1,1,0,0,0,0|2,0,0]=4 5649 B11R1.17 NNCCc1ccccc1Br Amb24701935 [1,1,0,0,0,0|1,0,0]=3 5650 B11R1.17 NNCCc1ccccc1F Amb20668135 [1,1,0,0,0,0|1,0,0]=3 5651 B11R1.17 NOCCc1ccccc1Br Amb18657908 [1,1,0,0,0,0|2,0,0]=4 5652 B11R1.17 NOCCc1ccccc1Cl Amb18647570 [1,1,0,0,0,0|2,0,0]=4 5653 B11R1.17 NOCCc1ccccc1F Amb22896629 [1,1,0,0,0,0|2,0,0]=4 5654 B11R1.17 Nc1[n]cccc1CCNN Amb25841161 [1,1,0,0,0,0|2,0,0]=4 5655 B11R1.17 Nc1ccccc1CCC#N Amb18124793 [1,1,0,0,0,0|2,0,0]=4 5656 B11R1.17 Nc1ccccc1CCC=O Amb25208520 [1,1,0,0,0,0|2,0,0]=4 5657 B11R1.17 Nc1ccccc1CCCBr Amb22228093 [1,1,0,0,0,0|2,0,0]=4 5658 B11R1.17 Nc1ccccc1CCCBr Amb25217893 [1,1,0,0,0,0|2,0,0]=4 5659 B11R1.17 O=CCCc1ccccc1Br Amb22498060 [1,1,0,0,0,0|2,0,0]=4 5660 B11R1.17 O=CCCc1ccccc1Cl Amb17081678 [1,1,0,0,0,0|2,0,0]=4 5661 B11R1.17 O=CCCc1ccccc1F Amb10602147 [1,1,0,0,0,0|2,0,0]=4 5662 B11R1.17 O=CCCc1ccccc1I Amb24093007 [1,1,0,0,0,0|2,0,0]=4 5663 B11R1.17 O=CCCc1ccccc1S Amb25325144 [1,1,0,0,0,0|2,0,0]=4 5664 B11R1.17 OCCCc1ccccc1Br Amb15692692 [1,1,0,0,0,0|2,0,0]=4 5665 B11R1.17 OCCCc1ccccc1C Amb17089494 [1,1,0,0,0,0|2,0,0]=4 5666 B11R1.17 OCCCc1ccccc1Cl Amb17089499 [1,1,0,0,0,0|2,0,0]=4 5667 B11R1.17 OCCCc1ccccc1F Amb17089496 [1,1,0,0,0,0|2,0,0]=4 5668 B11R1.17 OCCCc1ccccc1N Amb17477702 [1,1,0,0,0,0|2,0,0]=4 5669 B11R1.17 OCCCc1ccccc1O Amb17477714 [1,1,0,0,0,0|2,0,0]=4 5670 B11R1.17 Oc1ccccc1CCC=O Amb22228954 [1,1,0,0,0,0|2,0,0]=4 5671 B11R1.17 Oc1ccccc1CCCF Amb24100539 [1,1,0,0,0,0|2,0,0]=4 5672 B11R1.17 SCCCc1ccccc1Br Amb18070447 [1,1,0,0,0,0|2,0,0]=4 5673 B11R1.17 SCCCc1ccccc1C Amb17400218 [1,1,0,0,0,0|2,0,0]=4 5674 B11R1.17 SCCCc1ccccc1Cl Amb17401095 [1,1,0,0,0,0|2,0,0]=4 5675 B11R1.17 SCCCc1ccccc1F Amb17400332 [1,1,0,0,0,0|2,0,0]=4 5676 B11R1.17 Sc1ccccc1CCCBr Amb25196016 [1,1,0,0,0,0|2,0,0]=4 5677 B11R1.17 [C-]#[N+]CCc1ccccc1O Amb24644224 [1,1,0,0,0,0|0,0,2]=4 5678 B11R1.24 BrCCCc1cccc(c1)Br Amb17104576 [1,1,0,0,0,0|2,0,0]=4 5679 B11R1.24 BrCCCc1cccc(c1)C Amb17104553 [1,1,0,0,0,0|2,0,0]=4 5680 B11R1.24 BrCCCc1cccc(c1)Cl Amb17104561 [1,1,0,0,0,0|2,0,0]=4 5681 B11R1.24 Br[Zn]CCc1cccc(c1)Br Amb13890856 [1,1,0,0,0,0|2,0,0]=4 5682 B11R1.24 C#CCCc1cccc(Cl)c1 Amb18116942 [1,1,0,0,0,0|1,0,1]=4 5683 B11R1.24 C#CCCc1cccc(F)c1 Amb18118085 [1,1,0,0,0,0|1,0,1]=4 5684 B11R1.24 C=CCCc1cccc(O)c1 Amb25275934 [1,1,0,0,0,0|1,0,1]=4 5685 B11R1.24 CCCCC1=CC=CC(=S)N1 Amb25720838 [1,1,0,0,0,0|2,0,0]=4 5686 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22047356 [1,1,0,0,0,0|2,0,0]=4 5687 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22264602 [1,1,0,0,0,0|2,0,0]=4 5688 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb22411627 [1,1,0,0,0,0|2,0,0]=4 5689 B11R1.24 CCCC[n+]1cc(C)ccc1 Amb24323548 [1,1,0,0,0,0|2,0,0]=4 5690 B11R1.24 CCCCc1c[n]cc(N)c1 Amb24757999 [1,1,0,0,0,0|2,0,0]=4 5691 B11R1.24 CCCCc1cc(Br)cc[n]1 Amb24083005 [1,1,0,0,0,0|2,0,0]=4 5692 B11R1.24 CCCCc1cc(O)cc[n]1 Amb25109626 [1,1,0,0,0,0|2,0,0]=4 5693 B11R1.24 CCCCc1cc[n]c(N)c1 Amb24629138 [1,1,0,0,0,0|2,0,0]=4 5694 B11R1.24 CCCCc1cc[n]c(O)c1 Amb22749775 [1,1,0,0,0,0|2,0,0]=4 5695 B11R1.24 CCCCc1cccc(Br)c1 Amb19944057 [1,1,0,0,0,0|1,0,0]=3 5696 B11R1.24 CCCCc1cccc(I)c1 Amb19944046 [1,1,0,0,0,0|1,0,0]=3 5697 B11R1.24 CCCCc1cccc(N)[n]1 Amb18644442 [1,1,0,0,0,0|2,0,0]=4 5698 B11R1.24 CCCCc1cccc(S)c1 Amb24415059 [1,1,0,0,0,0|1,0,0]=3 5699 B11R1.24 CCCCc1cccc(c1)N Amb17593719 [1,1,0,0,0,0|1,0,0]=3 5700 B11R1.24 CCCOc1cc(Cl)ccc1 Amb25787001 [1,1,0,0,0,0|2,0,0]=4 5701 B11R1.24 CCCOc1cc(F)ccc1 Amb25700428 [1,1,0,0,0,0|2,0,0]=4 5702 B11R1.24 CCCOc1cccc(c1)C Amb10573406 [1,1,0,0,0,0|2,0,0]=4 5703 B11R1.24 CCCOc1cccc(c1)N Amb1138945 [1,1,0,0,0,0|2,0,0]=4 5704 B11R1.24 CCCSc1cc(Br)ccc1 Amb24538191 [1,1,0,0,0,0|2,0,0]=4 5705 B11R1.24 CCCSc1cc(Cl)ccc1 Amb25801816 [1,1,0,0,0,0|2,0,0]=4 5706 B11R1.24 CCCSc1cc(F)ccc1 Amb25806371 [1,1,0,0,0,0|2,0,0]=4 5707 B11R1.24 CCCSc1cc(N)ccc1 Amb18289141 [1,1,0,0,0,0|2,0,0]=4 5708 B11R1.24 CCCSc1cc(O)ccc1 Amb18126556 [1,1,0,0,0,0|2,0,0]=4 5709 B11R1.24 CCNCc1cc(I)ccc1 Amb24066806 [1,1,0,0,0,0|2,0,0]=4 5710 B11R1.24 CCNCc1cc(I)ccc1 Amb24066807 [1,1,0,0,0,0|2,0,0]=4 5711 B11R1.24 CCNCc1cc(N)ccc1 Amb18290000 [1,1,0,0,0,0|2,0,0]=4 5712 B11R1.24 CCNCc1cc(S)ccc1 Amb25705598 [1,1,0,0,0,0|2,0,0]=4 5713 B11R1.24 CCNCc1cccc(c1)Br Amb13949217 [1,1,0,0,0,0|2,0,0]=4 5714 B11R1.24 CCOCc1cc(Br)ccc1 Amb23512545 [1,1,0,0,0,0|2,0,0]=4 5715 B11R1.24 CCOCc1cc(Cl)ccc1 Amb24486866 [1,1,0,0,0,0|2,0,0]=4 5716 B11R1.24 CCOCc1cc(O)ccc1 Amb23443319 [1,1,0,0,0,0|2,0,0]=4 5717 B11R1.24 CCSCc1cc(Br)ccc1 Amb24476579 [1,1,0,0,0,0|2,0,0]=4 5718 B11R1.24 CCSCc1cc(O)ccc1 Amb18126555 [1,1,0,0,0,0|2,0,0]=4 5719 B11R1.24 CN/N=C/c1cccc(O)c1 Amb17803818 [1,1,0,0,0,0|1,0,1]=4 5720 B11R1.24 CNCCC=1C=CNC(=O)C1 Amb24759313 [1,1,0,0,0,0|1,0,0]=3 5721 B11R1.24 CNCCc1[n]c(O)cc[n]1 Amb18862495 [1,1,0,0,0,0|2,0,0]=4 5722 B11R1.24 CNCCc1c[n]cc(Br)c1 Amb25149055 [1,1,0,0,0,0|1,0,0]=3 5723 B11R1.24 CNCCc1c[n]cc(F)c1 Amb18993612 [1,1,0,0,0,0|1,0,0]=3 5724 B11R1.24 CNCCc1cc(Cl)cc[n]1 Amb25163179 [1,1,0,0,0,0|1,0,0]=3 5725 B11R1.24 CNCCc1cc(O)[n]c[n]1 Amb18224341 [1,1,0,0,0,0|2,0,0]=4 5726 B11R1.24 CNCCc1cc[n]c(Cl)c1 Amb24407156 [1,1,0,0,0,0|1,0,0]=3 5727 B11R1.24 CNCCc1cccc(Br)[n]1 Amb25324918 [1,1,0,0,0,0|1,0,0]=3 5728 B11R1.24 CNCCc1cccc(Cl)[n]1 Amb24679236 [1,1,0,0,0,0|1,0,0]=3 5729 B11R1.24 CNCCc1cccc(F)[n]1 Amb24596710 [1,1,0,0,0,0|1,0,0]=3 5730 B11R1.24 CNCCc1cccc(I)c1 Amb25187651 [1,1,0,0,0,0|0,0,0]=2 5731 B11R1.24 CNCCc1cccc(N)c1 Amb18550411 [1,1,0,0,0,0|0,0,0]=2 5732 B11R1.24 CNCCc1cccc(O)c1 Amb18560894 [1,1,0,0,0,0|0,0,0]=2 5733 B11R1.24 CNCCc1cccc(c1)Br Amb16230486 [1,1,0,0,0,0|0,0,0]=2 5734 B11R1.24 CNCCc1cccc(c1)C Amb16230487 [1,1,0,0,0,0|0,0,0]=2 5735 B11R1.24 CNNCc1cccc(Cl)c1 Amb22469834 [1,1,0,0,0,0|1,0,0]=3 5736 B11R1.24 CN\N=C/c1cccc(F)c1 Amb24100271 [1,1,0,0,0,0|1,0,1]=4 5737 B11R1.24 CN\N=C/c1cccc(O)c1 Amb24085681 [1,1,0,0,0,0|1,0,1]=4 5738 B11R1.24 CN\N=C\c1cccc(F)c1 Amb24371798 [1,1,0,0,0,0|1,0,1]=4 5739 B11R1.24 CN\N=C\c1cccc(c1)Br Amb16842805 [1,1,0,0,0,0|1,0,1]=4 5740 B11R1.24 COCCC1=CC=CC(=O)N1 Amb24485973 [1,1,0,0,0,0|2,0,0]=4 5741 B11R1.24 COCC[n+]1cc(C)ccc1 Amb25127531 [1,1,0,0,0,0|2,0,0]=4 5742 B11R1.24 COCC[n+]1cc(O)ccc1 Amb25822049 [1,1,0,0,0,0|2,0,0]=4 5743 B11R1.24 COCCc1c[n]cc(N)c1 Amb23570649 [1,1,0,0,0,0|2,0,0]=4 5744 B11R1.24 COCCc1cc(Br)cc[n]1 Amb25735992 [1,1,0,0,0,0|2,0,0]=4 5745 B11R1.24 COCCc1cccc(Br)[n]1 Amb25194969 [1,1,0,0,0,0|2,0,0]=4 5746 B11R1.24 COCCc1cccc(N)c1 Amb24373231 [1,1,0,0,0,0|1,0,0]=3 5747 B11R1.24 COCCc1cccc(O)c1 Amb22055706 [1,1,0,0,0,0|1,0,0]=3 5748 B11R1.24 COCCc1nccc(c1)C Amb10573767 [1,1,0,0,0,0|2,0,0]=4 5749 B11R1.24 COCNc1cccc(F)c1 Amb24102182 [1,1,0,0,0,0|2,0,0]=4 5750 B11R1.24 COCOc1cc(Br)ccc1 Amb25810590 [1,1,0,0,0,0|2,0,0]=4 5751 B11R1.24 COCOc1cc(Cl)ccc1 Amb24551706 [1,1,0,0,0,0|2,0,0]=4 5752 B11R1.24 COCOc1cc(F)ccc1 Amb21858121 [1,1,0,0,0,0|2,0,0]=4 5753 B11R1.24 COCOc1cc(N)ccc1 Amb25096531 [1,1,0,0,0,0|2,0,0]=4 5754 B11R1.24 COCSc1cccc(Cl)c1 Amb24706398 [1,1,0,0,0,0|2,0,0]=4 5755 B11R1.24 COCSc1cccc(N)c1 Amb24532948 [1,1,0,0,0,0|2,0,0]=4 5756 B11R1.24 CONCc1cccc(I)c1 Amb25719180 [1,1,0,0,0,0|2,0,0]=4 5757 B11R1.24 CSCCc1cccc(N)c1 Amb25364016 [1,1,0,0,0,0|1,0,0]=3 5758 B11R1.24 CSCOc1cccc(Cl)c1 Amb24516553 [1,1,0,0,0,0|2,0,0]=4 5759 B11R1.24 CSCSc1cc(Cl)ccc1 Amb24631399 [1,1,0,0,0,0|2,0,0]=4 5760 B11R1.24 Cc1[n]c(CCNC)cc[n]1 Amb25357841 [1,1,0,0,0,0|2,0,0]=4 5761 B11R1.24 Cc1c[n]cc(CCCC)c1 Amb24062203 [1,1,0,0,0,0|2,0,0]=4 5762 B11R1.24 Cc1c[n]cc(CCNC)[n]1 Amb25351862 [1,1,0,0,0,0|2,0,0]=4 5763 B11R1.24 Cc1cc(CCNC)[n]c[n]1 Amb18224297 [1,1,0,0,0,0|2,0,0]=4 5764 B11R1.24 Cc1cc(CCON)ccc1 Amb25704227 [1,1,0,0,0,0|2,0,0]=4 5765 B11R1.24 Cc1cc[n]c(CCCC)c1 Amb24065447 [1,1,0,0,0,0|2,0,0]=4 5766 B11R1.24 Cc1cc[n]c(CCNC)c1 Amb18125194 [1,1,0,0,0,0|1,0,0]=3 5767 B11R1.24 Cc1cccc(CCCC)[n]1 Amb24065450 [1,1,0,0,0,0|2,0,0]=4 5768 B11R1.24 Cc1cccc(CCCC)c1 Amb22730119 [1,1,0,0,0,0|1,0,0]=3 5769 B11R1.24 Cc1cccc(CCNC)[n]1 Amb18125196 [1,1,0,0,0,0|1,0,0]=3 5770 B11R1.24 Cc1cccc(CNOC)c1 Amb25362893 [1,1,0,0,0,0|2,0,0]=4 5771 B11R1.24 Cc1cccc(CSCC)c1 Amb25838308 [1,1,0,0,0,0|2,0,0]=4 5772 B11R1.24 Cc1cccc(c1)SCOC Amb25235859 [1,1,0,0,0,0|2,0,0]=4 5773 B11R1.24 ClCCCc1cccc(I)c1 Amb25239109 [1,1,0,0,0,0|2,0,0]=4 5774 B11R1.24 ClCCCc1cccc(c1)Br Amb17104548 [1,1,0,0,0,0|2,0,0]=4 5775 B11R1.24 ClCCCc1cccc(c1)C Amb17104526 [1,1,0,0,0,0|2,0,0]=4 5776 B11R1.24 ClCCCc1cccc(c1)Cl Amb17104534 [1,1,0,0,0,0|2,0,0]=4 5777 B11R1.24 ClCCCc1cccc(c1)N Amb17477709 [1,1,0,0,0,0|2,0,0]=4 5778 B11R1.24 ClCCCc1cccc(c1)O Amb17477723 [1,1,0,0,0,0|2,0,0]=4 5779 B11R1.24 Fc1cc(CCCBr)ccc1 Amb22886712 [1,1,0,0,0,0|2,0,0]=4 5780 B11R1.24 Fc1cc(CCCCl)ccc1 Amb18803316 [1,1,0,0,0,0|2,0,0]=4 5781 B11R1.24 Fc1cc(CCCS)ccc1 Amb18065480 [1,1,0,0,0,0|2,0,0]=4 5782 B11R1.24 Fc1cc(CC[Zn]Br)ccc1 Amb22000496 [1,1,0,0,0,0|2,0,0]=4 5783 B11R1.24 N#CCCc1cccc(I)c1 Amb25312666 [1,1,0,0,0,0|2,0,0]=4 5784 B11R1.24 N#CCCc1cccc(c1)C Amb17204296 [1,1,0,0,0,0|2,0,0]=4 5785 B11R1.24 N#CCCc1cccc(c1)Cl Amb17204310 [1,1,0,0,0,0|2,0,0]=4 5786 B11R1.24 N#CCCc1cccc(c1)F Amb10841716 [1,1,0,0,0,0|2,0,0]=4 5787 B11R1.24 NCCCc1cccc(Br)c1 Amb19373503 [1,1,0,0,0,0|2,0,0]=4 5788 B11R1.24 NCCCc1cccc(c1)Cl Amb13951536 [1,1,0,0,0,0|2,0,0]=4 5789 B11R1.24 NCCCc1cccc(c1)F Amb13949159 [1,1,0,0,0,0|2,0,0]=4 5790 B11R1.24 NCCCc1cccc(c1)N Amb17477694 [1,1,0,0,0,0|2,0,0]=4 5791 B11R1.24 NCCCc1cccc(c1)O Amb17101314 [1,1,0,0,0,0|2,0,0]=4 5792 B11R1.24 NNCCc1cccc(Cl)c1 Amb24064170 [1,1,0,0,0,0|1,0,0]=3 5793 B11R1.24 NNCCc1cccc(c1)Br Amb17404394 [1,1,0,0,0,0|1,0,0]=3 5794 B11R1.24 NNCCc1cccc(c1)C Amb17399915 [1,1,0,0,0,0|1,0,0]=3 5795 B11R1.24 NNCCc1cccc(c1)Cl Amb17400340 [1,1,0,0,0,0|1,0,0]=3 5796 B11R1.24 NOCCc1cccc(Cl)c1 Amb25152729 [1,1,0,0,0,0|2,0,0]=4 5797 B11R1.24 NOCCc1cccc(F)c1 Amb22896630 [1,1,0,0,0,0|2,0,0]=4 5798 B11R1.24 Nc1cc(CCC=O)ccc1 Amb24486988 [1,1,0,0,0,0|2,0,0]=4 5799 B11R1.24 Nc1cc(CCNN)cc[n]1 Amb25288641 [1,1,0,0,0,0|2,0,0]=4 5800 B11R1.24 O=CCCc1cccc(I)c1 Amb24637998 [1,1,0,0,0,0|2,0,0]=4 5801 B11R1.24 O=CCCc1cccc(S)c1 Amb24615973 [1,1,0,0,0,0|2,0,0]=4 5802 B11R1.24 O=CCCc1cccc(c1)Br Amb17081695 [1,1,0,0,0,0|2,0,0]=4 5803 B11R1.24 O=CCCc1cccc(c1)O Amb17081694 [1,1,0,0,0,0|2,0,0]=4 5804 B11R1.24 OCCCc1cccc(I)c1 Amb25075756 [1,1,0,0,0,0|2,0,0]=4 5805 B11R1.24 OCCCc1cccc(c1)Br Amb17089515 [1,1,0,0,0,0|2,0,0]=4 5806 B11R1.24 OCCCc1cccc(c1)C Amb17089495 [1,1,0,0,0,0|2,0,0]=4 5807 B11R1.24 OCCCc1cccc(c1)Cl Amb17089500 [1,1,0,0,0,0|2,0,0]=4 5808 B11R1.24 OCCCc1cccc(c1)F Amb17605781 [1,1,0,0,0,0|2,0,0]=4 5809 B11R1.24 OCCCc1cccc(c1)N Amb17477701 [1,1,0,0,0,0|2,0,0]=4 5810 B11R1.24 OCCCc1cccc(c1)O Amb17089514 [1,1,0,0,0,0|2,0,0]=4 5811 B11R1.24 Oc1cc(CCCBr)ccc1 Amb18657769 [1,1,0,0,0,0|2,0,0]=4 5812 B11R1.24 SCCCc1cccc(c1)Br Amb17407561 [1,1,0,0,0,0|2,0,0]=4 5813 B11R1.24 SCCCc1cccc(c1)C Amb17400219 [1,1,0,0,0,0|2,0,0]=4 5814 B11R1.24 SCCCc1cccc(c1)Cl Amb17401096 [1,1,0,0,0,0|2,0,0]=4 5815 B11R1.28 BrCCCCc1cc[n]cc1 Amb24102841 [1,1,0,0,0,0|2,0,0]=4 5816 B11R1.28 BrCCCOc1ccccc1 Amb1154134 [1,1,0,0,0,0|2,0,0]=4 5817 B11R1.28 BrCCNCc1ccccc1 Amb18131678 [1,1,0,0,0,0|2,0,0]=4 5818 B11R1.28 BrC\C=C\Cc1ccccc1 Amb25039914 [1,1,0,0,0,0|1,0,1]=4 5819 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [1,1,0,0,0,0|2,0,0]=4 5820 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [1,1,0,0,0,0|1,0,1]=4 5821 B11R1.28 C#CCCNc1ccccc1 Amb25063678 [1,1,0,0,0,0|1,0,1]=4 5822 B11R1.28 C#CCCSc1ccccc1 Amb24477610 [1,1,0,0,0,0|1,0,1]=4 5823 B11R1.28 C#CCNCc1ccccc1 Amb21972217 [1,1,0,0,0,0|1,0,1]=4 5824 B11R1.28 C#CCSCc1ccccc1 Amb18800670 [1,1,0,0,0,0|1,0,1]=4 5825 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [1,1,0,0,0,0|1,0,0]=3 5826 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [1,1,0,0,0,0|1,0,1]=4 5827 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [1,1,0,0,0,0|1,0,1]=4 5828 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [1,1,0,0,0,0|1,0,1]=4 5829 B11R1.28 C=NCCNc1ccccc1 Amb24486057 [1,1,0,0,0,0|0,0,2]=4 5830 B11R1.28 CC#CCNc1ccccc1 Amb21953777 [1,1,0,0,0,0|1,0,1]=4 5831 B11R1.28 CC#CCOc1ccccc1 Amb25119404 [1,1,0,0,0,0|1,0,1]=4 5832 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [1,1,0,0,0,0|2,0,0]=4 5833 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [1,1,0,0,0,0|1,0,0]=3 5834 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [1,1,0,0,0,0|2,0,0]=4 5835 B11R1.28 CCCCCc1cccnc1 Amb17672949 [1,1,0,0,0,0|2,0,0]=4 5836 B11R1.28 CCCCCc1ccncc1 Amb17672950 [1,1,0,0,0,0|2,0,0]=4 5837 B11R1.28 CCCCOc1c[n]ccc1 Amb25382997 [1,1,0,0,0,0|2,0,0]=4 5838 B11R1.28 CCCCOc1cc[n]cc1 Amb25383158 [1,1,0,0,0,0|2,0,0]=4 5839 B11R1.28 CCCCSc1cccc[n]1 Amb25383894 [1,1,0,0,0,0|2,0,0]=4 5840 B11R1.28 CCCNCc1c[n]ccc1 Amb19890575 [1,1,0,0,0,0|2,0,0]=4 5841 B11R1.28 CCCNCc1cc[n]cc1 Amb19890591 [1,1,0,0,0,0|2,0,0]=4 5842 B11R1.28 CCCNCc1cccc[n]1 Amb19890306 [1,1,0,0,0,0|2,0,0]=4 5843 B11R1.28 CCCNCc1cccc[n]1 Amb19890563 [1,1,0,0,0,0|2,0,0]=4 5844 B11R1.28 CCCNCc1ccccc1 Amb1105937 [1,1,0,0,0,0|1,0,0]=3 5845 B11R1.28 CCCSSc1ccccc1 Amb25383743 [1,1,0,0,0,0|2,0,0]=4 5846 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [1,1,0,0,0,0|1,0,1]=4 5847 B11R1.28 CCNCC[n+]1ccccc1 Amb25383240 [1,1,0,0,0,0|1,0,0]=3 5848 B11R1.28 CCNCCc1[n]ccc[n]1 Amb19028710 [1,1,0,0,0,0|2,0,0]=4 5849 B11R1.28 CCNCCc1c[n]c[n]c1 Amb18312962 [1,1,0,0,0,0|2,0,0]=4 5850 B11R1.28 CCNCCc1c[n]cc[n]1 Amb24750672 [1,1,0,0,0,0|2,0,0]=4 5851 B11R1.28 CCNCCc1c[n]ccc1 Amb18303850 [1,1,0,0,0,0|1,0,0]=3 5852 B11R1.28 CCNCCc1ccccc1 Amb2119468 [1,1,0,0,0,0|0,0,0]=2 5853 B11R1.28 CCOCC[n+]1ccccc1 Amb24762647 [1,1,0,0,0,0|2,0,0]=4 5854 B11R1.28 CCOCNc1ccccc1 Amb25856976 [1,1,0,0,0,0|2,0,0]=4 5855 B11R1.28 CCOCSc1ccccc1 Amb24762591 [1,1,0,0,0,0|2,0,0]=4 5856 B11R1.28 CCONCc1ccccc1 Amb25151184 [1,1,0,0,0,0|2,0,0]=4 5857 B11R1.28 CCSCSc1ccccc1 Amb25380606 [1,1,0,0,0,0|2,0,0]=4 5858 B11R1.28 CNCC#Cc1c[n]ccc1 Amb25367338 [1,1,0,0,0,0|1,0,1]=4 5859 B11R1.28 CNCC#Cc1ccccc1 Amb18296119 [1,1,0,0,0,0|0,0,1]=3 5860 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [1,1,0,0,0,0|1,0,0]=3 5861 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [1,1,0,0,0,0|1,0,0]=3 5862 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [1,1,0,0,0,0|1,0,0]=3 5863 B11R1.28 CNCCCc1ccccc1 Amb21954280 [1,1,0,0,0,0|0,0,0]=2 5864 B11R1.28 CNCCNc1[n]ccc[n]1 Amb18313181 [1,1,0,0,0,0|2,0,0]=4 5865 B11R1.28 CNCCNc1c[n]cc[n]1 Amb18313332 [1,1,0,0,0,0|2,0,0]=4 5866 B11R1.28 CNCCNc1cc[n]c[n]1 Amb18313343 [1,1,0,0,0,0|2,0,0]=4 5867 B11R1.28 CNCCNc1cc[n]cc1 Amb18313323 [1,1,0,0,0,0|1,0,0]=3 5868 B11R1.28 CNCCNc1ccc[n][n]1 Amb19027499 [1,1,0,0,0,0|2,0,0]=4 5869 B11R1.28 CNCCNc1cccc[n]1 Amb18313466 [1,1,0,0,0,0|1,0,0]=3 5870 B11R1.28 CNCCOc1[n]ccc[n]1 Amb19020814 [1,1,0,0,0,0|2,0,0]=4 5871 B11R1.28 CNCCOc1c[n]c[n]c1 Amb24095071 [1,1,0,0,0,0|2,0,0]=4 5872 B11R1.28 CNCCOc1c[n]cc[n]1 Amb19020813 [1,1,0,0,0,0|2,0,0]=4 5873 B11R1.28 CNCCOc1c[n]ccc1 Amb18312519 [1,1,0,0,0,0|1,0,0]=3 5874 B11R1.28 CNCCOc1cc[n]c[n]1 Amb19020825 [1,1,0,0,0,0|2,0,0]=4 5875 B11R1.28 CNCCOc1cc[n]cc1 Amb19020798 [1,1,0,0,0,0|1,0,0]=3 5876 B11R1.28 CNCCOc1ccc[n][n]1 Amb19023212 [1,1,0,0,0,0|2,0,0]=4 5877 B11R1.28 CNCCOc1cccc[n]1 Amb19020802 [1,1,0,0,0,0|1,0,0]=3 5878 B11R1.28 CNCCOc1ccccc1 Amb1105525 [1,1,0,0,0,0|0,0,0]=2 5879 B11R1.28 CNCCSc1[n]ccc[n]1 Amb18312269 [1,1,0,0,0,0|2,0,0]=4 5880 B11R1.28 CNCCSc1cccc[n]1 Amb19024669 [1,1,0,0,0,0|1,0,0]=3 5881 B11R1.28 CNCCSc1ccccc1 Amb10608735 [1,1,0,0,0,0|0,0,0]=2 5882 B11R1.28 CNCCSc1ccccc1 Amb17622507 [1,1,0,0,0,0|0,0,0]=2 5883 B11R1.28 CNC\C=C\c1c[n]ccc1 Amb23442752 [1,1,0,0,0,0|1,0,1]=4 5884 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [1,1,0,0,0,0|0,0,1]=3 5885 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [1,1,0,0,0,0|1,0,1]=4 5886 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [1,1,0,0,0,0|2,0,0]=4 5887 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [1,1,0,0,0,0|2,0,0]=4 5888 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [1,1,0,0,0,0|2,0,0]=4 5889 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [1,1,0,0,0,0|2,0,0]=4 5890 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [1,1,0,0,0,0|2,0,0]=4 5891 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [1,1,0,0,0,0|2,0,0]=4 5892 B11R1.28 COCCSc1ccccn1 Amb17760116 [1,1,0,0,0,0|2,0,0]=4 5893 B11R1.28 COCNCc1ccccc1 Amb25053350 [1,1,0,0,0,0|1,0,0]=3 5894 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [1,1,0,0,0,0|1,0,0]=3 5895 B11R1.28 CONCCc1ccccc1 Amb22897018 [1,1,0,0,0,0|0,0,0]=2 5896 B11R1.28 CONCOc1ccccc1 Amb24096695 [1,1,0,0,0,0|1,0,0]=3 5897 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [1,1,0,0,0,0|2,0,0]=4 5898 B11R1.28 CSCCCc1ccccc1 Amb25383748 [1,1,0,0,0,0|1,0,0]=3 5899 B11R1.28 CSCCNc1ccccc1 Amb17307504 [1,1,0,0,0,0|1,0,0]=3 5900 B11R1.28 CSCSCc1ccccc1 Amb25380610 [1,1,0,0,0,0|1,0,0]=3 5901 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [1,1,0,0,0,0|2,0,0]=4 5902 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [1,1,0,0,0,0|1,0,1]=4 5903 B11R1.28 ClCC#CCc1ccccc1 Amb24453719 [1,1,0,0,0,0|1,0,1]=4 5904 B11R1.28 ClCCCCc1c[n]ccc1 Amb24762958 [1,1,0,0,0,0|2,0,0]=4 5905 B11R1.28 ClCCCCc1cc[n]cc1 Amb20622009 [1,1,0,0,0,0|2,0,0]=4 5906 B11R1.28 ClCCCCc1cc[n]cc1 Amb21962609 [1,1,0,0,0,0|2,0,0]=4 5907 B11R1.28 ClCCCCc1cccc[n]1 Amb24762960 [1,1,0,0,0,0|2,0,0]=4 5908 B11R1.28 ClCCCOc1ccccc1 Amb1128627 [1,1,0,0,0,0|2,0,0]=4 5909 B11R1.28 ClCCCSc1ccccc1 Amb1132759 [1,1,0,0,0,0|2,0,0]=4 5910 B11R1.28 ClC\C=C\Cc1ccccc1 Amb24462747 [1,1,0,0,0,0|1,0,1]=4 5911 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [1,1,0,0,0,0|2,0,0]=4 5912 B11R1.28 FCCCOc1ccccc1 Amb22008296 [1,1,0,0,0,0|2,0,0]=4 5913 B11R1.28 FCCCSc1ccccc1 Amb25382654 [1,1,0,0,0,0|2,0,0]=4 5914 B11R1.28 FCCNCc1ccccc1 Amb24611358 [1,1,0,0,0,0|2,0,0]=4 5915 B11R1.28 ICCCCc1ccccc1 Amb25380384 [1,1,0,0,0,0|1,0,0]=3 5916 B11R1.28 ICCNCc1ccccc1 Amb25188796 [1,1,0,0,0,0|2,0,0]=4 5917 B11R1.28 ICCOCc1ccccc1 Amb16191915 [1,1,0,0,0,0|2,0,0]=4 5918 B11R1.28 N#CCCNc1ccccc1 Amb1645915 [1,1,0,0,0,0|2,0,0]=4 5919 B11R1.28 N#CCCOc1ccccc1 Amb1202508 [1,1,0,0,0,0|2,0,0]=4 5920 B11R1.28 N#CCNCc1ccccc1 Amb22491357 [1,1,0,0,0,0|2,0,0]=4 5921 B11R1.28 N#CC[NH2+]Cc1ccccc1 Amb24113886 [1,1,0,0,0,0|2,0,0]=4 5922 B11R1.28 N#CNCCc1c[n]ccc1 Amb25821764 [1,1,0,0,0,0|1,0,1]=4 5923 B11R1.28 N#CNCCc1cc[n]cc1 Amb25851038 [1,1,0,0,0,0|1,0,1]=4 5924 B11R1.28 NCC#CCc1ccccc1 Amb25104593 [1,1,0,0,0,0|1,0,1]=4 5925 B11R1.28 NCCCCc1cc[n]cc1 Amb17991253 [1,1,0,0,0,0|2,0,0]=4 5926 B11R1.28 NCCCCc1ccccc1 Amb1227740 [1,1,0,0,0,0|1,0,0]=3 5927 B11R1.28 NCCCCc1ccccc1 Amb19929939 [1,1,0,0,0,0|1,0,0]=3 5928 B11R1.28 NCCCCc1ccccn1 Amb1102767 [1,1,0,0,0,0|2,0,0]=4 5929 B11R1.28 NCCCNc1ccccc1 Amb10086594 [1,1,0,0,0,0|2,0,0]=4 5930 B11R1.28 NCCCOc1ccccc1 Amb1108619 [1,1,0,0,0,0|2,0,0]=4 5931 B11R1.28 NCCCSc1ccccc1 Amb1089343 [1,1,0,0,0,0|2,0,0]=4 5932 B11R1.28 NCCCSc1ccccc1 Amb2099802 [1,1,0,0,0,0|2,0,0]=4 5933 B11R1.28 NCCOCc1ccccc1 Amb1081962 [1,1,0,0,0,0|2,0,0]=4 5934 B11R1.28 NCCOCc1ccccc1 Amb2137059 [1,1,0,0,0,0|2,0,0]=4 5935 B11R1.28 NCNCCc1ccccc1 Amb25385258 [1,1,0,0,0,0|0,0,0]=2 5936 B11R1.28 NC\C=C\Cc1ccccc1 Amb24351087 [1,1,0,0,0,0|1,0,1]=4 5937 B11R1.28 NNCCCc1c[n]ccc1 Amb18125323 [1,1,0,0,0,0|2,0,0]=4 5938 B11R1.28 NNCCCc1ccccc1 Amb19373221 [1,1,0,0,0,0|1,0,0]=3 5939 B11R1.28 NNCCSc1ccccc1 Amb18126564 [1,1,0,0,0,0|1,0,0]=3 5940 B11R1.28 NNC\C=C\c1ccccc1 Amb24563952 [1,1,0,0,0,0|1,0,1]=4 5941 B11R1.28 NNNCNc1ccccc1 Amb25251558 [1,1,0,0,0,0|2,0,0]=4 5942 B11R1.28 NOCCCc1ccccc1 Amb22231356 [1,1,0,0,0,0|2,0,0]=4 5943 B11R1.28 NOCCNc1ccccc1 Amb24486573 [1,1,0,0,0,0|2,0,0]=4 5944 B11R1.28 NOCCOc1ccccc1 Amb17088287 [1,1,0,0,0,0|2,0,0]=4 5945 B11R1.28 NOCCOc1ccccc1 Amb19894640 [1,1,0,0,0,0|2,0,0]=4 5946 B11R1.28 NOCOCc1ccccc1 Amb10606697 [1,1,0,0,0,0|2,0,0]=4 5947 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [1,1,0,0,0,0|0,0,2]=4 5948 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [1,1,0,0,0,0|2,0,0]=4 5949 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [1,1,0,0,0,0|2,0,0]=4 5950 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [1,1,0,0,0,0|2,0,0]=4 5951 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [1,1,0,0,0,0|1,0,1]=4 5952 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [1,1,0,0,0,0|1,0,1]=4 5953 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [1,1,0,0,0,0|0,0,1]=3 5954 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [1,1,0,0,0,0|1,0,1]=4 5955 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [1,1,0,0,0,0|2,0,0]=4 5956 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [1,1,0,0,0,0|2,0,0]=4 5957 B11R1.28 OCCCCc1ccncc1 Amb17740015 [1,1,0,0,0,0|2,0,0]=4 5958 B11R1.28 OCCCNc1ccccc1 Amb17307125 [1,1,0,0,0,0|2,0,0]=4 5959 B11R1.28 OCCCNc1ccccc1 Amb17772314 [1,1,0,0,0,0|2,0,0]=4 5960 B11R1.28 OCCNCc1ccccc1 Amb1835287 [1,1,0,0,0,0|2,0,0]=4 5961 B11R1.28 OC\C=C\Cc1ccccc1 Amb25074433 [1,1,0,0,0,0|1,0,1]=4 5962 B11R1.28 ONCCOc1ccccc1 Amb17088413 [1,1,0,0,0,0|1,0,0]=3 5963 B11R1.28 SCCCCc1c[n]ccc1 Amb18563823 [1,1,0,0,0,0|2,0,0]=4 5964 B11R1.28 SCCCCc1cc[n]cc1 Amb18065469 [1,1,0,0,0,0|2,0,0]=4 5965 B11R1.28 SCCCCc1cccc[n]1 Amb18563822 [1,1,0,0,0,0|2,0,0]=4 5966 B11R1.28 SCCCCc1ccccc1 Amb17400224 [1,1,0,0,0,0|1,0,0]=3 5967 B11R1.28 [N-]=[N+]=NCCc1ccccc1 Amb19149244 [1,1,0,0,0,0|1,0,1]=4 5968 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [1,1,0,0,0,0|1,0,0]=3 5969 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [1,1,0,0,0,0|2,0,0]=4 5970 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [1,1,0,0,0,0|2,0,0]=4 5971 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [1,1,0,0,0,0|2,0,0]=4 5972 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [1,1,0,0,0,0|1,0,1]=4 5973 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [1,1,0,0,0,0|1,0,1]=4 5974 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [1,1,0,0,0,0|1,0,1]=4 5975 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [1,1,0,0,0,0|1,0,1]=4 5976 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,1,0,0,0,0|1,0,1]=4 5977 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [1,1,0,0,0,0|1,0,1]=4 5978 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [1,1,0,0,0,0|1,0,1]=4 5979 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,1,0,0,0,0|2,0,0]=4 5980 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,1,0,0,0,0|2,0,0]=4 5981 B11R1.40 CC(Cc1c[n]ccc1)NN Amb25341062 [1,1,0,0,0,0|2,0,0]=4 5982 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [1,1,0,0,0,0|2,0,0]=4 5983 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [1,1,0,0,0,0|1,0,1]=4 5984 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [1,1,0,0,0,0|1,0,0]=3 5985 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [1,1,0,0,0,0|2,0,0]=4 5986 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [1,1,0,0,0,0|2,0,0]=4 5987 B11R1.40 CC(NC)Cc1cnccn1 Amb1995173 [1,1,0,0,0,0|2,0,0]=4 5988 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [1,1,0,0,0,0|2,0,0]=4 5989 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,1,0,0,0,0|1,0,0]=3 5990 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [1,1,0,0,0,0|2,0,0]=4 5991 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [1,1,0,0,0,0|2,0,0]=4 5992 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,1,0,0,0,0|2,0,0]=4 5993 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,1,0,0,0,0|2,0,0]=4 5994 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [1,1,0,0,0,0|2,0,0]=4 5995 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [1,1,0,0,0,0|2,0,0]=4 5996 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [1,1,0,0,0,0|2,0,0]=4 5997 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [1,1,0,0,0,0|2,0,0]=4 5998 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [1,1,0,0,0,0|2,0,0]=4 5999 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [1,1,0,0,0,0|2,0,0]=4 6000 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,1,0,0,0,0|1,0,0]=3 6001 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [1,1,0,0,0,0|2,0,0]=4 6002 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [1,1,0,0,0,0|2,0,0]=4 6003 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [1,1,0,0,0,0|2,0,0]=4 6004 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [1,1,0,0,0,0|1,0,0]=3 6005 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [1,1,0,0,0,0|1,0,0]=3 6006 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [1,1,0,0,0,0|1,0,0]=3 6007 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,1,0,0,0,0|1,0,0]=3 6008 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,1,0,0,0,0|1,0,0]=3 6009 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [1,1,0,0,0,0|1,0,0]=3 6010 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [1,1,0,0,0,0|2,0,0]=4 6011 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,1,0,0,0,0|1,0,0]=3 6012 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [1,1,0,0,0,0|1,0,1]=4 6013 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,1,0,0,0,0|1,0,1]=4 6014 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,1,0,0,0,0|1,0,1]=4 6015 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,1,0,0,0,0|1,0,1]=4 6016 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [1,1,0,0,0,0|0,0,1]=3 6017 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [1,1,0,0,0,0|0,0,0]=2 6018 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [1,1,0,0,0,0|1,0,0]=3 6019 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [1,1,0,0,0,0|0,0,0]=2 6020 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [1,1,0,0,0,0|1,0,1]=4 6021 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,1,0,0,0,0|1,0,1]=4 6022 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,1,0,0,0,0|1,0,1]=4 6023 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [1,1,0,0,0,0|2,0,0]=4 6024 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [1,1,0,0,0,0|1,0,0]=3 6025 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [1,1,0,0,0,0|1,0,0]=3 6026 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [1,1,0,0,0,0|1,1,0]=4 6027 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [1,1,0,0,0,0|1,0,1]=4 6028 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [1,1,0,0,0,0|1,0,1]=4 6029 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,1,0,0,0,0|2,0,0]=4 6030 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,1,0,0,0,0|2,0,0]=4 6031 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [1,1,0,0,0,0|2,0,0]=4 6032 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [1,1,0,0,0,0|0,0,2]=4 6033 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [1,1,0,0,0,0|0,0,2]=4 6034 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [1,1,0,0,0,0|2,0,0]=4 6035 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [1,1,0,0,0,0|2,0,0]=4 6036 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [1,1,0,0,0,0|2,0,0]=4 6037 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [1,1,0,0,0,0|2,0,0]=4 6038 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [1,1,0,0,0,0|2,0,0]=4 6039 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,1,0,0,0,0|2,0,0]=4 6040 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [1,1,0,0,0,0|2,0,0]=4 6041 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [1,1,0,0,0,0|2,0,0]=4 6042 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,1,0,0,0,0|1,0,1]=4 6043 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [1,1,0,0,0,0|2,0,0]=4 6044 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [1,1,0,0,0,0|2,0,0]=4 6045 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [1,1,0,0,0,0|1,0,0]=3 6046 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [1,1,0,0,0,0|2,0,0]=4 6047 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [1,1,0,0,0,0|2,0,0]=4 6048 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [1,1,0,0,0,0|2,0,0]=4 6049 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [1,1,0,0,0,0|2,0,0]=4 6050 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,1,0,0,0,0|2,0,0]=4 6051 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [1,1,0,0,0,0|2,0,0]=4 6052 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,1,0,0,0,0|2,0,0]=4 6053 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [1,1,0,0,0,0|1,0,1]=4 6054 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [1,1,0,0,0,0|1,0,1]=4 6055 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [1,1,0,0,0,0|2,0,0]=4 6056 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [1,1,0,0,0,0|2,0,0]=4 6057 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [1,1,0,0,0,0|2,0,0]=4 6058 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [1,1,0,0,0,0|2,0,0]=4 6059 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [1,1,0,0,0,0|2,0,0]=4 6060 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [1,1,0,0,0,0|2,0,0]=4 6061 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [1,1,0,0,0,0|2,0,0]=4 6062 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [1,1,0,0,0,0|2,0,0]=4 6063 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [1,1,0,0,0,0|2,0,0]=4 6064 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [1,1,0,0,0,0|2,0,0]=4 6065 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [1,1,0,0,0,0|2,0,0]=4 6066 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [1,1,0,0,0,0|2,0,0]=4 6067 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [1,1,0,0,0,0|2,0,0]=4 6068 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [1,1,0,0,0,0|2,0,0]=4 6069 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [1,1,0,0,0,0|2,0,0]=4 6070 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [1,1,0,0,0,0|2,0,0]=4 6071 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,1,0,0,0,0|2,0,0]=4 6072 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [1,1,0,0,0,0|2,0,0]=4 6073 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [1,1,0,0,0,0|2,0,0]=4 6074 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [1,1,0,0,0,0|2,0,0]=4 6075 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [1,1,0,0,0,0|2,0,0]=4 6076 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,1,0,0,0,0|2,0,0]=4 6077 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [1,1,0,0,0,0|2,0,0]=4 6078 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [1,1,0,0,0,0|2,0,0]=4 6079 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [1,1,0,0,0,0|2,0,0]=4 6080 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [1,1,0,0,0,0|2,0,0]=4 6081 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,1,0,0,0,0|2,0,0]=4 6082 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [1,1,0,0,0,0|2,0,0]=4 6083 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,1,0,0,0,0|2,0,0]=4 6084 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [1,1,0,0,0,0|2,0,0]=4 6085 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [1,1,0,0,0,0|2,0,0]=4 6086 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,1,0,0,0,0|2,0,0]=4 6087 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,1,0,0,0,0|2,0,0]=4 6088 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,1,0,0,0,0|2,0,0]=4 6089 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,1,0,0,0,0|2,0,0]=4 6090 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,1,0,0,0,0|2,0,0]=4 6091 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,1,0,0,0,0|2,0,0]=4 6092 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,1,0,0,0,0|2,0,0]=4 6093 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,1,0,0,0,0|2,0,0]=4 6094 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,1,0,0,0,0|2,0,0]=4 6095 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,1,0,0,0,0|2,0,0]=4 6096 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,1,0,0,0,0|2,0,0]=4 6097 B11R1.91 CC(Br)COc1ccccc1 Amb25278262 [1,1,0,0,0,0|2,0,0]=4 6098 B11R1.91 CC(CCc1ccccn1)N Amb17507327 [1,1,0,0,0,0|2,0,0]=4 6099 B11R1.91 CC(CCc1ccccn1)O Amb17507263 [1,1,0,0,0,0|2,0,0]=4 6100 B11R1.91 CC(CCc1cccnc1)N Amb17507328 [1,1,0,0,0,0|2,0,0]=4 6101 B11R1.91 CC(CCc1cccnc1)O Amb17507264 [1,1,0,0,0,0|2,0,0]=4 6102 B11R1.91 CC(CCc1ccncc1)N Amb17507329 [1,1,0,0,0,0|2,0,0]=4 6103 B11R1.91 CC(CCc1ccncc1)O Amb17507265 [1,1,0,0,0,0|2,0,0]=4 6104 B11R1.91 CC(COc1ccccc1)N Amb10609380 [1,1,0,0,0,0|2,0,0]=4 6105 B11R1.91 CC(COc1ccccc1)N Amb1126967 [1,1,0,0,0,0|2,0,0]=4 6106 B11R1.91 CC(Cl)CCc1c[n]ccc1 Amb24486010 [1,1,0,0,0,0|2,0,0]=4 6107 B11R1.91 CC(Cl)CCc1cc[n]cc1 Amb24369393 [1,1,0,0,0,0|2,0,0]=4 6108 B11R1.91 CC(Cl)COc1ccccc1 Amb20248050 [1,1,0,0,0,0|2,0,0]=4 6109 B11R1.91 CC(Cl)CSc1ccccc1 Amb25361088 [1,1,0,0,0,0|2,0,0]=4 6110 B11R1.91 CC(N)CNc1ccccc1 Amb18972362 [1,1,0,0,0,0|2,0,0]=4 6111 B11R1.91 CC(N)CSc1ccccc1 Amb18065472 [1,1,0,0,0,0|2,0,0]=4 6112 B11R1.91 CC(N)CSc1ccccc1 Amb21988436 [1,1,0,0,0,0|2,0,0]=4 6113 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [1,1,0,0,0,0|2,0,0]=4 6114 B11R1.91 CC(O)CSc1ccccc1 Amb18793066 [1,1,0,0,0,0|2,0,0]=4 6115 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,1,0,0,0,0|2,0,0]=4 6116 B11R1.91 CC(S)CNc1ccccc1 Amb25701720 [1,1,0,0,0,0|2,0,0]=4 6117 B11R1.91 CN(C)/N=C/c1ccccc1 Amb17703328 [1,1,0,0,0,0|1,0,1]=4 6118 B11R1.91 CN(C)CCc1cc[n]cc1 Amb24073816 [1,1,0,0,0,0|1,0,0]=3 6119 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [1,1,0,0,0,0|0,0,0]=2 6120 B11R1.91 CN(C)NCc1cc[n]cc1 Amb25151715 [1,1,0,0,0,0|2,0,0]=4 6121 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [1,1,0,0,0,0|1,0,0]=3 6122 B11R1.91 CN(C)\C=C\c1ccccc1 Amb25056753 [1,1,0,0,0,0|0,0,2]=4 6123 B11R1.91 CN(C)\C=N\c1ccccc1 Amb22357796 [1,1,0,0,0,0|1,0,1]=4 6124 B11R1.91 CN(N)CCc1cccc[n]1 Amb25725193 [1,1,0,0,0,0|1,0,0]=3 6125 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,1,0,0,0,0|0,0,0]=2 6126 B11R1.91 CN(O)CCc1cc[n]cc1 Amb25684228 [1,1,0,0,0,0|1,0,0]=3 6127 B11R1.91 CN(O)N=Nc1ccccc1 Amb24064881 [1,1,0,0,0,0|2,0,0]=4 6128 B11R1.91 C[C@@H](COc1ccccc1)N Amb17232092 [1,1,0,0,0,0|2,0,0]=4 6129 B11R1.91 C[C@@H](N)CCc1cc[n]cc1 Amb24551017 [1,1,0,0,0,0|2,0,0]=4 6130 B11R1.91 C[C@@H](N)CCc1cccc[n]1 Amb25076768 [1,1,0,0,0,0|2,0,0]=4 6131 B11R1.91 C[C@@H](N)CNc1ccccc1 Amb24392348 [1,1,0,0,0,0|2,0,0]=4 6132 B11R1.91 C[C@@H](N)COc1ccccc1 Amb18538481 [1,1,0,0,0,0|2,0,0]=4 6133 B11R1.91 C[C@@H](N)CSc1ccccc1 Amb24692771 [1,1,0,0,0,0|2,0,0]=4 6134 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,1,0,0,0,0|1,0,0]=3 6135 B11R1.91 C[C@@H](O)CSc1ccccc1 Amb25148170 [1,1,0,0,0,0|2,0,0]=4 6136 B11R1.91 C[C@H](N)CCc1cc[n]cc1 Amb24715801 [1,1,0,0,0,0|2,0,0]=4 6137 B11R1.91 C[C@H](N)CNc1ccccc1 Amb24423922 [1,1,0,0,0,0|2,0,0]=4 6138 B11R1.91 C[C@H](N)CSc1ccccc1 Amb24486596 [1,1,0,0,0,0|2,0,0]=4 6139 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,1,0,0,0,0|1,0,0]=3 6140 B11R1.91 C[C@H](O)CNc1ccccc1 Amb25060992 [1,1,0,0,0,0|2,0,0]=4 6141 B11R1.91 C[C@H](O)COc1ccccc1 Amb25786939 [1,1,0,0,0,0|2,0,0]=4 6142 B11R1.91 C[C@H](O)CSc1ccccc1 Amb25852129 [1,1,0,0,0,0|2,0,0]=4 6143 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [1,1,0,0,0,0|1,0,0]=3 6144 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,1,0,0,0,0|2,0,0]=4 6145 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [1,1,0,0,0,0|2,0,0]=4 6146 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [1,1,0,0,0,0|2,0,0]=4 6147 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [1,1,0,0,0,0|2,0,0]=4 6148 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,1,0,0,0,0|2,0,0]=4 6149 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,1,0,0,0,0|2,0,0]=4 6150 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [1,1,0,0,0,0|2,0,0]=4 6151 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,1,0,0,0,0|2,0,0]=4 6152 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [1,1,0,0,0,0|2,0,0]=4 6153 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [1,1,0,0,0,0|2,0,0]=4 6154 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [1,1,0,0,0,0|1,0,1]=4 6155 B11R1.2 CCC(CCC)[n]1cccc1 Amb18799393 [0,1,0,0,1,0|2,0,0]=4 6156 B11R1.2 CCC(CNC)[n]1c[n]cc1 Amb19022976 [0,1,0,0,1,0|2,0,0]=4 6157 B11R1.2 CCC(CNC)[n]1ccc[n]1 Amb18311222 [0,1,0,0,1,0|2,0,0]=4 6158 B11R1.2 CCC(CSC)[n]1cccc1 Amb24761648 [0,1,0,0,1,0|2,0,0]=4 6159 B11R1.2 CCCC(NC)c1c[s]cc1 Amb18793547 [0,1,0,0,1,0|2,0,0]=4 6160 B11R1.2 CCCC(NC)c1ccco1 Amb19033674 [0,1,0,0,1,0|2,0,0]=4 6161 B11R1.2 CCCC(c1cccs1)CBr Amb17250571 [0,1,0,0,1,0|2,0,0]=4 6162 B11R1.2 CCCC(c1cccs1)CCl Amb17234618 [0,1,0,0,1,0|2,0,0]=4 6163 B11R1.2 CCCC(c1cccs1)CN Amb17232728 [0,1,0,0,1,0|2,0,0]=4 6164 B11R1.2 CCCC(c1cccs1)CO Amb17232754 [0,1,0,0,1,0|2,0,0]=4 6165 B11R1.2 CNC(CCC)c1c[nH]cc1 Amb25379979 [0,1,0,0,1,0|2,0,0]=4 6166 B11R1.2 CNC(COC)c1ccc[s]1 Amb18307787 [0,1,0,0,1,0|2,0,0]=4 6167 B11R1.2 CNCC(OC)c1c[nH]cc1 Amb18065424 [0,1,0,0,1,0|1,0,0]=3 6168 B11R1.2 CNCC(OC)c1ccc[s]1 Amb18563964 [0,1,0,0,1,0|1,0,0]=3 6169 B11R1.2 CNCC(c1cccs1)CC Amb17232726 [0,1,0,0,1,0|1,0,0]=3 6170 B11R1.2 COC(CNC)c1ccco1 Amb24767049 [0,1,0,0,1,0|1,0,0]=3 6171 B11R1.2 COC(COC)c1ccco1 Amb25379514 [0,1,0,0,1,0|2,0,0]=4 6172 B11R1.2 COCC(CO)[n]1cccc1 Amb24761575 [0,1,0,0,1,0|2,0,0]=4 6173 B11R1.2 CSCC(NC)c1c[s]cc1 Amb24764876 [0,1,0,0,1,0|2,0,0]=4 6174 B11R1.2 CSCC(NC)c1ccc[s]1 Amb19028866 [0,1,0,0,1,0|2,0,0]=4 6175 B11R1.15 CC(c1ccc(s1)Br)CNC Amb17251286 [0,1,0,0,1,0|1,0,0]=3 6176 B11R1.15 CC(c1ccc(s1)Cl)CNC Amb17234843 [0,1,0,0,1,0|1,0,0]=3 6177 B11R1.15 CNCC(C)[n]1cc(Br)c[n]1 Amb18992885 [0,1,0,0,1,0|2,0,0]=4 6178 B11R1.15 CNCC(C)[n]1cc(C)c[n]1 Amb18992883 [0,1,0,0,1,0|2,0,0]=4 6179 B11R1.15 CNCC(C)[n]1cc(Cl)c[n]1 Amb18992884 [0,1,0,0,1,0|2,0,0]=4 6180 B11R1.15 CNCC(C)c1[n]cc(Br)[s]1 Amb24679824 [0,1,0,0,1,0|2,0,0]=4 6181 B11R1.15 CNCC(C)c1[n]cc(Cl)[s]1 Amb24382379 [0,1,0,0,1,0|2,0,0]=4 6182 B11R1.15 CNCC(C)c1[n]cc(I)[s]1 Amb24382758 [0,1,0,0,1,0|2,0,0]=4 6183 B11R1.15 CNCC(O)c1c[n](C)cc1 Amb18065414 [0,1,0,0,1,0|2,0,0]=4 6184 B11R1.15 CNCC(O)c1c[s]c(Br)c1 Amb25189577 [0,1,0,0,1,0|2,0,0]=4 6185 B11R1.15 CNCC(O)c1cc(Br)c[s]1 Amb18301240 [0,1,0,0,1,0|2,0,0]=4 6186 B11R1.15 CNCC(O)c1ccc(Cl)o1 Amb24488003 [0,1,0,0,1,0|2,0,0]=4 6187 B11R1.15 CNCC(c1ccc(s1)Br)O Amb17252670 [0,1,0,0,1,0|2,0,0]=4 6188 B11R1.15 CNCC(c1ccc(s1)Cl)O Amb17235307 [0,1,0,0,1,0|2,0,0]=4 6189 B11R1.15 CNCC(c1scc(n1)C)C Amb17232760 [0,1,0,0,1,0|2,0,0]=4 6190 B11R1.15 Cc1c[n]c([s]1)C(C)CNC Amb24694935 [0,1,0,0,1,0|2,0,0]=4 6191 B11R1.15 Cc1cc(c[nH]1)C(C)CCC Amb24356604 [0,1,0,0,1,0|2,0,0]=4 6192 B11R1.15 Cc1cc(c[nH]1)[C@H](C)CCC Amb24425462 [0,1,0,0,1,0|2,0,0]=4 6193 B11R1.15 Cc1ccc([s]1)C(C)CNC Amb24474323 [0,1,0,0,1,0|1,0,0]=3 6194 B11R1.15 Cc1ccc([s]1)C(O)CNC Amb18301121 [0,1,0,0,1,0|2,0,0]=4 6195 B11R1.29 CC(CCCN)[n]1cccc1 Amb24755429 [0,1,0,0,1,0|2,0,0]=4 6196 B11R1.29 CC(CCCN)c1c[nH]cc1 Amb18563452 [0,1,0,0,1,0|2,0,0]=4 6197 B11R1.29 CC(CCCN)c1ccc[s]1 Amb18563916 [0,1,0,0,1,0|2,0,0]=4 6198 B11R1.29 CC(CCCO)=C1C=CC=C1 Amb24353028 [0,1,0,0,1,0|1,0,1]=4 6199 B11R1.29 CC(SCOC)c1ccc[s]1 Amb24751054 [0,1,0,0,1,0|2,0,0]=4 6200 B11R1.29 CCCCC(C)[n]1cccc1 Amb18799394 [0,1,0,0,1,0|2,0,0]=4 6201 B11R1.29 CCCNC(C)c1c[nH]cc1 Amb21971521 [0,1,0,0,1,0|2,0,0]=4 6202 B11R1.29 CCCNC(C)c1c[s]cc1 Amb18180230 [0,1,0,0,1,0|2,0,0]=4 6203 B11R1.29 CCCN[C@@H](C)c1ccc[s]1 Amb24762115 [0,1,0,0,1,0|2,0,0]=4 6204 B11R1.29 CCCN[C@@H](C)c1ccco1 Amb24762119 [0,1,0,0,1,0|2,0,0]=4 6205 B11R1.29 CCCN[C@H](C)c1ccc[s]1 Amb24762113 [0,1,0,0,1,0|2,0,0]=4 6206 B11R1.29 CCCN[C@H](C)c1ccco1 Amb24762120 [0,1,0,0,1,0|2,0,0]=4 6207 B11R1.29 CCNCC(C)[n]1c[n]cc1 Amb19024998 [0,1,0,0,1,0|2,0,0]=4 6208 B11R1.29 CCNCC(C)[n]1ccc[n]1 Amb19024992 [0,1,0,0,1,0|2,0,0]=4 6209 B11R1.29 CCNCC(C)c1c[s]c[n]1 Amb24754994 [0,1,0,0,1,0|2,0,0]=4 6210 B11R1.29 CCNCC(O)c1c[nH]cc1 Amb18563458 [0,1,0,0,1,0|2,0,0]=4 6211 B11R1.29 CCNCC(O)c1c[s]cc1 Amb19031259 [0,1,0,0,1,0|2,0,0]=4 6212 B11R1.29 CCNCC(c1ccco1)O Amb17138458 [0,1,0,0,1,0|2,0,0]=4 6213 B11R1.29 CCNCC(c1cccs1)O Amb17138677 [0,1,0,0,1,0|2,0,0]=4 6214 B11R1.29 CCOCC(C)[n]1cccc1 Amb18182861 [0,1,0,0,1,0|2,0,0]=4 6215 B11R1.29 CCSCC(C)[n]1cccc1 Amb24755043 [0,1,0,0,1,0|2,0,0]=4 6216 B11R1.29 CNCCC(C)[n]1c[n]cc1 Amb18311247 [0,1,0,0,1,0|2,0,0]=4 6217 B11R1.29 CNCCC(C)[n]1ccc[n]1 Amb18311232 [0,1,0,0,1,0|2,0,0]=4 6218 B11R1.29 CNCCC(C)c1cc[s][n]1 Amb24762855 [0,1,0,0,1,0|2,0,0]=4 6219 B11R1.29 CNCCC(O)c1c[nH]cc1 Amb18563459 [0,1,0,0,1,0|2,0,0]=4 6220 B11R1.29 CNCCC(O)c1ccc[s]1 Amb22055743 [0,1,0,0,1,0|2,0,0]=4 6221 B11R1.29 CNCCC(O)c1ccc[s]1 Amb22585937 [0,1,0,0,1,0|2,0,0]=4 6222 B11R1.29 CNCCC(O)c1ccco1 Amb25383736 [0,1,0,0,1,0|2,0,0]=4 6223 B11R1.29 CNCCC(c1cccs1)O Amb2383141 [0,1,0,0,1,0|2,0,0]=4 6224 B11R1.29 CNCCN(C)c1c[s]cc1 Amb24764881 [0,1,0,0,1,0|2,0,0]=4 6225 B11R1.29 CNCC[C@@H](c1cccs1)O Amb2383144 [0,1,0,0,1,0|2,0,0]=4 6226 B11R1.29 CNCC[C@H](c1cccs1)O Amb2383143 [0,1,0,0,1,0|2,0,0]=4 6227 B11R1.29 COCCC(C)[n]1cccc1 Amb25381603 [0,1,0,0,1,0|2,0,0]=4 6228 B11R1.29 CSCSC(C)c1ccc[s]1 Amb24764731 [0,1,0,0,1,0|2,0,0]=4 6229 B11R1.29 C\C(=C/CNC)\c1ccc[s]1 Amb23555597 [0,1,0,0,1,0|1,0,1]=4 6230 B11R1.29 C\C(=C\CNC)\c1ccc[s]1 Amb25260946 [0,1,0,0,1,0|1,0,1]=4 6231 B11R1.29 C\C=C\CC(C)c1ccc[s]1 Amb25320532 [0,1,0,0,1,0|2,0,0]=4 6232 B11R1.31 CC(NC)C(O)c1ccc[s]1 Amb18563963 [0,1,0,0,1,0|2,0,0]=4 6233 B11R1.31 CC(NC)C(O)c1ccco1 Amb24740899 [0,1,0,0,1,0|2,0,0]=4 6234 B11R1.31 CCC(C)C(C)[n]1cccc1 Amb18179411 [0,1,0,0,1,0|2,0,0]=4 6235 B11R1.31 CNC(=O)C(C)[n]1cccc1 Amb18179435 [0,1,0,0,1,0|1,0,1]=4 6236 B11R1.31 CNC(=O)C(C)c1ccco1 Amb25847739 [0,1,0,0,1,0|1,0,1]=4 6237 B11R1.31 CNC(C)C(C)[n]1c[n]cc1 Amb18982107 [0,1,0,0,1,0|2,0,0]=4 6238 B11R1.31 CNC(C)C(C)[n]1ccc[n]1 Amb18293732 [0,1,0,0,1,0|2,0,0]=4 6239 B11R1.31 C[C@@H](NC)[C@H](O)c1c[s]cc1 Amb25826694 [0,1,0,0,1,0|2,0,0]=4 6240 B11R1.31 C[C@H](NC)[C@H](O)c1ccc[s]1 Amb25222576 [0,1,0,0,1,0|2,0,0]=4 6241 B11R1.31 C[C@H](NC)[C@H](O)c1cocc1 Amb25764445 [0,1,0,0,1,0|2,0,0]=4 6242 B11R1.33 CC(O)(CNN)c1c[nH]cc1 Amb18065442 [0,1,0,0,1,0|2,0,0]=4 6243 B11R1.33 CCCC(C)(O)c1c[s]cc1 Amb24334741 [0,1,0,0,1,0|2,0,0]=4 6244 B11R1.33 CCCC(C)(O)c1ccc[nH]1 Amb25185314 [0,1,0,0,1,0|2,0,0]=4 6245 B11R1.33 CCCC(C)(O)c1ccc[s]1 Amb24466533 [0,1,0,0,1,0|2,0,0]=4 6246 B11R1.33 CNCC(C)(C)c1ccc[nH]1 Amb24662096 [0,1,0,0,1,0|1,0,0]=3 6247 B11R1.33 CNCC(C)(C)c1ccc[s]1 Amb18299632 [0,1,0,0,1,0|1,0,0]=3 6248 B11R1.33 CNCC(C)(O)c1c[nH]cc1 Amb18065422 [0,1,0,0,1,0|1,0,0]=3 6249 B11R1.33 CNCC(C)(O)c1c[s]c[n]1 Amb25830424 [0,1,0,0,1,0|2,0,0]=4 6250 B11R1.33 CNCC(C)(O)c1c[s]cc1 Amb24674441 [0,1,0,0,1,0|1,0,0]=3 6251 B11R1.33 COCC(C)(C)[n]1cccc1 Amb24488323 [0,1,0,0,1,0|2,0,0]=4 6252 B11R1.33 COCC(C)(N)c1c[s]cc1 Amb24367435 [0,1,0,0,1,0|2,0,0]=4 6253 B11R1.33 COCC(C)(N)c1ccc[nH]1 Amb25316041 [0,1,0,0,1,0|2,0,0]=4 6254 B11R1.33 COCC(C)(N)c1ccc[s]1 Amb18299364 [0,1,0,0,1,0|2,0,0]=4 6255 B11R1.33 COCC(C)(O)c1ccc[nH]1 Amb24454491 [0,1,0,0,1,0|2,0,0]=4 6256 B11R1.33 COCC(C)(O)c1ccc[s]1 Amb18185738 [0,1,0,0,1,0|2,0,0]=4 6257 B11R1.33 NNCC(c1cccs1)(O)C Amb17232903 [0,1,0,0,1,0|2,0,0]=4 6258 B11R1.77 CC(=O)CC(C)c1c[s]cc1 Amb25062699 [0,1,0,0,1,0|2,0,0]=4 6259 B11R1.77 CC(=O)CC(C)c1cocc1 Amb25223137 [0,1,0,0,1,0|2,0,0]=4 6260 B11R1.77 CC(=O)C[C@H](C)c1ccco1 Amb24691777 [0,1,0,0,1,0|2,0,0]=4 6261 B11R1.77 CC(CC(C)Cl)c1ccc[nH]1 Amb25293441 [0,1,0,0,1,0|2,0,0]=4 6262 B11R1.77 CC(CC(C)Cl)c1cocc1 Amb24615510 [0,1,0,0,1,0|2,0,0]=4 6263 B11R1.77 CC(CC(C)N)c1c[s]cc1 Amb24486669 [0,1,0,0,1,0|2,0,0]=4 6264 B11R1.77 CC(CC(C)N)c1ccc[nH]1 Amb25049788 [0,1,0,0,1,0|2,0,0]=4 6265 B11R1.77 CC(CC(C)N)c1ccco1 Amb25151306 [0,1,0,0,1,0|2,0,0]=4 6266 B11R1.77 CC(CC(C)N)c1cocc1 Amb24596427 [0,1,0,0,1,0|2,0,0]=4 6267 B11R1.77 CC(CC(C)O)c1ccc[nH]1 Amb25042051 [0,1,0,0,1,0|2,0,0]=4 6268 B11R1.77 CC(CC(C)O)c1ccc[s]1 Amb25151307 [0,1,0,0,1,0|2,0,0]=4 6269 B11R1.77 CC(CC(C)O)c1cocc1 Amb25835270 [0,1,0,0,1,0|2,0,0]=4 6270 B11R1.77 CC(CN(C)C)C=1C=CCC1 Amb24486037 [0,1,0,0,1,0|0,0,1]=3 6271 B11R1.77 CC(NN(C)C)c1cocc1 Amb25336025 [0,1,0,0,1,0|2,0,0]=4 6272 B11R1.77 CN(C)CC(N)c1c[nH]cc1 Amb18065404 [0,1,0,0,1,0|2,0,0]=4 6273 B11R1.77 CN(C)CC(O)c1c[nH]cc1 Amb24442513 [0,1,0,0,1,0|2,0,0]=4 6274 B11R1.77 CN(C)CC(O)c1cocc1 Amb25108421 [0,1,0,0,1,0|2,0,0]=4 6275 B11R1.77 CN(CC(c1ccco1)Cl)C Amb17548212 [0,1,0,0,1,0|2,0,0]=4 6276 B11R1.77 CN(CC(c1ccco1)N)C Amb1125377 [0,1,0,0,1,0|2,0,0]=4 6277 B11R1.77 CN(CC(c1ccco1)O)C Amb17104280 [0,1,0,0,1,0|2,0,0]=4 6278 B11R1.77 CN(CC(c1cccs1)Cl)C Amb17547925 [0,1,0,0,1,0|2,0,0]=4 6279 B11R1.77 CN(CC(c1cccs1)N)C Amb2371971 [0,1,0,0,1,0|2,0,0]=4 6280 B11R1.199 CCCC(C)c1[s]ccc1N Amb25132699 [0,1,0,0,1,0|2,0,0]=4 6281 B11R1.199 CNCC(C)[n]1cc[n]c1C Amb18992881 [0,1,0,0,1,0|2,0,0]=4 6282 B11R1.199 CNCC(C)c1cc[n][n]1C Amb24514590 [0,1,0,0,1,0|2,0,0]=4 6283 B11R1.199 CNCC(O)c1cc[s]c1Cl Amb24415512 [0,1,0,0,1,0|2,0,0]=4 6284 B11R1.199 CNCC(O)c1occc1Br Amb24388663 [0,1,0,0,1,0|2,0,0]=4 6285 B11R1.199 Cc1cc[s]c1C(O)CNC Amb18301176 [0,1,0,0,1,0|2,0,0]=4 6286 B13R1.19 CC(CC#N)Oc1ccc(N)cc1 Amb18291147 [0,1,0,0,0,1|2,0,0]=4 6287 B13R1.19 CC(CC#N)Sc1ccc(Cl)cc1 Amb25781322 [0,1,0,0,0,1|2,0,0]=4 6288 B13R1.19 CC(CC#N)Sc1ccc(F)cc1 Amb18321336 [0,1,0,0,0,1|2,0,0]=4 6289 B13R1.19 CC(CC=C)Nc1ccc(Cl)cc1 Amb25700814 [0,1,0,0,0,1|1,0,1]=4 6290 B13R1.19 CC(CC=C)Nc1ccc(N)cc1 Amb25139102 [0,1,0,0,0,1|1,0,1]=4 6291 B13R1.19 CC(CCO)Nc1ccc(Cl)cc1 Amb25295265 [0,1,0,0,0,1|2,0,0]=4 6292 B13R1.19 CC(CNN)Oc1ccc(Br)cc1 Amb18070505 [0,1,0,0,0,1|1,0,0]=3 6293 B13R1.19 CC(CNN)Oc1ccc(Cl)cc1 Amb18066553 [0,1,0,0,0,1|1,0,0]=3 6294 B13R1.19 CC(CNN)Oc1ccc(F)cc1 Amb18564286 [0,1,0,0,0,1|1,0,0]=3 6295 B13R1.19 CC(Nc1ccc(cc1)Br)CC#N Amb17158703 [0,1,0,0,0,1|2,0,0]=4 6296 B13R1.19 CC(Nc1ccc(cc1)C)CC#N Amb17138750 [0,1,0,0,0,1|2,0,0]=4 6297 B13R1.19 CC(Nc1ccc(cc1)Cl)CC#N Amb17139532 [0,1,0,0,0,1|2,0,0]=4 6298 B13R1.19 CC(Nc1ccc(cc1)F)CC#N Amb17138851 [0,1,0,0,0,1|2,0,0]=4 6299 B13R1.19 CC(Oc1ccc(cc1)Br)CC#N Amb17255072 [0,1,0,0,0,1|2,0,0]=4 6300 B13R1.19 CC(Oc1ccc(cc1)C)CC#N Amb17233110 [0,1,0,0,0,1|2,0,0]=4 6301 B13R1.19 CC(Oc1ccc(cc1)Cl)CC#N Amb17236323 [0,1,0,0,0,1|2,0,0]=4 6302 B13R1.19 CC(Oc1ccc(cc1)F)CC#N Amb17233522 [0,1,0,0,0,1|2,0,0]=4 6303 B13R1.19 CCCC(Br)Cc1ccc(Cl)cc1 Amb18049445 [0,1,0,0,0,1|2,0,0]=4 6304 B13R1.19 CCCC(C)Nc1ccc(F)[n]c1 Amb25124603 [0,1,0,0,0,1|2,0,0]=4 6305 B13R1.19 CCCC(C)Nc1ccc(F)c[n]1 Amb19012952 [0,1,0,0,0,1|2,0,0]=4 6306 B13R1.19 CCCC(C)Nc1ccc(I)c[n]1 Amb25158395 [0,1,0,0,0,1|2,0,0]=4 6307 B13R1.19 CCCC(O)Cc1ccc(Cl)cc1 Amb18322128 [0,1,0,0,0,1|2,0,0]=4 6308 B13R1.19 CCCC(O)Cc1ccc(F)cc1 Amb18796618 [0,1,0,0,0,1|2,0,0]=4 6309 B13R1.19 CCNC(C)Cc1ccc(N)cc1 Amb18050256 [0,1,0,0,0,1|2,0,0]=4 6310 B13R1.19 CNCC(=O)Nc1ccc(F)cc1 Amb19372369 [0,1,0,0,0,1|1,0,1]=4 6311 B13R1.19 CNCC(=O)Nc1ccc(N)cc1 Amb24749388 [0,1,0,0,0,1|1,0,1]=4 6312 B13R1.19 CNCC(=O)Nc1ccc(cc1)C Amb1105856 [0,1,0,0,0,1|1,0,1]=4 6313 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2276036 [0,1,0,0,0,1|1,0,1]=4 6314 B13R1.19 CNCC(=O)Nc1ccc(cc1)Cl Amb2370653 [0,1,0,0,0,1|1,0,1]=4 6315 B13R1.19 CNCC(=O)Nc1ccc(cc1)F Amb2370688 [0,1,0,0,0,1|1,0,1]=4 6316 B13R1.19 CNCC(=O)Nc1ccc(cc1)O Amb13951398 [0,1,0,0,0,1|1,0,1]=4 6317 B13R1.19 CNCC(C)Oc1ccc(Cl)cc1 Amb18312527 [0,1,0,0,0,1|0,0,0]=2 6318 B13R1.19 CNCC(Cc1ccc(cc1)Br)O Amb17256962 [0,1,0,0,0,1|1,0,0]=3 6319 B13R1.19 CNCC(Cc1ccc(cc1)C)O Amb17233571 [0,1,0,0,0,1|1,0,0]=3 6320 B13R1.19 CNCC(Cc1ccc(cc1)Cl)O Amb17237040 [0,1,0,0,0,1|1,0,0]=3 6321 B13R1.19 CNCC(Cc1ccc(cc1)F)O Amb17233990 [0,1,0,0,0,1|1,0,0]=3 6322 B13R1.19 COCC(C)Nc1ccc(Br)cc1 Amb18312245 [0,1,0,0,0,1|1,0,0]=3 6323 B13R1.19 COCC(C)Nc1ccc(Cl)[n]c1 Amb24696318 [0,1,0,0,0,1|2,0,0]=4 6324 B13R1.19 COCC(C)Nc1ccc(Cl)cc1 Amb18312243 [0,1,0,0,0,1|1,0,0]=3 6325 B13R1.19 COCC(C)Nc1ccc(F)c[n]1 Amb19012953 [0,1,0,0,0,1|2,0,0]=4 6326 B13R1.19 COCC(C)Nc1ccc(F)cc1 Amb18312247 [0,1,0,0,0,1|1,0,0]=3 6327 B13R1.19 COCC(C)Nc1ccc(O)cc1 Amb19024378 [0,1,0,0,0,1|1,0,0]=3 6328 B13R1.19 COC[C@@H](C)Nc1ccc(Cl)c[n]1 Amb25855617 [0,1,0,0,0,1|2,0,0]=4 6329 B13R1.19 CSCC(C)Nc1ccc(Br)c[n]1 Amb23667261 [0,1,0,0,0,1|2,0,0]=4 6330 B13R1.19 CSCC(C)Nc1ccc(Cl)c[n]1 Amb25192612 [0,1,0,0,0,1|2,0,0]=4 6331 B13R1.19 CSCC(C)Nc1ccc(N)[n]c1 Amb24650753 [0,1,0,0,0,1|2,0,0]=4 6332 B13R1.19 CSCC(C)Nc1ccc(N)cc1 Amb25275776 [0,1,0,0,0,1|1,0,0]=3 6333 B13R1.19 C\C(\CNC)=C/c1ccc(Br)cc1 Amb24489717 [0,1,0,0,0,1|0,0,1]=3 6334 B13R1.19 C\C(\CNC)=C/c1ccc(Cl)cc1 Amb25755871 [0,1,0,0,0,1|0,0,1]=3 6335 B13R1.19 C\C=C\C(C)Nc1ccc(Cl)cc1 Amb24382003 [0,1,0,0,0,1|1,0,1]=4 6336 B13R1.19 C\C=C\C(C)Nc1ccc(N)cc1 Amb18127788 [0,1,0,0,0,1|1,0,1]=4 6337 B13R1.19 Cc1ccc(CC(Br)CCC)cc1 Amb18049439 [0,1,0,0,0,1|2,0,0]=4 6338 B13R1.19 Cc1ccc(CC(O)CCC)cc1 Amb18180849 [0,1,0,0,0,1|2,0,0]=4 6339 B13R1.19 Cc1ccc(NC(C)CSC)[n]c1 Amb25784308 [0,1,0,0,0,1|2,0,0]=4 6340 B13R1.19 Cc1ccc(\C=C(/C)\CNC)cc1 Amb25344139 [0,1,0,0,0,1|0,0,1]=3 6341 B13R1.19 Cc1ccc(c[n]1)NC(C)CCC Amb24356361 [0,1,0,0,0,1|2,0,0]=4 6342 B13R1.19 Cc1ccc(cc1)NC(C)CCO Amb25800093 [0,1,0,0,0,1|2,0,0]=4 6343 B13R1.19 Cc1ccc(cc1)NC(C)COC Amb18312256 [0,1,0,0,0,1|1,0,0]=3 6344 B13R1.19 Cc1ccc(cc1)OC(C)CNC Amb18312328 [0,1,0,0,0,1|0,0,0]=2 6345 B13R1.19 Cc1ccc(cc1)OC(C)CNN Amb18065976 [0,1,0,0,0,1|1,0,0]=3 6346 B13R1.19 Cc1ccc(cc1)SC(C)CC#N Amb18321052 [0,1,0,0,0,1|2,0,0]=4 6347 B13R1.19 NCCC(Cc1ccc(cc1)Br)C Amb17255977 [0,1,0,0,0,1|2,0,0]=4 6348 B13R1.19 NCCC(Cc1ccc(cc1)C)C Amb17233335 [0,1,0,0,0,1|2,0,0]=4 6349 B13R1.19 NCCC(Cc1ccc(cc1)Cl)C Amb17236696 [0,1,0,0,0,1|2,0,0]=4 6350 B13R1.19 NCCC(Cc1ccc(cc1)F)C Amb17233830 [0,1,0,0,0,1|2,0,0]=4 6351 B13R1.19 NCCC(Oc1ccc(cc1)Br)C Amb17256976 [0,1,0,0,0,1|2,0,0]=4 6352 B13R1.19 NCCC(Oc1ccc(cc1)C)C Amb17233612 [0,1,0,0,0,1|2,0,0]=4 6353 B13R1.19 NCCC(Oc1ccc(cc1)Cl)C Amb17237053 [0,1,0,0,0,1|2,0,0]=4 6354 B13R1.19 NCCC(Oc1ccc(cc1)F)C Amb17234005 [0,1,0,0,0,1|2,0,0]=4 6355 B13R1.19 OCCC(Cc1ccc(cc1)Br)C Amb17256433 [0,1,0,0,0,1|2,0,0]=4 6356 B13R1.19 OCCC(Cc1ccc(cc1)C)C Amb17233454 [0,1,0,0,0,1|2,0,0]=4 6357 B13R1.19 OCCC(Cc1ccc(cc1)Cl)C Amb17236862 [0,1,0,0,0,1|2,0,0]=4 6358 B13R1.19 OCCC(Cc1ccc(cc1)F)C Amb17233915 [0,1,0,0,0,1|2,0,0]=4 6359 B13R1.19 OCCC(Oc1ccc(cc1)Br)C Amb17257496 [0,1,0,0,0,1|2,0,0]=4 6360 B13R1.19 OCCC(Oc1ccc(cc1)C)C Amb17233719 [0,1,0,0,0,1|2,0,0]=4 6361 B13R1.19 OCCC(Oc1ccc(cc1)Cl)C Amb17237193 [0,1,0,0,0,1|2,0,0]=4 6362 B13R1.19 OCCC(Oc1ccc(cc1)F)C Amb17234074 [0,1,0,0,0,1|2,0,0]=4 6363 B13R1.20 CC(CC#N)Oc1cccc(N)c1 Amb18291146 [0,1,0,0,0,1|2,0,0]=4 6364 B13R1.20 CC(CC=C)Nc1cccc(F)c1 Amb24749345 [0,1,0,0,0,1|1,0,1]=4 6365 B13R1.20 CC(CC=C)Nc1cccc(N)c1 Amb24559730 [0,1,0,0,0,1|1,0,1]=4 6366 B13R1.20 CC(CCO)Nc1cccc(N)c1 Amb24388121 [0,1,0,0,0,1|2,0,0]=4 6367 B13R1.20 CC(CNN)Oc1cccc(Br)c1 Amb18070493 [0,1,0,0,0,1|1,0,0]=3 6368 B13R1.20 CC(CNN)Oc1cccc(F)c1 Amb18066138 [0,1,0,0,0,1|1,0,0]=3 6369 B13R1.20 CCCC(C)Nc1c[n]cc(Br)c1 Amb24358504 [0,1,0,0,0,1|2,0,0]=4 6370 B13R1.20 CCCC(C)Nc1cc(N)cc[n]1 Amb18804919 [0,1,0,0,0,1|2,0,0]=4 6371 B13R1.20 CCCC(C)Nc1cc[n]c(N)c1 Amb25207538 [0,1,0,0,0,1|2,0,0]=4 6372 B13R1.20 CCCC(C)Nc1cccc(Br)[n]1 Amb25723369 [0,1,0,0,0,1|2,0,0]=4 6373 B13R1.20 CCCC(C)Nc1cccc(F)[n]1 Amb19011122 [0,1,0,0,0,1|2,0,0]=4 6374 B13R1.20 CCCC(C)Oc1cc(Cl)cc[n]1 Amb22276503 [0,1,0,0,0,1|2,0,0]=4 6375 B13R1.20 CCCC(C)Oc1cccc(N)c1 Amb20623754 [0,1,0,0,0,1|1,0,0]=3 6376 B13R1.20 CCCC(C)Sc1cc(Cl)cc[n]1 Amb22276504 [0,1,0,0,0,1|2,0,0]=4 6377 B13R1.20 CCCC(O)Cc1cccc(Cl)c1 Amb18322129 [0,1,0,0,0,1|2,0,0]=4 6378 B13R1.20 CCCC(O)Cc1cccc(F)c1 Amb18796621 [0,1,0,0,0,1|2,0,0]=4 6379 B13R1.20 CNCC(=O)Nc1cc(O)ccc1 Amb18290512 [0,1,0,0,0,1|1,0,1]=4 6380 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2277698 [0,1,0,0,0,1|1,0,1]=4 6381 B13R1.20 CNCC(=O)Nc1cccc(c1)F Amb2370682 [0,1,0,0,0,1|1,0,1]=4 6382 B13R1.20 CNCC(Cc1cccc(c1)Br)O Amb17256958 [0,1,0,0,0,1|1,0,0]=3 6383 B13R1.20 CNCC(Cc1cccc(c1)C)O Amb17233567 [0,1,0,0,0,1|1,0,0]=3 6384 B13R1.20 CNCC(Cc1cccc(c1)Cl)O Amb17237036 [0,1,0,0,0,1|1,0,0]=3 6385 B13R1.20 CNCC(O)Cc1cccc(F)c1 Amb18564245 [0,1,0,0,0,1|1,0,0]=3 6386 B13R1.20 COCC(C)Nc1c[n]cc(Br)c1 Amb25156216 [0,1,0,0,0,1|2,0,0]=4 6387 B13R1.20 COCC(C)Nc1cc(Br)cc[n]1 Amb25706016 [0,1,0,0,0,1|2,0,0]=4 6388 B13R1.20 COCC(C)Nc1cc(F)cc[n]1 Amb24421474 [0,1,0,0,0,1|2,0,0]=4 6389 B13R1.20 COCC(C)Nc1cc(N)cc[n]1 Amb18805263 [0,1,0,0,0,1|2,0,0]=4 6390 B13R1.20 COCC(C)Nc1cc[n]c(N)c1 Amb25075956 [0,1,0,0,0,1|2,0,0]=4 6391 B13R1.20 COCC(C)Nc1cccc(Br)[n]1 Amb24456758 [0,1,0,0,0,1|2,0,0]=4 6392 B13R1.20 COCC(C)Nc1cccc(Br)c1 Amb18312246 [0,1,0,0,0,1|1,0,0]=3 6393 B13R1.20 COCC(C)Nc1cccc(Cl)c1 Amb19024317 [0,1,0,0,0,1|1,0,0]=3 6394 B13R1.20 COCC(C)Nc1cccc(F)[n]1 Amb19011123 [0,1,0,0,0,1|2,0,0]=4 6395 B13R1.20 COCC(C)Nc1cccc(F)c1 Amb19024319 [0,1,0,0,0,1|1,0,0]=3 6396 B13R1.20 COCC(C)Nc1cccc(O)c1 Amb19024329 [0,1,0,0,0,1|1,0,0]=3 6397 B13R1.20 COC[C@@H](C)Nc1c[n]cc(Br)c1 Amb24403673 [0,1,0,0,0,1|2,0,0]=4 6398 B13R1.20 COC[C@@H](C)Nc1cc(Br)cc[n]1 Amb25763704 [0,1,0,0,0,1|2,0,0]=4 6399 B13R1.20 COC[C@@H](C)Nc1cccc(Cl)[n]1 Amb25295898 [0,1,0,0,0,1|2,0,0]=4 6400 B13R1.20 COC[C@@H](C)Nc1cccc(F)[n]1 Amb24335437 [0,1,0,0,0,1|2,0,0]=4 6401 B13R1.20 CSCC(C)Nc1c[n]cc(N)c1 Amb24461291 [0,1,0,0,0,1|2,0,0]=4 6402 B13R1.20 CSCC(C)Nc1cc(Br)cc[n]1 Amb25093439 [0,1,0,0,0,1|2,0,0]=4 6403 B13R1.20 CSCC(C)Nc1cc[n]c(F)c1 Amb24372863 [0,1,0,0,0,1|2,0,0]=4 6404 B13R1.20 CSCC(C)Nc1cc[n]c(N)c1 Amb25759906 [0,1,0,0,0,1|2,0,0]=4 6405 B13R1.20 CSCC(C)Nc1cccc(Br)[n]1 Amb25131889 [0,1,0,0,0,1|2,0,0]=4 6406 B13R1.20 CSCC(C)Nc1cccc(Cl)[n]1 Amb24401341 [0,1,0,0,0,1|2,0,0]=4 6407 B13R1.20 CSCC(C)Nc1cccc(F)[n]1 Amb23662918 [0,1,0,0,0,1|2,0,0]=4 6408 B13R1.20 CSCC(C)Nc1cccc(N)[n]1 Amb24636520 [0,1,0,0,0,1|2,0,0]=4 6409 B13R1.20 CSCC(C)Nc1cccc(N)c1 Amb24366347 [0,1,0,0,0,1|1,0,0]=3 6410 B13R1.20 C\C(\CNC)=C/c1cccc(Br)c1 Amb24389809 [0,1,0,0,0,1|0,0,1]=3 6411 B13R1.20 C\C(\CNC)=C/c1cccc(I)c1 Amb24666360 [0,1,0,0,0,1|0,0,1]=3 6412 B13R1.20 C\C=C\C(C)Nc1cccc(F)c1 Amb24399265 [0,1,0,0,0,1|1,0,1]=4 6413 B13R1.20 C\C=C\C(C)Nc1cccc(N)c1 Amb18127786 [0,1,0,0,0,1|1,0,1]=4 6414 B13R1.20 Cc1c[n]cc(c1)NC(C)CCC Amb25192403 [0,1,0,0,0,1|2,0,0]=4 6415 B13R1.20 Cc1cc(ccc1)NC(=O)CNC Amb21959010 [0,1,0,0,0,1|1,0,1]=4 6416 B13R1.20 Cc1cc[n]c(c1)NC(C)CCC Amb18184441 [0,1,0,0,0,1|2,0,0]=4 6417 B13R1.20 Cc1cc[n]c(c1)NC(C)COC Amb18184778 [0,1,0,0,0,1|2,0,0]=4 6418 B13R1.20 Cc1cc[n]c(c1)N[C@@H](C)COC Amb24726281 [0,1,0,0,0,1|2,0,0]=4 6419 B13R1.20 Cc1cc[n]c(c1)N[C@H](C)COC Amb24335058 [0,1,0,0,0,1|2,0,0]=4 6420 B13R1.20 Cc1cccc(NC(C)CCC)[n]1 Amb19005116 [0,1,0,0,0,1|2,0,0]=4 6421 B13R1.20 Cc1cccc(NC(C)COC)[n]1 Amb19005117 [0,1,0,0,0,1|2,0,0]=4 6422 B13R1.20 Cc1cccc(c1)NC(C)CCO Amb25376914 [0,1,0,0,0,1|2,0,0]=4 6423 B13R1.20 Cc1cccc(c1)NC(C)COC Amb19024305 [0,1,0,0,0,1|1,0,0]=3 6424 B13R1.20 Cc1cccc(c1)OC(C)CNC Amb19025041 [0,1,0,0,0,1|0,0,0]=2 6425 B13R1.20 Cc1cccc(c1)OC(C)CNN Amb18564143 [0,1,0,0,0,1|1,0,0]=3 6426 B13R1.20 Cc1cccc(c1)SC(C)CC#N Amb19041441 [0,1,0,0,0,1|2,0,0]=4 6427 B13R1.20 N#CCC(Nc1cccc(c1)Br)C Amb17158705 [0,1,0,0,0,1|2,0,0]=4 6428 B13R1.20 N#CCC(Nc1cccc(c1)C)C Amb17138749 [0,1,0,0,0,1|2,0,0]=4 6429 B13R1.20 N#CCC(Nc1cccc(c1)Cl)C Amb17139531 [0,1,0,0,0,1|2,0,0]=4 6430 B13R1.20 N#CCC(Nc1cccc(c1)F)C Amb17138852 [0,1,0,0,0,1|2,0,0]=4 6431 B13R1.20 N#CCC(Oc1cccc(c1)Br)C Amb17255071 [0,1,0,0,0,1|2,0,0]=4 6432 B13R1.20 N#CCC(Oc1cccc(c1)C)C Amb17233109 [0,1,0,0,0,1|2,0,0]=4 6433 B13R1.20 N#CCC(Oc1cccc(c1)Cl)C Amb17236322 [0,1,0,0,0,1|2,0,0]=4 6434 B13R1.20 N#CCC(Oc1cccc(c1)F)C Amb17233521 [0,1,0,0,0,1|2,0,0]=4 6435 B13R1.20 NCCC(Cc1cccc(c1)Br)C Amb17255972 [0,1,0,0,0,1|2,0,0]=4 6436 B13R1.20 NCCC(Cc1cccc(c1)C)C Amb17233331 [0,1,0,0,0,1|2,0,0]=4 6437 B13R1.20 NCCC(Cc1cccc(c1)Cl)C Amb17236692 [0,1,0,0,0,1|2,0,0]=4 6438 B13R1.20 NCCC(Oc1cccc(c1)Br)C Amb17256975 [0,1,0,0,0,1|2,0,0]=4 6439 B13R1.20 NCCC(Oc1cccc(c1)C)C Amb17233611 [0,1,0,0,0,1|2,0,0]=4 6440 B13R1.20 NCCC(Oc1cccc(c1)Cl)C Amb17237052 [0,1,0,0,0,1|2,0,0]=4 6441 B13R1.20 NCCC(Oc1cccc(c1)F)C Amb17234004 [0,1,0,0,0,1|2,0,0]=4 6442 B13R1.20 OCCC(Cc1cccc(c1)Br)C Amb17256430 [0,1,0,0,0,1|2,0,0]=4 6443 B13R1.20 OCCC(Cc1cccc(c1)C)C Amb17233452 [0,1,0,0,0,1|2,0,0]=4 6444 B13R1.20 OCCC(Cc1cccc(c1)Cl)C Amb17236860 [0,1,0,0,0,1|2,0,0]=4 6445 B13R1.20 OCCC(Oc1cccc(c1)Br)C Amb17257493 [0,1,0,0,0,1|2,0,0]=4 6446 B13R1.20 OCCC(Oc1cccc(c1)C)C Amb17233716 [0,1,0,0,0,1|2,0,0]=4 6447 B13R1.20 OCCC(Oc1cccc(c1)Cl)C Amb17237190 [0,1,0,0,0,1|2,0,0]=4 6448 B13R1.20 OCCC(Oc1cccc(c1)F)C Amb17234071 [0,1,0,0,0,1|2,0,0]=4 6449 B13R1.44 CC#CCC(N)Cc1ccccc1 Amb18183777 [0,1,0,0,0,1|2,0,0]=4 6450 B13R1.44 CC#CCC(O)Cc1ccccc1 Amb18183851 [0,1,0,0,0,1|2,0,0]=4 6451 B13R1.44 CC(CCCO)Nc1ccccc1 Amb21984572 [0,1,0,0,0,1|1,0,0]=3 6452 B13R1.44 CC(Cc1ccccc1)NCC#C Amb17618673 [0,1,0,0,0,1|1,0,1]=4 6453 B13R1.44 CC(Cc1ccccc1)NCC#C Amb19148861 [0,1,0,0,0,1|1,0,1]=4 6454 B13R1.44 CCCCN(Cc1ccccc1)C Amb1828371 [0,1,0,0,0,1|2,0,0]=4 6455 B13R1.44 CCCNC(C)Cc1ccccc1 Amb18180702 [0,1,0,0,0,1|1,0,0]=3 6456 B13R1.44 CCNCC(C)Oc1ccccc1 Amb18186428 [0,1,0,0,0,1|0,0,0]=2 6457 B13R1.44 CC\C=C\C(C)Nc1ccccc1 Amb25176158 [0,1,0,0,0,1|1,0,1]=4 6458 B13R1.44 CN(CCCF)Cc1ccccc1 Amb25098301 [0,1,0,0,0,1|2,0,0]=4 6459 B13R1.44 CN(CCCN)Cc1ccccc1 Amb22001972 [0,1,0,0,0,1|2,0,0]=4 6460 B13R1.44 CN(Cc1ccccc1)CCNN Amb24741208 [0,1,0,0,0,1|2,0,0]=4 6461 B13R1.44 CNCCC(=O)Nc1ccccc1 Amb15740952 [0,1,0,0,0,1|1,0,1]=4 6462 B13R1.44 CONCC(=O)Nc1ccccc1 Amb25039334 [0,1,0,0,0,1|1,0,1]=4 6463 B13R1.44 ClCCCN(Cc1ccccc1)C Amb17337263 [0,1,0,0,0,1|2,0,0]=4 6464 B13R1.44 NCCCN(Cc1ccccc1)C Amb2371220 [0,1,0,0,0,1|2,0,0]=4 6465 B13R1.47 CC(C#CC)C(O)c1ccccc1 Amb25065527 [0,1,0,0,0,1|1,0,1]=4 6466 B13R1.47 CC(CC#C)C(=O)c1ccccc1 Amb18118075 [0,1,0,0,0,1|1,0,1]=4 6467 B13R1.47 CC(CCN)C(O)c1ccccc1 Amb18194408 [0,1,0,0,0,1|2,0,0]=4 6468 B13R1.47 CC(N(c1ccccc1)C)CC#N Amb17334999 [0,1,0,0,0,1|2,0,0]=4 6469 B13R1.47 CCCC(C(=O)c1ccccc1)N Amb17594508 [0,1,0,0,0,1|2,0,0]=4 6470 B13R1.47 CCNC(C(=O)c1ccccc1)C Amb17613942 [0,1,0,0,0,1|2,0,0]=4 6471 B13R1.47 COCC(N)C(=O)c1ccccc1 Amb24106083 [0,1,0,0,0,1|2,0,0]=4 6472 B13R1.47 C[C@@H](C#CC)[C@H](O)c1ccccc1 Amb25098641 [0,1,0,0,0,1|1,0,1]=4 6473 B13R1.47 C[C@@H](\C=C\C)[C@H](O)c1ccccc1 Amb24420791 [0,1,0,0,0,1|1,0,1]=4 6474 B13R1.47 C[C@H](C#CC)[C@@H](O)c1ccccc1 Amb24353039 [0,1,0,0,0,1|1,0,1]=4 6475 B13R1.47 C[C@H](CC#N)[C@@H](O)c1ccccc1 Amb25306456 [0,1,0,0,0,1|2,0,0]=4 6476 B13R1.47 C[C@H](\C=C\C)[C@H](O)c1ccccc1 Amb25687816 [0,1,0,0,0,1|1,0,1]=4 6477 B13R1.47 C\C(=C/NC)\C(=O)c1ccccc1 Amb25805124 [0,1,0,0,0,1|0,0,2]=4 6478 B13R1.47 C\C(=C\NC)\C(=O)c1ccccc1 Amb25327890 [0,1,0,0,0,1|0,0,2]=4 6479 B13R1.47 C\C=C/C(C)C(=O)c1ccccc1 Amb24448967 [0,1,0,0,0,1|1,0,1]=4 6480 B13R1.47 C\C=C\C(C)C(=O)c1ccccc1 Amb24492785 [0,1,0,0,0,1|1,0,1]=4 6481 B13R1.47 NCCC(N(c1ccccc1)C)C Amb17138895 [0,1,0,0,0,1|2,0,0]=4 6482 B13R1.47 OC(c1ccccc1)C(CC#N)C Amb17335051 [0,1,0,0,0,1|2,0,0]=4 6483 B13R1.79 C=CCC(Sc1ccccc1)CC Amb10565502 [0,1,0,0,0,1|1,0,1]=4 6484 B13R1.79 CCC(CNC)Oc1ccccc1 Amb18809238 [0,1,0,0,0,1|0,0,0]=2 6485 B13R1.79 CCC(Cc1ccccc1)NCC Amb18180699 [0,1,0,0,0,1|2,0,0]=4 6486 B13R1.79 CCCC(C#N)Nc1ccccc1 Amb18304668 [0,1,0,0,0,1|1,0,1]=4 6487 B13R1.79 CCCN(Cc1ccccc1)OC Amb25098386 [0,1,0,0,0,1|2,0,0]=4 6488 B13R1.79 CNC(CCCl)Cc1ccccc1 Amb24063257 [0,1,0,0,0,1|2,0,0]=4 6489 B13R1.79 C\C=C\C(CC)Nc1ccccc1 Amb24417887 [0,1,0,0,0,1|1,0,1]=4 6490 B13R1.135 CC(Cc1ccccc1)C(=O)NN Amb24501376 [0,1,0,0,0,1|1,0,1]=4 6491 B13R1.135 CC(Cc1ccccc1)C(O)C#N Amb25152887 [0,1,0,0,0,1|2,0,0]=4 6492 B13R1.135 CC(NN)C(C)Nc1ccccc1 Amb18648286 [0,1,0,0,0,1|1,0,0]=3 6493 B13R1.135 CC(Nc1cc[n]cc1)C(Cl)CC Amb24557512 [0,1,0,0,0,1|2,0,0]=4 6494 B13R1.135 CC(Nc1ccccc1)C(O)CC Amb25108218 [0,1,0,0,0,1|1,0,0]=3 6495 B13R1.135 CC(OC)C(C)Nc1ccccc1 Amb24355037 [0,1,0,0,0,1|1,0,0]=3 6496 B13R1.135 CC(OC)[C@H](C)Nc1cccc[n]1 Amb24720500 [0,1,0,0,0,1|2,0,0]=4 6497 B13R1.135 CC(Oc1ccccc1)C(O)C#N Amb25179997 [0,1,0,0,0,1|2,0,0]=4 6498 B13R1.135 CCC(=O)C(Cc1ccccc1)C Amb17233202 [0,1,0,0,0,1|1,0,1]=4 6499 B13R1.135 CCC(C)C(C)Nc1cc[n]cc1 Amb19016841 [0,1,0,0,0,1|2,0,0]=4 6500 B13R1.135 CCC(C)C(C)Nc1cccc[n]1 Amb19016834 [0,1,0,0,0,1|2,0,0]=4 6501 B13R1.135 CN(Cc1ccccc1)C(=N)NC Amb18804661 [0,1,0,0,0,1|1,0,1]=4 6502 B13R1.135 CN(Cc1ccccc1)C(=S)NC Amb25211263 [0,1,0,0,0,1|1,0,1]=4 6503 B13R1.135 CNC(=O)C(C)Nc1cc[n]cc1 Amb18978321 [0,1,0,0,0,1|1,0,1]=4 6504 B13R1.135 CNC(=O)C(C)Nc1cccc[n]1 Amb18978306 [0,1,0,0,0,1|1,0,1]=4 6505 B13R1.135 CNC(=O)C(C)Oc1cccc[n]1 Amb25261720 [0,1,0,0,0,1|1,0,1]=4 6506 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,1,0,0,0,1|1,0,1]=4 6507 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,1,0,0,0,1|1,0,1]=4 6508 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,1|1,0,1]=4 6509 B13R1.135 CNC(=O)C(Sc1ccccn1)C Amb10679142 [0,1,0,0,0,1|1,0,1]=4 6510 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,1,0,0,0,1|0,0,1]=3 6511 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,1,0,0,0,1|1,0,1]=4 6512 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,1,0,0,0,1|1,0,1]=4 6513 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,1,0,0,0,1|1,0,1]=4 6514 B13R1.135 CNC(=O)[C@H](C)Nc1ccccc1 Amb25268956 [0,1,0,0,0,1|0,0,1]=3 6515 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,1,0,0,0,1|1,0,1]=4 6516 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,1,0,0,0,1|1,0,1]=4 6517 B13R1.135 CNC(=S)C(C)Cc1ccccc1 Amb24710289 [0,1,0,0,0,1|0,0,1]=3 6518 B13R1.135 COC(=O)[C@H](C)Nc1ccccc1 Amb25732039 [0,1,0,0,0,1|1,0,1]=4 6519 B13R1.135 C[C@@H](Cc1ccccc1)C(=O)NO Amb24408073 [0,1,0,0,0,1|1,0,1]=4 6520 B13R1.135 C[C@H](Cc1ccccc1)C(=O)NO Amb25370073 [0,1,0,0,0,1|1,0,1]=4 6521 B13R1.135 C[C@H](Cc1ccccc1)[C@H](O)C#N Amb24372065 [0,1,0,0,0,1|2,0,0]=4 6522 B13R1.135 C\C(=C/C)\[C@H](C)Nc1ccccc1 Amb25180843 [0,1,0,0,0,1|1,0,1]=4 6523 B13R1.135 C\C(=C/c1cc[n]cc1)\C(C)NC Amb24349551 [0,1,0,0,0,1|1,0,1]=4 6524 B13R1.135 C\C(=C/c1ccccc1)\C(=S)NC Amb25045335 [0,1,0,0,0,1|0,0,2]=4 6525 B13R1.135 C\C(=C/c1ccccc1)\C(O)CC Amb25687882 [0,1,0,0,0,1|1,0,1]=4 6526 B13R1.135 C\C(=C\C)\C(C)Nc1ccccc1 Amb24743269 [0,1,0,0,0,1|1,0,1]=4 6527 B13R1.135 C\C=C(/Cl)\C(C)Nc1ccccc1 Amb24595467 [0,1,0,0,0,1|1,0,1]=4 6528 B13R1.135 C\C=C(\Cl)/C(C)Nc1ccccc1 Amb24519547 [0,1,0,0,0,1|1,0,1]=4 6529 B13R1.135 NNC(=O)C(Oc1ccccc1)C Amb2553856 [0,1,0,0,0,1|1,0,1]=4 6530 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [0,1,0,0,0,1|1,0,1]=4 6531 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,1,0,0,0,1|2,0,0]=4 6532 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [0,1,0,0,0,1|2,0,0]=4 6533 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,1,0,0,0,1|2,0,0]=4 6534 B13R1.348 CC(Br)CN(C)Cc1ccccc1 Amb25206431 [0,1,0,0,0,1|2,0,0]=4 6535 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [0,1,0,0,0,1|2,0,0]=4 6536 B13R1.348 CC(C)CC(C)Cc1cc[n]cc1 Amb24094262 [0,1,0,0,0,1|2,0,0]=4 6537 B13R1.348 CC(C)CC(O)Cc1ccccc1 Amb18796054 [0,1,0,0,0,1|2,0,0]=4 6538 B13R1.348 CC(C)C[C@@H](C)Nc1ccccc1 Amb24520693 [0,1,0,0,0,1|1,0,0]=3 6539 B13R1.348 CC(C)C[C@H](C)Nc1ccccc1 Amb25040127 [0,1,0,0,0,1|1,0,0]=3 6540 B13R1.348 CC(CN(C)C)Nc1ccccc1 Amb24707149 [0,1,0,0,0,1|0,0,0]=2 6541 B13R1.348 CC(CN(Cc1ccccc1)C)C Amb17233316 [0,1,0,0,0,1|2,0,0]=4 6542 B13R1.348 CC(CN(Cc1ccccc1)C)O Amb17138921 [0,1,0,0,0,1|2,0,0]=4 6543 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [0,1,0,0,0,1|2,0,0]=4 6544 B13R1.348 CC(Nc1ccccc1)CC(=O)N Amb17233441 [0,1,0,0,0,1|2,0,0]=4 6545 B13R1.348 CC(Oc1ccccc1)CC(=O)N Amb17233539 [0,1,0,0,0,1|2,0,0]=4 6546 B13R1.348 CN(O)CC(=O)Nc1ccccc1 Amb25790561 [0,1,0,0,0,1|1,0,1]=4 6547 B13R1.348 C[C@@H](CC(N)=O)Nc1ccccc1 Amb24727147 [0,1,0,0,0,1|2,0,0]=4 6548 B13R1.348 C[C@@H](CN(C)C)Nc1cc[n]cc1 Amb25749442 [0,1,0,0,0,1|1,0,0]=3 6549 B13R1.348 C[C@@H](CN(C)C)Nc1ccc[n][n]1 Amb24632875 [0,1,0,0,0,1|2,0,0]=4 6550 B13R1.348 C[C@@H](N)CN(C)Cc1ccccc1 Amb18527668 [0,1,0,0,0,1|2,0,0]=4 6551 B13R1.348 C[C@@H](O)CN(C)Cc1ccccc1 Amb24367032 [0,1,0,0,0,1|2,0,0]=4 6552 B13R1.348 C[C@H](CC(N)=O)Nc1ccccc1 Amb25707756 [0,1,0,0,0,1|2,0,0]=4 6553 B13R1.348 C[C@H](C[C@H](C)O)Nc1ccccc1 Amb25858831 [0,1,0,0,0,1|1,0,0]=3 6554 B13R1.348 C[C@H](O)CN(C)Cc1ccccc1 Amb24596318 [0,1,0,0,0,1|2,0,0]=4 6555 B13R1.348 C\C(\CC(C)N)=C/c1ccccc1 Amb25113467 [0,1,0,0,0,1|1,0,1]=4 6556 B13R1.348 C\C(\CN(C)C)=C/c1ccccc1 Amb25058928 [0,1,0,0,0,1|0,0,1]=3 6557 B13R1.348 C\C(\C[C@@H](C)O)=C/c1ccccc1 Amb24495452 [0,1,0,0,0,1|1,0,1]=4 6558 B13R1.348 C\C(\C[C@H](C)O)=C/c1ccccc1 Amb24576963 [0,1,0,0,0,1|1,0,1]=4 6559 B13R1.470 CC(CC#N)Nc1ccccc1I Amb25337319 [0,1,0,0,0,1|2,0,0]=4 6560 B13R1.470 CC(CC#N)Sc1ccccc1Br Amb24361599 [0,1,0,0,0,1|2,0,0]=4 6561 B13R1.470 CC(CC#N)Sc1ccccc1F Amb18321335 [0,1,0,0,0,1|2,0,0]=4 6562 B13R1.470 CC(CC#N)Sc1ccccc1N Amb19329903 [0,1,0,0,0,1|2,0,0]=4 6563 B13R1.470 CC(CCO)Nc1ccccc1N Amb25291969 [0,1,0,0,0,1|2,0,0]=4 6564 B13R1.470 CC(CNN)Oc1ccccc1Br Amb18579101 [0,1,0,0,0,1|1,0,0]=3 6565 B13R1.470 CC(CNN)Oc1ccccc1Cl Amb18066550 [0,1,0,0,0,1|1,0,0]=3 6566 B13R1.470 CC(CNN)Oc1ccccc1F Amb18564284 [0,1,0,0,0,1|1,0,0]=3 6567 B13R1.470 CCCC(C)Nc1[n]cccc1F Amb18185543 [0,1,0,0,0,1|2,0,0]=4 6568 B13R1.470 CCCC(C)Nc1c[n]ccc1N Amb25153282 [0,1,0,0,0,1|2,0,0]=4 6569 B13R1.470 CCCC(C)Nc1ccc[n]c1Br Amb25124511 [0,1,0,0,0,1|2,0,0]=4 6570 B13R1.470 CCCC(O)Cc1ccccc1Cl Amb19056191 [0,1,0,0,0,1|2,0,0]=4 6571 B13R1.470 CCCC(O)Cc1ccccc1F Amb18796620 [0,1,0,0,0,1|2,0,0]=4 6572 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2277697 [0,1,0,0,0,1|1,0,1]=4 6573 B13R1.470 CNCC(=O)Nc1ccccc1Br Amb2370683 [0,1,0,0,0,1|1,0,1]=4 6574 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2281752 [0,1,0,0,0,1|1,0,1]=4 6575 B13R1.470 CNCC(=O)Nc1ccccc1Cl Amb2370637 [0,1,0,0,0,1|1,0,1]=4 6576 B13R1.470 CNCC(C)Oc1ccccc1Cl Amb19025040 [0,1,0,0,0,1|0,0,0]=2 6577 B13R1.470 CNCC(Cc1ccccc1C)O Amb17233563 [0,1,0,0,0,1|1,0,0]=3 6578 B13R1.470 CNCC(Cc1ccccc1Cl)O Amb17237032 [0,1,0,0,0,1|1,0,0]=3 6579 B13R1.470 CNCC(Cc1ccccc1F)O Amb17233986 [0,1,0,0,0,1|1,0,0]=3 6580 B13R1.470 CNCC(O)Cc1ccccc1Br Amb18071609 [0,1,0,0,0,1|1,0,0]=3 6581 B13R1.470 COCC(C)Nc1[n]cccc1Br Amb19015765 [0,1,0,0,0,1|2,0,0]=4 6582 B13R1.470 COCC(C)Nc1[n]cccc1F Amb18314048 [0,1,0,0,0,1|2,0,0]=4 6583 B13R1.470 COCC(C)Nc1[n]cccc1I Amb25833272 [0,1,0,0,0,1|2,0,0]=4 6584 B13R1.470 COCC(C)Nc1c[n]ccc1Cl Amb25691718 [0,1,0,0,0,1|2,0,0]=4 6585 B13R1.470 COCC(C)Nc1cc[n]cc1Cl Amb25859465 [0,1,0,0,0,1|2,0,0]=4 6586 B13R1.470 COCC(C)Nc1cc[n]cc1F Amb25236763 [0,1,0,0,0,1|2,0,0]=4 6587 B13R1.470 COCC(C)Nc1ccc[n]c1Cl Amb19024351 [0,1,0,0,0,1|2,0,0]=4 6588 B13R1.470 COCC(C)Nc1ccc[n]c1N Amb25156333 [0,1,0,0,0,1|2,0,0]=4 6589 B13R1.470 COCC(C)Nc1ccccc1Br Amb18312244 [0,1,0,0,0,1|1,0,0]=3 6590 B13R1.470 COCC(C)Nc1ccccc1Cl Amb18312248 [0,1,0,0,0,1|1,0,0]=3 6591 B13R1.470 COCC(C)Nc1ccccc1F Amb19024321 [0,1,0,0,0,1|1,0,0]=3 6592 B13R1.470 COC[C@@H](C)Nc1[n]cccc1Cl Amb24335440 [0,1,0,0,0,1|2,0,0]=4 6593 B13R1.470 COC[C@@H](C)Nc1cc[n]cc1Br Amb24592323 [0,1,0,0,0,1|2,0,0]=4 6594 B13R1.470 CSCC(C)Nc1[n]cccc1Br Amb25816065 [0,1,0,0,0,1|2,0,0]=4 6595 B13R1.470 CSCC(C)Nc1c[n]ccc1N Amb25848745 [0,1,0,0,0,1|2,0,0]=4 6596 B13R1.470 CSCC(C)Nc1ccc[n]c1N Amb25757777 [0,1,0,0,0,1|2,0,0]=4 6597 B13R1.470 CSCC(C)Nc1ccccc1N Amb24710963 [0,1,0,0,0,1|1,0,0]=3 6598 B13R1.470 C\C(\CNC)=C/c1ccccc1Br Amb24354592 [0,1,0,0,0,1|0,0,1]=3 6599 B13R1.470 C\C(\CNC)=C/c1ccccc1Cl Amb24657004 [0,1,0,0,0,1|0,0,1]=3 6600 B13R1.470 C\C(\CNC)=C/c1ccccc1F Amb25080873 [0,1,0,0,0,1|0,0,1]=3 6601 B13R1.470 C\C=C\C(C)Nc1ccccc1Cl Amb25102585 [0,1,0,0,0,1|1,0,1]=4 6602 B13R1.470 C\C=C\C(C)Nc1ccccc1N Amb18127785 [0,1,0,0,0,1|1,0,1]=4 6603 B13R1.470 Cc1c[n]ccc1NC(C)CCC Amb25720534 [0,1,0,0,0,1|2,0,0]=4 6604 B13R1.470 Cc1cc[n]cc1\C=C(/C)\CNC Amb25742779 [0,1,0,0,0,1|1,0,1]=4 6605 B13R1.470 Cc1ccc[n]c1NC(C)CCC Amb18186285 [0,1,0,0,0,1|2,0,0]=4 6606 B13R1.470 Cc1ccc[n]c1NC(C)COC Amb18186671 [0,1,0,0,0,1|2,0,0]=4 6607 B13R1.470 Cc1ccccc1NC(=O)CNC Amb21958993 [0,1,0,0,0,1|1,0,1]=4 6608 B13R1.470 Cc1ccccc1NC(C)COC Amb19024323 [0,1,0,0,0,1|1,0,0]=3 6609 B13R1.470 Cc1ccccc1NC(C)\C=C\C Amb24488867 [0,1,0,0,0,1|1,0,1]=4 6610 B13R1.470 Cc1ccccc1OC(C)CNC Amb19025042 [0,1,0,0,0,1|0,0,0]=2 6611 B13R1.470 Cc1ccccc1OC(C)CNN Amb18065973 [0,1,0,0,0,1|1,0,0]=3 6612 B13R1.470 Cc1ccccc1SC(C)CC#N Amb18321053 [0,1,0,0,0,1|2,0,0]=4 6613 B13R1.470 N#CCC(Nc1ccccc1Br)C Amb17158704 [0,1,0,0,0,1|2,0,0]=4 6614 B13R1.470 N#CCC(Nc1ccccc1C)C Amb17138748 [0,1,0,0,0,1|2,0,0]=4 6615 B13R1.470 N#CCC(Nc1ccccc1Cl)C Amb17139530 [0,1,0,0,0,1|2,0,0]=4 6616 B13R1.470 N#CCC(Nc1ccccc1F)C Amb17138850 [0,1,0,0,0,1|2,0,0]=4 6617 B13R1.470 N#CCC(Oc1ccccc1Br)C Amb17255070 [0,1,0,0,0,1|2,0,0]=4 6618 B13R1.470 N#CCC(Oc1ccccc1C)C Amb17233108 [0,1,0,0,0,1|2,0,0]=4 6619 B13R1.470 N#CCC(Oc1ccccc1Cl)C Amb17236321 [0,1,0,0,0,1|2,0,0]=4 6620 B13R1.470 N#CCC(Oc1ccccc1F)C Amb17233520 [0,1,0,0,0,1|2,0,0]=4 6621 B13R1.470 NCCC(Cc1ccccc1C)C Amb17233327 [0,1,0,0,0,1|2,0,0]=4 6622 B13R1.470 NCCC(Cc1ccccc1Cl)C Amb17236688 [0,1,0,0,0,1|2,0,0]=4 6623 B13R1.470 NCCC(Cc1ccccc1F)C Amb17233826 [0,1,0,0,0,1|2,0,0]=4 6624 B13R1.470 NCCC(Oc1ccccc1Br)C Amb17256974 [0,1,0,0,0,1|2,0,0]=4 6625 B13R1.470 NCCC(Oc1ccccc1C)C Amb17233610 [0,1,0,0,0,1|2,0,0]=4 6626 B13R1.470 NCCC(Oc1ccccc1Cl)C Amb17237051 [0,1,0,0,0,1|2,0,0]=4 6627 B13R1.470 NCCC(Oc1ccccc1F)C Amb17234003 [0,1,0,0,0,1|2,0,0]=4 6628 B13R1.470 OCCC(Cc1ccccc1C)C Amb17233450 [0,1,0,0,0,1|2,0,0]=4 6629 B13R1.470 OCCC(Cc1ccccc1Cl)C Amb17236858 [0,1,0,0,0,1|2,0,0]=4 6630 B13R1.470 OCCC(Cc1ccccc1F)C Amb17233913 [0,1,0,0,0,1|2,0,0]=4 6631 B13R1.470 OCCC(Oc1ccccc1Br)C Amb17257490 [0,1,0,0,0,1|2,0,0]=4 6632 B13R1.470 OCCC(Oc1ccccc1C)C Amb17233713 [0,1,0,0,0,1|2,0,0]=4 6633 B13R1.470 OCCC(Oc1ccccc1Cl)C Amb17237187 [0,1,0,0,0,1|2,0,0]=4 6634 B13R1.470 OCCC(Oc1ccccc1F)C Amb17234068 [0,1,0,0,0,1|2,0,0]=4 6635 B13R1.470 [C-]#[N+]CC(C)Oc1ccccc1C Amb25249516 [0,1,0,0,0,1|0,0,2]=4 6636 B13R1.470 [C-]#[N+]CC(C)Oc1ccccc1Cl Amb25178290 [0,1,0,0,0,1|0,0,2]=4 6637 B13R1.470 [C-]#[N+]CC(C)Oc1ccccc1F Amb25217103 [0,1,0,0,0,1|0,0,2]=4 6638 B13R1.1327 CC(F)(CC#N)Cc1ccccc1 Amb24672464 [0,1,0,0,0,1|2,0,0]=4 6639 B13R1.1327 CCCC(C)(C)Nc1cccc[n]1 Amb24403946 [0,1,0,0,0,1|2,0,0]=4 6640 B13R1.1327 CCCC(C)(O)Cc1c[n]ccc1 Amb24065738 [0,1,0,0,0,1|2,0,0]=4 6641 B13R1.1327 CNCC(Cc1ccccc1)(O)C Amb17082168 [0,1,0,0,0,1|0,0,0]=2 6642 B13R1.1327 CNCC(Cc1ccccn1)(O)C Amb17082165 [0,1,0,0,0,1|1,0,0]=3 6643 B13R1.1327 CNCC(Cc1cccnc1)(O)C Amb17082166 [0,1,0,0,0,1|1,0,0]=3 6644 B13R1.1327 CNCC(Cc1ccncc1)(O)C Amb17082167 [0,1,0,0,0,1|1,0,0]=3 6645 B13R1.1327 COCC(C)(C)Nc1cc[n]cc1 Amb25280570 [0,1,0,0,0,1|2,0,0]=4 6646 B13R1.1327 N#CCC(Oc1ccccc1)(C)C Amb17233106 [0,1,0,0,0,1|2,0,0]=4 6647 B13R1.1327 NCCC(Cc1ccccc1)(C)C Amb17335193 [0,1,0,0,0,1|2,0,0]=4 6648 B13R1.1327 NCCC(Oc1ccccc1)(C)C Amb17233604 [0,1,0,0,0,1|2,0,0]=4 6649 B13R1.1327 OCCC(Cc1ccccc1)(C)C Amb17335249 [0,1,0,0,0,1|2,0,0]=4 6650 B13R1.1 CCC(OCC)c1ccc(Br)cc1 Amb23443745 [0,2,0,0,0,0|2,0,0]=4 6651 B13R1.1 CCC(OCC)c1ccc(S)cc1 Amb23568733 [0,2,0,0,0,0|2,0,0]=4 6652 B13R1.1 CCC(c1ccc(cc1)Br)NCC Amb1095033 [0,2,0,0,0,0|2,0,0]=4 6653 B13R1.1 CCCC(CN)c1ccc(F)cc1 Amb22900953 [0,2,0,0,0,0|1,0,0]=3 6654 B13R1.1 CCCC(NC)c1ccc(Br)cc1 Amb22042490 [0,2,0,0,0,0|1,0,0]=3 6655 B13R1.1 CCCC(OC)c1ccc(N)cc1 Amb23568679 [0,2,0,0,0,0|1,0,0]=3 6656 B13R1.1 CCCC(OC)c1ccc(S)cc1 Amb23568729 [0,2,0,0,0,0|1,0,0]=3 6657 B13R1.1 CCCC(c1ccc(cc1)Br)C#N Amb17254043 [0,2,0,0,0,0|1,0,1]=4 6658 B13R1.1 CCCC(c1ccc(cc1)Br)CN Amb17255981 [0,2,0,0,0,0|1,0,0]=3 6659 B13R1.1 CCCC(c1ccc(cc1)Br)CO Amb17256435 [0,2,0,0,0,0|1,0,0]=3 6660 B13R1.1 CCCC(c1ccc(cc1)C)C#N Amb17232974 [0,2,0,0,0,0|1,0,1]=4 6661 B13R1.1 CCCC(c1ccc(cc1)C)CCl Amb17236524 [0,2,0,0,0,0|1,0,0]=3 6662 B13R1.1 CCCC(c1ccc(cc1)C)CN Amb13881881 [0,2,0,0,0,0|1,0,0]=3 6663 B13R1.1 CCCC(c1ccc(cc1)C)CO Amb17233459 [0,2,0,0,0,0|1,0,0]=3 6664 B13R1.1 CCCC(c1ccc(cc1)Cl)C#N Amb17235861 [0,2,0,0,0,0|1,0,1]=4 6665 B13R1.1 CCCC(c1ccc(cc1)Cl)CN Amb17236700 [0,2,0,0,0,0|1,0,0]=3 6666 B13R1.1 CCCC(c1ccc(cc1)Cl)CO Amb17236864 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.1 CCCC(c1ccc(cc1)F)C#N Amb17233265 [0,2,0,0,0,0|1,0,1]=4 6668 B13R1.1 CCCC(c1ccc(cc1)F)CBr Amb17257511 [0,2,0,0,0,0|1,0,0]=3 6669 B13R1.1 CCCC(c1ccc(cc1)F)CCl Amb17237207 [0,2,0,0,0,0|1,0,0]=3 6670 B13R1.1 CCCC(c1ccc(cc1)F)CN Amb13881880 [0,2,0,0,0,0|1,0,0]=3 6671 B13R1.1 CCCC(c1ccc(cc1)F)CO Amb17233917 [0,2,0,0,0,0|1,0,0]=3 6672 B13R1.1 CCNC(c1ccc(cc1)C)CC Amb10610169 [0,2,0,0,0,0|2,0,0]=4 6673 B13R1.1 CCOC(c1ccc(cc1)C)CN Amb17606011 [0,2,0,0,0,0|2,0,0]=4 6674 B13R1.1 CC\C(=N\NC)\c1ccc(F)cc1 Amb24414765 [0,2,0,0,0,0|1,0,1]=4 6675 B13R1.1 CNC(CC#C)c1ccc(Cl)cc1 Amb18330433 [0,2,0,0,0,0|1,0,1]=4 6676 B13R1.1 CNC(CC#C)c1ccc(F)cc1 Amb18808963 [0,2,0,0,0,0|1,0,1]=4 6677 B13R1.1 CNC(CC#C)c1ccc(I)cc1 Amb25343000 [0,2,0,0,0,0|1,0,1]=4 6678 B13R1.1 CNC(CCO)c1ccc(Br)cc1 Amb18071616 [0,2,0,0,0,0|2,0,0]=4 6679 B13R1.1 CNC(CCO)c1ccc(Cl)cc1 Amb18066520 [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.1 CNC(CCO)c1ccc(F)cc1 Amb18066112 [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.1 CNC(COC)c1ccc(Cl)cc1 Amb19018141 [0,2,0,0,0,0|1,0,0]=3 6682 B13R1.1 CNCC(c1ccc(cc1)Br)CC Amb17255980 [0,2,0,0,0,0|0,0,0]=2 6683 B13R1.1 CNCC(c1ccc(cc1)Br)OC Amb17605855 [0,2,0,0,0,0|0,0,0]=2 6684 B13R1.1 CNCC(c1ccc(cc1)C)CC Amb17233338 [0,2,0,0,0,0|0,0,0]=2 6685 B13R1.1 CNCC(c1ccc(cc1)C)OC Amb17605881 [0,2,0,0,0,0|0,0,0]=2 6686 B13R1.1 CNCC(c1ccc(cc1)Cl)CC Amb17236699 [0,2,0,0,0,0|0,0,0]=2 6687 B13R1.1 CNCC(c1ccc(cc1)Cl)OC Amb17605882 [0,2,0,0,0,0|0,0,0]=2 6688 B13R1.1 CNCC(c1ccc(cc1)F)CC Amb17233833 [0,2,0,0,0,0|0,0,0]=2 6689 B13R1.1 COC(COC)c1ccc(Br)cc1 Amb23568753 [0,2,0,0,0,0|1,0,0]=3 6690 B13R1.1 COC(COC)c1ccc(N)cc1 Amb23443732 [0,2,0,0,0,0|1,0,0]=3 6691 B13R1.1 Cc1ccc(cc1)C(CC#C)NC Amb18808004 [0,2,0,0,0,0|1,0,1]=4 6692 B13R1.1 Cc1ccc(cc1)C(CCO)NC Amb18065869 [0,2,0,0,0,0|2,0,0]=4 6693 B13R1.1 N#CCC(CO)c1ccc(Cl)cc1 Amb25105862 [0,2,0,0,0,0|2,0,0]=4 6694 B13R1.1 N#CC[C@@H](CO)c1ccc(Cl)cc1 Amb24353036 [0,2,0,0,0,0|2,0,0]=4 6695 B13R1.1 NCC(c1ccc(cc1)Br)OCC Amb17605996 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.1 NCC(c1ccc(cc1)Cl)OCC Amb17606012 [0,2,0,0,0,0|2,0,0]=4 6697 B13R1.1 NCCC(c1ccc(cc1)Br)CN Amb17256468 [0,2,0,0,0,0|2,0,0]=4 6698 B13R1.1 NCCC(c1ccc(cc1)Br)OC Amb17349687 [0,2,0,0,0,0|2,0,0]=4 6699 B13R1.1 NCCC(c1ccc(cc1)C)CN Amb17233491 [0,2,0,0,0,0|2,0,0]=4 6700 B13R1.1 NCCC(c1ccc(cc1)C)OC Amb17335347 [0,2,0,0,0,0|2,0,0]=4 6701 B13R1.1 NCCC(c1ccc(cc1)Cl)CN Amb17236899 [0,2,0,0,0,0|2,0,0]=4 6702 B13R1.1 NCCC(c1ccc(cc1)Cl)OC Amb17337498 [0,2,0,0,0,0|2,0,0]=4 6703 B13R1.1 NCCC(c1ccc(cc1)F)CN Amb17233929 [0,2,0,0,0,0|2,0,0]=4 6704 B13R1.1 NCCC(c1ccc(cc1)F)OC Amb17335622 [0,2,0,0,0,0|2,0,0]=4 6705 B13R1.1 NC[C@H](CC#N)c1ccc(Cl)cc1 Amb24424589 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.1 OCCC(c1ccc(cc1)Br)CC Amb17256436 [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.1 OCCC(c1ccc(cc1)Br)CN Amb17256963 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.1 OCCC(c1ccc(cc1)C)CC Amb17233460 [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.1 OCCC(c1ccc(cc1)C)CN Amb17233572 [0,2,0,0,0,0|2,0,0]=4 6710 B13R1.1 OCCC(c1ccc(cc1)Cl)CC Amb17236865 [0,2,0,0,0,0|2,0,0]=4 6711 B13R1.1 OCCC(c1ccc(cc1)Cl)CN Amb17237041 [0,2,0,0,0,0|2,0,0]=4 6712 B13R1.1 OCCC(c1ccc(cc1)F)CC Amb17233918 [0,2,0,0,0,0|2,0,0]=4 6713 B13R1.1 OCCC(c1ccc(cc1)F)CN Amb17233991 [0,2,0,0,0,0|2,0,0]=4 6714 B13R1.2 CCC(OCC)c1cccc(N)c1 Amb23443787 [0,2,0,0,0,0|2,0,0]=4 6715 B13R1.2 CCCC(c1cccc(c1)C)CN Amb17233361 [0,2,0,0,0,0|1,0,0]=3 6716 B13R1.2 CCCC(c1cccc(c1)Cl)CN Amb17236706 [0,2,0,0,0,0|1,0,0]=3 6717 B13R1.2 CCCC(c1cccc(c1)F)CN Amb17233841 [0,2,0,0,0,0|1,0,0]=3 6718 B13R1.2 CCOC(c1cccc(c1)Br)CN Amb17606016 [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.2 CCOC(c1cccc(c1)Cl)CN Amb17605998 [0,2,0,0,0,0|2,0,0]=4 6720 B13R1.2 CCOC(c1cccc(c1)F)CN Amb17606013 [0,2,0,0,0,0|2,0,0]=4 6721 B13R1.2 CNC(CC#C)c1cccc(Cl)c1 Amb18330434 [0,2,0,0,0,0|1,0,1]=4 6722 B13R1.2 CNC(CC#C)c1cccc(F)c1 Amb18808964 [0,2,0,0,0,0|1,0,1]=4 6723 B13R1.2 CNC(CC#C)c1cccc(I)c1 Amb24697125 [0,2,0,0,0,0|1,0,1]=4 6724 B13R1.2 CNCC(c1cccc(c1)Br)OC Amb17605886 [0,2,0,0,0,0|0,0,0]=2 6725 B13R1.2 CNCC(c1cccc(c1)Cl)OC Amb17605863 [0,2,0,0,0,0|0,0,0]=2 6726 B13R1.2 CNCC(c1cccc(c1)F)OC Amb17605883 [0,2,0,0,0,0|0,0,0]=2 6727 B13R1.2 COC(COC)c1cccc(N)c1 Amb23443789 [0,2,0,0,0,0|1,0,0]=3 6728 B13R1.2 Cc1cccc(c1)C(CC#C)NC Amb18808005 [0,2,0,0,0,0|1,0,1]=4 6729 B13R1.2 NCCC(c1cccc(c1)Br)CN Amb17256467 [0,2,0,0,0,0|2,0,0]=4 6730 B13R1.2 NCCC(c1cccc(c1)C)CC Amb17233364 [0,2,0,0,0,0|2,0,0]=4 6731 B13R1.2 NCCC(c1cccc(c1)C)CN Amb17233490 [0,2,0,0,0,0|2,0,0]=4 6732 B13R1.2 NCCC(c1cccc(c1)Cl)CC Amb17236709 [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.2 NCCC(c1cccc(c1)Cl)CN Amb17236898 [0,2,0,0,0,0|2,0,0]=4 6734 B13R1.2 NCCC(c1cccc(c1)F)CC Amb17233844 [0,2,0,0,0,0|2,0,0]=4 6735 B13R1.2 OCCC(c1cccc(c1)Br)CN Amb17256960 [0,2,0,0,0,0|2,0,0]=4 6736 B13R1.2 OCCC(c1cccc(c1)C)CC Amb17233479 [0,2,0,0,0,0|2,0,0]=4 6737 B13R1.2 OCCC(c1cccc(c1)C)CN Amb17233569 [0,2,0,0,0,0|2,0,0]=4 6738 B13R1.2 OCCC(c1cccc(c1)Cl)CC Amb17236881 [0,2,0,0,0,0|2,0,0]=4 6739 B13R1.2 OCCC(c1cccc(c1)Cl)CN Amb17237038 [0,2,0,0,0,0|2,0,0]=4 6740 B13R1.2 OCCC(c1cccc(c1)F)CC Amb17233925 [0,2,0,0,0,0|2,0,0]=4 6741 B13R1.26 CC#CCC(NC)c1c[n]ccc1 Amb18804165 [0,2,0,0,0,0|2,0,0]=4 6742 B13R1.26 CC#CCC(NC)c1cc[n]cc1 Amb18804166 [0,2,0,0,0,0|2,0,0]=4 6743 B13R1.26 CC#CCC(NC)c1cccc[n]1 Amb18804164 [0,2,0,0,0,0|2,0,0]=4 6744 B13R1.26 CC#CCC(NC)c1ccccc1 Amb18803524 [0,2,0,0,0,0|1,0,0]=3 6745 B13R1.26 CC#CCC(NN)c1ccccc1 Amb25766082 [0,2,0,0,0,0|2,0,0]=4 6746 B13R1.26 CCCCC(c1ccccc1)NO Amb10605017 [0,2,0,0,0,0|2,0,0]=4 6747 B13R1.26 CCCCC(c1cccnc1)NC Amb10607966 [0,2,0,0,0,0|2,0,0]=4 6748 B13R1.26 CCCCC(c1cccnc1)NC Amb13949195 [0,2,0,0,0,0|2,0,0]=4 6749 B13R1.26 CCOCN(c1ccccc1)CC Amb10559528 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.26 NCC(OCCO)c1ccccc1 Amb23580589 [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.26 NCCCN(c1ccccc1)CC Amb1216937 [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.26 OCCCC(c1cccnc1)NC Amb17617179 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.173 CCC(NCC)c1ccccc1Cl Amb19054924 [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.173 CCCC(C#N)c1ccccc1Cl Amb24496248 [0,2,0,0,0,0|1,0,1]=4 6755 B13R1.173 CCCC(c1ccccc1C)CN Amb17233356 [0,2,0,0,0,0|1,0,0]=3 6756 B13R1.173 CCCC(c1ccccc1Cl)CN Amb17236701 [0,2,0,0,0,0|1,0,0]=3 6757 B13R1.173 CCCC(c1ccccc1F)CN Amb17233836 [0,2,0,0,0,0|1,0,0]=3 6758 B13R1.173 CCC\C(=N\C)\c1ccccc1O Amb24598943 [0,2,0,0,0,0|1,0,1]=4 6759 B13R1.173 CCOC(c1ccccc1C)CN Amb17606025 [0,2,0,0,0,0|2,0,0]=4 6760 B13R1.173 CCOC(c1ccccc1Cl)CN Amb17606018 [0,2,0,0,0,0|2,0,0]=4 6761 B13R1.173 CCOC(c1ccccc1F)CN Amb17606019 [0,2,0,0,0,0|2,0,0]=4 6762 B13R1.173 CNC(CC#C)c1ccccc1Br Amb24358399 [0,2,0,0,0,0|1,0,1]=4 6763 B13R1.173 CNC(CC#C)c1ccccc1Cl Amb18330435 [0,2,0,0,0,0|1,0,1]=4 6764 B13R1.173 CNC(CC#C)c1ccccc1F Amb18790834 [0,2,0,0,0,0|1,0,1]=4 6765 B13R1.173 CNCC(c1ccccc1C)OC Amb17605895 [0,2,0,0,0,0|0,0,0]=2 6766 B13R1.173 CNCC(c1ccccc1Cl)OC Amb17605888 [0,2,0,0,0,0|0,0,0]=2 6767 B13R1.173 CNCC(c1ccccc1F)OC Amb17605889 [0,2,0,0,0,0|0,0,0]=2 6768 B13R1.173 C\C=C/C(CC)c1ccccc1O Amb24467574 [0,2,0,0,0,0|1,0,1]=4 6769 B13R1.173 C\C=C\C(CC)c1ccccc1O Amb24422325 [0,2,0,0,0,0|1,0,1]=4 6770 B13R1.173 Cc1ccccc1C(CC#C)NC Amb18185791 [0,2,0,0,0,0|1,0,1]=4 6771 B13R1.173 NCCC(c1ccccc1C)CC Amb17233359 [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.173 NCCC(c1ccccc1C)CN Amb17233489 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.173 NCCC(c1ccccc1Cl)CC Amb17236704 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.173 NCCC(c1ccccc1Cl)CN Amb17236897 [0,2,0,0,0,0|2,0,0]=4 6775 B13R1.173 NCCC(c1ccccc1F)CC Amb17233839 [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.173 NCCC(c1ccccc1F)CN Amb17233928 [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.173 OCCC(c1ccccc1C)CC Amb17233477 [0,2,0,0,0,0|2,0,0]=4 6778 B13R1.173 OCCC(c1ccccc1C)CN Amb17233565 [0,2,0,0,0,0|2,0,0]=4 6779 B13R1.173 OCCC(c1ccccc1Cl)CC Amb17236879 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.173 OCCC(c1ccccc1Cl)CN Amb17237034 [0,2,0,0,0,0|2,0,0]=4 6781 B13R1.173 OCCC(c1ccccc1F)CC Amb17233922 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.173 OCCC(c1ccccc1F)CN Amb17233988 [0,2,0,0,0,0|2,0,0]=4 6783 B13R1.398 CC=C=C(CNN)c1ccccc1 Amb24501316 [0,2,0,0,0,0|1,0,1]=4 6784 B13R1.398 CCOC(CCCl)c1ccccc1 Amb24093905 [0,2,0,0,0,0|2,0,0]=4 6785 B13R1.398 CCOC(c1ccccc1)OCC Amb10561865 [0,2,0,0,0,0|2,0,0]=4 6786 B13R1.398 CNCC(c1ccccc1)OCC Amb17605900 [0,2,0,0,0,0|0,0,0]=2 6787 B13R1.398 N#CCC(CC#N)c1ccccc1 Amb18126688 [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.402 CC#CC(C)(CO)c1ccccc1 Amb25191736 [0,2,0,0,0,0|1,0,1]=4 6789 B13R1.402 CC#CC(O)(CC)c1ccccc1 Amb25733643 [0,2,0,0,0,0|1,0,1]=4 6790 B13R1.402 CC(CCCl)(C#N)c1ccccc1 Amb18651639 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.402 CC(CN)(CC#C)c1ccccc1 Amb24705638 [0,2,0,0,0,0|1,0,1]=4 6792 B13R1.402 CCC(O)(CC#C)c1ccccc1 Amb25850620 [0,2,0,0,0,0|1,0,1]=4 6793 B13R1.402 CCC(O)(CCN)c1ccccc1 Amb18194407 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.402 CCNC(C)(C#N)c1ccccc1 Amb24113639 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.402 CCSC(c1ccccc1)(C#N)C Amb17595005 [0,2,0,0,0,0|2,0,0]=4 6796 B13R1.402 CNCC(c1ccccc1)(CC)O Amb17138917 [0,2,0,0,0,0|0,0,0]=2 6797 B13R1.402 COCC(N)(C#N)c1ccccc1 Amb18294442 [0,2,0,0,0,0|1,0,1]=4 6798 B13R1.402 COCC(c1ccccc1)(C#N)C Amb17594447 [0,2,0,0,0,0|1,0,0]=3 6799 B13R1.402 CSCC(N)(C#N)c1ccccc1 Amb18984231 [0,2,0,0,0,0|1,0,1]=4 6800 B13R1.402 C\C=C\C(C)(C=O)c1ccccc1 Amb18127300 [0,2,0,0,0,0|1,0,1]=4 6801 B13R1.402 N#CCC(O)(CO)c1ccccc1 Amb25051287 [0,2,0,0,0,0|2,0,0]=4 6802 B13R1.405 BrCCC(c1ccccc1)C(C)C Amb17255496 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.405 CC(=O)C(CC#C)c1ccccc1 Amb24492635 [0,2,0,0,0,0|1,0,1]=4 6804 B13R1.405 CC(=O)\C(=C/NC)\c1ccccc1 Amb24399834 [0,2,0,0,0,0|0,0,2]=4 6805 B13R1.405 CC(=O)\C(=C\NC)\c1ccccc1 Amb24567970 [0,2,0,0,0,0|0,0,2]=4 6806 B13R1.405 CCCC(C(N)=O)c1ccccc1 Amb19186061 [0,2,0,0,0,0|1,0,1]=4 6807 B13R1.405 CN(C)C(CCCl)c1ccccc1 Amb24117903 [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.405 CN(C)C(CCN)c1ccccc1 Amb19373168 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.405 CN(C)C(CCO)c1ccccc1 Amb22499572 [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.405 CNCC(c1ccccc1)C(C)C Amb17233323 [0,2,0,0,0,0|0,0,0]=2 6811 B13R1.405 CNCC(c1cccnc1)N(C)C Amb10576427 [0,2,0,0,0,0|1,0,0]=3 6812 B13R1.405 CS(=O)C(CC#N)c1ccccc1 Amb24513657 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.405 CSCC(C(O)=O)c1ccccc1 Amb19037338 [0,2,0,0,0,0|1,0,1]=4 6814 B13R1.405 C[C@@H](O)[C@@H](CC#N)c1ccccc1 Amb24363575 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.405 ClCCC(c1ccccc1)C(C)C Amb17236523 [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.405 OCCC(c1ccccc1)C(C)C Amb17233457 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.532 CC(NC)C(OC)c1ccccc1 Amb22733802 [0,2,0,0,0,0|0,0,0]=2 6818 B13R1.532 CCC(C(=S)NC)c1ccccc1 Amb25690915 [0,2,0,0,0,0|0,0,1]=3 6819 B13R1.532 CCC(C(O)C#C)c1ccccc1 Amb24429433 [0,2,0,0,0,0|1,0,1]=4 6820 B13R1.532 CCN(C(=N)NC)c1ccccc1 Amb18804662 [0,2,0,0,0,0|1,0,1]=4 6821 B13R1.532 CCN(C(=S)NC)c1ccccc1 Amb25073460 [0,2,0,0,0,0|1,0,1]=4 6822 B13R1.532 CCP(C(=S)NC)c1ccccc1 Amb25324580 [0,2,0,0,0,0|1,0,1]=4 6823 B13R1.532 CC[C@@H](C(=O)NC)c1ccccc1 Amb25685863 [0,2,0,0,0,0|0,0,1]=3 6824 B13R1.532 CC[C@H](O)[C@@H](C#N)c1ccccc1 Amb24386945 [0,2,0,0,0,0|1,0,1]=4 6825 B13R1.532 CNC(=N)C(OC)c1ccccc1 Amb25132391 [0,2,0,0,0,0|0,0,1]=3 6826 B13R1.532 CNC(=O)C(C#N)c1ccccc1 Amb18790298 [0,2,0,0,0,0|0,0,2]=4 6827 B13R1.532 CNC(=O)C(CN)c1ccc[n]c1 Amb23571968 [0,2,0,0,0,0|1,0,1]=4 6828 B13R1.532 CNC(=O)C(CN)c1cccc[n]1 Amb23571969 [0,2,0,0,0,0|1,0,1]=4 6829 B13R1.532 CNC(=O)C(CN)c1ccccc1 Amb18999518 [0,2,0,0,0,0|0,0,1]=3 6830 B13R1.532 CNC(=O)C(CO)c1ccccc1 Amb25685879 [0,2,0,0,0,0|0,0,1]=3 6831 B13R1.532 CNC(=O)C(NC)c1ccccc1 Amb18128254 [0,2,0,0,0,0|0,0,1]=3 6832 B13R1.532 CNC(=O)C(OC)c1ccccc1 Amb24390519 [0,2,0,0,0,0|0,0,1]=3 6833 B13R1.532 CNC(=O)N(NC)c1ccccc1 Amb25731876 [0,2,0,0,0,0|1,0,1]=4 6834 B13R1.532 CNC(=O)[C@@H](NO)c1ccccc1 Amb25803643 [0,2,0,0,0,0|1,0,1]=4 6835 B13R1.532 CNC(=S)C(OC)c1cccc[n]1 Amb25731942 [0,2,0,0,0,0|1,0,1]=4 6836 B13R1.532 CNC(C(=O)NO)c1ccccc1 Amb25110038 [0,2,0,0,0,0|1,0,1]=4 6837 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb18809173 [0,2,0,0,0,0|1,0,1]=4 6838 B13R1.532 CNC(C(=O)OC)c1ccccc1 Amb19374443 [0,2,0,0,0,0|1,0,1]=4 6839 B13R1.532 CNC(C)\C(=N\O)\c1ccccc1 Amb24563841 [0,2,0,0,0,0|1,0,1]=4 6840 B13R1.532 CN[C@@H](C(=O)NO)c1ccccc1 Amb24739805 [0,2,0,0,0,0|1,0,1]=4 6841 B13R1.532 COC(=O)C(CBr)c1ccccc1 Amb20671515 [0,2,0,0,0,0|1,0,1]=4 6842 B13R1.532 COC(=O)[C@@H](OC)c1ccccc1 Amb22746502 [0,2,0,0,0,0|1,0,1]=4 6843 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 Amb22274921 [0,2,0,0,0,0|1,0,1]=4 6844 B13R1.532 COC(C(=O)NO)c1ccccc1 Amb18184979 [0,2,0,0,0,0|1,0,1]=4 6845 B13R1.532 COC(c1ccccc1)C(=O)OC Amb10783162 [0,2,0,0,0,0|1,0,1]=4 6846 B13R1.532 CO[C@H]([C@@H](O)C#N)c1ccccc1 Amb25792480 [0,2,0,0,0,0|2,0,0]=4 6847 B13R1.532 CO[C@H]([C@H](O)C#N)c1ccccc1 Amb24355254 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.532 CSC(C(=O)NN)c1ccccc1 Amb24568850 [0,2,0,0,0,0|1,0,1]=4 6849 B13R1.532 C\C=C(\C(C)NC)/c1ccccc1 Amb24451964 [0,2,0,0,0,0|0,0,1]=3 6850 B13R1.532 NCC(C(=O)NO)c1ccccc1 Amb25363657 [0,2,0,0,0,0|1,0,1]=4 6851 B13R1.532 NCC(c1ccccc1)C(=O)OC Amb17400701 [0,2,0,0,0,0|1,0,1]=4 6852 B13R1.532 NNC(=O)C(CO)c1ccccc1 Amb24747140 [0,2,0,0,0,0|1,0,1]=4 6853 B13R1.532 [NH3+]CC(c1ccccc1)C(=O)OC Amb10564340 [0,2,0,0,0,0|1,0,1]=4 6854 B13R1.713 BrCC(c1ccccc1)CC(C)C Amb17255495 [0,2,0,0,0,0|1,0,0]=3 6855 B13R1.713 C=CC(c1ccccc1)CC(=O)C Amb17594412 [0,2,0,0,0,0|1,0,1]=4 6856 B13R1.713 CC(=O)C[C@H](C#C)c1ccccc1 Amb25086564 [0,2,0,0,0,0|1,0,1]=4 6857 B13R1.713 CC(=O)C\C(=N\C)\c1ccccc1 Amb25718365 [0,2,0,0,0,0|1,0,1]=4 6858 B13R1.713 CC(=O)NC(CF)c1ccccc1 Amb24071988 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.713 CC(=O)NC(CN)c1ccccc1 Amb18909054 [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 Amb22801576 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.713 CC(=O)N[C@H](CC)c1ccccc1 Amb25278238 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.713 CC(=O)N[C@H](CF)c1ccccc1 Amb24674275 [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 Amb25366132 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.713 CC(=O)OC(CC)c1ccccc1 Amb24064892 [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.713 CC(=O)OC(CN)c1ccccc1 Amb20246079 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.713 CC(=S)N[C@@H](CO)c1ccccc1 Amb25689720 [0,2,0,0,0,0|2,0,0]=4 6867 B13R1.713 CC(C)=CC(NC)c1ccccc1 Amb25128430 [0,2,0,0,0,0|1,0,1]=4 6868 B13R1.713 CC(C)=N[C@H](CO)c1ccccc1 Amb25855749 [0,2,0,0,0,0|2,0,0]=4 6869 B13R1.713 CC(C)CC(CN)c1cc[n]cc1 Amb19515162 [0,2,0,0,0,0|2,0,0]=4 6870 B13R1.713 CC(C)CC(CN)c1cccc[n]1 Amb19515161 [0,2,0,0,0,0|2,0,0]=4 6871 B13R1.713 CC(N)CC(C#N)c1ccccc1 Amb18825228 [0,2,0,0,0,0|1,0,1]=4 6872 B13R1.713 CC(N)CC(CC)c1ccccc1 Amb24064889 [0,2,0,0,0,0|1,0,0]=3 6873 B13R1.713 CC(O)CC(CN)c1ccccc1 Amb20668981 [0,2,0,0,0,0|1,0,0]=3 6874 B13R1.713 CCC(CN(C)C)c1ccccc1 Amb22491733 [0,2,0,0,0,0|0,0,0]=2 6875 B13R1.713 CCC(NC(C)=O)c1ccccc1 Amb17844502 [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.713 CCC(c1ccccc1)CC(=O)N Amb17233286 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.713 CCN(c1ccccc1)CC(C)C Amb17233317 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.713 CCN(c1ccccc1)CC(N)C Amb1136881 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.713 CCN(c1ccccc1)CC(O)C Amb17138930 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.713 CC[C@@H](c1ccccc1)NC(=O)C Amb10559459 [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.713 CN(C)NC(C#C)c1ccccc1 Amb25377729 [0,2,0,0,0,0|1,0,1]=4 6882 B13R1.713 CN(C)NC(CN)c1ccccc1 Amb18563043 [0,2,0,0,0,0|1,0,0]=3 6883 B13R1.713 CN(C)\N=C(\NC)/c1ccccc1 Amb25035292 [0,2,0,0,0,0|1,0,1]=4 6884 B13R1.713 CN(CC(c1ccccc1)C#N)C Amb17233031 [0,2,0,0,0,0|0,0,1]=3 6885 B13R1.713 CNC(c1ccccc1)CN(C)C Amb10068793 [0,2,0,0,0,0|0,0,0]=2 6886 B13R1.713 ClCC(c1ccccc1)CC(C)C Amb17236522 [0,2,0,0,0,0|1,0,0]=3 6887 B13R1.713 N#CC(c1ccccc1)CC(=O)C Amb1019551 [0,2,0,0,0,0|1,0,1]=4 6888 B13R1.713 NC(=O)CC(CN)c1ccccc1 Amb23441535 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.713 NCC(CC(O)=O)c1ccccc1 Amb22047642 [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.713 NCC(c1ccccc1)CC(=O)O Amb1033044 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.713 NCC(c1ccccc1)OC(C)C Amb17605965 [0,2,0,0,0,0|2,0,0]=4 6892 B13R1.713 NCC(c1ccccn1)CN(C)C Amb17322078 [0,2,0,0,0,0|1,0,0]=3 6893 B13R1.713 NCC(c1cccnc1)CN(C)C Amb17322092 [0,2,0,0,0,0|1,0,0]=3 6894 B13R1.713 NCC(c1ccncc1)CN(C)C Amb17322106 [0,2,0,0,0,0|1,0,0]=3 6895 B13R1.713 NC[C@@H](CC(O)=O)c1ccccc1 Amb20241745 [0,2,0,0,0,0|2,0,0]=4 6896 B13R1.713 NC[C@@H](CC(O)=O)c1ccccc1 Amb22747178 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.713 NC[C@H](CC(O)=O)c1ccccc1 Amb20241740 [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.713 OCC(c1ccccc1)CC(C)C Amb17233456 [0,2,0,0,0,0|1,0,0]=3 6899 B13R1.713 OCC(c1ccccc1)NC(=O)C Amb17138902 [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.713 ONC(c1ccccc1)CC(C)C Amb10605005 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.17 CC#CCC(N)c1ccc(Cl)cc1 Amb19062407 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.17 CC#CCC(N)c1ccc(F)cc1 Amb18988271 [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.17 CC#CCC(N)c1ccc(I)cc1 Amb25158782 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.17 CC#CCC(O)c1ccc(Cl)cc1 Amb19063293 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.17 CC#CCC(O)c1ccc(F)cc1 Amb18184295 [0,2,0,0,0,0|2,0,0]=4 6906 B13R1.17 CC#CCC(O)c1ccc(I)cc1 Amb25159223 [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.17 CC#CCC(O)c1ccc(N)cc1 Amb24460140 [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.17 CC#CCN(C)c1ccc(I)cc1 Amb24475700 [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.17 CC(CCC#N)c1ccc(N)cc1 Amb25290406 [0,2,0,0,0,0|1,0,1]=4 6910 B13R1.17 CC(CCCN)c1ccc(Br)cc1 Amb18071389 [0,2,0,0,0,0|1,0,0]=3 6911 B13R1.17 CC(CCCN)c1ccc(Cl)cc1 Amb18066474 [0,2,0,0,0,0|1,0,0]=3 6912 B13R1.17 CC(CCCN)c1ccc(F)cc1 Amb18564173 [0,2,0,0,0,0|1,0,0]=3 6913 B13R1.17 CC(NCC#N)c1ccc(Br)cc1 Amb18291998 [0,2,0,0,0,0|2,0,0]=4 6914 B13R1.17 CC(NCC#N)c1ccc(Cl)cc1 Amb18977435 [0,2,0,0,0,0|2,0,0]=4 6915 B13R1.17 CC(NCC#N)c1ccc(F)cc1 Amb18977432 [0,2,0,0,0,0|2,0,0]=4 6916 B13R1.17 CC(NCCN)c1ccc(Br)cc1 Amb19005484 [0,2,0,0,0,0|2,0,0]=4 6917 B13R1.17 CC(NCCN)c1ccc(I)cc1 Amb24768629 [0,2,0,0,0,0|2,0,0]=4 6918 B13R1.17 CC(OCC#C)c1ccc(Br)cc1 Amb23443739 [0,2,0,0,0,0|1,0,1]=4 6919 B13R1.17 CC(OCC#N)c1ccc(Br)cc1 Amb25090252 [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.17 CC(OCC=C)c1ccc(Br)cc1 Amb23443738 [0,2,0,0,0,0|1,0,1]=4 6921 B13R1.17 CC(OCC=C)c1ccc(N)cc1 Amb23443730 [0,2,0,0,0,0|1,0,1]=4 6922 B13R1.17 CC(OCCN)c1ccc(Br)cc1 Amb18071618 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.17 CC(SCC#C)c1ccc(F)cc1 Amb24502984 [0,2,0,0,0,0|1,0,1]=4 6924 B13R1.17 CC(SCC#N)c1ccc(F)cc1 Amb24672368 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.17 CC(c1ccc(cc1)Br)CN=C=O Amb17106007 [0,2,0,0,0,0|0,0,2]=4 6926 B13R1.17 CC(c1ccc(cc1)C)CN=C=O Amb17105998 [0,2,0,0,0,0|0,0,2]=4 6927 B13R1.17 CC(c1ccc(cc1)Cl)CN=C=O Amb17106006 [0,2,0,0,0,0|0,0,2]=4 6928 B13R1.17 CC(c1ccc(cc1)F)CN=C=O Amb17106005 [0,2,0,0,0,0|0,0,2]=4 6929 B13R1.17 CCCCC(c1ccc(cc1)Br)O Amb17196245 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.17 CCCCC(c1ccc(cc1)C)O Amb17194526 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.17 CCCCC(c1ccc(cc1)Cl)O Amb17194788 [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.17 CCCOC(C)c1ccc(Br)cc1 Amb23443735 [0,2,0,0,0,0|1,0,0]=3 6933 B13R1.17 CCNCC(=O)c1ccc(N)cc1 Amb18550894 [0,2,0,0,0,0|1,0,1]=4 6934 B13R1.17 CCNCC(=O)c1ccc(cc1)F Amb17314099 [0,2,0,0,0,0|1,0,1]=4 6935 B13R1.17 CCNCC(O)c1ccc(Br)c[n]1 Amb23586106 [0,2,0,0,0,0|2,0,0]=4 6936 B13R1.17 CCNCC(O)c1ccc(N)cc1 Amb19888322 [0,2,0,0,0,0|1,0,0]=3 6937 B13R1.17 CCNCC(O)c1ccc(O)cc1 Amb22733230 [0,2,0,0,0,0|1,0,0]=3 6938 B13R1.17 CCNCC(O)c1ccc(O)cc1 Amb22734355 [0,2,0,0,0,0|1,0,0]=3 6939 B13R1.17 CCNCC(c1ccc(cc1)Br)O Amb17159562 [0,2,0,0,0,0|1,0,0]=3 6940 B13R1.17 CCNCC(c1ccc(cc1)C)O Amb17138911 [0,2,0,0,0,0|1,0,0]=3 6941 B13R1.17 CCNCC(c1ccc(cc1)Cl)O Amb17139773 [0,2,0,0,0,0|1,0,0]=3 6942 B13R1.17 CCNCC(c1ccc(cc1)F)O Amb17139059 [0,2,0,0,0,0|1,0,0]=3 6943 B13R1.17 CC\C=C\C(C)c1ccc(N)cc1 Amb25059084 [0,2,0,0,0,0|1,0,1]=4 6944 B13R1.17 CN(CCNC)c1ccc(Br)c[n]1 Amb19025558 [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.17 CN(CCNC)c1ccc(Br)cc1 Amb18246785 [0,2,0,0,0,0|1,0,0]=3 6946 B13R1.17 CN(CCNC)c1ccc(Cl)cc1 Amb18894610 [0,2,0,0,0,0|1,0,0]=3 6947 B13R1.17 CNCCC(=O)c1ccc(F)cc1 Amb23458615 [0,2,0,0,0,0|1,0,1]=4 6948 B13R1.17 CNCCC(=O)c1ccc(cc1)Br Amb17349007 [0,2,0,0,0,0|1,0,1]=4 6949 B13R1.17 CNCCC(=O)c1ccc(cc1)C Amb17335181 [0,2,0,0,0,0|1,0,1]=4 6950 B13R1.17 CNCCC(=O)c1ccc(cc1)Cl Amb17337252 [0,2,0,0,0,0|1,0,1]=4 6951 B13R1.17 CNCCC(=O)c1ccc(cc1)F Amb17335484 [0,2,0,0,0,0|1,0,1]=4 6952 B13R1.17 CNCCC(c1ccc(cc1)Br)O Amb17349681 [0,2,0,0,0,0|1,0,0]=3 6953 B13R1.17 CNCCC(c1ccc(cc1)C)O Amb17335342 [0,2,0,0,0,0|1,0,0]=3 6954 B13R1.17 CNCCC(c1ccc(cc1)Cl)O Amb17337495 [0,2,0,0,0,0|1,0,0]=3 6955 B13R1.17 COCCC(N)c1ccc(Cl)cc1 Amb20629735 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.17 C[C@@H](NCC#C)c1ccc(Cl)cc1 Amb25732835 [0,2,0,0,0,0|1,0,1]=4 6957 B13R1.17 C[C@@H](NCC#N)c1ccc(Br)cc1 Amb25306151 [0,2,0,0,0,0|2,0,0]=4 6958 B13R1.17 C\C(=C\CNC)\c1ccc(Br)cc1 Amb24685017 [0,2,0,0,0,0|0,0,1]=3 6959 B13R1.17 C\C(=C\CNC)\c1ccc(Cl)cc1 Amb24396190 [0,2,0,0,0,0|0,0,1]=3 6960 B13R1.17 C\C=C\CC(O)c1ccc(F)cc1 Amb24495600 [0,2,0,0,0,0|2,0,0]=4 6961 B13R1.17 C\C=C\CN(C)c1ccc(F)cc1 Amb25845863 [0,2,0,0,0,0|2,0,0]=4 6962 B13R1.17 C\C=C\CN(C)c1ccc(I)cc1 Amb24430644 [0,2,0,0,0,0|2,0,0]=4 6963 B13R1.17 C\C=C\C[C@@H](O)c1ccc(Cl)cc1 Amb24466198 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.17 C\C=C\C[C@H](O)c1ccc(F)cc1 Amb25136288 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.17 Cc1ccc(cc1)C(C)CCCN Amb18065734 [0,2,0,0,0,0|1,0,0]=3 6966 B13R1.17 Cc1ccc(cc1)C(C)NCC#N Amb18978692 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.17 Cc1ccc(cc1)C(N)CC#CC Amb18803523 [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.17 Cc1ccc(cc1)C(O)CC#CC Amb18183850 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.17 Cc1ccc(cc1)C(O)CCCN Amb21984552 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.17 Cc1ccc(cc1)C(O)CNC=O Amb24756484 [0,2,0,0,0,0|1,0,1]=4 6971 B13R1.17 Cc1ccc(cc1)N(C)CC#CC Amb24751876 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.17 Cc1ccc(cc1)N(C)C\C=C\C Amb24362377 [0,2,0,0,0,0|2,0,0]=4 6973 B13R1.17 Cc1ccc(cc1)[C@@H](C)NCC#C Amb25770265 [0,2,0,0,0,0|1,0,1]=4 6974 B13R1.17 Cc1ccc(cc1)\C(\C)=C/CNC Amb25721188 [0,2,0,0,0,0|0,0,1]=3 6975 B13R1.17 ClCCCC(c1ccc(cc1)Br)O Amb17197215 [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.17 ClCCCC(c1ccc(cc1)C)O Amb17194782 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.17 ClCCCC(c1ccc(cc1)Cl)O Amb17195326 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.17 ClCCCC(c1ccc(cc1)F)O Amb17194843 [0,2,0,0,0,0|2,0,0]=4 6979 B13R1.17 ClCCCN(c1ccc(cc1)Br)C Amb17359051 [0,2,0,0,0,0|2,0,0]=4 6980 B13R1.17 ClCCCN(c1ccc(cc1)C)C Amb17337271 [0,2,0,0,0,0|2,0,0]=4 6981 B13R1.17 ClCCCN(c1ccc(cc1)Cl)C Amb17340959 [0,2,0,0,0,0|2,0,0]=4 6982 B13R1.17 ClCCCN(c1ccc(cc1)F)C Amb17337713 [0,2,0,0,0,0|2,0,0]=4 6983 B13R1.17 NCCCC(O)c1ccc(Br)cc1 Amb21984553 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.17 NCCCC(O)c1ccc(Cl)cc1 Amb21984478 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.17 NCCCC(O)c1ccc(F)cc1 Amb18564244 [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.17 NCCCC(c1ccc(cc1)Br)O Amb17079164 [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.17 NCCCC(c1ccc(cc1)C)O Amb17079155 [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.17 NCCCC(c1ccc(cc1)Cl)O Amb17079163 [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.17 NCCCC(c1ccc(cc1)F)O Amb17079162 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.17 NCCCN(c1ccc(cc1)Br)C Amb17059629 [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.17 NCCCN(c1ccc(cc1)Cl)C Amb17059628 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.17 NCCNC(c1ccc(cc1)F)C Amb17091033 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.17 NCCOC(c1ccc(cc1)C)C Amb17079448 [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.17 NCCOC(c1ccc(cc1)Cl)C Amb17079523 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.17 NCCOC(c1ccc(cc1)F)C Amb17079492 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.17 O=CCCC(c1ccc(cc1)C)C Amb17594492 [0,2,0,0,0,0|1,0,1]=4 6997 B13R1.17 OCCCC(c1ccc(cc1)Br)O Amb17350035 [0,2,0,0,0,0|2,0,0]=4 6998 B13R1.17 OCCCC(c1ccc(cc1)C)O Amb17335424 [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.17 OCCCC(c1ccc(cc1)Cl)O Amb17337618 [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.17 OCCCC(c1ccc(cc1)F)O Amb17335677 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.17 OCCCN(c1ccc(cc1)Br)C Amb17349689 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.17 OCCCN(c1ccc(cc1)C)C Amb17335362 [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.17 OCCCN(c1ccc(cc1)Cl)C Amb17337506 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.17 OCCCN(c1ccc(cc1)F)C Amb17335629 [0,2,0,0,0,0|2,0,0]=4 7005 B13R1.21 CC(C(=O)NN)c1ccc(O)cc1 Amb25298528 [0,2,0,0,0,0|1,0,1]=4 7006 B13R1.21 CC(C(Br)CC)c1ccc(F)cc1 Amb24489611 [0,2,0,0,0,0|1,0,0]=3 7007 B13R1.21 CC(C(Br)CC)c1ccc(I)cc1 Amb24736667 [0,2,0,0,0,0|1,0,0]=3 7008 B13R1.21 CC(C(Cl)CC)c1ccc(Cl)cc1 Amb24632690 [0,2,0,0,0,0|1,0,0]=3 7009 B13R1.21 CC(C(N)CC)c1ccc(Cl)cc1 Amb24427149 [0,2,0,0,0,0|1,0,0]=3 7010 B13R1.21 CC(C(N)CC)c1ccc(F)c[n]1 Amb24461362 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.21 CC(C(N)CC)c1ccc(F)cc1 Amb25670384 [0,2,0,0,0,0|1,0,0]=3 7012 B13R1.21 CC(C(N)CC)c1ccc(I)cc1 Amb24533492 [0,2,0,0,0,0|1,0,0]=3 7013 B13R1.21 CC(C(N)CO)c1ccc(F)cc1 Amb24669178 [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.21 CC(C(O)CC)c1ccc(Cl)cc1 Amb25743792 [0,2,0,0,0,0|1,0,0]=3 7015 B13R1.21 CC(C(O)CC)c1ccc(F)c[n]1 Amb25187976 [0,2,0,0,0,0|2,0,0]=4 7016 B13R1.21 CC(C(O)CC)c1ccc(I)cc1 Amb25859488 [0,2,0,0,0,0|1,0,0]=3 7017 B13R1.21 CC(CC)C(Br)c1ccc(Br)cc1 Amb24462231 [0,2,0,0,0,0|2,0,0]=4 7018 B13R1.21 CC(CC)C(Br)c1ccc(Cl)cc1 Amb24590675 [0,2,0,0,0,0|2,0,0]=4 7019 B13R1.21 CC(CC)C(C)c1ccc(O)cc1 Amb25833640 [0,2,0,0,0,0|1,0,0]=3 7020 B13R1.21 CC(CC)C(Cl)c1ccc(Br)cc1 Amb24354769 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.21 CC(CC)C(Cl)c1ccc(Cl)cc1 Amb25681629 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.21 CC(CC)C(Cl)c1ccc(F)cc1 Amb18320529 [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.21 CC(CC)C(N)c1ccc(I)cc1 Amb24350453 [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.21 CC(CC)C(N)c1ccc(O)cc1 Amb24655049 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.21 CC(CC)C(O)c1ccc(Cl)cc1 Amb19056193 [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.21 CC(CC)C(O)c1ccc(F)cc1 Amb18796622 [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.21 CC(CC)[C@@H](N)c1ccc(F)cc1 Amb24634729 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.21 CC(CN)C(C)c1ccc(Cl)cc1 Amb18188140 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.21 CC(CN)C(C)c1ccc(F)cc1 Amb18192870 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.21 CC(NC)C(C)c1ccc(Cl)cc1 Amb20623680 [0,2,0,0,0,0|0,0,0]=2 7031 B13R1.21 CC(NC)C(O)c1ccc(Cl)cc1 Amb18066518 [0,2,0,0,0,0|1,0,0]=3 7032 B13R1.21 CC(NC)C(O)c1ccc(F)cc1 Amb18564246 [0,2,0,0,0,0|1,0,0]=3 7033 B13R1.21 CC(OC)C(N)c1ccc(Br)cc1 Amb18155746 [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.21 CC(OC)C(N)c1ccc(Cl)cc1 Amb18187532 [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.21 CC(SC)C(N)c1ccc(F)cc1 Amb25157777 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.21 CCC(=O)C(C)c1ccc(Cl)cc1 Amb25828661 [0,2,0,0,0,0|1,0,1]=4 7037 B13R1.21 CCC(=O)C(C)c1ccc(F)cc1 Amb24466369 [0,2,0,0,0,0|1,0,1]=4 7038 B13R1.21 CCC(=O)C(C)c1ccc(N)cc1 Amb24547919 [0,2,0,0,0,0|1,0,1]=4 7039 B13R1.21 CCC(=O)C(C)c1ccc(O)cc1 Amb18648132 [0,2,0,0,0,0|1,0,1]=4 7040 B13R1.21 CCC(N)C(N)c1ccc(O)cc1 Amb25238424 [0,2,0,0,0,0|2,0,0]=4 7041 B13R1.21 CCC(N)C(O)c1ccc(N)cc1 Amb25211794 [0,2,0,0,0,0|2,0,0]=4 7042 B13R1.21 CCC(O)C(N)c1ccc(Br)cc1 Amb18723288 [0,2,0,0,0,0|2,0,0]=4 7043 B13R1.21 CCC(O)C(N)c1ccc(Cl)cc1 Amb18810921 [0,2,0,0,0,0|2,0,0]=4 7044 B13R1.21 CCC(O)C(N)c1ccc(F)cc1 Amb25206264 [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.21 CCC(O)C(N)c1ccc(I)cc1 Amb25069695 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.21 CCC(O)C(N)c1ccc(O)cc1 Amb18193108 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.21 CCS(=O)C(C)c1ccc(Br)cc1 Amb24510229 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.21 CCS(=O)C(C)c1ccc(F)cc1 Amb25120620 [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.21 CC[C@@H](N)[C@@H](N)c1ccc(Cl)cc1 Amb25375781 [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(Br)cc1 Amb24672715 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(F)cc1 Amb25291138 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(N)cc1 Amb25200296 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(N)cc1 Amb25200288 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(F)cc1 Amb25355068 [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(I)cc1 Amb25083505 [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(O)cc1 Amb25214623 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(Cl)cc1 Amb25804627 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(I)cc1 Amb24542794 [0,2,0,0,0,0|2,0,0]=4 7059 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(O)cc1 Amb25249273 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(O)cc1 Amb24558780 [0,2,0,0,0,0|2,0,0]=4 7061 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(Br)cc1 Amb24423456 [0,2,0,0,0,0|2,0,0]=4 7062 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(Cl)cc1 Amb24645223 [0,2,0,0,0,0|2,0,0]=4 7063 B13R1.21 CN(C(=N)NC)c1ccc(F)cc1 Amb18805220 [0,2,0,0,0,0|1,0,1]=4 7064 B13R1.21 CN(C(=O)NC)c1ccc(Cl)cc1 Amb24064348 [0,2,0,0,0,0|1,0,1]=4 7065 B13R1.21 CN(C(=O)NC)c1ccc(F)cc1 Amb25052943 [0,2,0,0,0,0|1,0,1]=4 7066 B13R1.21 CN(C(=O)NC)c1ccc(N)cc1 Amb25702285 [0,2,0,0,0,0|1,0,1]=4 7067 B13R1.21 CN(C(=O)NC)c1ccc(O)cc1 Amb25829844 [0,2,0,0,0,0|1,0,1]=4 7068 B13R1.21 CN(C(C)CC)c1ccc(F)cc1 Amb24732769 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.21 CN(CC)C(C)c1ccc(Cl)cc1 Amb24541454 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.21 CN(CC)C(C)c1ccc(N)cc1 Amb18973999 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.21 CN(OC)C(C)c1ccc(N)cc1 Amb18974002 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.21 CNC(=O)C(C)c1ccc(Br)cc1 Amb24677369 [0,2,0,0,0,0|0,0,1]=3 7073 B13R1.21 CNC(=O)C(C)c1ccc(N)cc1 Amb24415382 [0,2,0,0,0,0|0,0,1]=3 7074 B13R1.21 CNC(=O)C(Cl)c1ccc(Br)cc1 Amb25782797 [0,2,0,0,0,0|1,0,1]=4 7075 B13R1.21 CNC(=O)C(Cl)c1ccc(Cl)cc1 Amb24439006 [0,2,0,0,0,0|1,0,1]=4 7076 B13R1.21 CNC(=O)C(Cl)c1ccc(I)cc1 Amb25112892 [0,2,0,0,0,0|1,0,1]=4 7077 B13R1.21 CNC(=O)C(N)c1ccc(Br)cc1 Amb25102382 [0,2,0,0,0,0|1,0,1]=4 7078 B13R1.21 CNC(=O)C(O)c1ccc(O)cc1 Amb25292381 [0,2,0,0,0,0|1,0,1]=4 7079 B13R1.21 CNC(=O)C(c1ccc(cc1)C)O Amb17400709 [0,2,0,0,0,0|1,0,1]=4 7080 B13R1.21 CNC(=O)C(c1ccc(cc1)Cl)O Amb17402319 [0,2,0,0,0,0|1,0,1]=4 7081 B13R1.21 CNC(=O)C(c1ccc(cc1)F)O Amb17400966 [0,2,0,0,0,0|1,0,1]=4 7082 B13R1.21 CNC(=O)[C@@H](N)c1ccc(F)cc1 Amb25764582 [0,2,0,0,0,0|1,0,1]=4 7083 B13R1.21 CNC(=O)[C@@H](N)c1ccc(O)cc1 Amb25138741 [0,2,0,0,0,0|1,0,1]=4 7084 B13R1.21 CNC(=O)[C@H](N)c1ccc(F)cc1 Amb25049377 [0,2,0,0,0,0|1,0,1]=4 7085 B13R1.21 CNC(=O)[C@H](N)c1ccc(O)cc1 Amb25793593 [0,2,0,0,0,0|1,0,1]=4 7086 B13R1.21 CNC(C(=O)c1ccc(cc1)Br)C Amb17312906 [0,2,0,0,0,0|1,0,1]=4 7087 B13R1.21 CNC(C(=O)c1ccc(cc1)C)C Amb17312656 [0,2,0,0,0,0|1,0,1]=4 7088 B13R1.21 CNC(C(=O)c1ccc(cc1)Cl)C Amb17312952 [0,2,0,0,0,0|1,0,1]=4 7089 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17313013 [0,2,0,0,0,0|1,0,1]=4 7090 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17614417 [0,2,0,0,0,0|1,0,1]=4 7091 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,2,0,0,0,0|1,0,1]=4 7092 B13R1.21 COC(=O)C(C)c1ccc(Cl)cc1 Amb19084562 [0,2,0,0,0,0|1,0,1]=4 7093 B13R1.21 COC(=O)C(C)c1ccc(F)cc1 Amb18185420 [0,2,0,0,0,0|1,0,1]=4 7094 B13R1.21 COC(=O)C(C)c1ccc(I)cc1 Amb25353760 [0,2,0,0,0,0|1,0,1]=4 7095 B13R1.21 COC(=O)C(C)c1ccc(N)cc1 Amb18648244 [0,2,0,0,0,0|1,0,1]=4 7096 B13R1.21 COC(=O)C(C)c1ccc(O)cc1 Amb18128607 [0,2,0,0,0,0|1,0,1]=4 7097 B13R1.21 COC(=O)[C@@H](C)c1ccc(O)cc1 Amb25112603 [0,2,0,0,0,0|1,0,1]=4 7098 B13R1.21 COC(=O)[C@H](C)c1ccc(O)cc1 Amb24633423 [0,2,0,0,0,0|1,0,1]=4 7099 B13R1.21 COC(C(c1ccc(cc1)C)N)C Amb1133669 [0,2,0,0,0,0|2,0,0]=4 7100 B13R1.21 COC(C(c1ccc(cc1)F)N)C Amb1139503 [0,2,0,0,0,0|2,0,0]=4 7101 B13R1.21 C[C@@H](NC)[C@@H](O)c1ccc(N)cc1 Amb25858781 [0,2,0,0,0,0|1,0,0]=3 7102 B13R1.21 C[C@H](NC)[C@@H](O)c1ccc(N)cc1 Amb25771909 [0,2,0,0,0,0|1,0,0]=3 7103 B13R1.21 C[C@H](NC)[C@H](O)c1ccc(N)cc1 Amb24366029 [0,2,0,0,0,0|1,0,0]=3 7104 B13R1.21 C[C@H](NC)[C@H](O)c1ccc(O)cc1 Amb25069019 [0,2,0,0,0,0|1,0,0]=3 7105 B13R1.21 C[C@H]([C@H](O)CO)c1ccc(F)cc1 Amb24495716 [0,2,0,0,0,0|2,0,0]=4 7106 B13R1.21 Cc1ccc(cc1)C(=O)C(C)NC Amb18540236 [0,2,0,0,0,0|1,0,1]=4 7107 B13R1.21 Cc1ccc(cc1)C(Br)C(C)CC Amb24363076 [0,2,0,0,0,0|2,0,0]=4 7108 B13R1.21 Cc1ccc(cc1)C(C)C(=N)NO Amb25313204 [0,2,0,0,0,0|1,0,1]=4 7109 B13R1.21 Cc1ccc(cc1)C(C)C(=O)NC Amb24440896 [0,2,0,0,0,0|0,0,1]=3 7110 B13R1.21 Cc1ccc(cc1)C(C)C(=O)OC Amb18184314 [0,2,0,0,0,0|1,0,1]=4 7111 B13R1.21 Cc1ccc(cc1)C(C)C(C)CN Amb18195748 [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.21 Cc1ccc(cc1)C(C)C(C)CO Amb25846204 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.21 Cc1ccc(cc1)C(C)C(C)NC Amb25239920 [0,2,0,0,0,0|0,0,0]=2 7114 B13R1.21 Cc1ccc(cc1)C(C)C(Cl)CC Amb25830099 [0,2,0,0,0,0|1,0,0]=3 7115 B13R1.21 Cc1ccc(cc1)C(C)C(N)CC Amb18195746 [0,2,0,0,0,0|1,0,0]=3 7116 B13R1.21 Cc1ccc(cc1)C(C)C(O)CC Amb24759809 [0,2,0,0,0,0|1,0,0]=3 7117 B13R1.21 Cc1ccc(cc1)C(C)C(O)CO Amb25852833 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.21 Cc1ccc(cc1)C(C)N(C)CC Amb24473662 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.21 Cc1ccc(cc1)C(Cl)C(=O)NC Amb18330996 [0,2,0,0,0,0|1,0,1]=4 7120 B13R1.21 Cc1ccc(cc1)C(Cl)C(C)CC Amb24412425 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.21 Cc1ccc(cc1)C(N)C(C)SC Amb25039654 [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.21 Cc1ccc(cc1)C(O)C(C)CC Amb18796057 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.21 Cc1ccc(cc1)C(O)C(C)NC Amb18065867 [0,2,0,0,0,0|1,0,0]=3 7124 B13R1.21 Cc1ccc(cc1)C(O)C(C)OC Amb18809339 [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.21 Cc1ccc(cc1)N(C)C(=N)NC Amb18184204 [0,2,0,0,0,0|1,0,1]=4 7126 B13R1.21 Cc1ccc(cc1)N(C)C(C)CC Amb24502946 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.21 Cc1ccc(cc1)[C@@H](C)[C@@H](O)CO Amb25357698 [0,2,0,0,0,0|2,0,0]=4 7128 B13R1.21 Cc1ccc(cc1)[C@@H](N)C(C)CC Amb24604868 [0,2,0,0,0,0|2,0,0]=4 7129 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](O)CC Amb25725424 [0,2,0,0,0,0|2,0,0]=4 7130 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](C)NC Amb24677754 [0,2,0,0,0,0|1,0,0]=3 7131 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](N)CC Amb24346984 [0,2,0,0,0,0|2,0,0]=4 7132 B13R1.21 NCC(C(c1ccc(cc1)Br)C)O Amb17256969 [0,2,0,0,0,0|2,0,0]=4 7133 B13R1.21 NCC(C(c1ccc(cc1)C)C)O Amb17233587 [0,2,0,0,0,0|2,0,0]=4 7134 B13R1.21 NCC(C(c1ccc(cc1)Cl)C)O Amb17237048 [0,2,0,0,0,0|2,0,0]=4 7135 B13R1.21 NCC(C(c1ccc(cc1)F)C)O Amb17233999 [0,2,0,0,0,0|2,0,0]=4 7136 B13R1.29 CC#CC(C)(O)c1ccc(Br)cc1 Amb25081634 [0,2,0,0,0,0|1,0,1]=4 7137 B13R1.29 CC#CC(C)(O)c1ccc(Cl)cc1 Amb24442562 [0,2,0,0,0,0|1,0,1]=4 7138 B13R1.29 CC(C)(CC#N)c1ccc(Cl)cc1 Amb24401109 [0,2,0,0,0,0|2,0,0]=4 7139 B13R1.29 CC(C)(CC=O)c1ccc(Cl)cc1 Amb24694228 [0,2,0,0,0,0|2,0,0]=4 7140 B13R1.29 CC(C)(CC=O)c1ccc(F)cc1 Amb24585673 [0,2,0,0,0,0|2,0,0]=4 7141 B13R1.29 CC(C)(CCBr)c1ccc(I)cc1 Amb24625408 [0,2,0,0,0,0|2,0,0]=4 7142 B13R1.29 CC(C)(CCCl)c1ccc(F)cc1 Amb24646922 [0,2,0,0,0,0|2,0,0]=4 7143 B13R1.29 CC(C)(CCCl)c1ccc(I)cc1 Amb25768667 [0,2,0,0,0,0|2,0,0]=4 7144 B13R1.29 CC(C)(CCO)c1ccc(Br)cc1 Amb24489544 [0,2,0,0,0,0|2,0,0]=4 7145 B13R1.29 CC(C)(CNC)c1ccc(N)cc1 Amb25050307 [0,2,0,0,0,0|0,0,0]=2 7146 B13R1.29 CC(C)(COC)c1ccc(Br)c[n]1 Amb25078046 [0,2,0,0,0,0|2,0,0]=4 7147 B13R1.29 CC(C)(COC)c1ccc(N)cc1 Amb25073268 [0,2,0,0,0,0|1,0,0]=3 7148 B13R1.29 CC(C)(NCC)c1ccc(F)cc1 Amb25098366 [0,2,0,0,0,0|2,0,0]=4 7149 B13R1.29 CC(F)(CCN)c1ccc(F)cc1 Amb24702710 [0,2,0,0,0,0|2,0,0]=4 7150 B13R1.29 CC(F)(CCN)c1ccc(O)cc1 Amb24596226 [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.29 CC(N)(CC=C)c1ccc(Cl)cc1 Amb24418513 [0,2,0,0,0,0|1,0,1]=4 7152 B13R1.29 CC(N)(CC=C)c1ccc(F)cc1 Amb25308163 [0,2,0,0,0,0|1,0,1]=4 7153 B13R1.29 CC(N)(CC=C)c1ccc(N)cc1 Amb25230013 [0,2,0,0,0,0|1,0,1]=4 7154 B13R1.29 CC(N)(CC=C)c1ccc(O)cc1 Amb24490642 [0,2,0,0,0,0|1,0,1]=4 7155 B13R1.29 CC(N)(CCO)c1ccc(Br)cc1 Amb18229200 [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.29 CC(N)(CCO)c1ccc(Cl)cc1 Amb18225029 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.29 CC(N)(CCO)c1ccc(F)cc1 Amb18224780 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.29 CC(N)(CCO)c1ccc(S)cc1 Amb25133747 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.29 CC(N)(COC)c1ccc(Br)cc1 Amb25128146 [0,2,0,0,0,0|1,0,0]=3 7160 B13R1.29 CC(N)(COC)c1ccc(Cl)cc1 Amb18299365 [0,2,0,0,0,0|1,0,0]=3 7161 B13R1.29 CC(N)(COC)c1ccc(F)cc1 Amb18992593 [0,2,0,0,0,0|1,0,0]=3 7162 B13R1.29 CC(O)(CC#C)c1ccc(F)cc1 Amb25676949 [0,2,0,0,0,0|1,0,1]=4 7163 B13R1.29 CC(O)(CC#N)c1ccc(Br)cc1 Amb24429546 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.29 CC(O)(CC#N)c1ccc(Cl)cc1 Amb24429545 [0,2,0,0,0,0|2,0,0]=4 7165 B13R1.29 CC(O)(CC#N)c1ccc(F)cc1 Amb24591972 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.29 CC(O)(CC=O)c1ccc(Cl)cc1 Amb25684491 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.29 CC(O)(CCN)c1ccc(Br)cc1 Amb18155765 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.29 CC(O)(CCN)c1ccc(Cl)cc1 Amb18066534 [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.29 CC(O)(CCN)c1ccc(F)cc1 Amb18066119 [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.29 CC(O)(CCN)c1ccc(I)cc1 Amb24752562 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.29 CC(O)(CCO)c1ccc(F)cc1 Amb24474209 [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.29 CC(O)(COC)c1ccc(Br)cc1 Amb24459625 [0,2,0,0,0,0|1,0,0]=3 7173 B13R1.29 CC(O)(COC)c1ccc(Cl)cc1 Amb18333910 [0,2,0,0,0,0|1,0,0]=3 7174 B13R1.29 CC(O)(COC)c1ccc(F)c[n]1 Amb24428845 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.29 CC(O)(COC)c1ccc(F)cc1 Amb18328473 [0,2,0,0,0,0|1,0,0]=3 7176 B13R1.29 CC(O)(COC)c1ccc(I)cc1 Amb24614343 [0,2,0,0,0,0|1,0,0]=3 7177 B13R1.29 CCCC(C)(C)c1ccc(N)cc1 Amb24489038 [0,2,0,0,0,0|1,0,0]=3 7178 B13R1.29 CCCC(C)(N)c1ccc(F)c[n]1 Amb24430481 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.29 CCCC(C)(O)c1ccc(F)c[n]1 Amb24491185 [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.29 CCCC(C)(O)c1ccc(I)cc1 Amb25100343 [0,2,0,0,0,0|1,0,0]=3 7181 B13R1.29 CCCC(F)(F)c1ccc(F)cc1 Amb20669701 [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.29 CNCC(F)(F)c1ccc(Br)cc1 Amb25340842 [0,2,0,0,0,0|1,0,0]=3 7183 B13R1.29 CNCC(c1ccc(cc1)Br)(C)C Amb17255979 [0,2,0,0,0,0|0,0,0]=2 7184 B13R1.29 CNCC(c1ccc(cc1)C)(C)C Amb17233337 [0,2,0,0,0,0|0,0,0]=2 7185 B13R1.29 CNCC(c1ccc(cc1)Cl)(C)C Amb17236698 [0,2,0,0,0,0|0,0,0]=2 7186 B13R1.29 CNCC(c1ccc(cc1)F)(C)C Amb17233832 [0,2,0,0,0,0|0,0,0]=2 7187 B13R1.29 COCC(C)(O)c1ccc(O)cc1 Amb24534262 [0,2,0,0,0,0|1,0,0]=3 7188 B13R1.29 C[C@@](N)(CC#N)c1ccc(Br)cc1 Amb25103768 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.29 C[C@@](N)(CC#N)c1ccc(F)cc1 Amb25291838 [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.29 C[C@@](N)(CC=C)c1ccc(Cl)cc1 Amb25323985 [0,2,0,0,0,0|1,0,1]=4 7191 B13R1.29 C[C@@](N)(CC=C)c1ccc(F)cc1 Amb24686802 [0,2,0,0,0,0|1,0,1]=4 7192 B13R1.29 C[C@@](N)(CC=C)c1ccc(N)cc1 Amb24387340 [0,2,0,0,0,0|1,0,1]=4 7193 B13R1.29 C[C@@](N)(CCO)c1ccc(Br)cc1 Amb24488733 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.29 C[C@@](N)(CCO)c1ccc(Cl)cc1 Amb24356139 [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.29 C[C@@](O)(CC=C)c1ccc(O)cc1 Amb25713018 [0,2,0,0,0,0|1,0,1]=4 7196 B13R1.29 C[C@](N)(CC#N)c1ccc(F)cc1 Amb24496842 [0,2,0,0,0,0|2,0,0]=4 7197 B13R1.29 C[C@](N)(CC=C)c1ccc(Br)cc1 Amb25341205 [0,2,0,0,0,0|1,0,1]=4 7198 B13R1.29 C[C@](N)(CC=C)c1ccc(Cl)cc1 Amb25790440 [0,2,0,0,0,0|1,0,1]=4 7199 B13R1.29 C[C@](N)(CCO)c1ccc(Br)cc1 Amb25338150 [0,2,0,0,0,0|2,0,0]=4 7200 B13R1.29 C[C@](N)(CCO)c1ccc(O)cc1 Amb25251726 [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.29 C[C@](N)(CCO)c1ccc(S)cc1 Amb25125367 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.29 C[C@](O)(CC=C)c1ccc(O)cc1 Amb24706819 [0,2,0,0,0,0|1,0,1]=4 7203 B13R1.29 Cc1ccc(c[n]1)C(C)(O)CCC Amb25273611 [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.29 Cc1ccc(c[n]1)C(C)(O)CNC Amb24683353 [0,2,0,0,0,0|1,0,0]=3 7205 B13R1.29 Cc1ccc(cc1)C(C)(C)CC=O Amb24729649 [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.29 Cc1ccc(cc1)C(C)(C)CCCl Amb25322019 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.29 Cc1ccc(cc1)C(C)(C)CCO Amb25137754 [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.29 Cc1ccc(cc1)C(C)(F)CCN Amb25238521 [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.29 Cc1ccc(cc1)C(C)(N)CC#N Amb24529377 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.29 Cc1ccc(cc1)C(C)(N)CC=C Amb24403349 [0,2,0,0,0,0|1,0,1]=4 7211 B13R1.29 Cc1ccc(cc1)C(C)(N)CCO Amb18862953 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.29 Cc1ccc(cc1)C(C)(N)COC Amb18992595 [0,2,0,0,0,0|1,0,0]=3 7213 B13R1.29 Cc1ccc(cc1)C(C)(O)CC#N Amb24369410 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.29 Cc1ccc(cc1)C(C)(O)CC=C Amb25092233 [0,2,0,0,0,0|1,0,1]=4 7215 B13R1.29 Cc1ccc(cc1)C(C)(O)CCN Amb18065882 [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.29 Cc1ccc(cc1)C(C)(O)COC Amb18186607 [0,2,0,0,0,0|1,0,0]=3 7217 B13R1.29 Cc1ccc(cc1)C(C)(S)CCO Amb25802958 [0,2,0,0,0,0|2,0,0]=4 7218 B13R1.29 Cc1ccc(cc1)[C@](C)(N)CCO Amb24432332 [0,2,0,0,0,0|2,0,0]=4 7219 B13R1.29 Cc1ccc(cc1)[C@](C)(S)CCO Amb24474203 [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.29 NCCC(c1ccc(cc1)Br)(C)C Amb17255978 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.29 NCCC(c1ccc(cc1)C)(C)C Amb17233336 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.29 NCCC(c1ccc(cc1)Cl)(C)C Amb17236697 [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.29 NCCC(c1ccc(cc1)F)(C)C Amb17233831 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.29 NNCC(c1ccc(cc1)Br)(O)C Amb17257508 [0,2,0,0,0,0|1,0,0]=3 7225 B13R1.29 NNCC(c1ccc(cc1)C)(O)C Amb17233749 [0,2,0,0,0,0|1,0,0]=3 7226 B13R1.29 NNCC(c1ccc(cc1)Cl)(O)C Amb17237204 [0,2,0,0,0,0|1,0,0]=3 7227 B13R1.29 NNCC(c1ccc(cc1)F)(O)C Amb17234076 [0,2,0,0,0,0|1,0,0]=3 7228 B13R1.132 CC(=C)CC(N)c1ccc(Cl)cc1 Amb25137701 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.132 CC(=C)CC(N)c1ccc(I)cc1 Amb25161110 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.132 CC(=C)CC(O)c1ccc(Cl)cc1 Amb25757059 [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.132 CC(=C)CC(O)c1ccc(F)cc1 Amb24531926 [0,2,0,0,0,0|2,0,0]=4 7232 B13R1.132 CC(=C)CC(O)c1ccc(I)cc1 Amb25161022 [0,2,0,0,0,0|2,0,0]=4 7233 B13R1.132 CC(=C)CC(O)c1ccc(N)cc1 Amb24761112 [0,2,0,0,0,0|2,0,0]=4 7234 B13R1.132 CC(=C)CN(C)c1ccc(F)cc1 Amb25847704 [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.132 CC(=C)CN(C)c1ccc(N)cc1 Amb25240740 [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.132 CC(=C)CN(C)c1ccc(O)cc1 Amb24458512 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.132 CC(=N)NC(C)c1ccc(Cl)cc1 Amb25728600 [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.132 CC(=O)CC(O)c1ccc(Cl)cc1 Amb24346726 [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.132 CC(=O)CC(O)c1ccc(F)cc1 Amb25080847 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.132 CC(=O)CN(C)c1ccc(F)cc1 Amb18179022 [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.132 CC(=O)CN(C)c1ccc(O)cc1 Amb18128413 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.132 CC(=O)C[C@@H](O)c1ccc(Br)cc1 Amb25689126 [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.132 CC(=O)C[C@H](O)c1ccc(Br)cc1 Amb24733813 [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.132 CC(=O)C[C@H](O)c1ccc(Cl)cc1 Amb24495353 [0,2,0,0,0,0|2,0,0]=4 7245 B13R1.132 CC(=O)N[C@@H](C)c1ccc(F)cc1 Amb25759857 [0,2,0,0,0,0|2,0,0]=4 7246 B13R1.132 CC(=O)N[C@@H](C)c1ccc(I)cc1 Amb24596753 [0,2,0,0,0,0|2,0,0]=4 7247 B13R1.132 CC(=O)N[C@@H](C)c1ccc(O)cc1 Amb24602338 [0,2,0,0,0,0|2,0,0]=4 7248 B13R1.132 CC(=O)N[C@H](C)c1ccc(F)cc1 Amb25670331 [0,2,0,0,0,0|2,0,0]=4 7249 B13R1.132 CC(=O)OC(C)c1ccc(Br)cc1 Amb24688904 [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.132 CC(=O)OC(C)c1ccc(Cl)cc1 Amb24397810 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.132 CC(=O)OC(C)c1ccc(F)cc1 Amb24719345 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.132 CC(=O)OC(C)c1ccc(O)cc1 Amb18128606 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.132 CC(=O)O[C@H](C)c1ccc(O)cc1 Amb25318784 [0,2,0,0,0,0|2,0,0]=4 7254 B13R1.132 CC(Br)CC(C)c1ccc(Cl)cc1 Amb24674407 [0,2,0,0,0,0|1,0,0]=3 7255 B13R1.132 CC(Br)CC(C)c1ccc(F)cc1 Amb24379714 [0,2,0,0,0,0|1,0,0]=3 7256 B13R1.132 CC(C)CC(Br)c1ccc(Cl)cc1 Amb25051597 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.132 CC(C)CC(Br)c1ccc(F)cc1 Amb25815132 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.132 CC(C)CC(Cl)c1ccc(Cl)cc1 Amb25847103 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.132 CC(C)CC(Cl)c1ccc(F)cc1 Amb18320528 [0,2,0,0,0,0|2,0,0]=4 7260 B13R1.132 CC(C)CC(N)c1ccc(O)cc1 Amb24656146 [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.132 CC(C)CC(O)c1ccc(I)cc1 Amb25038964 [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.132 CC(C)CC(O)c1ccc(O)cc1 Amb24408370 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.132 CC(C)C[C@@H](N)c1ccc(Cl)cc1 Amb24604735 [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.132 CC(C)C[C@@H](N)c1ccc(F)cc1 Amb24745712 [0,2,0,0,0,0|2,0,0]=4 7265 B13R1.132 CC(C)C[C@H](N)c1ccc(F)cc1 Amb25368486 [0,2,0,0,0,0|2,0,0]=4 7266 B13R1.132 CC(C)C[C@H](N)c1ccc(I)cc1 Amb25328880 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.132 CC(C)C[C@H](O)c1ccc(Cl)cc1 Amb25284336 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.132 CC(C)N[C@@H](C)c1ccc(Cl)cc1 Amb24728946 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.132 CC(C)N[C@H](C)c1ccc(Br)cc1 Amb25058373 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.132 CC(C)N[C@H](C)c1ccc(Cl)cc1 Amb25119010 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.132 CC(C)OC(C)c1ccc(Br)cc1 Amb23443734 [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.132 CC(C)OC(C)c1ccc(N)cc1 Amb18292845 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.132 CC(C)SC(C)c1ccc(F)cc1 Amb24380621 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.132 CC(C)SC(C)c1ccc(N)cc1 Amb18974010 [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.132 CC(CC(N)=O)c1ccc(N)cc1 Amb25859609 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.132 CC(CC(N)=O)c1ccc(O)cc1 Amb18128419 [0,2,0,0,0,0|2,0,0]=4 7277 B13R1.132 CC(CC(O)=O)c1ccc(I)cc1 Amb25783621 [0,2,0,0,0,0|2,0,0]=4 7278 B13R1.132 CC(CC([O-])=O)c1ccc(C)cc1 Amb17843541 [0,2,0,0,0,0|2,0,0]=4 7279 B13R1.132 CC(CC(c1ccc(cc1)C)O)C Amb17138882 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.132 CC(CN(c1ccc(cc1)Br)C)N Amb17059706 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.132 CC(CN(c1ccc(cc1)Br)C)O Amb17349688 [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.132 CC(CN(c1ccc(cc1)C)C)N Amb17059699 [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.132 CC(CN(c1ccc(cc1)C)C)O Amb17335361 [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.132 CC(CN(c1ccc(cc1)Cl)C)N Amb17059705 [0,2,0,0,0,0|2,0,0]=4 7285 B13R1.132 CC(CN(c1ccc(cc1)Cl)C)O Amb17337505 [0,2,0,0,0,0|2,0,0]=4 7286 B13R1.132 CC(CN(c1ccc(cc1)F)C)N Amb17059702 [0,2,0,0,0,0|2,0,0]=4 7287 B13R1.132 CC(CN(c1ccc(cc1)F)C)O Amb17335628 [0,2,0,0,0,0|2,0,0]=4 7288 B13R1.132 CC(Cl)CC(C)c1ccc(F)cc1 Amb24457307 [0,2,0,0,0,0|1,0,0]=3 7289 B13R1.132 CC(N)CC(O)c1ccc(Br)cc1 Amb25717949 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.132 CC(N)CC(O)c1ccc(F)cc1 Amb20669400 [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.132 CC(N)CC(O)c1ccc(I)cc1 Amb25038909 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.132 CC(c1ccc(cc1)Br)CC(=O)N Amb17255957 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.132 CC(c1ccc(cc1)C)CC(=O)N Amb17233275 [0,2,0,0,0,0|2,0,0]=4 7294 B13R1.132 CC(c1ccc(cc1)Cl)CC(=O)N Amb17236666 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.132 CC(c1ccc(cc1)Cl)NC(=O)C Amb11014279 [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.132 CC(c1ccc(cc1)F)CC(=O)N Amb17233786 [0,2,0,0,0,0|2,0,0]=4 7297 B13R1.132 CC(c1ccc(cc1)O)NC(=O)C Amb1068623 [0,2,0,0,0,0|2,0,0]=4 7298 B13R1.132 CN(C)CC(C)c1ccc(Br)cc1 Amb24727329 [0,2,0,0,0,0|0,0,0]=2 7299 B13R1.132 CN(C)CC(C)c1ccc(N)cc1 Amb24604559 [0,2,0,0,0,0|0,0,0]=2 7300 B13R1.132 CN(C)CC(F)c1ccc(N)cc1 Amb25722054 [0,2,0,0,0,0|1,0,0]=3 7301 B13R1.132 CN(C)CC(F)c1ccc(O)cc1 Amb25048368 [0,2,0,0,0,0|1,0,0]=3 7302 B13R1.132 CN(C)NC(C)c1ccc(F)cc1 Amb25114838 [0,2,0,0,0,0|1,0,0]=3 7303 B13R1.132 CN(C)NC(C)c1ccc(I)cc1 Amb25211134 [0,2,0,0,0,0|1,0,0]=3 7304 B13R1.132 CN(C)NC(C)c1ccc(O)cc1 Amb25781444 [0,2,0,0,0,0|1,0,0]=3 7305 B13R1.132 CN(CC(=O)c1ccc(cc1)Br)C Amb10563747 [0,2,0,0,0,0|1,0,1]=4 7306 B13R1.132 CN(CC(=O)c1ccc(cc1)F)C Amb17598448 [0,2,0,0,0,0|1,0,1]=4 7307 B13R1.132 CN(CC(=O)c1ccc(cc1)N)C Amb17090484 [0,2,0,0,0,0|1,0,1]=4 7308 B13R1.132 CN(CC(C)C)c1ccc(Br)cc1 Amb24395009 [0,2,0,0,0,0|2,0,0]=4 7309 B13R1.132 CN(CC(C)C)c1ccc(F)cc1 Amb25687729 [0,2,0,0,0,0|2,0,0]=4 7310 B13R1.132 CN(CC(C)C)c1ccc(O)cc1 Amb25145134 [0,2,0,0,0,0|2,0,0]=4 7311 B13R1.132 CN(CC(C)O)c1ccc(N)cc1 Amb18298293 [0,2,0,0,0,0|2,0,0]=4 7312 B13R1.132 CN(CC(c1ccc(cc1)C)Cl)C Amb17546849 [0,2,0,0,0,0|1,0,0]=3 7313 B13R1.132 CN(CC(c1ccc(cc1)C)N)C Amb1127953 [0,2,0,0,0,0|1,0,0]=3 7314 B13R1.132 CN(CC(c1ccc(cc1)C)O)C Amb17104284 [0,2,0,0,0,0|1,0,0]=3 7315 B13R1.132 CN(C[C@@H](C)O)c1ccc(F)cc1 Amb25195197 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.132 CN(N)CC(O)c1ccc(F)cc1 Amb25226296 [0,2,0,0,0,0|1,0,0]=3 7317 B13R1.132 CS(=O)NC(C)c1ccc(Br)cc1 Amb25177330 [0,2,0,0,0,0|2,0,0]=4 7318 B13R1.132 C[C@@H](CC(O)=O)c1ccc(F)cc1 Amb22226567 [0,2,0,0,0,0|2,0,0]=4 7319 B13R1.132 C[C@H](CC(O)=O)c1ccc(Cl)cc1 Amb25288141 [0,2,0,0,0,0|2,0,0]=4 7320 B13R1.132 C[C@H](CC(O)=O)c1ccc(F)cc1 Amb22225229 [0,2,0,0,0,0|2,0,0]=4 7321 B13R1.132 C[C@H](C[C@@H](C)O)c1ccc(F)cc1 Amb25753353 [0,2,0,0,0,0|1,0,0]=3 7322 B13R1.132 C\C(=N\N(C)C)\c1ccc(F)cc1 Amb24335234 [0,2,0,0,0,0|1,0,1]=4 7323 B13R1.132 C\C(=N\N(C)C)\c1ccc(I)cc1 Amb24335235 [0,2,0,0,0,0|1,0,1]=4 7324 B13R1.132 C\C(=N\N(C)C)\c1ccc(N)cc1 Amb25074573 [0,2,0,0,0,0|1,0,1]=4 7325 B13R1.132 C\C(=N\N(C)C)\c1ccc(O)cc1 Amb24343306 [0,2,0,0,0,0|1,0,1]=4 7326 B13R1.132 Cc1ccc(c[n]1)C(C)CC(C)O Amb24705901 [0,2,0,0,0,0|2,0,0]=4 7327 B13R1.132 Cc1ccc(c[n]1)C(N)CN(C)C Amb24489909 [0,2,0,0,0,0|2,0,0]=4 7328 B13R1.132 Cc1ccc(cc1)C(Br)CC(C)C Amb25345462 [0,2,0,0,0,0|2,0,0]=4 7329 B13R1.132 Cc1ccc(cc1)C(C)CC(C)Br Amb24601116 [0,2,0,0,0,0|1,0,0]=3 7330 B13R1.132 Cc1ccc(cc1)C(C)CC(C)N Amb25247124 [0,2,0,0,0,0|1,0,0]=3 7331 B13R1.132 Cc1ccc(cc1)C(C)CC(C)O Amb25129759 [0,2,0,0,0,0|1,0,0]=3 7332 B13R1.132 Cc1ccc(cc1)C(C)NN(C)C Amb24738823 [0,2,0,0,0,0|1,0,0]=3 7333 B13R1.132 Cc1ccc(cc1)C(Cl)CC(C)C Amb24475349 [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.132 Cc1ccc(cc1)C(N)CS(C)=O Amb25187932 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.132 Cc1ccc(cc1)C(O)CC(C)=O Amb25821404 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.132 Cc1ccc(cc1)N(C)CC(C)=C Amb25369268 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.132 Cc1ccc(cc1)N(C)CC(C)=O Amb18178411 [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.132 Cc1ccc(cc1)N(C)C[C@@H](C)O Amb25083012 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.132 Cc1ccc(cc1)N(C)C[C@H](C)N Amb24743150 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.132 Cc1ccc(cc1)N(C)C[C@H](C)O Amb25842657 [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.132 Cc1ccc(cc1)[C@@H](O)CC(C)=C Amb25796385 [0,2,0,0,0,0|2,0,0]=4 7342 B13R1.132 Cc1ccc(cc1)[C@@H](O)CC(C)=O Amb24424862 [0,2,0,0,0,0|2,0,0]=4 7343 B13R1.132 Cc1ccc(cc1)[C@@H](O)C[C@@H](C)O Amb24466308 [0,2,0,0,0,0|2,0,0]=4 7344 B13R1.132 Cc1ccc(cc1)[C@@H](O)C[C@H](C)O Amb25191728 [0,2,0,0,0,0|2,0,0]=4 7345 B13R1.132 Cc1ccc(cc1)[C@H](C)CC(C)=O Amb24691740 [0,2,0,0,0,0|1,0,0]=3 7346 B13R1.132 Cc1ccc(cc1)[C@H](C)CC(O)=O Amb24373882 [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.132 Cc1ccc(cc1)[C@H](C)NC(C)=O Amb24375905 [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.132 Cc1ccc(cc1)[C@H](N)CC(C)C Amb24604732 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.132 Cc1ccc(cc1)[C@H](O)CC(C)C Amb24698680 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.132 ClC(c1ccc(cc1)Br)CN(C)C Amb17547049 [0,2,0,0,0,0|1,0,0]=3 7351 B13R1.132 ClC(c1ccc(cc1)Cl)CN(C)C Amb17547086 [0,2,0,0,0,0|1,0,0]=3 7352 B13R1.132 ClC(c1ccc(cc1)F)CN(C)C Amb17547138 [0,2,0,0,0,0|1,0,0]=3 7353 B13R1.132 NC(c1ccc(cc1)F)CN(C)C Amb1125585 [0,2,0,0,0,0|1,0,0]=3 7354 B13R1.132 OC(c1ccc(cc1)Br)CC(C)C Amb17159432 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.132 OC(c1ccc(cc1)Br)CN(C)C Amb10563750 [0,2,0,0,0,0|1,0,0]=3 7356 B13R1.132 OC(c1ccc(cc1)Br)CN(C)C Amb17104307 [0,2,0,0,0,0|1,0,0]=3 7357 B13R1.132 OC(c1ccc(cc1)Cl)CC(C)C Amb17139733 [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.132 OC(c1ccc(cc1)Cl)CN(C)C Amb17104292 [0,2,0,0,0,0|1,0,0]=3 7359 B13R1.132 OC(c1ccc(cc1)F)CC(C)C Amb17139022 [0,2,0,0,0,0|2,0,0]=4 7360 B13R1.132 OC(c1ccc(cc1)F)CC(O)C Amb1109638 [0,2,0,0,0,0|2,0,0]=4 7361 B13R1.132 OC(c1ccc(cc1)F)CN(C)C Amb17104286 [0,2,0,0,0,0|1,0,0]=3 7362 B13R1.132 OC(c1ccc(cc1)N)CC(C)C Amb17101752 [0,2,0,0,0,0|2,0,0]=4 7363 B13R1.132 OC(c1ccc(cc1)N)CN(C)C Amb17090505 [0,2,0,0,0,0|1,0,0]=3 7364 B13R1.132 OC(c1ccc(cc1)O)CN(C)C Amb17307602 [0,2,0,0,0,0|1,0,0]=3 7365 B13R1.452 BrCCC(c1ccc(cc1)OC)C Amb17256438 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.452 CC(CC=O)c1ccc(cc1)C#N Amb25116670 [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.452 CCCC(N)c1ccc(cc1)C#N Amb25076705 [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.452 CCCC(N)c1ccc(cc1)SC Amb18942914 [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.452 CCCC(c1ccc(cc1)CC)O Amb17138883 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.452 CCCC(c1ccc(cc1)OC)Cl Amb17139740 [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.452 CCC[C@@H](N)c1ccc(cc1)C#N Amb22288793 [0,2,0,0,0,0|2,0,0]=4 7372 B13R1.452 CCC[C@@H](N)c1ccc(cc1)NC Amb24603014 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.452 CCC[C@H](N)c1ccc(cc1)C#N Amb22288794 [0,2,0,0,0,0|2,0,0]=4 7374 B13R1.452 CCC[C@H](N)c1ccc(cc1)C#N Amb24493908 [0,2,0,0,0,0|2,0,0]=4 7375 B13R1.452 CCc1ccc(cc1)C(CNN)O Amb17233734 [0,2,0,0,0,0|2,0,0]=4 7376 B13R1.452 CCc1ccc(cc1)C(CNO)O Amb17335486 [0,2,0,0,0,0|2,0,0]=4 7377 B13R1.452 CNCC(=O)c1ccc(cc1)CC Amb17233277 [0,2,0,0,0,0|1,0,1]=4 7378 B13R1.452 CNCC(=O)c1ccc(cc1)OC Amb17233534 [0,2,0,0,0,0|1,0,1]=4 7379 B13R1.452 CNCC(=O)c1ccc(cc1)SC Amb18894528 [0,2,0,0,0,0|1,0,1]=4 7380 B13R1.452 CNCC(C)c1ccc(cc1)SC Amb18244078 [0,2,0,0,0,0|0,0,0]=2 7381 B13R1.452 CNCC(O)c1ccc(cc1)C#N Amb18289720 [0,2,0,0,0,0|1,0,0]=3 7382 B13R1.452 CNCC(O)c1ccc(cc1)SC Amb18244096 [0,2,0,0,0,0|1,0,0]=3 7383 B13R1.452 CNCC(c1ccc(cc1)CC)C Amb17233339 [0,2,0,0,0,0|0,0,0]=2 7384 B13R1.452 CNCC(c1ccc(cc1)OC)C Amb17233590 [0,2,0,0,0,0|0,0,0]=2 7385 B13R1.452 CNc1ccc(cc1)[C@H](N)COC Amb25050129 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.452 COC[C@@H](N)c1ccc(cc1)C#N Amb25084542 [0,2,0,0,0,0|2,0,0]=4 7387 B13R1.452 COC[C@H](N)c1ccc(cc1)C#N Amb25084599 [0,2,0,0,0,0|2,0,0]=4 7388 B13R1.452 CONC(C)c1ccc(cc1)C#N Amb25045897 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.452 CSc1ccc(cc1)C(C)CCN Amb18894538 [0,2,0,0,0,0|2,0,0]=4 7390 B13R1.452 C\C(=N\NC)\c1ccc(cc1)C#N Amb25318425 [0,2,0,0,0,0|1,0,1]=4 7391 B13R1.452 C\C(=N\NC)\c1ccc(cc1)SC Amb25270861 [0,2,0,0,0,0|1,0,1]=4 7392 B13R1.452 ClCCC(c1ccc(cc1)CC)C Amb17236526 [0,2,0,0,0,0|2,0,0]=4 7393 B13R1.452 ClCCC(c1ccc(cc1)OC)C Amb17236867 [0,2,0,0,0,0|2,0,0]=4 7394 B13R1.452 NNCC(c1ccc(cc1)OC)O Amb17233905 [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.452 OCCC(c1ccc(cc1)CC)C Amb17233462 [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.452 OCCC(c1ccc(cc1)OC)C Amb17233696 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.452 ONCC(c1ccc(cc1)OC)O Amb17335613 [0,2,0,0,0,0|2,0,0]=4 7398 B13R1.466 BrCCC(c1ccc(c(c1)C)C)C Amb17255502 [0,2,0,0,0,0|2,0,0]=4 7399 B13R1.466 BrCCC(c1ccc(c(c1)C)F)C Amb17257513 [0,2,0,0,0,0|2,0,0]=4 7400 B13R1.466 CC(CC#N)c1cc(C)c(C)cc1 Amb24397128 [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.466 CC(CC#N)c1cc(F)c(F)cc1 Amb24645303 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.466 CC(CC#N)c1ccc(F)c(Cl)c1 Amb25699947 [0,2,0,0,0,0|2,0,0]=4 7403 B13R1.466 CC(CC=O)c1cc(C)c(C)cc1 Amb25075636 [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.466 CC(CC=O)c1ccc(Cl)c(F)c1 Amb25208671 [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.466 CC(CCN)c1cc(Cl)c(F)cc1 Amb18244121 [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.466 CC(NCC)c1ccc(Cl)c(Br)c1 Amb25713036 [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.466 CC(NCC)c1ccc(Cl)c(F)c1 Amb25685159 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.466 CC(NCC)c1ccc(O)c(Br)c1 Amb18999791 [0,2,0,0,0,0|2,0,0]=4 7409 B13R1.466 CC(NCC)c1ccc(O)c(Cl)c1 Amb18999790 [0,2,0,0,0,0|2,0,0]=4 7410 B13R1.466 CCCC(C)c1ccc(N)c(Cl)c1 Amb24400666 [0,2,0,0,0,0|1,0,0]=3 7411 B13R1.466 CCCC(C)c1ccc(O)c(Cl)c1 Amb24700230 [0,2,0,0,0,0|1,0,0]=3 7412 B13R1.466 CCCC(Cl)c1cc(Cl)c(Cl)cc1 Amb25144816 [0,2,0,0,0,0|2,0,0]=4 7413 B13R1.466 CCCC(Cl)c1cc(F)c(F)cc1 Amb24666296 [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.466 CCCC(N)c1cc(Br)c(I)cc1 Amb25342209 [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.466 CCCC(N)c1cc(Cl)c(F)cc1 Amb25036610 [0,2,0,0,0,0|2,0,0]=4 7416 B13R1.466 CCCC(N)c1cc(Cl)c(N)cc1 Amb24763497 [0,2,0,0,0,0|2,0,0]=4 7417 B13R1.466 CCCC(N)c1cc(F)c(Br)cc1 Amb24639039 [0,2,0,0,0,0|2,0,0]=4 7418 B13R1.466 CCCC(N)c1cc(I)c(Br)cc1 Amb24717155 [0,2,0,0,0,0|2,0,0]=4 7419 B13R1.466 CCCC(N)c1cc(N)c(O)cc1 Amb25102733 [0,2,0,0,0,0|2,0,0]=4 7420 B13R1.466 CCCC(O)c1cc(Br)c(Br)cc1 Amb25158614 [0,2,0,0,0,0|2,0,0]=4 7421 B13R1.466 CCCC(O)c1cc(Cl)c(Br)cc1 Amb25319412 [0,2,0,0,0,0|2,0,0]=4 7422 B13R1.466 CCCC(O)c1cc(Cl)c(Cl)cc1 Amb24531725 [0,2,0,0,0,0|2,0,0]=4 7423 B13R1.466 CCCC(O)c1cc(Cl)c(I)cc1 Amb24417462 [0,2,0,0,0,0|2,0,0]=4 7424 B13R1.466 CCCC(O)c1cc(F)c(Cl)cc1 Amb24450596 [0,2,0,0,0,0|2,0,0]=4 7425 B13R1.466 CCCC(O)c1cc(O)c(O)cc1 Amb25086709 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.466 CCCC(c1ccc(c(c1)C)C)Cl Amb17139643 [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.466 CCCC(c1ccc(c(c1)C)C)O Amb17138884 [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.466 CCCC(c1ccc(c(c1)C)F)Cl Amb17139835 [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.466 CCCC(c1ccc(c(c1)C)F)N Amb17194548 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.466 CCCC(c1ccc(c(c1)C)F)O Amb17139023 [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.466 CCCC(c1ccc(c(c1)Cl)Cl)N Amb13951613 [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.466 CCCC(c1ccc(c(c1)F)F)O Amb17194580 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.466 CCCN(C)c1cc(C)c(C)cc1 Amb25043607 [0,2,0,0,0,0|2,0,0]=4 7434 B13R1.466 CCCN(C)c1cc(N)c(N)cc1 Amb24661501 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.466 CCC[C@@H](N)c1cc(Br)c(Br)cc1 Amb25790451 [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.466 CCC[C@@H](N)c1cc(Br)c(N)cc1 Amb25090903 [0,2,0,0,0,0|2,0,0]=4 7437 B13R1.466 CCC[C@@H](N)c1cc(Br)c(O)cc1 Amb25155137 [0,2,0,0,0,0|2,0,0]=4 7438 B13R1.466 CCC[C@@H](N)c1cc(C)c(C)cc1 Amb24391955 [0,2,0,0,0,0|2,0,0]=4 7439 B13R1.466 CCC[C@@H](N)c1cc(Cl)c(I)cc1 Amb24662215 [0,2,0,0,0,0|2,0,0]=4 7440 B13R1.466 CCC[C@@H](N)c1cc(F)c(F)cc1 Amb24493910 [0,2,0,0,0,0|2,0,0]=4 7441 B13R1.466 CCC[C@@H](N)c1cc(F)c(N)cc1 Amb25272923 [0,2,0,0,0,0|2,0,0]=4 7442 B13R1.466 CCC[C@@H](N)c1cc(N)c(Br)cc1 Amb24686716 [0,2,0,0,0,0|2,0,0]=4 7443 B13R1.466 CCC[C@@H](N)c1cc(N)c(Cl)cc1 Amb25763302 [0,2,0,0,0,0|2,0,0]=4 7444 B13R1.466 CCC[C@@H](N)c1cc(N)c(F)cc1 Amb24738567 [0,2,0,0,0,0|2,0,0]=4 7445 B13R1.466 CCC[C@@H](N)c1cc(O)c(Cl)cc1 Amb24730731 [0,2,0,0,0,0|2,0,0]=4 7446 B13R1.466 CCC[C@@H](N)c1cc(O)c(F)cc1 Amb25684696 [0,2,0,0,0,0|2,0,0]=4 7447 B13R1.466 CCC[C@@H](N)c1cc(O)c(O)cc1 Amb25680048 [0,2,0,0,0,0|2,0,0]=4 7448 B13R1.466 CCC[C@@H](O)c1cc(Cl)c(Cl)cc1 Amb24596955 [0,2,0,0,0,0|2,0,0]=4 7449 B13R1.466 CCC[C@H](N)c1cc(Br)c(Cl)cc1 Amb25364228 [0,2,0,0,0,0|2,0,0]=4 7450 B13R1.466 CCC[C@H](N)c1cc(Br)c(N)cc1 Amb25352570 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.466 CCC[C@H](N)c1cc(Cl)c(F)cc1 Amb25667989 [0,2,0,0,0,0|2,0,0]=4 7452 B13R1.466 CCC[C@H](N)c1cc(Cl)c(N)cc1 Amb25218095 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.466 CCC[C@H](N)c1cc(Cl)c(O)cc1 Amb25784530 [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.466 CCC[C@H](N)c1cc(F)c(F)cc1 Amb24700421 [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.466 CCC[C@H](N)c1cc(F)c(I)cc1 Amb24578807 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.466 CCC[C@H](N)c1cc(F)c(N)cc1 Amb25287350 [0,2,0,0,0,0|2,0,0]=4 7457 B13R1.466 CCC[C@H](N)c1cc(N)c(Br)cc1 Amb25847940 [0,2,0,0,0,0|2,0,0]=4 7458 B13R1.466 CCC[C@H](N)c1cc(N)c(F)cc1 Amb25144068 [0,2,0,0,0,0|2,0,0]=4 7459 B13R1.466 CCC[C@H](N)c1cc(O)c(Br)cc1 Amb25352444 [0,2,0,0,0,0|2,0,0]=4 7460 B13R1.466 CCC[C@H](N)c1cc(O)c(O)cc1 Amb24386022 [0,2,0,0,0,0|2,0,0]=4 7461 B13R1.466 CCC[C@H](O)c1cc(Br)c(Cl)cc1 Amb25824878 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.466 CCC[C@H](O)c1cc(Br)c(F)cc1 Amb24663916 [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.466 CCC[C@H](O)c1cc(Cl)c(Cl)cc1 Amb25309109 [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.466 CCN[C@@H](C)c1cc(Cl)c(Cl)cc1 Amb24747807 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.466 CCSC(C)c1cc(F)c(F)cc1 Amb25681195 [0,2,0,0,0,0|2,0,0]=4 7466 B13R1.466 CNCC(=O)c1ccc(Br)c(Cl)c1 Amb24379078 [0,2,0,0,0,0|1,0,1]=4 7467 B13R1.466 CNCC(=O)c1ccc(Br)c(F)c1 Amb25342778 [0,2,0,0,0,0|1,0,1]=4 7468 B13R1.466 CNCC(=O)c1ccc(Br)c(N)c1 Amb18227846 [0,2,0,0,0,0|1,0,1]=4 7469 B13R1.466 CNCC(=O)c1ccc(Cl)c(F)c1 Amb25180475 [0,2,0,0,0,0|1,0,1]=4 7470 B13R1.466 CNCC(=O)c1ccc(Cl)c(N)c1 Amb18864185 [0,2,0,0,0,0|1,0,1]=4 7471 B13R1.466 CNCC(=O)c1ccc(F)c(Br)c1 Amb25158269 [0,2,0,0,0,0|1,0,1]=4 7472 B13R1.466 CNCC(=O)c1ccc(F)c(Cl)c1 Amb18864487 [0,2,0,0,0,0|1,0,1]=4 7473 B13R1.466 CNCC(=O)c1ccc(F)c(N)c1 Amb18863009 [0,2,0,0,0,0|1,0,1]=4 7474 B13R1.466 CNCC(=O)c1ccc(c(c1)C)C Amb17233278 [0,2,0,0,0,0|1,0,1]=4 7475 B13R1.466 CNCC(=O)c1ccc(c(c1)C)Cl Amb17314398 [0,2,0,0,0,0|1,0,1]=4 7476 B13R1.466 CNCC(=O)c1ccc(c(c1)C)F Amb17233788 [0,2,0,0,0,0|1,0,1]=4 7477 B13R1.466 CNCC(=O)c1ccc(c(c1)Cl)Cl Amb17314508 [0,2,0,0,0,0|1,0,1]=4 7478 B13R1.466 CNCC(=O)c1ccc(c(c1)F)F Amb17335732 [0,2,0,0,0,0|1,0,1]=4 7479 B13R1.466 CNCC(C)c1cc(F)c(F)cc1 Amb18243850 [0,2,0,0,0,0|0,0,0]=2 7480 B13R1.466 CNCC(C)c1ccc(Br)c(O)c1 Amb24671459 [0,2,0,0,0,0|0,0,0]=2 7481 B13R1.466 CNCC(C)c1ccc(Cl)c(Br)c1 Amb25683070 [0,2,0,0,0,0|0,0,0]=2 7482 B13R1.466 CNCC(C)c1ccc(F)c(Cl)c1 Amb18244124 [0,2,0,0,0,0|0,0,0]=2 7483 B13R1.466 CNCC(C)c1ccc(F)c(O)c1 Amb25372024 [0,2,0,0,0,0|0,0,0]=2 7484 B13R1.466 CNCC(C)c1ccc(O)c(Br)c1 Amb24671364 [0,2,0,0,0,0|0,0,0]=2 7485 B13R1.466 CNCC(C)c1ccc(O)c(Cl)c1 Amb25158279 [0,2,0,0,0,0|0,0,0]=2 7486 B13R1.466 CNCC(C)c1ccc(O)c(F)c1 Amb25156936 [0,2,0,0,0,0|0,0,0]=2 7487 B13R1.466 CNCC(Cl)c1cc(C)c(C)cc1 Amb25724929 [0,2,0,0,0,0|1,0,0]=3 7488 B13R1.466 CNCC(N)c1cc(O)c(O)cc1 Amb25778177 [0,2,0,0,0,0|1,0,0]=3 7489 B13R1.466 CNCC(O)C1=CC(=O)C(=O)C=C1 Amb24697571 [0,2,0,0,0,0|1,0,0]=3 7490 B13R1.466 CNCC(O)c1cc(Cl)c(Cl)cc1 Amb18997467 [0,2,0,0,0,0|1,0,0]=3 7491 B13R1.466 CNCC(O)c1cc(O)c(Br)cc1 Amb22054570 [0,2,0,0,0,0|1,0,0]=3 7492 B13R1.466 CNCC(O)c1cc(O)c(F)cc1 Amb18129514 [0,2,0,0,0,0|1,0,0]=3 7493 B13R1.466 CNCC(O)c1ccc(Br)c(Cl)c1 Amb25158726 [0,2,0,0,0,0|1,0,0]=3 7494 B13R1.466 CNCC(O)c1ccc(Br)c(N)c1 Amb18873507 [0,2,0,0,0,0|1,0,0]=3 7495 B13R1.466 CNCC(O)c1ccc(Cl)c(F)c1 Amb18997483 [0,2,0,0,0,0|1,0,0]=3 7496 B13R1.466 CNCC(O)c1ccc(Cl)c(N)c1 Amb18225067 [0,2,0,0,0,0|1,0,0]=3 7497 B13R1.466 CNCC(O)c1ccc(F)c(Br)c1 Amb18997465 [0,2,0,0,0,0|1,0,0]=3 7498 B13R1.466 CNCC(O)c1ccc(F)c(Cl)c1 Amb18244128 [0,2,0,0,0,0|1,0,0]=3 7499 B13R1.466 CNCC(O)c1ccc(F)c(N)c1 Amb18863085 [0,2,0,0,0,0|1,0,0]=3 7500 B13R1.466 CNCC(O)c1ccc(O)c(N)c1 Amb24366030 [0,2,0,0,0,0|1,0,0]=3 7501 B13R1.466 CNCC(c1ccc(c(c1)C)C)C Amb17233341 [0,2,0,0,0,0|0,0,0]=2 7502 B13R1.466 CNCC(c1ccc(c(c1)C)C)O Amb17233588 [0,2,0,0,0,0|1,0,0]=3 7503 B13R1.466 CNCC(c1ccc(c(c1)C)F)C Amb17233834 [0,2,0,0,0,0|0,0,0]=2 7504 B13R1.466 CNCC(c1ccc(c(c1)C)F)O Amb17234000 [0,2,0,0,0,0|1,0,0]=3 7505 B13R1.466 CNCC(c1ccc(c(c1)F)F)O Amb17335898 [0,2,0,0,0,0|1,0,0]=3 7506 B13R1.466 CNC[C@@H](O)c1cc(O)c(O)cc1 Amb19132113 [0,2,0,0,0,0|1,0,0]=3 7507 B13R1.466 CNC[C@@H](O)c1cc(O)c(O)cc1 Amb22801017 [0,2,0,0,0,0|1,0,0]=3 7508 B13R1.466 CNC[C@H](O)C1=CC(=O)C(=O)C=C1 Amb25312041 [0,2,0,0,0,0|1,0,0]=3 7509 B13R1.466 CNC[C@H](O)c1cc(O)c(F)cc1 Amb25847886 [0,2,0,0,0,0|1,0,0]=3 7510 B13R1.466 CNC[C@H](c1ccc(c(c1)O)O)O Amb10843543 [0,2,0,0,0,0|1,0,0]=3 7511 B13R1.466 COCC(N)c1cc(Br)c(Br)cc1 Amb24534666 [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.466 COCC(N)c1cc(Cl)c(Cl)cc1 Amb18992517 [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.466 COCC(N)c1cc(N)c(Cl)cc1 Amb24730845 [0,2,0,0,0,0|2,0,0]=4 7514 B13R1.466 COCC(N)c1cc(N)c(O)cc1 Amb25716079 [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.466 COCC(N)c1ccc(Br)c(Cl)c1 Amb25790502 [0,2,0,0,0,0|2,0,0]=4 7516 B13R1.466 COCC(N)c1ccc(Br)c(F)c1 Amb24534231 [0,2,0,0,0,0|2,0,0]=4 7517 B13R1.466 COCC(N)c1ccc(Br)c(O)c1 Amb25841474 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.466 COCC(N)c1ccc(Cl)c(F)c1 Amb24349753 [0,2,0,0,0,0|2,0,0]=4 7519 B13R1.466 COCC(N)c1ccc(Cl)c(I)c1 Amb25850677 [0,2,0,0,0,0|2,0,0]=4 7520 B13R1.466 COCC(N)c1ccc(F)c(Br)c1 Amb24728181 [0,2,0,0,0,0|2,0,0]=4 7521 B13R1.466 COCC(N)c1ccc(F)c(I)c1 Amb24556606 [0,2,0,0,0,0|2,0,0]=4 7522 B13R1.466 COCC(N)c1ccc(F)c(O)c1 Amb24551065 [0,2,0,0,0,0|2,0,0]=4 7523 B13R1.466 COCC(N)c1ccc(I)c(Br)c1 Amb25786329 [0,2,0,0,0,0|2,0,0]=4 7524 B13R1.466 COCC(N)c1ccc(N)c(Br)c1 Amb25718474 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.466 COCC(N)c1ccc(N)c(Cl)c1 Amb24349681 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.466 COCC(N)c1ccc(N)c(O)c1 Amb25292192 [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.466 COCC(N)c1ccc(O)c(F)c1 Amb24351666 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.466 COCC(N)c1ccc(O)c(I)c1 Amb25155424 [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.466 COCC(O)c1cc(Br)c(Br)cc1 Amb24745343 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.466 COCC(O)c1cc(C)c(C)cc1 Amb18186589 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.466 COCC(O)c1cc(Cl)c(Cl)cc1 Amb25057869 [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.466 COCC(O)c1cc(F)c(F)cc1 Amb18324056 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.466 COCC(O)c1ccc(Br)c(Cl)c1 Amb25206059 [0,2,0,0,0,0|2,0,0]=4 7534 B13R1.466 COCC(O)c1ccc(F)c(Br)c1 Amb24635172 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.466 COCC(c1ccc(c(c1)F)F)N Amb1137160 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.466 COC[C@@H](N)c1cc(Br)c(Br)cc1 Amb24490753 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.466 COC[C@@H](N)c1cc(C)c(C)cc1 Amb25160672 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.466 COC[C@@H](N)c1cc(N)c(Cl)cc1 Amb25139977 [0,2,0,0,0,0|2,0,0]=4 7539 B13R1.466 COC[C@@H](N)c1cc(N)c(F)cc1 Amb24761527 [0,2,0,0,0,0|2,0,0]=4 7540 B13R1.466 COC[C@@H](N)c1ccc(Br)c(F)c1 Amb24427576 [0,2,0,0,0,0|2,0,0]=4 7541 B13R1.466 COC[C@@H](N)c1ccc(Br)c(I)c1 Amb25329812 [0,2,0,0,0,0|2,0,0]=4 7542 B13R1.466 COC[C@@H](N)c1ccc(F)c(I)c1 Amb25192514 [0,2,0,0,0,0|2,0,0]=4 7543 B13R1.466 COC[C@@H](N)c1ccc(F)c(O)c1 Amb24426841 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.466 COC[C@@H](N)c1ccc(I)c(Br)c1 Amb25229607 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.466 COC[C@@H](N)c1ccc(I)c(Cl)c1 Amb25154921 [0,2,0,0,0,0|2,0,0]=4 7546 B13R1.466 COC[C@@H](N)c1ccc(I)c(F)c1 Amb25827056 [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.466 COC[C@@H](N)c1ccc(N)c(Cl)c1 Amb25743630 [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.466 COC[C@@H](N)c1ccc(N)c(F)c1 Amb25703157 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.466 COC[C@@H](N)c1ccc(N)c(O)c1 Amb25347626 [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.466 COC[C@@H](N)c1ccc(O)c(Br)c1 Amb24702469 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.466 COC[C@@H](N)c1ccc(O)c(F)c1 Amb24377594 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.466 COC[C@H](N)c1cc(C)c(C)cc1 Amb25351399 [0,2,0,0,0,0|2,0,0]=4 7553 B13R1.466 COC[C@H](N)c1cc(Cl)c(Cl)cc1 Amb25155501 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.466 COC[C@H](N)c1cc(N)c(F)cc1 Amb25160782 [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.466 COC[C@H](N)c1cc(O)c(O)cc1 Amb25703571 [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.466 COC[C@H](N)c1ccc(Br)c(Cl)c1 Amb24534227 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.466 COC[C@H](N)c1ccc(Br)c(F)c1 Amb25856893 [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.466 COC[C@H](N)c1ccc(Br)c(I)c1 Amb24403173 [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.466 COC[C@H](N)c1ccc(Cl)c(F)c1 Amb25752136 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.466 COC[C@H](N)c1ccc(I)c(Cl)c1 Amb25364186 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.466 COC[C@H](N)c1ccc(I)c(F)c1 Amb25742913 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.466 COC[C@H](N)c1ccc(N)c(Br)c1 Amb25190469 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.466 COC[C@H](N)c1ccc(N)c(F)c1 Amb24462740 [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.466 CONC(C)c1cc(C)c(C)cc1 Amb25073690 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.466 CONC(C)c1cc(Cl)c(Cl)cc1 Amb25837191 [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.466 CONC(C)c1ccc(F)c(Cl)c1 Amb25808236 [0,2,0,0,0,0|2,0,0]=4 7567 B13R1.466 CSCC(N)c1cc(C)c(C)cc1 Amb18995357 [0,2,0,0,0,0|2,0,0]=4 7568 B13R1.466 CSCC(N)c1cc(F)c(F)cc1 Amb18301396 [0,2,0,0,0,0|2,0,0]=4 7569 B13R1.466 CSCC(O)c1cc(C)c(C)cc1 Amb19065319 [0,2,0,0,0,0|2,0,0]=4 7570 B13R1.466 CSCC(O)c1cc(F)c(F)cc1 Amb25064717 [0,2,0,0,0,0|2,0,0]=4 7571 B13R1.466 CSCC(O)c1cc(O)c(O)cc1 Amb18653357 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.466 C[C@@H](CCO)c1cc(C)c(C)cc1 Amb24379948 [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.466 C[C@@H](NCC)c1ccc(F)c(Cl)c1 Amb25226196 [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.466 C[C@H](CCO)c1cc(C)c(C)cc1 Amb25753166 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.466 C\C(=N\NC)\c1cc(Br)c(F)cc1 Amb25369213 [0,2,0,0,0,0|1,0,1]=4 7576 B13R1.466 C\C(=N\NC)\c1cc(Cl)c(Cl)cc1 Amb25372642 [0,2,0,0,0,0|1,0,1]=4 7577 B13R1.466 C\C(=N\NC)\c1cc(F)c(F)cc1 Amb24448633 [0,2,0,0,0,0|1,0,1]=4 7578 B13R1.466 C\C=C\C(C)c1cc(N)c(N)cc1 Amb18647990 [0,2,0,0,0,0|1,0,1]=4 7579 B13R1.466 C\C=C\C(C)c1ccc(N)c(Cl)c1 Amb24440828 [0,2,0,0,0,0|1,0,1]=4 7580 B13R1.466 C\C=C\C(C)c1ccc(O)c(Cl)c1 Amb24573504 [0,2,0,0,0,0|1,0,1]=4 7581 B13R1.466 Cc1cc(ccc1Br)C(=O)CNC Amb18227887 [0,2,0,0,0,0|1,0,1]=4 7582 B13R1.466 Cc1cc(ccc1Br)C(C)NCC Amb25087576 [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.466 Cc1cc(ccc1Br)C(N)CCC Amb18276340 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.466 Cc1cc(ccc1Br)C(N)COC Amb25301209 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.466 Cc1cc(ccc1Br)[C@H](N)CCC Amb25377102 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.466 Cc1cc(ccc1C)C(O)CNN Amb18564141 [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.466 Cc1cc(ccc1Cl)C(C)CCN Amb18188139 [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.466 Cc1cc(ccc1Cl)C(C)NCC Amb25720008 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.466 Cc1cc(ccc1Cl)C(N)CCC Amb18275886 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.466 Cc1cc(ccc1Cl)C(N)COC Amb18187533 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.466 Cc1cc(ccc1Cl)C(O)CCC Amb18105838 [0,2,0,0,0,0|2,0,0]=4 7592 B13R1.466 Cc1cc(ccc1Cl)C(O)CNC Amb18604580 [0,2,0,0,0,0|1,0,0]=3 7593 B13R1.466 Cc1cc(ccc1Cl)C(O)COC Amb25225429 [0,2,0,0,0,0|2,0,0]=4 7594 B13R1.466 Cc1cc(ccc1Cl)[C@@H](N)CCC Amb25827814 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.466 Cc1cc(ccc1F)C(C)NCC Amb18997542 [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.466 Cc1cc(ccc1F)C(N)COC Amb18301385 [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.466 Cc1cc(ccc1F)C(N)CSC Amb18301390 [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.466 Cc1cc(ccc1F)C(O)CNN Amb18066135 [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.466 Cc1cc(ccc1F)C(O)COC Amb19068701 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.466 Cc1cc(ccc1F)C(O)CSC Amb19086357 [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.466 Cc1cc(ccc1F)[C@@H](N)COC Amb25121093 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.466 Cc1cc(ccc1F)[C@H](N)CCC Amb24409505 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.466 Cc1cc(ccc1F)[C@H](O)CCC Amb24406709 [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.466 Cc1cc(ccc1I)C(N)CCC Amb25737694 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.466 Cc1cc(ccc1I)C(N)COC Amb25081004 [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.466 Cc1cc(ccc1I)[C@H](N)COC Amb25155329 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.466 Cc1cc(ccc1N)C(C)\C=C\C Amb18647922 [0,2,0,0,0,0|1,0,1]=4 7608 B13R1.466 Cc1cc(ccc1N)[C@@H](N)CCC Amb25707465 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.466 Cc1cc(ccc1N)[C@@H](N)COC Amb25809506 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.466 Cc1cc(ccc1N)[C@H](N)CCC Amb25072692 [0,2,0,0,0,0|2,0,0]=4 7611 B13R1.466 Cc1cc(ccc1O)C(C)CC#N Amb25093773 [0,2,0,0,0,0|2,0,0]=4 7612 B13R1.466 Cc1cc(ccc1O)C(C)NCC Amb25087316 [0,2,0,0,0,0|2,0,0]=4 7613 B13R1.466 Cc1cc(ccc1O)C(N)COC Amb25324393 [0,2,0,0,0,0|2,0,0]=4 7614 B13R1.466 Cc1cc(ccc1O)C(O)CNC Amb24468783 [0,2,0,0,0,0|1,0,0]=3 7615 B13R1.466 Cc1cc(ccc1O)[C@H](N)CCC Amb25690608 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.466 Cc1ccc(cc1Br)C(=O)CNC Amb18872420 [0,2,0,0,0,0|1,0,1]=4 7617 B13R1.466 Cc1ccc(cc1Br)C(C)CCN Amb25699936 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.466 Cc1ccc(cc1Br)C(O)CCC Amb25222644 [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.466 Cc1ccc(cc1Br)C(O)CNC Amb25157401 [0,2,0,0,0,0|1,0,0]=3 7620 B13R1.466 Cc1ccc(cc1Br)C(O)COC Amb25140665 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.466 Cc1ccc(cc1Br)[C@@H](N)CCC Amb25155305 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.466 Cc1ccc(cc1Br)[C@@H](N)COC Amb25069038 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.466 Cc1ccc(cc1Br)[C@H](N)CCC Amb25111838 [0,2,0,0,0,0|2,0,0]=4 7624 B13R1.466 Cc1ccc(cc1Br)[C@H](O)CCC Amb25118801 [0,2,0,0,0,0|2,0,0]=4 7625 B13R1.466 Cc1ccc(cc1Cl)C(=O)CNC Amb18224989 [0,2,0,0,0,0|1,0,1]=4 7626 B13R1.466 Cc1ccc(cc1Cl)C(C)CC#N Amb25839341 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.466 Cc1ccc(cc1Cl)C(C)CCN Amb25346479 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.466 Cc1ccc(cc1Cl)C(C)CNC Amb25157030 [0,2,0,0,0,0|0,0,0]=2 7629 B13R1.466 Cc1ccc(cc1Cl)C(Cl)CCC Amb24385438 [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.466 Cc1ccc(cc1Cl)C(N)CCC Amb24745592 [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.466 Cc1ccc(cc1Cl)C(N)COC Amb25339042 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.466 Cc1ccc(cc1Cl)C(O)COC Amb25783430 [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.466 Cc1ccc(cc1Cl)N(C)CCC Amb25663483 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.466 Cc1ccc(cc1Cl)[C@@H](O)CCC Amb25113122 [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.466 Cc1ccc(cc1Cl)[C@H](N)CCC Amb24437041 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.466 Cc1ccc(cc1Cl)[C@H](O)CCC Amb25694522 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.466 Cc1ccc(cc1F)C(C)CNC Amb24582205 [0,2,0,0,0,0|0,0,0]=2 7638 B13R1.466 Cc1ccc(cc1F)C(C)NCC Amb18968344 [0,2,0,0,0,0|2,0,0]=4 7639 B13R1.466 Cc1ccc(cc1F)C(N)CCC Amb18181398 [0,2,0,0,0,0|2,0,0]=4 7640 B13R1.466 Cc1ccc(cc1F)C(N)COC Amb24568306 [0,2,0,0,0,0|2,0,0]=4 7641 B13R1.466 Cc1ccc(cc1F)C(O)CCC Amb18796619 [0,2,0,0,0,0|2,0,0]=4 7642 B13R1.466 Cc1ccc(cc1F)C(O)COC Amb25067247 [0,2,0,0,0,0|2,0,0]=4 7643 B13R1.466 Cc1ccc(cc1F)C(O)CSC Amb25682968 [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.466 Cc1ccc(cc1F)[C@@H](N)CCC Amb25737777 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.466 Cc1ccc(cc1F)[C@@H](O)CCC Amb24590191 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.466 Cc1ccc(cc1F)[C@H](O)CCC Amb25760797 [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.466 Cc1ccc(cc1I)C(N)CCC Amb25771816 [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.466 Cc1ccc(cc1I)[C@@H](N)CCC Amb24758989 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.466 Cc1ccc(cc1I)[C@H](N)CCC Amb25123453 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.466 Cc1ccc(cc1N)C(=O)CNC Amb18862930 [0,2,0,0,0,0|1,0,1]=4 7651 B13R1.466 Cc1ccc(cc1N)C(C)CCC Amb25815186 [0,2,0,0,0,0|1,0,0]=3 7652 B13R1.466 Cc1ccc(cc1N)C(C)OCC Amb23541108 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.466 Cc1ccc(cc1N)C(N)CCC Amb24714749 [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.466 Cc1ccc(cc1N)C(O)CNC Amb18862980 [0,2,0,0,0,0|1,0,0]=3 7655 B13R1.466 Cc1ccc(cc1N)N(C)CCC Amb18999809 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.466 Cc1ccc(cc1N)[C@H](N)COC Amb24746689 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.466 Cc1ccc(cc1O)C(=O)CNC Amb25786501 [0,2,0,0,0,0|1,0,1]=4 7658 B13R1.466 Cc1ccc(cc1O)C(C)CCC Amb25767801 [0,2,0,0,0,0|1,0,0]=3 7659 B13R1.466 Cc1ccc(cc1O)C(C)CNC Amb24591843 [0,2,0,0,0,0|0,0,0]=2 7660 B13R1.466 Cc1ccc(cc1O)[C@H](N)COC Amb24401106 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.466 ClCCC(c1ccc(c(c1)C)C)C Amb17236529 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.466 ClCCC(c1ccc(c(c1)C)F)C Amb17237209 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.466 NCCC(c1ccc(c(c1)F)F)C Amb17234177 [0,2,0,0,0,0|2,0,0]=4 7664 B13R1.466 NNCC(O)c1cc(F)c(F)cc1 Amb18564463 [0,2,0,0,0,0|2,0,0]=4 7665 B13R1.466 NNCC(O)c1ccc(F)c(Cl)c1 Amb25079102 [0,2,0,0,0,0|2,0,0]=4 7666 B13R1.466 OCCC(c1ccc(c(c1)C)C)C Amb17233464 [0,2,0,0,0,0|2,0,0]=4 7667 B13R1.466 OCCC(c1ccc(c(c1)C)F)C Amb17233920 [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.466 OCCC(c1ccc(c(c1)F)F)C Amb17234278 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.466 ONCC(c1ccc(c(c1)C)C)O Amb17335489 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.466 ONCC(c1ccc(c(c1)C)F)O Amb17335736 [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.466 ONCC(c1ccc(c(c1)F)F)O Amb17336065 [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.1511 CC(CC#N)c1ccc(Cl)cc1Cl Amb25802788 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.1511 CC(CCN)c1ccc(Cl)cc1Cl Amb22036519 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.1511 CC(CCN)c1ccc(F)cc1F Amb18293551 [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.1511 CCCC(Br)c1ccc(C)cc1C Amb25847102 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.1511 CCCC(Br)c1ccc(Cl)cc1Cl Amb25769614 [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.1511 CCCC(Br)c1ccc(F)cc1F Amb24707549 [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.1511 CCCC(C)c1ccc(N)cc1Cl Amb25774427 [0,2,0,0,0,0|1,0,0]=3 7679 B13R1.1511 CCCC(Cl)c1ccc(F)cc1F Amb25792910 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.1511 CCCC(N)c1ccc(Br)cc1Br Amb24378487 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.1511 CCCC(N)c1ccc(Br)cc1N Amb25315254 [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.1511 CCCC(N)c1ccc(Cl)cc1Cl Amb24608762 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.1511 CCCC(N)c1ccc(Cl)cc1F Amb24379209 [0,2,0,0,0,0|2,0,0]=4 7684 B13R1.1511 CCCC(N)c1ccc(Cl)cc1O Amb25177281 [0,2,0,0,0,0|2,0,0]=4 7685 B13R1.1511 CCCC(N)c1ccc(F)cc1Cl Amb24583911 [0,2,0,0,0,0|2,0,0]=4 7686 B13R1.1511 CCCC(N)c1ccc(F)cc1N Amb25075529 [0,2,0,0,0,0|2,0,0]=4 7687 B13R1.1511 CCCC(N)c1ccc(F)cc1O Amb25809388 [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.1511 CCCC(N)c1ccc(I)cc1Cl Amb25824054 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.1511 CCCC(N)c1ccc(I)cc1O Amb24760294 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.1511 CCCC(N)c1ccc(N)cc1Cl Amb24680529 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.1511 CCCC(N)c1ccc(O)cc1Cl Amb25817485 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.1511 CCCC(N)c1ccc(O)cc1N Amb25133024 [0,2,0,0,0,0|2,0,0]=4 7693 B13R1.1511 CCCC(N)c1ccc(O)cc1O Amb18275065 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.1511 CCCC(O)c1ccc(Br)cc1Br Amb25845666 [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.1511 CCCC(O)c1ccc(Cl)cc1Br Amb24662681 [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.1511 CCCC(O)c1ccc(Cl)cc1N Amb24732457 [0,2,0,0,0,0|2,0,0]=4 7697 B13R1.1511 CCCC(O)c1ccc(F)cc1Cl Amb25356800 [0,2,0,0,0,0|2,0,0]=4 7698 B13R1.1511 CCCC(O)c1ccc(F)cc1F Amb19058347 [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.1511 CCCC(c1ccc(cc1C)C)O Amb17194529 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.1511 CCCN(C)c1ccc(C)cc1C Amb25663484 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.1511 CCCN(C)c1ccc(N)cc1Br Amb18981629 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.1511 CCC[C@@H](N)c1ccc(Br)cc1O Amb25351622 [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1Br Amb25259069 [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.1511 CCC[C@@H](N)c1ccc(Cl)cc1Cl Amb24344236 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1Br Amb25727180 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.1511 CCC[C@@H](N)c1ccc(F)cc1O Amb25063792 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.1511 CCC[C@@H](N)c1ccc(I)cc1Cl Amb25324013 [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.1511 CCC[C@@H](N)c1ccc(I)cc1F Amb25293925 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.1511 CCC[C@@H](N)c1ccc(N)cc1Cl Amb24407267 [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.1511 CCC[C@@H](N)c1ccc(O)cc1Cl Amb24649790 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.1511 CCC[C@@H](O)c1ccc(Cl)cc1F Amb24534714 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.1511 CCC[C@@H](O)c1ccc(F)cc1Br Amb25341153 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.1511 CCC[C@@H](O)c1ccc(F)cc1Cl Amb24638683 [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.1511 CCC[C@H](N)c1ccc(Br)cc1Br Amb25132284 [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.1511 CCC[C@H](N)c1ccc(Br)cc1F Amb24383832 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.1511 CCC[C@H](N)c1ccc(Br)cc1O Amb24758944 [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.1511 CCC[C@H](N)c1ccc(Cl)cc1Cl Amb25338282 [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.1511 CCC[C@H](N)c1ccc(Cl)cc1N Amb25087833 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.1511 CCC[C@H](N)c1ccc(Cl)cc1O Amb25667948 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.1511 CCC[C@H](N)c1ccc(I)cc1F Amb25055338 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.1511 CCC[C@H](N)c1ccc(O)cc1I Amb24417943 [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.1511 CCNC(C)c1ccc(Br)cc1Br Amb24442161 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.1511 CCNC(C)c1ccc(F)cc1I Amb24632280 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.1511 CCNC(C)c1ccc(F)cc1O Amb18303037 [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.1511 CCNC(C)c1ccc(O)cc1Cl Amb25323776 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.1511 CCNC(C)c1ccc(O)cc1F Amb25342105 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.1511 CCN[C@@H](C)c1ccc(Br)cc1F Amb24371077 [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.1511 CCN[C@@H](C)c1ccc(F)cc1F Amb24705251 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.1511 CCN[C@H](C)c1ccc(Cl)cc1Cl Amb24465955 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.1511 CCSC(C)c1ccc(F)cc1F Amb24363227 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.1511 CNCC(=N)c1ccc(O)cc1O Amb24682561 [0,2,0,0,0,0|1,0,1]=4 7732 B13R1.1511 CNCC(=O)c1ccc(Br)cc1Cl Amb25066509 [0,2,0,0,0,0|1,0,1]=4 7733 B13R1.1511 CNCC(=O)c1ccc(Cl)cc1F Amb25327295 [0,2,0,0,0,0|1,0,1]=4 7734 B13R1.1511 CNCC(=O)c1ccc(F)cc1F Amb18564319 [0,2,0,0,0,0|1,0,1]=4 7735 B13R1.1511 CNCC(=O)c1ccc(O)cc1O Amb25180646 [0,2,0,0,0,0|1,0,1]=4 7736 B13R1.1511 CNCC(=O)c1ccc(cc1C)C Amb17233281 [0,2,0,0,0,0|1,0,1]=4 7737 B13R1.1511 CNCC(=O)c1ccc(cc1Cl)Cl Amb17314180 [0,2,0,0,0,0|1,0,1]=4 7738 B13R1.1511 CNCC(C)c1ccc(Br)cc1F Amb25192550 [0,2,0,0,0,0|0,0,0]=2 7739 B13R1.1511 CNCC(C)c1ccc(Cl)cc1Br Amb25066510 [0,2,0,0,0,0|0,0,0]=2 7740 B13R1.1511 CNCC(C)c1ccc(F)cc1Br Amb24421752 [0,2,0,0,0,0|0,0,0]=2 7741 B13R1.1511 CNCC(C)c1ccc(F)cc1Cl Amb24420935 [0,2,0,0,0,0|0,0,0]=2 7742 B13R1.1511 CNCC(C)c1ccc(F)cc1F Amb18243851 [0,2,0,0,0,0|0,0,0]=2 7743 B13R1.1511 CNCC(C)c1ccc(O)cc1Cl Amb24718302 [0,2,0,0,0,0|0,0,0]=2 7744 B13R1.1511 CNCC(O)c1[n]cc(Br)cc1Br Amb25050731 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.1511 CNCC(O)c1ccc(Br)cc1Cl Amb25741122 [0,2,0,0,0,0|1,0,0]=3 7746 B13R1.1511 CNCC(O)c1ccc(Br)cc1F Amb18997472 [0,2,0,0,0,0|1,0,0]=3 7747 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Br Amb25828813 [0,2,0,0,0,0|1,0,0]=3 7748 B13R1.1511 CNCC(O)c1ccc(Cl)cc1Cl Amb18301235 [0,2,0,0,0,0|1,0,0]=3 7749 B13R1.1511 CNCC(O)c1ccc(Cl)cc1F Amb24388791 [0,2,0,0,0,0|1,0,0]=3 7750 B13R1.1511 CNCC(O)c1ccc(F)cc1F Amb18289717 [0,2,0,0,0,0|1,0,0]=3 7751 B13R1.1511 CNCC(O)c1ccc(O)cc1Cl Amb25095789 [0,2,0,0,0,0|1,0,0]=3 7752 B13R1.1511 CNCC(c1ccc(cc1C)C)C Amb17233345 [0,2,0,0,0,0|0,0,0]=2 7753 B13R1.1511 CNCC(c1ccc(cc1C)C)O Amb17233596 [0,2,0,0,0,0|1,0,0]=3 7754 B13R1.1511 COCC(N)c1ccc(Br)cc1Br Amb25219879 [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.1511 COCC(N)c1ccc(Br)cc1Cl Amb24391776 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.1511 COCC(N)c1ccc(Br)cc1N Amb25841030 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.1511 COCC(N)c1ccc(Br)cc1O Amb25696559 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.1511 COCC(N)c1ccc(Cl)cc1Br Amb24534208 [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.1511 COCC(N)c1ccc(Cl)cc1I Amb24701292 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.1511 COCC(N)c1ccc(Cl)cc1N Amb25835591 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.1511 COCC(N)c1ccc(F)cc1O Amb25809482 [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.1511 COCC(N)c1ccc(N)cc1Cl Amb24417892 [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.1511 COCC(N)c1ccc(N)cc1F Amb24529413 [0,2,0,0,0,0|2,0,0]=4 7764 B13R1.1511 COCC(N)c1ccc(O)cc1F Amb24629716 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.1511 COCC(N)c1ccc(O)cc1I Amb25180610 [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.1511 COCC(N)c1ccc(S)cc1O Amb25198000 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.1511 COCC(O)c1ccc(Br)cc1Br Amb25160911 [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.1511 COCC(O)c1ccc(Cl)cc1Br Amb25055102 [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.1511 COCC(O)c1ccc(Cl)cc1F Amb25254692 [0,2,0,0,0,0|2,0,0]=4 7770 B13R1.1511 COCC(O)c1ccc(Cl)cc1N Amb24359490 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.1511 COCC(O)c1ccc(F)cc1Br Amb25266465 [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.1511 COCC(O)c1ccc(F)cc1F Amb19059639 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.1511 COCC(O)c1ccc(F)cc1I Amb25356698 [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.1511 COCC(c1ccc(cc1C)C)N Amb1139722 [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.1511 COCC(c1ccc(cc1F)F)N Amb1140792 [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1Cl Amb24367264 [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.1511 COC[C@@H](N)c1ccc(Br)cc1O Amb24710669 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.1511 COC[C@@H](N)c1ccc(Cl)cc1O Amb24520684 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.1511 COC[C@@H](N)c1ccc(F)cc1F Amb24655789 [0,2,0,0,0,0|2,0,0]=4 7780 B13R1.1511 COC[C@@H](N)c1ccc(F)cc1I Amb24494245 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.1511 COC[C@@H](N)c1ccc(I)cc1F Amb25692199 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.1511 COC[C@@H](N)c1ccc(I)cc1O Amb25050123 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1Br Amb25727901 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.1511 COC[C@@H](N)c1ccc(N)cc1Cl Amb25690932 [0,2,0,0,0,0|2,0,0]=4 7785 B13R1.1511 COC[C@@H](N)c1ccc(O)cc1Cl Amb25364187 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.1511 COC[C@@H](N)c1ccc(O)cc1I Amb24741623 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.1511 COC[C@@H](N)c1ccc(O)cc1N Amb24341306 [0,2,0,0,0,0|2,0,0]=4 7788 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1Br Amb24494723 [0,2,0,0,0,0|2,0,0]=4 7789 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1Cl Amb25208937 [0,2,0,0,0,0|2,0,0]=4 7790 B13R1.1511 COC[C@H](N)c1ccc(Br)cc1O Amb24417950 [0,2,0,0,0,0|2,0,0]=4 7791 B13R1.1511 COC[C@H](N)c1ccc(Cl)cc1F Amb25096463 [0,2,0,0,0,0|2,0,0]=4 7792 B13R1.1511 COC[C@H](N)c1ccc(Cl)cc1N Amb25154959 [0,2,0,0,0,0|2,0,0]=4 7793 B13R1.1511 COC[C@H](N)c1ccc(F)cc1Br Amb25366086 [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.1511 COC[C@H](N)c1ccc(F)cc1Cl Amb25670294 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.1511 COC[C@H](N)c1ccc(O)cc1Cl Amb25827076 [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.1511 COC[C@H](N)c1ccc(O)cc1I Amb24468891 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.1511 CONC(C)c1ccc(Br)cc1Br Amb24465441 [0,2,0,0,0,0|2,0,0]=4 7798 B13R1.1511 CONC(C)c1ccc(Br)cc1F Amb24491109 [0,2,0,0,0,0|2,0,0]=4 7799 B13R1.1511 CONC(C)c1ccc(F)cc1Br Amb25711604 [0,2,0,0,0,0|2,0,0]=4 7800 B13R1.1511 CONC(C)c1ccc(F)cc1O Amb25794564 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.1511 CONC(C)c1ccc(O)cc1O Amb25724825 [0,2,0,0,0,0|2,0,0]=4 7802 B13R1.1511 CSCC(N)c1ccc(Cl)cc1F Amb24489565 [0,2,0,0,0,0|2,0,0]=4 7803 B13R1.1511 CSCC(N)c1ccc(F)cc1F Amb18997928 [0,2,0,0,0,0|2,0,0]=4 7804 B13R1.1511 C\C(=N\NC)\c1ccc(Cl)cc1Cl Amb24509848 [0,2,0,0,0,0|1,0,1]=4 7805 B13R1.1511 C\C(=N\NC)\c1ccc(F)cc1Cl Amb25833241 [0,2,0,0,0,0|1,0,1]=4 7806 B13R1.1511 C\C(=N\NC)\c1ccc(O)cc1O Amb25742058 [0,2,0,0,0,0|1,0,1]=4 7807 B13R1.1511 C\C=C\C(C)c1ccc(Cl)cc1O Amb25821414 [0,2,0,0,0,0|1,0,1]=4 7808 B13R1.1511 C\C=C\C(C)c1ccc(N)cc1N Amb18127787 [0,2,0,0,0,0|1,0,1]=4 7809 B13R1.1511 Cc1cc(Br)ccc1C(=O)CNC Amb18227884 [0,2,0,0,0,0|1,0,1]=4 7810 B13R1.1511 Cc1cc(Br)ccc1C(C)CCN Amb24732119 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.1511 Cc1cc(Br)ccc1C(C)NCC Amb25808855 [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.1511 Cc1cc(Br)ccc1[C@@H](N)CCC Amb24678863 [0,2,0,0,0,0|2,0,0]=4 7813 B13R1.1511 Cc1cc(Br)ccc1[C@@H](N)COC Amb24654497 [0,2,0,0,0,0|2,0,0]=4 7814 B13R1.1511 Cc1cc(Br)ccc1[C@H](N)CCC Amb25118800 [0,2,0,0,0,0|2,0,0]=4 7815 B13R1.1511 Cc1cc(C)c(cc1)C(C)CC#N Amb24464698 [0,2,0,0,0,0|2,0,0]=4 7816 B13R1.1511 Cc1cc(C)c(cc1)C(N)CSC Amb18997924 [0,2,0,0,0,0|2,0,0]=4 7817 B13R1.1511 Cc1cc(C)c(cc1)C(O)CNN Amb18065949 [0,2,0,0,0,0|2,0,0]=4 7818 B13R1.1511 Cc1cc(C)c(cc1)C(O)COC Amb18809341 [0,2,0,0,0,0|2,0,0]=4 7819 B13R1.1511 Cc1cc(C)c(cc1)C(O)CSC Amb18321548 [0,2,0,0,0,0|2,0,0]=4 7820 B13R1.1511 Cc1cc(C)c(cc1)[C@@H](N)COC Amb24411451 [0,2,0,0,0,0|2,0,0]=4 7821 B13R1.1511 Cc1cc(C)c(cc1)[C@H](N)COC Amb25824178 [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.1511 Cc1cc(Cl)ccc1C(=O)CNC Amb18224988 [0,2,0,0,0,0|1,0,1]=4 7823 B13R1.1511 Cc1cc(Cl)ccc1C(C)NCC Amb25191415 [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.1511 Cc1cc(Cl)ccc1C(N)CCC Amb25680121 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.1511 Cc1cc(Cl)ccc1C(O)COC Amb24644618 [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.1511 Cc1cc(F)ccc1C(C)CCN Amb25062309 [0,2,0,0,0,0|2,0,0]=4 7827 B13R1.1511 Cc1cc(F)ccc1C(C)NCC Amb18997901 [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.1511 Cc1cc(F)ccc1C(N)CCC Amb18796470 [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.1511 Cc1cc(F)ccc1C(N)COC Amb18301384 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.1511 Cc1cc(F)ccc1C(N)CSC Amb18301389 [0,2,0,0,0,0|2,0,0]=4 7831 B13R1.1511 Cc1cc(F)ccc1C(O)CCC Amb18805551 [0,2,0,0,0,0|2,0,0]=4 7832 B13R1.1511 Cc1cc(F)ccc1C(O)CNC Amb18997476 [0,2,0,0,0,0|1,0,0]=3 7833 B13R1.1511 Cc1cc(F)ccc1C(O)COC Amb19068700 [0,2,0,0,0,0|2,0,0]=4 7834 B13R1.1511 Cc1cc(F)ccc1C(O)CSC Amb19086356 [0,2,0,0,0,0|2,0,0]=4 7835 B13R1.1511 Cc1cc(F)ccc1[C@@H](N)CCC Amb24654851 [0,2,0,0,0,0|2,0,0]=4 7836 B13R1.1511 Cc1cc(F)ccc1[C@@H](N)COC Amb24447027 [0,2,0,0,0,0|2,0,0]=4 7837 B13R1.1511 Cc1cc(F)ccc1[C@@H](O)CCC Amb25707558 [0,2,0,0,0,0|2,0,0]=4 7838 B13R1.1511 Cc1cc(F)ccc1[C@H](N)COC Amb24761526 [0,2,0,0,0,0|2,0,0]=4 7839 B13R1.1511 Cc1cc(I)ccc1[C@@H](N)CCC Amb25123339 [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.1511 Cc1cc(I)ccc1[C@H](N)CCC Amb25118795 [0,2,0,0,0,0|2,0,0]=4 7841 B13R1.1511 Cc1cc(I)ccc1[C@H](N)COC Amb24447596 [0,2,0,0,0,0|2,0,0]=4 7842 B13R1.1511 Cc1cc(N)ccc1C(C)\C=C\C Amb18647924 [0,2,0,0,0,0|1,0,1]=4 7843 B13R1.1511 Cc1cc(N)ccc1C(N)CCC Amb24426886 [0,2,0,0,0,0|2,0,0]=4 7844 B13R1.1511 Cc1cc(N)ccc1[C@@H](N)COC Amb25160728 [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.1511 Cc1cc(N)ccc1[C@H](N)COC Amb25789967 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.1511 Cc1cc(O)ccc1C(C)CC#N Amb25050226 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.1511 Cc1cc(O)ccc1C(C)CCC Amb24344013 [0,2,0,0,0,0|1,0,0]=3 7848 B13R1.1511 Cc1cc(O)ccc1C(C)CCO Amb25134144 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.1511 Cc1cc(O)ccc1C(C)CNC Amb25769248 [0,2,0,0,0,0|0,0,0]=2 7850 B13R1.1511 Cc1cc(O)ccc1C(C)\C=C\C Amb24582581 [0,2,0,0,0,0|1,0,1]=4 7851 B13R1.1511 Cc1cc(O)ccc1C(N)COC Amb25791625 [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.1511 Cc1cc(O)ccc1[C@H](N)COC Amb25674697 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.1511 Cc1ccc(C(C)CC=C)c(O)c1 Amb25371855 [0,2,0,0,0,0|1,0,1]=4 7854 B13R1.1511 Cc1ccc(C(C)CCC)c(O)c1 Amb24676712 [0,2,0,0,0,0|1,0,0]=3 7855 B13R1.1511 Cc1ccc(C(C)CCO)c(O)c1 Amb24584507 [0,2,0,0,0,0|2,0,0]=4 7856 B13R1.1511 Cc1ccc(C(C)CNC)c(Br)c1 Amb24379660 [0,2,0,0,0,0|0,0,0]=2 7857 B13R1.1511 Cc1ccc(C(C)CNC)c(O)c1 Amb24473330 [0,2,0,0,0,0|0,0,0]=2 7858 B13R1.1511 Cc1ccc(C(C)NCC)c(F)c1 Amb25097951 [0,2,0,0,0,0|2,0,0]=4 7859 B13R1.1511 Cc1ccc(C(C)\C=C\C)c(N)c1 Amb18647923 [0,2,0,0,0,0|1,0,1]=4 7860 B13R1.1511 Cc1ccc(C(N)CCC)c(Cl)c1 Amb22642872 [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.1511 Cc1ccc(C(N)CCC)c(N)c1 Amb24376695 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.1511 Cc1ccc(C(N)COC)c(Br)c1 Amb24682547 [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.1511 Cc1ccc(C(N)COC)c(O)c1 Amb25824648 [0,2,0,0,0,0|2,0,0]=4 7864 B13R1.1511 Cc1ccc(C(O)CCC)c(Br)c1 Amb25155286 [0,2,0,0,0,0|2,0,0]=4 7865 B13R1.1511 Cc1ccc(C(O)CNC)c(Br)c1 Amb25695051 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.1511 Cc1ccc(C(O)COC)c(Cl)c1 Amb25333940 [0,2,0,0,0,0|2,0,0]=4 7867 B13R1.1511 Cc1ccc([C@@H](C)CCO)c(O)c1 Amb25094426 [0,2,0,0,0,0|2,0,0]=4 7868 B13R1.1511 Cc1ccc([C@@H](N)CCC)c(F)c1 Amb24763667 [0,2,0,0,0,0|2,0,0]=4 7869 B13R1.1511 Cc1ccc([C@@H](N)CCC)c(O)c1 Amb25674533 [0,2,0,0,0,0|2,0,0]=4 7870 B13R1.1511 Cc1ccc([C@@H](N)COC)c(Cl)c1 Amb25726661 [0,2,0,0,0,0|2,0,0]=4 7871 B13R1.1511 Cc1ccc([C@@H](N)COC)c(O)c1 Amb25160783 [0,2,0,0,0,0|2,0,0]=4 7872 B13R1.1511 Cc1ccc([C@H](C)\C=C\C)c(O)c1 Amb25370808 [0,2,0,0,0,0|1,0,1]=4 7873 B13R1.1511 Cc1ccc([C@H](N)CCC)c(Br)c1 Amb25154915 [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.1511 Cc1ccc([C@H](N)CCC)c(Cl)c1 Amb24346933 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.1511 Cc1ccc([C@H](N)CCC)c(F)c1 Amb24426845 [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.1511 Cc1ccc([C@H](N)CCC)c(O)c1 Amb24653279 [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.1511 Cc1ccc([C@H](N)COC)c(F)c1 Amb25757522 [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.1511 Cc1ccc([C@H](O)CCC)c(F)c1 Amb24744239 [0,2,0,0,0,0|2,0,0]=4 7879 B13R1.1511 Cc1ccc(c(Br)c1)C(=O)CNC Amb24533505 [0,2,0,0,0,0|1,0,1]=4 7880 B13R1.1511 Cc1ccc(c(F)c1)C(=O)CNC Amb25157233 [0,2,0,0,0,0|1,0,1]=4 7881 B13R1.1511 Cc1ccc(c(O)c1)C(=O)CNC Amb25723071 [0,2,0,0,0,0|1,0,1]=4 7882 B13R1.1511 Cc1ccc(c(O)c1)\C(\C)=N/NC Amb24343394 [0,2,0,0,0,0|1,0,1]=4 7883 B13R1.1511 ClCCC(c1ccc(cc1C)C)C Amb17236533 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.1511 NCCC(c1ccc(cc1C)C)C Amb17233348 [0,2,0,0,0,0|2,0,0]=4 7885 B13R1.1511 NNCC(O)c1ccc(F)cc1F Amb18066217 [0,2,0,0,0,0|2,0,0]=4 7886 B13R1.1511 OCCC(c1ccc(cc1C)C)C Amb17233468 [0,2,0,0,0,0|2,0,0]=4 7887 B13R1.1511 ONCC(c1ccc(cc1C)C)O Amb17335497 [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.12 CC(CC#N)c1cccc(Cl)c1Cl Amb25800991 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.12 CC(c1cccc(c1C)C)CCN Amb17233373 [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.12 CC(c1cccc(c1C)C)CCO Amb17233486 [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.12 CCCC(Cl)c1cccc(Br)c1F Amb24673633 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.12 CCCC(Cl)c1cccc(Cl)c1Cl Amb25052438 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.12 CCCC(N)c1cccc(Br)c1O Amb25756717 [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.12 CCCC(N)c1cccc(F)c1Br Amb25697672 [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.12 CCCC(N)c1cccc(F)c1Cl Amb25155223 [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.12 CCCC(N)c1cccc(F)c1F Amb25691968 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.12 CCCC(N)c1cccc(F)c1I Amb25841459 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.12 CCCC(N)c1cccc(F)c1N Amb24349716 [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.12 CCCC(N)c1cccc(I)c1O Amb24760293 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.12 CCCC(N)c1cccc(N)c1F Amb24494325 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.12 CCCC(N)c1cccc(N)c1N Amb24761433 [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.12 CCCC(N)c1cccc(O)c1F Amb25711291 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.12 CCCC(N)c1cccc(O)c1O Amb25720200 [0,2,0,0,0,0|2,0,0]=4 7904 B13R1.12 CCCC(N)c1cccc(S)c1O Amb25798651 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.12 CCCC(O)c1cccc(Br)c1Cl Amb25159147 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.12 CCCC(O)c1cccc(Cl)c1Cl Amb24400054 [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.12 CCCC(O)c1cccc(F)c1Cl Amb25159148 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.12 CCCC(O)c1cccc(O)c1O Amb24408537 [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.12 CCCC(c1cccc(c1C)C)N Amb17233372 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.12 CCCC(c1cccc(c1C)C)O Amb17233485 [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.12 CCCN(C)c1cccc(Br)c1N Amb24359383 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.12 CCCN(C)c1cccc(C)c1C Amb25663486 [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.12 CCCN(C)c1cccc(Cl)c1N Amb25153856 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.12 CCCN(C)c1cccc(F)c1N Amb18968056 [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.12 CCC[C@@H](N)c1cccc(Br)c1Br Amb24662458 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.12 CCC[C@@H](N)c1cccc(C)c1C Amb25102828 [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1Br Amb25307998 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1F Amb25729891 [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.12 CCC[C@@H](N)c1cccc(Cl)c1I Amb25352611 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.12 CCC[C@@H](N)c1cccc(F)c1Br Amb25154883 [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.12 CCC[C@@H](N)c1cccc(N)c1N Amb24425486 [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.12 CCC[C@H](N)c1cccc(Br)c1Br Amb24427476 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.12 CCC[C@H](N)c1cccc(Br)c1Cl Amb24684480 [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.12 CCC[C@H](N)c1cccc(Br)c1O Amb25770682 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.12 CCC[C@H](N)c1cccc(Cl)c1Cl Amb24638954 [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.12 CCC[C@H](N)c1cccc(Cl)c1F Amb25122866 [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.12 CCC[C@H](N)c1cccc(Cl)c1I Amb24647799 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.12 CCC[C@H](N)c1cccc(Cl)c1N Amb25353852 [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.12 CCC[C@H](N)c1cccc(Cl)c1O Amb24496852 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.12 CCC[C@H](N)c1cccc(F)c1Cl Amb24379662 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.12 CCC[C@H](N)c1cccc(F)c1O Amb25791582 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.12 CCC[C@H](N)c1cccc(I)c1Cl Amb24427431 [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.12 CCC[C@H](N)c1cccc(I)c1O Amb24468874 [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.12 CCC[C@H](N)c1cccc(O)c1Br Amb24682173 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.12 CCC[C@H](N)c1cccc(O)c1O Amb24494315 [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.12 CCC[C@H](O)c1cccc(C)c1C Amb24715818 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.12 CCNC(C)c1cccc(Br)c1F Amb25072008 [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.12 CCNC(C)c1cccc(C)c1C Amb18804696 [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.12 CCNC(C)c1cccc(F)c1F Amb25731202 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.12 CCNC(C)c1cccc(F)c1O Amb25725789 [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.12 CCN[C@@H](C)c1cccc(Cl)c1F Amb25668800 [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.12 CNCC(=O)c1cccc(Br)c1Cl Amb25038829 [0,2,0,0,0,0|1,0,1]=4 7943 B13R1.12 CNCC(=O)c1cccc(Br)c1F Amb25158632 [0,2,0,0,0,0|1,0,1]=4 7944 B13R1.12 CNCC(=O)c1cccc(Cl)c1Cl Amb18866812 [0,2,0,0,0,0|1,0,1]=4 7945 B13R1.12 CNCC(=O)c1cccc(F)c1F Amb25795369 [0,2,0,0,0,0|1,0,1]=4 7946 B13R1.12 CNCC(=O)c1cccc(F)c1O Amb25320557 [0,2,0,0,0,0|1,0,1]=4 7947 B13R1.12 CNCC(=O)c1cccc(O)c1F Amb25755292 [0,2,0,0,0,0|1,0,1]=4 7948 B13R1.12 CNCC(C)c1cccc(Br)c1O Amb25266358 [0,2,0,0,0,0|0,0,0]=2 7949 B13R1.12 CNCC(C)c1cccc(Cl)c1Br Amb24408997 [0,2,0,0,0,0|0,0,0]=2 7950 B13R1.12 CNCC(C)c1cccc(Cl)c1Cl Amb25217532 [0,2,0,0,0,0|0,0,0]=2 7951 B13R1.12 CNCC(C)c1cccc(Cl)c1O Amb24384475 [0,2,0,0,0,0|0,0,0]=2 7952 B13R1.12 CNCC(C)c1cccc(F)c1Br Amb24535375 [0,2,0,0,0,0|0,0,0]=2 7953 B13R1.12 CNCC(C)c1cccc(F)c1F Amb25823421 [0,2,0,0,0,0|0,0,0]=2 7954 B13R1.12 CNCC(C)c1cccc(O)c1F Amb24686183 [0,2,0,0,0,0|0,0,0]=2 7955 B13R1.12 CNCC(O)c1cccc(Br)c1Cl Amb25116690 [0,2,0,0,0,0|1,0,0]=3 7956 B13R1.12 CNCC(O)c1cccc(Cl)c1Br Amb25832404 [0,2,0,0,0,0|1,0,0]=3 7957 B13R1.12 CNCC(O)c1cccc(Cl)c1Cl Amb18997458 [0,2,0,0,0,0|1,0,0]=3 7958 B13R1.12 CNCC(O)c1cccc(F)c1Br Amb25851315 [0,2,0,0,0,0|1,0,0]=3 7959 B13R1.12 CNCC(O)c1cccc(O)c1Cl Amb25832391 [0,2,0,0,0,0|1,0,0]=3 7960 B13R1.12 CNCC(O)c1cccc(O)c1F Amb18129513 [0,2,0,0,0,0|1,0,0]=3 7961 B13R1.12 CNC[C@H](O)c1cccc(O)c1F Amb24496006 [0,2,0,0,0,0|1,0,0]=3 7962 B13R1.12 COCC(N)c1cccc(Br)c1Br Amb25304112 [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.12 COCC(N)c1cccc(Cl)c1Cl Amb18301381 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.12 COCC(N)c1cccc(Cl)c1F Amb24697545 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.12 COCC(N)c1cccc(Cl)c1N Amb25066421 [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.12 COCC(N)c1cccc(Cl)c1O Amb25141053 [0,2,0,0,0,0|2,0,0]=4 7967 B13R1.12 COCC(N)c1cccc(F)c1Cl Amb25139669 [0,2,0,0,0,0|2,0,0]=4 7968 B13R1.12 COCC(N)c1cccc(F)c1I Amb24380737 [0,2,0,0,0,0|2,0,0]=4 7969 B13R1.12 COCC(N)c1cccc(F)c1O Amb24493861 [0,2,0,0,0,0|2,0,0]=4 7970 B13R1.12 COCC(N)c1cccc(I)c1Br Amb24730606 [0,2,0,0,0,0|2,0,0]=4 7971 B13R1.12 COCC(N)c1cccc(I)c1O Amb24367920 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.12 COCC(N)c1cccc(N)c1N Amb24470673 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.12 COCC(N)c1cccc(O)c1Br Amb24491895 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.12 COCC(N)c1cccc(S)c1O Amb25244474 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.12 COCC(O)c1cccc(Br)c1Cl Amb25731344 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.12 COCC(O)c1cccc(Br)c1F Amb25201457 [0,2,0,0,0,0|2,0,0]=4 7977 B13R1.12 COCC(O)c1cccc(Cl)c1Cl Amb24416087 [0,2,0,0,0,0|2,0,0]=4 7978 B13R1.12 COCC(O)c1cccc(Cl)c1F Amb24489345 [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.12 COCC(O)c1cccc(F)c1Br Amb25161024 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.12 COCC(O)c1cccc(F)c1F Amb25112522 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.12 COC[C@@H](N)c1cccc(Br)c1Cl Amb24702385 [0,2,0,0,0,0|2,0,0]=4 7982 B13R1.12 COC[C@@H](N)c1cccc(Br)c1F Amb24367330 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1Br Amb25692286 [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1Cl Amb25364229 [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1I Amb24491028 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.12 COC[C@@H](N)c1cccc(Cl)c1O Amb24437458 [0,2,0,0,0,0|2,0,0]=4 7987 B13R1.12 COC[C@@H](N)c1cccc(F)c1Cl Amb25242602 [0,2,0,0,0,0|2,0,0]=4 7988 B13R1.12 COC[C@@H](N)c1cccc(F)c1F Amb24392855 [0,2,0,0,0,0|2,0,0]=4 7989 B13R1.12 COC[C@@H](N)c1cccc(I)c1Br Amb25192309 [0,2,0,0,0,0|2,0,0]=4 7990 B13R1.12 COC[C@@H](N)c1cccc(I)c1O Amb25816150 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.12 COC[C@@H](N)c1cccc(O)c1O Amb24490688 [0,2,0,0,0,0|2,0,0]=4 7992 B13R1.12 COC[C@H](N)c1cccc(Br)c1Br Amb25140129 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.12 COC[C@H](N)c1cccc(Br)c1Cl Amb25132724 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.12 COC[C@H](N)c1cccc(Br)c1F Amb25212059 [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.12 COC[C@H](N)c1cccc(Cl)c1Br Amb24452058 [0,2,0,0,0,0|2,0,0]=4 7996 B13R1.12 COC[C@H](N)c1cccc(Cl)c1Cl Amb25314053 [0,2,0,0,0,0|2,0,0]=4 7997 B13R1.12 COC[C@H](N)c1cccc(Cl)c1N Amb25132828 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.12 COC[C@H](N)c1cccc(F)c1Br Amb25758907 [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.12 COC[C@H](N)c1cccc(F)c1Cl Amb25375918 [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.12 COC[C@H](N)c1cccc(F)c1F Amb25127938 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.12 COC[C@H](N)c1cccc(I)c1Cl Amb24410255 [0,2,0,0,0,0|2,0,0]=4 8002 B13R1.12 CONC(C)c1cccc(Cl)c1Cl Amb24463131 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.12 CONC(C)c1cccc(Cl)c1F Amb25119834 [0,2,0,0,0,0|2,0,0]=4 8004 B13R1.12 CSCC(O)c1cccc(Br)c1F Amb25351396 [0,2,0,0,0,0|2,0,0]=4 8005 B13R1.12 CSCC(O)c1cccc(F)c1F Amb25091442 [0,2,0,0,0,0|2,0,0]=4 8006 B13R1.12 C\C=C\C(C)c1cccc(Cl)c1N Amb24571189 [0,2,0,0,0,0|1,0,1]=4 8007 B13R1.12 C\C=C\C(C)c1cccc(N)c1N Amb18127784 [0,2,0,0,0,0|1,0,1]=4 8008 B13R1.12 C\C=C\C(C)c1cccc(O)c1O Amb25205416 [0,2,0,0,0,0|1,0,1]=4 8009 B13R1.12 Cc1c(Br)cccc1C(O)CCC Amb25828951 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.12 Cc1c(Br)cccc1C(O)CNC Amb25158740 [0,2,0,0,0,0|1,0,0]=3 8011 B13R1.12 Cc1c(Br)cccc1C(O)COC Amb24556227 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.12 Cc1c(Br)cccc1[C@@H](O)CCC Amb24675160 [0,2,0,0,0,0|2,0,0]=4 8013 B13R1.12 Cc1c(Br)cccc1[C@H](N)CCC Amb25835269 [0,2,0,0,0,0|2,0,0]=4 8014 B13R1.12 Cc1c(Cl)cccc1C(C)CC#N Amb24359098 [0,2,0,0,0,0|2,0,0]=4 8015 B13R1.12 Cc1c(Cl)cccc1C(C)CNC Amb25280153 [0,2,0,0,0,0|0,0,0]=2 8016 B13R1.12 Cc1c(Cl)cccc1C(N)CCC Amb24446586 [0,2,0,0,0,0|2,0,0]=4 8017 B13R1.12 Cc1c(Cl)cccc1C(N)COC Amb25737370 [0,2,0,0,0,0|2,0,0]=4 8018 B13R1.12 Cc1c(Cl)cccc1C(O)CCC Amb25694315 [0,2,0,0,0,0|2,0,0]=4 8019 B13R1.12 Cc1c(Cl)cccc1[C@@H](N)CCC Amb24628451 [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.12 Cc1c(Cl)cccc1[C@@H](N)COC Amb25756606 [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.12 Cc1c(Cl)cccc1[C@H](N)COC Amb24670210 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.12 Cc1c(F)cccc1C(N)CCC Amb25757412 [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.12 Cc1c(F)cccc1C(N)COC Amb25077201 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.12 Cc1c(F)cccc1C(O)CNC Amb25142390 [0,2,0,0,0,0|1,0,0]=3 8025 B13R1.12 Cc1c(I)cccc1C(N)CCC Amb25732600 [0,2,0,0,0,0|2,0,0]=4 8026 B13R1.12 Cc1c(I)cccc1[C@@H](N)COC Amb24401070 [0,2,0,0,0,0|2,0,0]=4 8027 B13R1.12 Cc1c(I)cccc1[C@H](N)CCC Amb24641418 [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.12 Cc1c(I)cccc1[C@H](N)COC Amb24737583 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.12 Cc1c(N)cccc1N(C)CCC Amb19002467 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.12 Cc1c(O)cccc1C(C)CNC Amb24533736 [0,2,0,0,0,0|0,0,0]=2 8031 B13R1.12 Cc1c(O)cccc1[C@@H](N)COC Amb24671349 [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.12 Cc1c(O)cccc1[C@H](N)COC Amb24674079 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.12 Cc1c(cccc1Cl)C(=O)CNC Amb18224962 [0,2,0,0,0,0|1,0,1]=4 8034 B13R1.12 Cc1c(cccc1Cl)C(C)CCN Amb24645219 [0,2,0,0,0,0|2,0,0]=4 8035 B13R1.12 Cc1c(cccc1F)C(=O)CNC Amb25158393 [0,2,0,0,0,0|1,0,1]=4 8036 B13R1.12 Cc1c(cccc1O)C(O)CNC Amb25848428 [0,2,0,0,0,0|1,0,0]=3 8037 B13R1.12 Cc1cccc(C(=O)CNC)c1C Amb18224566 [0,2,0,0,0,0|1,0,1]=4 8038 B13R1.12 Cc1cccc(C(C)CCC)c1O Amb24455467 [0,2,0,0,0,0|1,0,0]=3 8039 B13R1.12 Cc1cccc(C(C)CNC)c1C Amb25762222 [0,2,0,0,0,0|0,0,0]=2 8040 B13R1.12 Cc1cccc(C(C)NCC)c1Cl Amb24747458 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.12 Cc1cccc(C(C)NCC)c1I Amb24412309 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.12 Cc1cccc(C(C)\C=C\C)c1N Amb18647921 [0,2,0,0,0,0|1,0,1]=4 8043 B13R1.12 Cc1cccc(C(C)\C=C\C)c1O Amb25815797 [0,2,0,0,0,0|1,0,1]=4 8044 B13R1.12 Cc1cccc(C(N)CCC)c1N Amb25076670 [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.12 Cc1cccc(C(N)COC)c1Br Amb24341510 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.12 Cc1cccc(C(N)COC)c1C Amb18993063 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.12 Cc1cccc(C(N)COC)c1Cl Amb25711388 [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.12 Cc1cccc(C(N)COC)c1N Amb25077202 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.12 Cc1cccc(C(N)CSC)c1C Amb18300369 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.12 Cc1cccc(C(O)CCC)c1Cl Amb25126431 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.12 Cc1cccc(C(O)CCC)c1I Amb24673158 [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.12 Cc1cccc(C(O)CNC)c1Br Amb24724264 [0,2,0,0,0,0|1,0,0]=3 8053 B13R1.12 Cc1cccc(C(O)CNC)c1C Amb18997480 [0,2,0,0,0,0|1,0,0]=3 8054 B13R1.12 Cc1cccc(C(O)COC)c1C Amb18184753 [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.12 Cc1cccc(C(O)COC)c1F Amb25161168 [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.12 Cc1cccc(C(O)CSC)c1C Amb18325106 [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.12 Cc1cccc([C@@H](N)CCC)c1F Amb24707785 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.12 Cc1cccc([C@@H](N)CCC)c1N Amb25294670 [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.12 Cc1cccc([C@@H](N)CCC)c1O Amb25331732 [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.12 Cc1cccc([C@@H](N)COC)c1C Amb24533897 [0,2,0,0,0,0|2,0,0]=4 8061 B13R1.12 Cc1cccc([C@@H](O)CCC)c1Br Amb25779619 [0,2,0,0,0,0|2,0,0]=4 8062 B13R1.12 Cc1cccc([C@H](N)CCC)c1I Amb25751987 [0,2,0,0,0,0|2,0,0]=4 8063 B13R1.12 Cc1cccc([C@H](N)COC)c1Br Amb24447540 [0,2,0,0,0,0|2,0,0]=4 8064 B13R1.12 Cc1cccc([C@H](N)COC)c1C Amb25160673 [0,2,0,0,0,0|2,0,0]=4 8065 B13R1.12 Cc1cccc([C@H](N)COC)c1F Amb25265768 [0,2,0,0,0,0|2,0,0]=4 8066 B13R1.12 Cc1cccc([C@H](N)COC)c1I Amb25711259 [0,2,0,0,0,0|2,0,0]=4 8067 B13R1.12 Cc1cccc([C@H](N)COC)c1N Amb24604410 [0,2,0,0,0,0|2,0,0]=4 8068 B13R1.12 Cc1cccc([C@H](O)CCC)c1Br Amb25062953 [0,2,0,0,0,0|2,0,0]=4 8069 B13R1.12 Cc1cccc([C@H](O)CCC)c1F Amb24401430 [0,2,0,0,0,0|2,0,0]=4 8070 B13R1.12 Cc1cccc(c1Br)C(=O)CNC Amb24463728 [0,2,0,0,0,0|1,0,1]=4 8071 B13R1.12 Cc1cccc(c1F)C(=O)CNC Amb24685079 [0,2,0,0,0,0|1,0,1]=4 8072 B13R1.12 Cc1cccc(c1O)C(=O)CNC Amb25048342 [0,2,0,0,0,0|1,0,1]=4 8073 B13R1.18 CC#CCC(N)c1cc(Br)ccc1 Amb24730145 [0,2,0,0,0,0|2,0,0]=4 8074 B13R1.18 CC#CCC(N)c1cc(Cl)ccc1 Amb19062408 [0,2,0,0,0,0|2,0,0]=4 8075 B13R1.18 CC#CCC(N)c1cc(F)ccc1 Amb18988272 [0,2,0,0,0,0|2,0,0]=4 8076 B13R1.18 CC#CCC(N)c1cc(I)ccc1 Amb25158839 [0,2,0,0,0,0|2,0,0]=4 8077 B13R1.18 CC#CCC(O)c1cc(Cl)ccc1 Amb18324826 [0,2,0,0,0,0|2,0,0]=4 8078 B13R1.18 CC#CCC(O)c1cc(F)ccc1 Amb18804737 [0,2,0,0,0,0|2,0,0]=4 8079 B13R1.18 CC#CCC(O)c1cc(N)ccc1 Amb24358492 [0,2,0,0,0,0|2,0,0]=4 8080 B13R1.18 CC(CN=C=O)c1cccc(Br)c1 Amb25700029 [0,2,0,0,0,0|0,0,2]=4 8081 B13R1.18 CC(CN=C=O)c1cccc(F)c1 Amb24564951 [0,2,0,0,0,0|0,0,2]=4 8082 B13R1.18 CC(NCC#N)c1cccc(Br)c1 Amb18971223 [0,2,0,0,0,0|2,0,0]=4 8083 B13R1.18 CC(NCC#N)c1cccc(Cl)c1 Amb18971035 [0,2,0,0,0,0|2,0,0]=4 8084 B13R1.18 CC(NCC#N)c1cccc(F)c1 Amb18977437 [0,2,0,0,0,0|2,0,0]=4 8085 B13R1.18 CC(NCCN)c1cc(Br)ccc1 Amb19005485 [0,2,0,0,0,0|2,0,0]=4 8086 B13R1.18 CC(NCCN)c1cc(F)ccc1 Amb19005504 [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.18 CCCCC(N)c1cccc(O)c1 Amb24117966 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.18 CCNCC(=O)c1cc(N)ccc1 Amb18550939 [0,2,0,0,0,0|1,0,1]=4 8089 B13R1.18 CCNCC(=O)c1cccc(c1)Br Amb17315031 [0,2,0,0,0,0|1,0,1]=4 8090 B13R1.18 CCNCC(=O)c1cccc(c1)O Amb17594589 [0,2,0,0,0,0|1,0,1]=4 8091 B13R1.18 CCNCC(O)c1c[n]cc(Br)c1 Amb23586089 [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.18 CCNCC(c1cccc(c1)Br)O Amb17159561 [0,2,0,0,0,0|1,0,0]=3 8093 B13R1.18 CCNCC(c1cccc(c1)C)O Amb17138910 [0,2,0,0,0,0|1,0,0]=3 8094 B13R1.18 CCNCC(c1cccc(c1)Cl)O Amb17139772 [0,2,0,0,0,0|1,0,0]=3 8095 B13R1.18 CCNCC(c1cccc(c1)N)O Amb17594626 [0,2,0,0,0,0|1,0,0]=3 8096 B13R1.18 CCNCC(c1cccc(c1)O)O Amb1104311 [0,2,0,0,0,0|1,0,0]=3 8097 B13R1.18 CNCCC(=O)c1cccc(N)c1 Amb18862931 [0,2,0,0,0,0|1,0,1]=4 8098 B13R1.18 CNCCC(O)c1cccc(N)c1 Amb18862981 [0,2,0,0,0,0|1,0,0]=3 8099 B13R1.18 CNCCC(c1cccc(c1)C)C Amb17233365 [0,2,0,0,0,0|0,0,0]=2 8100 B13R1.18 CNCCC(c1cccc(c1)Cl)C Amb17236710 [0,2,0,0,0,0|0,0,0]=2 8101 B13R1.18 CNCCC(c1cccc(c1)F)C Amb17233845 [0,2,0,0,0,0|0,0,0]=2 8102 B13R1.18 CNCCN(C)c1c[n]cc(Br)c1 Amb24769624 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.18 CO\N=C\C(C)c1cccc(Br)c1 Amb24706394 [0,2,0,0,0,0|0,0,2]=4 8104 B13R1.18 CO\N=C\C(C)c1cccc(Cl)c1 Amb25105726 [0,2,0,0,0,0|0,0,2]=4 8105 B13R1.18 C[C@@H](NCC#C)c1cccc(Br)c1 Amb24718884 [0,2,0,0,0,0|1,0,1]=4 8106 B13R1.18 C[C@@H](NCC#C)c1cccc(F)c1 Amb25345336 [0,2,0,0,0,0|1,0,1]=4 8107 B13R1.18 C[C@@H](NCC#C)c1cccc(O)c1 Amb24448801 [0,2,0,0,0,0|1,0,1]=4 8108 B13R1.18 C[C@H](NCC#C)c1cccc(Br)c1 Amb25752061 [0,2,0,0,0,0|1,0,1]=4 8109 B13R1.18 C[C@H](NCC#N)c1cccc(Cl)c1 Amb25803228 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.18 C\C(=C\CNC)\c1cc(Br)ccc1 Amb25776959 [0,2,0,0,0,0|0,0,1]=3 8111 B13R1.18 C\C=C\CN(C)c1cccc(Br)c1 Amb25220480 [0,2,0,0,0,0|2,0,0]=4 8112 B13R1.18 C\C=C\CN(C)c1cccc(O)c1 Amb25680431 [0,2,0,0,0,0|2,0,0]=4 8113 B13R1.18 Cc1cccc(c1)C(C)SCC#C Amb24354038 [0,2,0,0,0,0|1,0,1]=4 8114 B13R1.18 Cc1cccc(c1)C(N)CC#CC Amb18183779 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.18 Cc1cccc(c1)C(O)CC#CC Amb18804026 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.18 Cc1cccc(c1)[C@@H](C)NCC#C Amb24676065 [0,2,0,0,0,0|1,0,1]=4 8117 B13R1.18 Cc1cccc(c1)[C@H](C)NCC#N Amb24691112 [0,2,0,0,0,0|2,0,0]=4 8118 B13R1.18 ClCCCN(c1cccc(c1)Br)C Amb17359054 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.18 ClCCCN(c1cccc(c1)C)C Amb17337270 [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.18 ClCCCN(c1cccc(c1)Cl)C Amb17340958 [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.18 ClCCCN(c1cccc(c1)F)C Amb17337714 [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.18 N#CNCC(O)c1cc(O)ccc1 Amb25112116 [0,2,0,0,0,0|1,0,1]=4 8123 B13R1.18 NCCCC(O)c1cccc(F)c1 Amb18066107 [0,2,0,0,0,0|2,0,0]=4 8124 B13R1.18 NCCCC(c1cccc(c1)Br)O Amb17256959 [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.18 NCCCC(c1cccc(c1)C)O Amb17233568 [0,2,0,0,0,0|2,0,0]=4 8126 B13R1.18 NCCCC(c1cccc(c1)Cl)O Amb17237037 [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.18 NCCCN(c1cccc(c1)Br)C Amb17059827 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.18 NCCCN(c1cccc(c1)Cl)C Amb17059627 [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.18 NCCOC(c1cccc(c1)C)C Amb17079426 [0,2,0,0,0,0|2,0,0]=4 8130 B13R1.18 NCCOC(c1cccc(c1)Cl)C Amb17079509 [0,2,0,0,0,0|2,0,0]=4 8131 B13R1.18 NCCOC(c1cccc(c1)F)C Amb17079471 [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.18 OCCCN(c1cccc(c1)Br)C Amb17349694 [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.18 OCCCN(c1cccc(c1)C)C Amb17335360 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.18 OCCCN(c1cccc(c1)Cl)C Amb17337504 [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.18 OCCCN(c1cccc(c1)F)C Amb17335631 [0,2,0,0,0,0|2,0,0]=4 8136 B13R1.22 CC(C(=O)NO)c1cccc(Br)c1 Amb25099255 [0,2,0,0,0,0|1,0,1]=4 8137 B13R1.22 CC(C(=O)NO)c1cccc(Cl)c1 Amb24505440 [0,2,0,0,0,0|1,0,1]=4 8138 B13R1.22 CC(C(Br)CC)c1cc(F)ccc1 Amb25191908 [0,2,0,0,0,0|1,0,0]=3 8139 B13R1.22 CC(C(Cl)CC)c1cc(Br)ccc1 Amb25670385 [0,2,0,0,0,0|1,0,0]=3 8140 B13R1.22 CC(C(Cl)CC)c1cc(Cl)ccc1 Amb25302707 [0,2,0,0,0,0|1,0,0]=3 8141 B13R1.22 CC(C(Cl)CC)c1cc(F)ccc1 Amb24411264 [0,2,0,0,0,0|1,0,0]=3 8142 B13R1.22 CC(C(N)CC)c1cc(Br)ccc1 Amb18156155 [0,2,0,0,0,0|1,0,0]=3 8143 B13R1.22 CC(C(N)CC)c1cc(Cl)ccc1 Amb18812026 [0,2,0,0,0,0|1,0,0]=3 8144 B13R1.22 CC(CC)C(Cl)c1cccc(F)c1 Amb24413095 [0,2,0,0,0,0|2,0,0]=4 8145 B13R1.22 CC(CC)C(N)c1cccc(Cl)c1 Amb25280336 [0,2,0,0,0,0|2,0,0]=4 8146 B13R1.22 CC(CC)C(N)c1cccc(I)c1 Amb24459640 [0,2,0,0,0,0|2,0,0]=4 8147 B13R1.22 CC(CC)C(O)c1cccc(I)c1 Amb25763175 [0,2,0,0,0,0|2,0,0]=4 8148 B13R1.22 CC(CC)C(O)c1cccc(N)c1 Amb25083585 [0,2,0,0,0,0|2,0,0]=4 8149 B13R1.22 CC(CC)[C@@H](N)c1cccc(Cl)c1 Amb25264908 [0,2,0,0,0,0|2,0,0]=4 8150 B13R1.22 CC(CC)[C@H](N)c1cccc(Br)c1 Amb24694438 [0,2,0,0,0,0|2,0,0]=4 8151 B13R1.22 CC(CC)[C@H](N)c1cccc(Cl)c1 Amb24565914 [0,2,0,0,0,0|2,0,0]=4 8152 B13R1.22 CC(CC)[C@H](N)c1cccc(I)c1 Amb24550215 [0,2,0,0,0,0|2,0,0]=4 8153 B13R1.22 CC(CN)C(C)c1cccc(Cl)c1 Amb25101190 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.22 CC(CN)C(C)c1cccc(F)c1 Amb25117804 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.22 CC(NC)C(C)c1cccc(F)c1 Amb24695040 [0,2,0,0,0,0|0,0,0]=2 8156 B13R1.22 CC(NC)C(O)c1cccc(N)c1 Amb24663100 [0,2,0,0,0,0|1,0,0]=3 8157 B13R1.22 CCC(=O)C(C)c1cccc(Cl)c1 Amb25334147 [0,2,0,0,0,0|1,0,1]=4 8158 B13R1.22 CCC(=O)C(C)c1cccc(F)c1 Amb25730418 [0,2,0,0,0,0|1,0,1]=4 8159 B13R1.22 CCC(N)C(N)c1cccc(Br)c1 Amb24699715 [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.22 CCC(N)C(O)c1cc(I)ccc1 Amb25037244 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.22 CCC(O)C(N)c1cccc(Br)c1 Amb25356130 [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.22 CCC(O)C(N)c1cccc(Cl)c1 Amb24576898 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.22 CCC(O)C(N)c1cccc(I)c1 Amb25686209 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.22 CCC(O)C(N)c1cccc(O)c1 Amb25072474 [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.22 CCC(O)C(O)c1cccc(Cl)c1 Amb25090781 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.22 CCC(O)C(O)c1cccc(F)c1 Amb24344685 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.22 CCS(=O)C(C)c1cccc(Br)c1 Amb25317085 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.22 CCS(=O)C(C)c1cccc(F)c1 Amb25284042 [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.22 CC[C@@H](N)[C@@H](O)c1cc(N)ccc1 Amb24678304 [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(Br)ccc1 Amb24542963 [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(O)ccc1 Amb25327896 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(O)c1 Amb24397000 [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(Br)c1 Amb25269654 [0,2,0,0,0,0|2,0,0]=4 8174 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(Cl)c1 Amb25258552 [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(I)c1 Amb24542639 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(F)ccc1 Amb25200286 [0,2,0,0,0,0|2,0,0]=4 8177 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(O)ccc1 Amb24610155 [0,2,0,0,0,0|2,0,0]=4 8178 B13R1.22 CC[C@H](N)[C@H](O)c1cc(Br)ccc1 Amb24542747 [0,2,0,0,0,0|2,0,0]=4 8179 B13R1.22 CC[C@H](N)[C@H](O)c1cc(O)ccc1 Amb25258553 [0,2,0,0,0,0|2,0,0]=4 8180 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(I)c1 Amb25180113 [0,2,0,0,0,0|2,0,0]=4 8181 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(O)c1 Amb25848499 [0,2,0,0,0,0|2,0,0]=4 8182 B13R1.22 CN(C(=N)NC)c1cccc(F)c1 Amb18185010 [0,2,0,0,0,0|1,0,1]=4 8183 B13R1.22 CN(C(=O)NC)c1cccc(N)c1 Amb25052138 [0,2,0,0,0,0|1,0,1]=4 8184 B13R1.22 CN(C(=O)NC)c1cccc(O)c1 Amb24623282 [0,2,0,0,0,0|1,0,1]=4 8185 B13R1.22 CN(C(=S)NC)c1cccc(F)c1 Amb25155855 [0,2,0,0,0,0|1,0,1]=4 8186 B13R1.22 CN(C(C)CC)c1cccc(O)c1 Amb25057287 [0,2,0,0,0,0|2,0,0]=4 8187 B13R1.22 CN(CC)C(C)c1cccc(F)c1 Amb25802681 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.22 CN(CC)C(C)c1cccc(N)c1 Amb18973982 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.22 CN(OC)C(C)c1cccc(N)c1 Amb18973985 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.22 CNC(=O)C(C)c1cccc(Cl)c1 Amb25804173 [0,2,0,0,0,0|0,0,1]=3 8191 B13R1.22 CNC(=O)C(C)c1cccc(N)c1 Amb25071108 [0,2,0,0,0,0|0,0,1]=3 8192 B13R1.22 CNC(=O)C(Cl)c1cccc(I)c1 Amb24693230 [0,2,0,0,0,0|1,0,1]=4 8193 B13R1.22 CNC(=O)C(N)c1cccc(Cl)c1 Amb25833191 [0,2,0,0,0,0|1,0,1]=4 8194 B13R1.22 CNC(=O)C(N)c1cccc(F)c1 Amb24459874 [0,2,0,0,0,0|1,0,1]=4 8195 B13R1.22 CNC(=O)C(O)c1cccc(Br)c1 Amb24704267 [0,2,0,0,0,0|1,0,1]=4 8196 B13R1.22 CNC(=O)C(O)c1cccc(F)c1 Amb24439436 [0,2,0,0,0,0|1,0,1]=4 8197 B13R1.22 CNC(=O)[C@@H](N)c1cccc(F)c1 Amb25287035 [0,2,0,0,0,0|1,0,1]=4 8198 B13R1.22 CNC(C(=O)c1cccc(c1)C)C Amb17617552 [0,2,0,0,0,0|1,0,1]=4 8199 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,2,0,0,0,0|1,0,1]=4 8200 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb22055294 [0,2,0,0,0,0|1,0,1]=4 8201 B13R1.22 COC(=O)C(C)c1cccc(Br)c1 Amb24183608 [0,2,0,0,0,0|1,0,1]=4 8202 B13R1.22 COC(=O)C(C)c1cccc(Cl)c1 Amb18331146 [0,2,0,0,0,0|1,0,1]=4 8203 B13R1.22 COC(=O)C(C)c1cccc(F)c1 Amb18185421 [0,2,0,0,0,0|1,0,1]=4 8204 B13R1.22 COC(=O)C(C)c1cccc(I)c1 Amb25085006 [0,2,0,0,0,0|1,0,1]=4 8205 B13R1.22 COC(=O)C(C)c1cccc(N)c1 Amb18128401 [0,2,0,0,0,0|1,0,1]=4 8206 B13R1.22 COC(=O)[C@@H](C)c1cccc(N)c1 Amb24182085 [0,2,0,0,0,0|1,0,1]=4 8207 B13R1.22 COC(=O)[C@H](C)c1cccc(O)c1 Amb25371828 [0,2,0,0,0,0|1,0,1]=4 8208 B13R1.22 C[C@@H](NC)[C@@H](O)c1cccc(F)c1 Amb25258576 [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.22 C[C@@H](NC)[C@@H](O)c1cccc(N)c1 Amb24739849 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.22 C[C@H](NC)[C@H](O)c1cc(O)ccc1 Amb24697532 [0,2,0,0,0,0|1,0,0]=3 8211 B13R1.22 Cc1cc(ccc1)C(C)C(=O)OC Amb18804749 [0,2,0,0,0,0|1,0,1]=4 8212 B13R1.22 Cc1cc(ccc1)C(Cl)C(=O)NC Amb19083266 [0,2,0,0,0,0|1,0,1]=4 8213 B13R1.22 Cc1cc(ccc1)C(O)C(=O)NC Amb25695140 [0,2,0,0,0,0|1,0,1]=4 8214 B13R1.22 Cc1cc(ccc1)N(C)C(=N)NC Amb18184203 [0,2,0,0,0,0|1,0,1]=4 8215 B13R1.22 Cc1cc(ccc1)N(C)C(=O)NC Amb24534567 [0,2,0,0,0,0|1,0,1]=4 8216 B13R1.22 Cc1cc(ccc1)[C@H](O)[C@@H](N)CC Amb24559269 [0,2,0,0,0,0|2,0,0]=4 8217 B13R1.22 Cc1cc(ccc1)[C@H](O)[C@H](N)CC Amb25366508 [0,2,0,0,0,0|2,0,0]=4 8218 B13R1.22 Cc1cccc(c1)C(C)C(Cl)CC Amb25131795 [0,2,0,0,0,0|1,0,0]=3 8219 B13R1.22 Cc1cccc(c1)C(C)C(N)CC Amb18195745 [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.22 Cc1cccc(c1)C(C)S(=O)CC Amb25105579 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.22 Cc1cccc(c1)C(N)C(C)CC Amb25696275 [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.22 Cc1cccc(c1)C(N)C(N)CC Amb24548687 [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.22 Cc1cccc(c1)C(O)C(C)OC Amb24413096 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.22 Cc1cccc(c1)[C@H](N)C(C)CC Amb24747056 [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.22 Cc1cccc(c1)[C@H](N)[C@@H](N)CC Amb25202150 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.30 CC#CC(C)(O)c1cccc(Br)c1 Amb24442563 [0,2,0,0,0,0|1,0,1]=4 8227 B13R1.30 CC#CC(C)(O)c1cccc(F)c1 Amb25733647 [0,2,0,0,0,0|1,0,1]=4 8228 B13R1.30 CC(C)(CC=O)c1cccc(Cl)c1 Amb25835615 [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.30 CC(C)(CNC)c1cccc(F)c1 Amb18993432 [0,2,0,0,0,0|0,0,0]=2 8230 B13R1.30 CC(C)(COC)c1cccc(Br)c1 Amb24496305 [0,2,0,0,0,0|1,0,0]=3 8231 B13R1.30 CC(C)(NCC)c1cccc(Cl)c1 Amb25344615 [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.30 CC(F)(CC#N)c1cc(F)ccc1 Amb25084247 [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.30 CC(F)(CCN)c1cc(F)ccc1 Amb25795445 [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.30 CC(N)(CC#N)c1cccc(Br)c1 Amb24667734 [0,2,0,0,0,0|2,0,0]=4 8235 B13R1.30 CC(N)(CC=C)c1cccc(Cl)c1 Amb24659612 [0,2,0,0,0,0|1,0,1]=4 8236 B13R1.30 CC(N)(CC=C)c1cccc(F)c1 Amb25069787 [0,2,0,0,0,0|1,0,1]=4 8237 B13R1.30 CC(N)(CC=C)c1cccc(O)c1 Amb25782952 [0,2,0,0,0,0|1,0,1]=4 8238 B13R1.30 CC(N)(CCO)c1cc(Br)ccc1 Amb18872958 [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.30 CC(N)(CCO)c1cc(Cl)ccc1 Amb18225027 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.30 CC(N)(COC)c1cccc(Br)c1 Amb24685075 [0,2,0,0,0,0|1,0,0]=3 8241 B13R1.30 CC(N)(COC)c1cccc(Cl)c1 Amb18992598 [0,2,0,0,0,0|1,0,0]=3 8242 B13R1.30 CC(N)(COC)c1cccc(F)c1 Amb18299357 [0,2,0,0,0,0|1,0,0]=3 8243 B13R1.30 CC(O)(CC#C)c1cccc(Br)c1 Amb24437875 [0,2,0,0,0,0|1,0,1]=4 8244 B13R1.30 CC(O)(CC#C)c1cccc(F)c1 Amb25134527 [0,2,0,0,0,0|1,0,1]=4 8245 B13R1.30 CC(O)(CC#N)c1cccc(Cl)c1 Amb24361617 [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.30 CC(O)(CC=C)c1cccc(Cl)c1 Amb24703581 [0,2,0,0,0,0|1,0,1]=4 8247 B13R1.30 CC(O)(CC=O)c1cccc(Cl)c1 Amb24644353 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.30 CC(O)(CCN)c1cc(Cl)ccc1 Amb18066532 [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.30 CC(O)(CCN)c1cc(F)ccc1 Amb18066117 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.30 CC(O)(CNC)c1cccc(Br)c1 Amb18301256 [0,2,0,0,0,0|0,0,0]=2 8251 B13R1.30 CC(O)(CNC)c1cccc(Cl)c1 Amb18301258 [0,2,0,0,0,0|0,0,0]=2 8252 B13R1.30 CC(O)(CNC)c1cccc(F)c1 Amb18997537 [0,2,0,0,0,0|0,0,0]=2 8253 B13R1.30 CC(O)(COC)c1cccc(Cl)c1 Amb18333909 [0,2,0,0,0,0|1,0,0]=3 8254 B13R1.30 CC(O)(COC)c1cccc(F)c1 Amb18328474 [0,2,0,0,0,0|1,0,0]=3 8255 B13R1.30 CCCC(C)(O)c1cc(O)ccc1 Amb24633334 [0,2,0,0,0,0|1,0,0]=3 8256 B13R1.30 CNCC(F)(F)c1cc(F)ccc1 Amb25373597 [0,2,0,0,0,0|1,0,0]=3 8257 B13R1.30 CNCC(c1cccc(c1)Br)(C)C Amb17255975 [0,2,0,0,0,0|0,0,0]=2 8258 B13R1.30 CNCC(c1cccc(c1)C)(C)C Amb17233333 [0,2,0,0,0,0|0,0,0]=2 8259 B13R1.30 CNCC(c1cccc(c1)Cl)(C)C Amb17236694 [0,2,0,0,0,0|0,0,0]=2 8260 B13R1.30 COCC(C)(N)c1c[n]cc(F)c1 Amb18992597 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.30 COCC(C)(O)c1c[n]cc(F)c1 Amb19075190 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.30 C[C@@](N)(CC#N)c1cccc(Br)c1 Amb24441704 [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.30 C[C@@](N)(CC=C)c1cc(N)ccc1 Amb25669202 [0,2,0,0,0,0|1,0,1]=4 8264 B13R1.30 C[C@@](N)(CC=C)c1cccc(F)c1 Amb24445132 [0,2,0,0,0,0|1,0,1]=4 8265 B13R1.30 C[C@@](N)(CCO)c1cc(Br)ccc1 Amb25103240 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.30 C[C@@](N)(CCO)c1cc(S)ccc1 Amb24490752 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.30 C[C@](N)(CC#N)c1cccc(F)c1 Amb25760130 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.30 C[C@](N)(CC=C)c1cccc(Cl)c1 Amb25244139 [0,2,0,0,0,0|1,0,1]=4 8269 B13R1.30 C[C@](N)(CC=C)c1cccc(F)c1 Amb25126882 [0,2,0,0,0,0|1,0,1]=4 8270 B13R1.30 C[C@](N)(CCO)c1cc(F)ccc1 Amb25097176 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.30 C[C@](N)(CCO)c1cc(S)ccc1 Amb25775972 [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.30 C[Si](C)(CNC)c1cccc(Cl)c1 Amb25770560 [0,2,0,0,0,0|0,1,0]=3 8273 B13R1.30 Cc1c[n]cc(c1)C(C)(N)COC Amb25686393 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.30 Cc1c[n]cc(c1)C(C)(O)CCC Amb24359577 [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.30 Cc1c[n]cc(c1)C(C)(O)COC Amb24763254 [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.30 Cc1cccc(c1)C(C)(C)CC=C Amb24493822 [0,2,0,0,0,0|1,0,1]=4 8277 B13R1.30 Cc1cccc(c1)C(C)(C)CCO Amb24495975 [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.30 Cc1cccc(c1)C(C)(C)NCC Amb24719382 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.30 Cc1cccc(c1)C(C)(N)CCO Amb18862952 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.30 Cc1cccc(c1)C(C)(N)COC Amb18992594 [0,2,0,0,0,0|1,0,0]=3 8281 B13R1.30 Cc1cccc(c1)C(C)(O)CC#C Amb25341545 [0,2,0,0,0,0|1,0,1]=4 8282 B13R1.30 Cc1cccc(c1)C(C)(O)CC#N Amb25699747 [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.30 Cc1cccc(c1)C(C)(O)CC=O Amb24445765 [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.30 Cc1cccc(c1)C(C)(O)CCN Amb18564113 [0,2,0,0,0,0|2,0,0]=4 8285 B13R1.30 Cc1cccc(c1)C(C)(O)CNC Amb18997534 [0,2,0,0,0,0|0,0,0]=2 8286 B13R1.30 Cc1cccc(c1)C(C)(O)COC Amb18186606 [0,2,0,0,0,0|1,0,0]=3 8287 B13R1.30 Cc1cccc(c1)[C@@](C)(N)CC#N Amb25667724 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.30 Cc1cccc(c1)[C@@](C)(N)CC=C Amb24717032 [0,2,0,0,0,0|1,0,1]=4 8289 B13R1.30 Cc1cccc(c1)[C@@](C)(O)CCO Amb24630768 [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.30 Cc1cccc(c1)[C@](C)(N)CC=C Amb24731752 [0,2,0,0,0,0|1,0,1]=4 8291 B13R1.30 NCCC(c1cccc(c1)Br)(C)C Amb17255973 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.30 NCCC(c1cccc(c1)C)(C)C Amb17233332 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.30 NCCC(c1cccc(c1)Cl)(C)C Amb17236693 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.147 CC(=C)CC(Cl)c1cc(Cl)ccc1 Amb25278291 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.147 CC(=C)CC(N)c1cccc(Br)c1 Amb24436151 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.147 CC(=C)CC(N)c1cccc(Cl)c1 Amb25833922 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.147 CC(=C)CC(N)c1cccc(F)c1 Amb24689876 [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.147 CC(=C)CC(N)c1cccc(I)c1 Amb25161348 [0,2,0,0,0,0|2,0,0]=4 8299 B13R1.147 CC(=C)CC(O)c1cccc(Br)c1 Amb25052701 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.147 CC(=C)CC(O)c1cccc(Cl)c1 Amb24655318 [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.147 CC(=C)CC(O)c1cccc(I)c1 Amb25345270 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.147 CC(=C)CC(O)c1cccc(N)c1 Amb25753367 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.147 CC(=C)CN(C)c1cccc(F)c1 Amb24632835 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.147 CC(=C)C[C@@H](N)c1cccc(I)c1 Amb25252214 [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.147 CC(=N)NC(C)c1cccc(Br)c1 Amb25128441 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.147 CC(=O)CC(C)c1c[n]cc(F)c1 Amb24465169 [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.147 CC(=O)CC(C)c1cccc(F)c1 Amb25719077 [0,2,0,0,0,0|1,0,0]=3 8308 B13R1.147 CC(=O)CC(O)c1cccc(Br)c1 Amb24464735 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.147 CC(=O)CC(O)c1cccc(F)c1 Amb25369345 [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.147 CC(=O)CN(C)c1cccc(F)c1 Amb18791228 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.147 CC(=O)C[C@H](O)c1cccc(Br)c1 Amb24593557 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.147 CC(=O)C[C@H](O)c1cccc(Cl)c1 Amb24533369 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.147 CC(=O)NC(C)c1cc(N)ccc1 Amb21959592 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.147 CC(=O)NC(C)c1cccc(O)c1 Amb25823431 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.147 CC(=O)NC(c1cccc(c1)Br)C Amb14005116 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.147 CC(=O)NC(c1cccc(c1)Cl)C Amb10666947 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.147 CC(=O)NC(c1cccc(c1)F)C Amb10667278 [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.147 CC(=O)NC(c1cccc(c1)N)C Amb1089732 [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.147 CC(=O)NC(c1cccc(c1)N)C Amb2099817 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.147 CC(=O)N[C@@H](C)c1cccc(Br)c1 Amb25787630 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.147 CC(=O)N[C@@H](C)c1cccc(F)c1 Amb24354509 [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.147 CC(=O)N[C@@H](C)c1cccc(O)c1 Amb24529355 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.147 CC(=O)OC(C)c1cccc(O)c1 Amb25712940 [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.147 CC(=O)O[C@@H](C)c1cccc(Br)c1 Amb24720583 [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.147 CC(=O)O[C@@H](C)c1cccc(F)c1 Amb24525305 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.147 CC(=O)O[C@H](C)c1cccc(O)c1 Amb24364063 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.147 CC(C)CC(Cl)c1cccc(Cl)c1 Amb24416074 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.147 CC(C)CC(N)c1cccc(Br)c1 Amb24664836 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.147 CC(C)CC(N)c1cccc(I)c1 Amb24592006 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.147 CC(C)CC(O)c1cccc(I)c1 Amb24710801 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.147 CC(C)CC(O)c1cccc(N)c1 Amb25302555 [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.147 CC(C)C[C@@H](N)c1cccc(Br)c1 Amb24604774 [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.147 CC(C)C[C@@H](N)c1cccc(Cl)c1 Amb25314563 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.147 CC(C)C[C@@H](N)c1cccc(I)c1 Amb25366536 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.147 CC(C)C[C@H](N)c1cccc(F)c1 Amb24642030 [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.147 CC(C)NC(C)c1cccc(N)c1 Amb24489399 [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.147 CC(C)N[C@@H](C)c1cccc(Cl)c1 Amb24534087 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.147 CC(C)N[C@@H](C)c1cccc(O)c1 Amb25822828 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.147 CC(C)N[C@H](C)c1cccc(Br)c1 Amb24688533 [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.147 CC(C)N[C@H](C)c1cccc(Cl)c1 Amb24705060 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.147 CC(C)N[C@H](C)c1cccc(F)c1 Amb25044122 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.147 CC(C)N[C@H](C)c1cccc(O)c1 Amb24473864 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.147 CC(C)OC(C)c1cccc(N)c1 Amb18292843 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.147 CC(C)SC(C)c1cccc(Cl)c1 Amb24473865 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.147 CC(C)SC(C)c1cccc(N)c1 Amb18973996 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.147 CC(CC(C)N)c1cc(Cl)ccc1 Amb25815215 [0,2,0,0,0,0|1,0,0]=3 8347 B13R1.147 CC(CC(C)O)c1cc(Cl)ccc1 Amb25852925 [0,2,0,0,0,0|1,0,0]=3 8348 B13R1.147 CC(CC(C)O)c1cc(F)c[n]c1 Amb25129757 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.147 CC(CC(O)=O)c1cc(O)ccc1 Amb18128622 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.147 CC(CC(c1cccc(c1)Br)O)C Amb17256425 [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.147 CC(CC(c1cccc(c1)C)N)C Amb17233362 [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.147 CC(CC(c1cccc(c1)C)O)C Amb17233448 [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.147 CC(CC(c1cccc(c1)Cl)N)C Amb17236707 [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.147 CC(CC(c1cccc(c1)Cl)O)C Amb17236853 [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.147 CC(CC(c1cccc(c1)F)N)C Amb17233842 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.147 CC(CC(c1cccc(c1)F)O)C Amb17233923 [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.147 CC(CN(c1cccc(c1)Br)C)O Amb17349693 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.147 CC(CN(c1cccc(c1)C)C)N Amb17059698 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.147 CC(CN(c1cccc(c1)C)C)O Amb17335359 [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.147 CC(CN(c1cccc(c1)Cl)C)N Amb17059704 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.147 CC(CN(c1cccc(c1)Cl)C)O Amb17337503 [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.147 CC(CN(c1cccc(c1)F)C)N Amb17059701 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.147 CC(CN(c1cccc(c1)F)C)O Amb17335630 [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.147 CC(N)CC(O)c1cc(Br)ccc1 Amb24614342 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.147 CC(N)CC(O)c1cc(F)ccc1 Amb25205509 [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.147 CN(C)CC(=O)c1cccc(I)c1 Amb25155324 [0,2,0,0,0,0|1,0,1]=4 8367 B13R1.147 CN(C)CC(=O)c1cccc(O)c1 Amb25094482 [0,2,0,0,0,0|1,0,1]=4 8368 B13R1.147 CN(C)CC(F)c1cccc(N)c1 Amb25256341 [0,2,0,0,0,0|1,0,0]=3 8369 B13R1.147 CN(C)CC(F)c1cccc(O)c1 Amb25214597 [0,2,0,0,0,0|1,0,0]=3 8370 B13R1.147 CN(C)CC(N)c1c[n]cc(F)c1 Amb24442016 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.147 CN(C)CC(N)c1cccc(Cl)c1 Amb24489907 [0,2,0,0,0,0|1,0,0]=3 8372 B13R1.147 CN(C)CC(O)c1cccc(F)c1 Amb25180719 [0,2,0,0,0,0|1,0,0]=3 8373 B13R1.147 CN(C)C[C@@H](O)c1cc(O)ccc1 Amb25759619 [0,2,0,0,0,0|1,0,0]=3 8374 B13R1.147 CN(C)C[C@H](O)c1cccc(Cl)c1 Amb25357661 [0,2,0,0,0,0|1,0,0]=3 8375 B13R1.147 CN(C)NC(C)c1cccc(Br)c1 Amb24529684 [0,2,0,0,0,0|1,0,0]=3 8376 B13R1.147 CN(C)NC(C)c1cccc(Cl)c1 Amb24357904 [0,2,0,0,0,0|1,0,0]=3 8377 B13R1.147 CN(CC(=O)c1cccc(c1)N)C Amb17090521 [0,2,0,0,0,0|1,0,1]=4 8378 B13R1.147 CN(CC(C)C)c1cccc(Br)c1 Amb25756636 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.147 CN(CC(C)N)c1cccc(Br)c1 Amb25854978 [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.147 CN(CC(C)N)c1cccc(O)c1 Amb25307115 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.147 CN(CC(C)O)c1cccc(N)c1 Amb18296386 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.147 CN(CC(c1cccc(c1)Br)Cl)C Amb17548303 [0,2,0,0,0,0|1,0,0]=3 8383 B13R1.147 CN(CC(c1cccc(c1)Br)O)C Amb17104306 [0,2,0,0,0,0|1,0,0]=3 8384 B13R1.147 CN(CC(c1cccc(c1)C)O)C Amb17104283 [0,2,0,0,0,0|1,0,0]=3 8385 B13R1.147 CN(CC(c1cccc(c1)Cl)O)C Amb17104291 [0,2,0,0,0,0|1,0,0]=3 8386 B13R1.147 CN(CC(c1cccc(c1)N)O)C Amb17090543 [0,2,0,0,0,0|1,0,0]=3 8387 B13R1.147 CN(CC(c1cccc(c1)O)O)C Amb17307593 [0,2,0,0,0,0|1,0,0]=3 8388 B13R1.147 CS(=O)CC(O)c1cccc(Cl)c1 Amb22446270 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.147 CS(=O)NC(C)c1cccc(N)c1 Amb24536641 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.147 CS(=O)NC(C)c1cccc(O)c1 Amb25177265 [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.147 Cc1c[n]cc(c1)C(C)CC(C)O Amb24540476 [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.147 Cc1c[n]cc(c1)C(N)CN(C)C Amb25757207 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.147 Cc1c[n]cc(c1)C(O)CN(C)C Amb25678148 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.147 Cc1cc(ccc1)[C@@H](C)CC(O)=O Amb24391487 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.147 Cc1cc(ccc1)[C@H](C)CC(O)=O Amb25774483 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.147 Cc1cc(ccc1)\C(\C)=N/N(C)C Amb24719076 [0,2,0,0,0,0|1,0,1]=4 8397 B13R1.147 Cc1cccc(c1)C(C)CC(C)=O Amb24430310 [0,2,0,0,0,0|1,0,0]=3 8398 B13R1.147 Cc1cccc(c1)C(C)CC(C)N Amb25098579 [0,2,0,0,0,0|1,0,0]=3 8399 B13R1.147 Cc1cccc(c1)C(C)CC(C)O Amb25296262 [0,2,0,0,0,0|1,0,0]=3 8400 B13R1.147 Cc1cccc(c1)C(C)OC(C)=O Amb24530231 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.147 Cc1cccc(c1)C(N)CN(C)C Amb18975548 [0,2,0,0,0,0|1,0,0]=3 8402 B13R1.147 Cc1cccc(c1)C(O)CC(C)=O Amb25298405 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.147 Cc1cccc(c1)N(C)CC(C)=O Amb18178409 [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.147 Cc1cccc(c1)N(C)CC(C)C Amb24613688 [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.147 Cc1cccc(c1)N(C)C[C@H](C)N Amb25125125 [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.147 Cc1cccc(c1)N(C)C[C@H](C)O Amb25764143 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)=O Amb25099533 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C Amb25789175 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.147 Cc1cccc(c1)[C@@H](N)CC(C)C Amb24567844 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.147 Cc1cccc(c1)[C@H](C)OC(C)=O Amb25115848 [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.147 NC(=O)CC(c1cccc(c1)C)C Amb17233288 [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.147 NC(=O)CC(c1cccc(c1)Cl)C Amb17236669 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.147 NC(=O)CC(c1cccc(c1)F)C Amb17233790 [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.147 OC(=O)CC(c1cccc(c1)Br)C Amb10844377 [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.147 OC(=O)CC(c1cccc(c1)C)C Amb17233412 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.147 OC(=O)CC(c1cccc(c1)Cl)C Amb17236836 [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.446 CC(CC#N)c1cc(Cl)ccc1Cl Amb24449978 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.446 CC(CC#N)c1cc(O)ccc1O Amb24646582 [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.446 CC(CC=O)c1cc(F)ccc1Cl Amb24638296 [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.446 CC(CCN)c1cc(Br)ccc1F Amb25090197 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.446 CC(CCN)c1cc(Cl)ccc1F Amb18894779 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.446 CC(CCN)c1cc(F)ccc1Cl Amb24471865 [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.446 CC(CCN)c1cc(F)ccc1F Amb18981391 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.446 CC(c1cc(C)ccc1C)CCCl Amb17236531 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.446 CC(c1cc(C)ccc1C)CCO Amb17233466 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.446 CCCC(Br)c1cc(Br)ccc1Br Amb25051491 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.446 CCCC(C)c1cc(Cl)c[n]c1N Amb25711064 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.446 CCCC(C)c1cc(F)ccc1O Amb24614268 [0,2,0,0,0,0|1,0,0]=3 8429 B13R1.446 CCCC(C)c1cc(O)ccc1O Amb25112534 [0,2,0,0,0,0|1,0,0]=3 8430 B13R1.446 CCCC(Cl)c1cc(Br)ccc1F Amb25800440 [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.446 CCCC(N)c1cc(Br)ccc1Cl Amb24681725 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.446 CCCC(N)c1cc(Br)ccc1F Amb18940359 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.446 CCCC(N)c1cc(Br)ccc1I Amb24641436 [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.446 CCCC(N)c1cc(Cl)ccc1I Amb24376224 [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.446 CCCC(N)c1cc(Cl)ccc1N Amb24599336 [0,2,0,0,0,0|2,0,0]=4 8436 B13R1.446 CCCC(N)c1cc(Cl)ccc1O Amb18275472 [0,2,0,0,0,0|2,0,0]=4 8437 B13R1.446 CCCC(N)c1cc(F)ccc1O Amb18941520 [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.446 CCCC(N)c1cc(I)ccc1Br Amb25293977 [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.446 CCCC(N)c1cc(I)ccc1F Amb24643409 [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.446 CCCC(N)c1cc(N)ccc1N Amb25715901 [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.446 CCCC(N)c1cc(O)ccc1F Amb25160638 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.446 CCCC(O)c1cc(Br)ccc1Br Amb25854540 [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.446 CCCC(O)c1cc(Br)ccc1Cl Amb25159224 [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.446 CCCC(O)c1cc(Br)ccc1F Amb24362895 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.446 CCCC(O)c1cc(Br)ccc1N Amb25758566 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.446 CCCC(O)c1cc(Cl)ccc1F Amb25088939 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.446 CCCC(O)c1cc(Cl)ccc1I Amb24354662 [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.446 CCCC(O)c1cc(F)ccc1Br Amb25043916 [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.446 CCCC(O)c1cc(F)ccc1Cl Amb25710800 [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.446 CCCC(O)c1cc(F)ccc1N Amb24377323 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.446 CCCC(O)c1cc(O)ccc1Br Amb25826199 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.446 CCCC(c1cc(C)ccc1C)Cl Amb17139644 [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.446 CCCC(c1cc(C)ccc1C)O Amb17138885 [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.446 CCCC(c1cc(F)ccc1F)O Amb17194583 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.446 CCCN(C)c1cc(C)ccc1C Amb25344497 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.446 CCCN(C)c1cc(F)ccc1N Amb18297593 [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1Br Amb24454747 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1F Amb25696594 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1I Amb24741644 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1N Amb24710766 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.446 CCC[C@@H](N)c1cc(Br)ccc1O Amb24342429 [0,2,0,0,0,0|2,0,0]=4 8462 B13R1.446 CCC[C@@H](N)c1cc(Cl)ccc1Br Amb24664385 [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.446 CCC[C@@H](N)c1cc(Cl)ccc1Cl Amb24451627 [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.446 CCC[C@@H](N)c1cc(Cl)ccc1N Amb24531733 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1Br Amb24399848 [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1Cl Amb24419012 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1F Amb24376635 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.446 CCC[C@@H](N)c1cc(F)ccc1N Amb24753219 [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.446 CCC[C@@H](N)c1cc(I)ccc1Br Amb25055753 [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.446 CCC[C@@H](N)c1cc(I)ccc1F Amb25275810 [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.446 CCC[C@@H](N)c1cc(I)ccc1I Amb25301868 [0,2,0,0,0,0|2,0,0]=4 8472 B13R1.446 CCC[C@@H](N)c1cc(N)ccc1F Amb24407234 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.446 CCC[C@@H](N)c1cc(N)ccc1N Amb25121792 [0,2,0,0,0,0|2,0,0]=4 8474 B13R1.446 CCC[C@@H](N)c1cc(N)ccc1O Amb25760139 [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1N Amb25295302 [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.446 CCC[C@@H](N)c1cc(O)ccc1O Amb25245247 [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.446 CCC[C@@H](O)c1cc(Br)ccc1F Amb24740347 [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.446 CCC[C@@H](O)c1cc(Cl)ccc1Br Amb25711359 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.446 CCC[C@@H](O)c1cc(F)ccc1Br Amb25304184 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.446 CCC[C@@H](O)c1cc(O)ccc1Br Amb25329733 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.446 CCC[C@H](N)c1cc(C)ccc1C Amb25068413 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.446 CCC[C@H](N)c1cc(Cl)ccc1F Amb24357487 [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.446 CCC[C@H](N)c1cc(I)ccc1F Amb24526472 [0,2,0,0,0,0|2,0,0]=4 8484 B13R1.446 CCC[C@H](N)c1cc(I)ccc1I Amb25800099 [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.446 CCC[C@H](N)c1cc(I)ccc1O Amb24666485 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.446 CCC[C@H](N)c1cc(N)ccc1Cl Amb25798470 [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.446 CCC[C@H](N)c1cc(O)ccc1Br Amb24534204 [0,2,0,0,0,0|2,0,0]=4 8488 B13R1.446 CCC[C@H](N)c1cc(O)ccc1N Amb25691138 [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.446 CCC[C@H](O)c1cc(Br)ccc1F Amb25300106 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.446 CCC[C@H](O)c1cc(Cl)ccc1Br Amb25303946 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.446 CCC[C@H](O)c1cc(Cl)ccc1F Amb24461474 [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.446 CCC[C@H](O)c1cc(F)ccc1Br Amb24731956 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.446 CCC[C@H](O)c1cc(F)ccc1F Amb25758227 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.446 CCNC(C)c1cc(Br)ccc1Cl Amb25673704 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.446 CCNC(C)c1cc(Br)ccc1O Amb18297285 [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.446 CCNC(C)c1cc(Cl)ccc1O Amb18294996 [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.446 CCNC(C)c1cc(F)ccc1Cl Amb25103959 [0,2,0,0,0,0|2,0,0]=4 8498 B13R1.446 CCNC(C)c1cc(I)ccc1Br Amb24674626 [0,2,0,0,0,0|2,0,0]=4 8499 B13R1.446 CCN[C@H](C)c1cc(Cl)ccc1Cl Amb25806306 [0,2,0,0,0,0|2,0,0]=4 8500 B13R1.446 CCSC(C)c1cc(C)ccc1C Amb25120616 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.446 CCSC(C)c1cc(Cl)ccc1N Amb25277233 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.446 CCSC(C)c1cc(F)ccc1F Amb24474857 [0,2,0,0,0,0|2,0,0]=4 8503 B13R1.446 CNCC(=O)c1cc(Br)ccc1F Amb25153485 [0,2,0,0,0,0|1,0,1]=4 8504 B13R1.446 CNCC(=O)c1cc(C)ccc1C Amb17233279 [0,2,0,0,0,0|1,0,1]=4 8505 B13R1.446 CNCC(=O)c1cc(Cl)ccc1Cl Amb18225699 [0,2,0,0,0,0|1,0,1]=4 8506 B13R1.446 CNCC(=O)c1cc(Cl)ccc1F Amb18894775 [0,2,0,0,0,0|1,0,1]=4 8507 B13R1.446 CNCC(=O)c1cc(F)ccc1Br Amb25191402 [0,2,0,0,0,0|1,0,1]=4 8508 B13R1.446 CNCC(=O)c1cc(F)ccc1F Amb17335731 [0,2,0,0,0,0|1,0,1]=4 8509 B13R1.446 CNCC(C)c1cc(Br)ccc1F Amb25357943 [0,2,0,0,0,0|0,0,0]=2 8510 B13R1.446 CNCC(C)c1cc(Cl)ccc1F Amb18244125 [0,2,0,0,0,0|0,0,0]=2 8511 B13R1.446 CNCC(C)c1cc(F)ccc1Cl Amb25802013 [0,2,0,0,0,0|0,0,0]=2 8512 B13R1.446 CNCC(C)c1cc(F)ccc1F Amb18243849 [0,2,0,0,0,0|0,0,0]=2 8513 B13R1.446 CNCC(C)c1cc(F)ccc1O Amb25079100 [0,2,0,0,0,0|0,0,0]=2 8514 B13R1.446 CNCC(C)c1cc(O)ccc1Br Amb25341505 [0,2,0,0,0,0|0,0,0]=2 8515 B13R1.446 CNCC(C)c1cc(O)ccc1Cl Amb24361969 [0,2,0,0,0,0|0,0,0]=2 8516 B13R1.446 CNCC(C)c1cc(O)ccc1F Amb25119955 [0,2,0,0,0,0|0,0,0]=2 8517 B13R1.446 CNCC(O)c1cc(Br)ccc1F Amb18997464 [0,2,0,0,0,0|1,0,0]=3 8518 B13R1.446 CNCC(O)c1cc(Cl)ccc1Cl Amb18289716 [0,2,0,0,0,0|1,0,0]=3 8519 B13R1.446 CNCC(O)c1cc(Cl)ccc1F Amb18244129 [0,2,0,0,0,0|1,0,0]=3 8520 B13R1.446 CNCC(O)c1cc(F)ccc1Br Amb24715440 [0,2,0,0,0,0|1,0,0]=3 8521 B13R1.446 CNCC(O)c1cc(O)ccc1Br Amb22054571 [0,2,0,0,0,0|1,0,0]=3 8522 B13R1.446 CNCC(O)c1cc(O)ccc1Br Amb25720409 [0,2,0,0,0,0|1,0,0]=3 8523 B13R1.446 CNCC(O)c1cc(O)ccc1F Amb18129515 [0,2,0,0,0,0|1,0,0]=3 8524 B13R1.446 CNCC(c1cc(C)ccc1C)C Amb17233343 [0,2,0,0,0,0|0,0,0]=2 8525 B13R1.446 CNCC(c1cc(C)ccc1C)O Amb17233589 [0,2,0,0,0,0|1,0,0]=3 8526 B13R1.446 CNCC(c1cc(F)ccc1F)O Amb17335897 [0,2,0,0,0,0|1,0,0]=3 8527 B13R1.446 CNC[C@H](O)c1cc(O)ccc1F Amb24425501 [0,2,0,0,0,0|1,0,0]=3 8528 B13R1.446 COCC(C)c1cc(Cl)c[n]c1N Amb25693463 [0,2,0,0,0,0|2,0,0]=4 8529 B13R1.446 COCC(N)c1cc(Br)ccc1F Amb25858707 [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.446 COCC(N)c1cc(Cl)ccc1Cl Amb18301383 [0,2,0,0,0,0|2,0,0]=4 8531 B13R1.446 COCC(N)c1cc(Cl)ccc1F Amb24741694 [0,2,0,0,0,0|2,0,0]=4 8532 B13R1.446 COCC(N)c1cc(F)ccc1I Amb25856971 [0,2,0,0,0,0|2,0,0]=4 8533 B13R1.446 COCC(N)c1cc(I)ccc1Cl Amb25678657 [0,2,0,0,0,0|2,0,0]=4 8534 B13R1.446 COCC(N)c1cc(I)ccc1F Amb24534042 [0,2,0,0,0,0|2,0,0]=4 8535 B13R1.446 COCC(N)c1cc(N)ccc1F Amb24351659 [0,2,0,0,0,0|2,0,0]=4 8536 B13R1.446 COCC(N)c1cc(N)ccc1N Amb24494323 [0,2,0,0,0,0|2,0,0]=4 8537 B13R1.446 COCC(N)c1cc(O)ccc1N Amb25698311 [0,2,0,0,0,0|2,0,0]=4 8538 B13R1.446 COCC(N)c1cc(O)ccc1O Amb25281836 [0,2,0,0,0,0|2,0,0]=4 8539 B13R1.446 COCC(N)c1cc(S)ccc1O Amb24701287 [0,2,0,0,0,0|2,0,0]=4 8540 B13R1.446 COCC(O)c1cc(Cl)ccc1Br Amb24727848 [0,2,0,0,0,0|2,0,0]=4 8541 B13R1.446 COCC(O)c1cc(Cl)ccc1Cl Amb24678746 [0,2,0,0,0,0|2,0,0]=4 8542 B13R1.446 COCC(O)c1cc(Cl)ccc1I Amb25345447 [0,2,0,0,0,0|2,0,0]=4 8543 B13R1.446 COCC(O)c1cc(F)ccc1Br Amb25341922 [0,2,0,0,0,0|2,0,0]=4 8544 B13R1.446 COCC(O)c1cc(F)ccc1Cl Amb24394686 [0,2,0,0,0,0|2,0,0]=4 8545 B13R1.446 COCC(O)c1cc(F)ccc1F Amb18324057 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.446 COCC(O)c1cc(F)ccc1N Amb24409744 [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.446 COCC(O)c1cc(I)ccc1Br Amb25691953 [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.446 COCC(c1cc(C)ccc1C)N Amb1139265 [0,2,0,0,0,0|2,0,0]=4 8549 B13R1.446 COCC(c1cc(F)ccc1F)N Amb10610140 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.446 COCC(c1cc(F)ccc1F)N Amb1131932 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.446 COC[C@@H](N)c1cc(Br)ccc1N Amb24756457 [0,2,0,0,0,0|2,0,0]=4 8552 B13R1.446 COC[C@@H](N)c1cc(Cl)ccc1Cl Amb25805132 [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.446 COC[C@@H](N)c1cc(F)ccc1Br Amb24660860 [0,2,0,0,0,0|2,0,0]=4 8554 B13R1.446 COC[C@@H](N)c1cc(F)ccc1F Amb25327528 [0,2,0,0,0,0|2,0,0]=4 8555 B13R1.446 COC[C@@H](N)c1cc(F)ccc1I Amb25155107 [0,2,0,0,0,0|2,0,0]=4 8556 B13R1.446 COC[C@@H](N)c1cc(I)ccc1Cl Amb25804812 [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.446 COC[C@@H](N)c1cc(I)ccc1F Amb24400442 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.446 COC[C@@H](N)c1cc(N)ccc1N Amb24445137 [0,2,0,0,0,0|2,0,0]=4 8559 B13R1.446 COC[C@@H](N)c1cc(N)ccc1O Amb24346768 [0,2,0,0,0,0|2,0,0]=4 8560 B13R1.446 COC[C@@H](N)c1cc(O)ccc1Br Amb25082918 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.446 COC[C@@H](N)c1cc(O)ccc1O Amb25049505 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.446 COC[C@@H](N)c1cc(S)ccc1O Amb24455545 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.446 COC[C@H](N)c1cc(Br)ccc1Br Amb25330682 [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.446 COC[C@H](N)c1cc(Br)ccc1N Amb25857550 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.446 COC[C@H](N)c1cc(Cl)ccc1Br Amb24451782 [0,2,0,0,0,0|2,0,0]=4 8566 B13R1.446 COC[C@H](N)c1cc(Cl)ccc1Cl Amb25808913 [0,2,0,0,0,0|2,0,0]=4 8567 B13R1.446 COC[C@H](N)c1cc(Cl)ccc1F Amb25223160 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.446 COC[C@H](N)c1cc(Cl)ccc1N Amb24344090 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.446 COC[C@H](N)c1cc(F)ccc1Br Amb24615257 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.446 COC[C@H](N)c1cc(F)ccc1Cl Amb25732541 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.446 COC[C@H](N)c1cc(F)ccc1I Amb25118639 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.446 COC[C@H](N)c1cc(F)ccc1O Amb25843303 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.446 COC[C@H](N)c1cc(N)ccc1F Amb24409575 [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.446 COC[C@H](N)c1cc(O)ccc1Br Amb25843449 [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.446 COC[C@H](N)c1cc(O)ccc1N Amb24560932 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.446 CONC(C)c1cc(F)ccc1O Amb25736558 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.446 CSCC(N)c1cc(Cl)ccc1Cl Amb24443484 [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.446 CSCC(N)c1cc(F)ccc1Cl Amb25704607 [0,2,0,0,0,0|2,0,0]=4 8579 B13R1.446 CSCC(N)c1cc(F)ccc1F Amb18997940 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.446 C\C(=N\NC)\c1cc(Cl)ccc1O Amb24509847 [0,2,0,0,0,0|1,0,1]=4 8581 B13R1.446 C\C(=N\NC)\c1cc(F)ccc1F Amb25717478 [0,2,0,0,0,0|1,0,1]=4 8582 B13R1.446 C\C(=N\NC)\c1cc(F)ccc1O Amb25833435 [0,2,0,0,0,0|1,0,1]=4 8583 B13R1.446 C\C=C\C(C)c1cc(N)ccc1N Amb18127789 [0,2,0,0,0,0|1,0,1]=4 8584 B13R1.446 Cc1cc(C(C)COC)c(N)[n]c1 Amb25324429 [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.446 Cc1cc(C(C)NOC)c(C)cc1 Amb25337157 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.446 Cc1cc(C(C)\C=C\C)c(N)cc1 Amb18647925 [0,2,0,0,0,0|1,0,1]=4 8587 B13R1.446 Cc1cc(C(N)CSC)c(C)cc1 Amb18995355 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.446 Cc1cc(C(O)CNC)c(N)[n]c1 Amb24666438 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.446 Cc1cc(C(O)CNN)c(C)cc1 Amb18065948 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.446 Cc1cc(C(O)COC)c(C)cc1 Amb18809340 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.446 Cc1cc(C(O)CSC)c(C)cc1 Amb19065317 [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.446 Cc1cc([C@H](N)COC)c(C)cc1 Amb25836810 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.446 Cc1ccc(Br)c(c1)C(C)NCC Amb25346643 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.446 Cc1ccc(Br)c(c1)C(N)COC Amb24490894 [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.446 Cc1ccc(Br)c(c1)C(O)CCC Amb25784170 [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.446 Cc1ccc(Br)c(c1)[C@@H](N)CCC Amb25364177 [0,2,0,0,0,0|2,0,0]=4 8597 B13R1.446 Cc1ccc(Br)c(c1)[C@H](N)CCC Amb24696388 [0,2,0,0,0,0|2,0,0]=4 8598 B13R1.446 Cc1ccc(Br)c(c1)[C@H](N)COC Amb25198721 [0,2,0,0,0,0|2,0,0]=4 8599 B13R1.446 Cc1ccc(Br)cc1C(C)CCN Amb24680832 [0,2,0,0,0,0|2,0,0]=4 8600 B13R1.446 Cc1ccc(Br)cc1C(C)NCC Amb24465630 [0,2,0,0,0,0|2,0,0]=4 8601 B13R1.446 Cc1ccc(Br)cc1C(N)CCC Amb24399877 [0,2,0,0,0,0|2,0,0]=4 8602 B13R1.446 Cc1ccc(Br)cc1C(O)CCC Amb25110168 [0,2,0,0,0,0|2,0,0]=4 8603 B13R1.446 Cc1ccc(Br)cc1C(O)CNC Amb25135385 [0,2,0,0,0,0|1,0,0]=3 8604 B13R1.446 Cc1ccc(Cl)c(c1)C(C)CNC Amb25781805 [0,2,0,0,0,0|0,0,0]=2 8605 B13R1.446 Cc1ccc(Cl)c(c1)C(N)COC Amb24684029 [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.446 Cc1ccc(Cl)c(c1)C(O)CNC Amb24450049 [0,2,0,0,0,0|1,0,0]=3 8607 B13R1.446 Cc1ccc(Cl)c(c1)C(O)COC Amb24339226 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.446 Cc1ccc(Cl)c(c1)[C@H](N)COC Amb25354764 [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.446 Cc1ccc(Cl)cc1C(=O)CNC Amb18864129 [0,2,0,0,0,0|1,0,1]=4 8610 B13R1.446 Cc1ccc(Cl)cc1C(C)CNC Amb24533700 [0,2,0,0,0,0|0,0,0]=2 8611 B13R1.446 Cc1ccc(Cl)cc1C(C)NCC Amb25110169 [0,2,0,0,0,0|2,0,0]=4 8612 B13R1.446 Cc1ccc(Cl)cc1C(N)CCC Amb25076738 [0,2,0,0,0,0|2,0,0]=4 8613 B13R1.446 Cc1ccc(Cl)cc1C(O)COC Amb24471175 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.446 Cc1ccc(Cl)cc1[C@@H](N)COC Amb25857757 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.446 Cc1ccc(Cl)cc1[C@H](N)CCC Amb24435306 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.446 Cc1ccc(Cl)cc1[C@H](N)COC Amb25064340 [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.446 Cc1ccc(F)c(c1)C(C)CCN Amb24520713 [0,2,0,0,0,0|2,0,0]=4 8618 B13R1.446 Cc1ccc(F)c(c1)C(C)CNC Amb25177554 [0,2,0,0,0,0|0,0,0]=2 8619 B13R1.446 Cc1ccc(F)c(c1)C(C)NCC Amb18301379 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.446 Cc1ccc(F)c(c1)C(N)CCC Amb18181402 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.446 Cc1ccc(F)c(c1)C(N)COC Amb18301386 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.446 Cc1ccc(F)c(c1)C(N)CSC Amb18301391 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.446 Cc1ccc(F)c(c1)C(O)CCC Amb18805552 [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.446 Cc1ccc(F)c(c1)C(O)CNC Amb24583855 [0,2,0,0,0,0|1,0,0]=3 8625 B13R1.446 Cc1ccc(F)c(c1)C(O)COC Amb18326268 [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.446 Cc1ccc(F)c(c1)C(O)CSC Amb18331503 [0,2,0,0,0,0|2,0,0]=4 8627 B13R1.446 Cc1ccc(F)c(c1)[C@@H](N)CCC Amb25104747 [0,2,0,0,0,0|2,0,0]=4 8628 B13R1.446 Cc1ccc(F)c(c1)[C@H](O)CCC Amb24393109 [0,2,0,0,0,0|2,0,0]=4 8629 B13R1.446 Cc1ccc(F)cc1C(=O)CNC Amb25820145 [0,2,0,0,0,0|1,0,1]=4 8630 B13R1.446 Cc1ccc(F)cc1C(C)CCN Amb25068207 [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.446 Cc1ccc(F)cc1C(C)NCC Amb18997550 [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.446 Cc1ccc(F)cc1C(Cl)CCC Amb24763294 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.446 Cc1ccc(F)cc1C(N)CCC Amb18805317 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.446 Cc1ccc(F)cc1C(N)COC Amb18997902 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.446 Cc1ccc(F)cc1C(N)CSC Amb18997903 [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.446 Cc1ccc(F)cc1C(O)CCC Amb18185536 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.446 Cc1ccc(F)cc1C(O)COC Amb19068699 [0,2,0,0,0,0|2,0,0]=4 8638 B13R1.446 Cc1ccc(F)cc1C(O)CSC Amb19086355 [0,2,0,0,0,0|2,0,0]=4 8639 B13R1.446 Cc1ccc(F)cc1[C@@H](N)CCC Amb25736932 [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.446 Cc1ccc(I)c(c1)[C@@H](N)CCC Amb25858682 [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.446 Cc1ccc(I)c(c1)[C@H](N)CCC Amb25217621 [0,2,0,0,0,0|2,0,0]=4 8642 B13R1.446 Cc1ccc(I)cc1C(N)CCC Amb25676345 [0,2,0,0,0,0|2,0,0]=4 8643 B13R1.446 Cc1ccc(I)cc1[C@@H](N)CCC Amb24490969 [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.446 Cc1ccc(I)cc1[C@@H](N)COC Amb24642950 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.446 Cc1ccc(I)cc1[C@H](N)CCC Amb25775370 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.446 Cc1ccc(N)c(c1)C(N)CCC Amb25087240 [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.446 Cc1ccc(N)c(c1)C(N)COC Amb24393347 [0,2,0,0,0,0|2,0,0]=4 8648 B13R1.446 Cc1ccc(N)c(c1)[C@@H](N)CCC Amb24364725 [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.446 Cc1ccc(N)c(c1)[C@H](N)COC Amb24745692 [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.446 Cc1ccc(N)cc1C(N)COC Amb25850002 [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.446 Cc1ccc(N)cc1N(C)CCC Amb18993364 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.446 Cc1ccc(N)cc1[C@H](N)CCC Amb24402404 [0,2,0,0,0,0|2,0,0]=4 8653 B13R1.446 Cc1ccc(N)cc1[C@H](N)COC Amb24494427 [0,2,0,0,0,0|2,0,0]=4 8654 B13R1.446 Cc1ccc(O)c(c1)C(C)CCC Amb24379027 [0,2,0,0,0,0|1,0,0]=3 8655 B13R1.446 Cc1ccc(O)c(c1)C(C)CNC Amb25121987 [0,2,0,0,0,0|0,0,0]=2 8656 B13R1.446 Cc1ccc(O)c(c1)C(N)CCC Amb18940456 [0,2,0,0,0,0|2,0,0]=4 8657 B13R1.446 Cc1ccc(O)c(c1)[C@@H](N)COC Amb24359915 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.446 Cc1ccc(O)cc1C(O)CNC Amb25204267 [0,2,0,0,0,0|1,0,0]=3 8659 B13R1.446 Cc1ccc(O)cc1[C@H](N)CCC Amb25123608 [0,2,0,0,0,0|2,0,0]=4 8660 B13R1.446 Cc1ccc(cc1C(CNO)O)C Amb17335491 [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.446 NNCC(O)c1cc(Cl)ccc1F Amb24686949 [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.446 NNCC(O)c1cc(F)ccc1F Amb18564462 [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.446 OC(c1cc(F)ccc1F)CNO Amb17336063 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.450 CC(NCC)c1cc(Cl)cc(Br)c1 Amb24709769 [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.450 CCCC(C)c1cc(O)cc(O)c1 Amb24434624 [0,2,0,0,0,0|1,0,0]=3 8666 B13R1.450 CCCC(Cl)c1cc(F)cc(F)c1 Amb25354267 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.450 CCCC(N)c1cc(Br)cc(Br)c1 Amb25126626 [0,2,0,0,0,0|2,0,0]=4 8668 B13R1.450 CCCC(N)c1cc(Br)cc(Cl)c1 Amb25085025 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.450 CCCC(N)c1cc(Br)cc(F)c1 Amb25785129 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.450 CCCC(N)c1cc(Cl)cc(F)c1 Amb24640451 [0,2,0,0,0,0|2,0,0]=4 8671 B13R1.450 CCCC(N)c1cc(F)cc(O)c1 Amb25727251 [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.450 CCCC(N)c1cc(I)cc(I)c1 Amb24386314 [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.450 CCCC(O)c1cc(Cl)cc(Cl)c1 Amb24429210 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.450 CCCC(O)c1cc(Cl)cc(F)c1 Amb25773917 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.450 CCCC(c1cc(C)cc(c1)C)N Amb17233368 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.450 CCCC(c1cc(C)cc(c1)C)O Amb17233482 [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.450 CCCC(c1cc(F)cc(c1)F)N Amb17234180 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.450 CCCC(c1cc(F)cc(c1)F)O Amb17234280 [0,2,0,0,0,0|2,0,0]=4 8679 B13R1.450 CCCN(C)c1cc(N)cc(F)c1 Amb18969368 [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.450 CCC[C@@H](N)c1cc(Br)cc(F)c1 Amb24611722 [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.450 CCC[C@@H](N)c1cc(I)cc(Cl)c1 Amb25732985 [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.450 CCC[C@@H](N)c1cc(O)cc(O)c1 Amb24359883 [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.450 CCC[C@@H](O)c1cc(C)cc(C)c1 Amb24752708 [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.450 CCC[C@H](N)c1cc(Br)cc(Cl)c1 Amb24534483 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.450 CCC[C@H](N)c1cc(C)cc(C)c1 Amb25737776 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.450 CCC[C@H](N)c1cc(F)cc(F)c1 Amb25757400 [0,2,0,0,0,0|2,0,0]=4 8687 B13R1.450 CCC[C@H](O)c1cc(Br)cc(F)c1 Amb25859041 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.450 CCC[C@H](O)c1cc(F)cc(F)c1 Amb25225343 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.450 CCNC(C)c1cc(C)cc(C)c1 Amb18795960 [0,2,0,0,0,0|2,0,0]=4 8690 B13R1.450 CCNC(C)c1cc(F)cc(F)c1 Amb18980635 [0,2,0,0,0,0|2,0,0]=4 8691 B13R1.450 CCNC(C)c1cc(O)cc(O)c1 Amb24721841 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.450 CNCC(=O)c1cc(C)cc(C)c1 Amb18862918 [0,2,0,0,0,0|1,0,1]=4 8693 B13R1.450 CNCC(=O)c1cc(Cl)cc(Br)c1 Amb24456871 [0,2,0,0,0,0|1,0,1]=4 8694 B13R1.450 CNCC(=O)c1cc(Cl)cc(Cl)c1 Amb18225701 [0,2,0,0,0,0|1,0,1]=4 8695 B13R1.450 CNCC(=O)c1cc(F)cc(Br)c1 Amb24472526 [0,2,0,0,0,0|1,0,1]=4 8696 B13R1.450 CNCC(=O)c1cc(F)cc(F)c1 Amb25698006 [0,2,0,0,0,0|1,0,1]=4 8697 B13R1.450 CNCC(=O)c1cc(O)cc(Cl)c1 Amb25180539 [0,2,0,0,0,0|1,0,1]=4 8698 B13R1.450 CNCC(=O)c1cc(O)cc(F)c1 Amb25094521 [0,2,0,0,0,0|1,0,1]=4 8699 B13R1.450 CNCC(O)c1cc(C)cc(C)c1 Amb18997481 [0,2,0,0,0,0|1,0,0]=3 8700 B13R1.450 CNCC(O)c1cc(Cl)cc(Br)c1 Amb24689229 [0,2,0,0,0,0|1,0,0]=3 8701 B13R1.450 CNCC(O)c1cc(Cl)cc(Cl)c1 Amb18997474 [0,2,0,0,0,0|1,0,0]=3 8702 B13R1.450 CNCC(O)c1cc(F)cc(Br)c1 Amb25306117 [0,2,0,0,0,0|1,0,0]=3 8703 B13R1.450 CNCC(O)c1cc(F)cc(Cl)c1 Amb25700516 [0,2,0,0,0,0|1,0,0]=3 8704 B13R1.450 CNCC(O)c1cc(O)cc(Cl)c1 Amb25800875 [0,2,0,0,0,0|1,0,0]=3 8705 B13R1.450 CNCC(O)c1cc(O)cc(O)c1 Amb25790462 [0,2,0,0,0,0|1,0,0]=3 8706 B13R1.450 COCC(N)c1cc(Br)cc(Br)c1 Amb24453421 [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.450 COCC(N)c1cc(C)cc(C)c1 Amb18979035 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.450 COCC(N)c1cc(Cl)cc(Br)c1 Amb25353501 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.450 COCC(N)c1cc(Cl)cc(Cl)c1 Amb24343941 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.450 COCC(N)c1cc(F)cc(F)c1 Amb18301382 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.450 COCC(N)c1cc(F)cc(I)c1 Amb24491225 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.450 COCC(N)c1cc(I)cc(I)c1 Amb24490793 [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.450 COCC(N)c1cc(N)cc(F)c1 Amb25776839 [0,2,0,0,0,0|2,0,0]=4 8714 B13R1.450 COCC(N)c1cc(O)cc(F)c1 Amb25064343 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.450 COCC(O)c1cc(C)cc(C)c1 Amb18796269 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.450 COCC(O)c1cc(Cl)cc(Br)c1 Amb25265896 [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.450 COCC(O)c1cc(Cl)cc(Cl)c1 Amb24459412 [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.450 COCC(O)c1cc(F)cc(F)c1 Amb19071524 [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.450 COC[C@@H](N)c1cc(C)cc(C)c1 Amb24346787 [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.450 COC[C@@H](N)c1cc(Cl)cc(Br)c1 Amb24583083 [0,2,0,0,0,0|2,0,0]=4 8721 B13R1.450 COC[C@@H](N)c1cc(Cl)cc(I)c1 Amb25720198 [0,2,0,0,0,0|2,0,0]=4 8722 B13R1.450 COC[C@@H](N)c1cc(F)cc(Cl)c1 Amb24448406 [0,2,0,0,0,0|2,0,0]=4 8723 B13R1.450 COC[C@@H](N)c1cc(F)cc(F)c1 Amb24745486 [0,2,0,0,0,0|2,0,0]=4 8724 B13R1.450 COC[C@@H](N)c1cc(N)cc(F)c1 Amb24470871 [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.450 COC[C@H](N)c1cc(Cl)cc(Br)c1 Amb24691798 [0,2,0,0,0,0|2,0,0]=4 8726 B13R1.450 COC[C@H](N)c1cc(F)cc(F)c1 Amb24386017 [0,2,0,0,0,0|2,0,0]=4 8727 B13R1.450 COC[C@H](N)c1cc(O)cc(O)c1 Amb25112028 [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.450 CONC(C)c1cc(F)cc(F)c1 Amb25210341 [0,2,0,0,0,0|2,0,0]=4 8729 B13R1.450 CSCC(N)c1cc(C)cc(C)c1 Amb18995343 [0,2,0,0,0,0|2,0,0]=4 8730 B13R1.450 CSCC(N)c1cc(F)cc(F)c1 Amb18997908 [0,2,0,0,0,0|2,0,0]=4 8731 B13R1.450 CSCC(O)c1cc(C)cc(C)c1 Amb19065315 [0,2,0,0,0,0|2,0,0]=4 8732 B13R1.450 C[C@H](CCO)c1cc(C)cc(C)c1 Amb25236007 [0,2,0,0,0,0|2,0,0]=4 8733 B13R1.450 Cc1cc(Br)cc(c1)C(C)NCC Amb25339111 [0,2,0,0,0,0|2,0,0]=4 8734 B13R1.450 Cc1cc(Br)cc(c1)C(N)CCC Amb25208340 [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.450 Cc1cc(Br)cc(c1)C(O)COC Amb24471241 [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.450 Cc1cc(Br)cc(c1)[C@@H](N)CCC Amb24637942 [0,2,0,0,0,0|2,0,0]=4 8737 B13R1.450 Cc1cc(Br)cc(c1)[C@@H](N)COC Amb25084721 [0,2,0,0,0,0|2,0,0]=4 8738 B13R1.450 Cc1cc(Br)cc(c1)[C@H](N)CCC Amb25233162 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.450 Cc1cc(Cl)cc(c1)C(C)NCC Amb25082368 [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.450 Cc1cc(Cl)cc(c1)C(N)COC Amb25141019 [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.450 Cc1cc(Cl)cc(c1)[C@H](N)CCC Amb24655795 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.450 Cc1cc(F)cc(c1)C(=O)CNC Amb25155763 [0,2,0,0,0,0|1,0,1]=4 8743 B13R1.450 Cc1cc(F)cc(c1)C(C)CCN Amb24715351 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.450 Cc1cc(F)cc(c1)C(N)CSC Amb25692649 [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.450 Cc1cc(F)cc(c1)C(O)CSC Amb24643636 [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.450 Cc1cc(F)cc(c1)[C@@H](N)CCC Amb24598778 [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.450 Cc1cc(F)cc(c1)[C@@H](O)CCC Amb24534712 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.450 Cc1cc(N)cc(c1)C(N)COC Amb25669398 [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.450 Cc1cc(N)cc(c1)C(O)CCC Amb24650423 [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.450 Cc1cc(N)cc(c1)[C@H](N)COC Amb25783132 [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.450 Cc1cc(O)cc(c1)C(=O)CNC Amb24379656 [0,2,0,0,0,0|1,0,1]=4 8752 B13R1.450 Cc1cc(cc(Cl)c1)C(C)CNC Amb25119977 [0,2,0,0,0,0|0,0,0]=2 8753 B13R1.450 Cc1cc(cc(O)c1)C(C)CNC Amb24685051 [0,2,0,0,0,0|0,0,0]=2 8754 B13R1.450 NCCC(c1cc(C)cc(c1)C)C Amb17233369 [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.450 NCCC(c1cc(F)cc(c1)F)C Amb17234181 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.450 OCCC(c1cc(C)cc(c1)C)C Amb17233483 [0,2,0,0,0,0|2,0,0]=4 8757 B13R1.450 OCCC(c1cc(F)cc(c1)F)C Amb17234281 [0,2,0,0,0,0|2,0,0]=4 8758 B13R1.460 BrCCC(c1cccc(c1)OC)C Amb17256444 [0,2,0,0,0,0|2,0,0]=4 8759 B13R1.460 CCCC(c1cccc(c1)OC)N Amb17233601 [0,2,0,0,0,0|2,0,0]=4 8760 B13R1.460 CCCC(c1cccc(c1)OC)O Amb17233693 [0,2,0,0,0,0|2,0,0]=4 8761 B13R1.460 CCCN(C)c1cc(ccc1)C#C Amb25763720 [0,2,0,0,0,0|2,0,0]=4 8762 B13R1.460 CCCN(C)c1cc(ccc1)C#N Amb18804160 [0,2,0,0,0,0|2,0,0]=4 8763 B13R1.460 CCC[C@@H](N)c1cc(ccc1)C#N Amb22288735 [0,2,0,0,0,0|2,0,0]=4 8764 B13R1.460 CCC[C@H](N)c1cc(ccc1)C#N Amb22288737 [0,2,0,0,0,0|2,0,0]=4 8765 B13R1.460 CNCC(=O)c1cccc(c1)OC Amb17233536 [0,2,0,0,0,0|1,0,1]=4 8766 B13R1.460 CNCC(c1cccc(c1)OC)C Amb17233594 [0,2,0,0,0,0|0,0,0]=2 8767 B13R1.460 COCC(O)c1cc(ccc1)C#N Amb24697270 [0,2,0,0,0,0|2,0,0]=4 8768 B13R1.460 COC[C@@H](N)c1cc(ccc1)C#N Amb25698273 [0,2,0,0,0,0|2,0,0]=4 8769 B13R1.460 COC[C@H](N)c1cc(ccc1)C#N Amb25231200 [0,2,0,0,0,0|2,0,0]=4 8770 B13R1.460 COc1cc(ccc1)C(C)CC#N Amb25042867 [0,2,0,0,0,0|2,0,0]=4 8771 B13R1.460 ClCCC(c1cccc(c1)OC)C Amb17236873 [0,2,0,0,0,0|2,0,0]=4 8772 B13R1.460 NCCC(c1cccc(c1)OC)C Amb17233595 [0,2,0,0,0,0|2,0,0]=4 8773 B13R1.460 NNCC(c1cccc(c1)OC)O Amb17233904 [0,2,0,0,0,0|2,0,0]=4 8774 B13R1.460 OCCC(c1cccc(c1)OC)C Amb17233702 [0,2,0,0,0,0|2,0,0]=4 8775 B13R1.460 ONCC(c1cccc(c1)OC)O Amb17335612 [0,2,0,0,0,0|2,0,0]=4 8776 B13R1.11 CC(CC(=O)C#N)c1ccccc1 Amb24494969 [0,2,0,0,0,0|1,0,1]=4 8777 B13R1.11 CC(CC(=O)NO)c1ccccc1 Amb24387362 [0,2,0,0,0,0|1,0,0]=3 8778 B13R1.11 CC(CC(C)C=O)c1ccccc1 Amb18127778 [0,2,0,0,0,0|1,0,0]=3 8779 B13R1.11 CC(CC(Cl)C#N)c1ccccc1 Amb19042402 [0,2,0,0,0,0|1,0,1]=4 8780 B13R1.11 CC(CC(N)C#N)c1ccccc1 Amb18979389 [0,2,0,0,0,0|1,0,1]=4 8781 B13R1.11 CC(CC(O)C#N)c1ccccc1 Amb18183925 [0,2,0,0,0,0|1,0,1]=4 8782 B13R1.11 CC(CC(O)c1ccccc1)=C=C Amb25266831 [0,2,0,0,0,0|2,0,0]=4 8783 B13R1.11 CC(CC(O)c1ccccc1)C#C Amb24688211 [0,2,0,0,0,0|2,0,0]=4 8784 B13R1.11 CC(CO)CC(C)c1ccccc1 Amb22733184 [0,2,0,0,0,0|1,0,0]=3 8785 B13R1.11 CC(NC(=O)CF)c1ccccc1 Amb25041090 [0,2,0,0,0,0|2,0,0]=4 8786 B13R1.11 CC(NC(=O)CI)c1ccccc1 Amb22340599 [0,2,0,0,0,0|2,0,0]=4 8787 B13R1.11 CC(NC(=O)NO)c1ccccc1 Amb25121196 [0,2,0,0,0,0|1,0,1]=4 8788 B13R1.11 CC(NC(C)C#C)c1ccccc1 Amb25858830 [0,2,0,0,0,0|1,0,1]=4 8789 B13R1.11 CC(OC(=S)NN)c1ccccc1 Amb25772337 [0,2,0,0,0,0|1,0,1]=4 8790 B13R1.11 CC(c1ccccc1)NC(C#N)C Amb17400450 [0,2,0,0,0,0|2,0,0]=4 8791 B13R1.11 CCC(=O)CC(c1ccccc1)C Amb17594493 [0,2,0,0,0,0|1,0,0]=3 8792 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,2,0,0,0,0|1,0,1]=4 8793 B13R1.11 CC[C@@H](O)C[C@@H](N)c1ccccc1 Amb19929596 [0,2,0,0,0,0|2,0,0]=4 8794 B13R1.11 CC[C@@H](O)C[C@H](N)c1ccccc1 Amb19929595 [0,2,0,0,0,0|2,0,0]=4 8795 B13R1.11 CN(CC(=O)NC)c1cc[n]cc1 Amb25252497 [0,2,0,0,0,0|2,0,0]=4 8796 B13R1.11 CN(CC(=O)NC)c1cccc[n]1 Amb24422204 [0,2,0,0,0,0|2,0,0]=4 8797 B13R1.11 CN(CC(=O)NC)c1ccccc1 Amb19971421 [0,2,0,0,0,0|1,0,0]=3 8798 B13R1.11 CN(CC(Cl)c1ccccc1)C#N Amb25841949 [0,2,0,0,0,0|1,0,0]=3 8799 B13R1.11 CNC(=N)CC(=O)c1ccccc1 Amb25275499 [0,2,0,0,0,0|1,0,1]=4 8800 B13R1.11 CNC(=N)NC(C)c1cc[n]cc1 Amb18184395 [0,2,0,0,0,0|1,0,1]=4 8801 B13R1.11 CNC(=N)NC(C)c1ccc[n]c1 Amb18184394 [0,2,0,0,0,0|1,0,1]=4 8802 B13R1.11 CNC(=N)NC(C)c1cccc[n]1 Amb18184396 [0,2,0,0,0,0|1,0,1]=4 8803 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,2,0,0,0,0|0,0,1]=3 8804 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb20631264 [0,2,0,0,0,0|0,0,1]=3 8805 B13R1.11 CNC(=N)N[C@@H](C)c1cc[n]cc1 Amb25300802 [0,2,0,0,0,0|1,0,1]=4 8806 B13R1.11 CNC(=N)N[C@@H](C)c1cccc[n]1 Amb24353594 [0,2,0,0,0,0|1,0,1]=4 8807 B13R1.11 CNC(=N)N[C@@H](C)c1ccccc1 Amb25152972 [0,2,0,0,0,0|0,0,1]=3 8808 B13R1.11 CNC(=N)N[C@H](C)c1cc[n]cc1 Amb25702002 [0,2,0,0,0,0|1,0,1]=4 8809 B13R1.11 CNC(=N)N[C@H](C)c1cccc[n]1 Amb25858377 [0,2,0,0,0,0|1,0,1]=4 8810 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,2,0,0,0,0|1,0,1]=4 8811 B13R1.11 CNC(=O)CC(=S)c1ccccc1 Amb25125271 [0,2,0,0,0,0|1,0,1]=4 8812 B13R1.11 CNC(=O)CC(C)c1cc[n]cc1 Amb25686680 [0,2,0,0,0,0|1,0,0]=3 8813 B13R1.11 CNC(=O)CC(C)c1ccc[n]c1 Amb24397679 [0,2,0,0,0,0|1,0,0]=3 8814 B13R1.11 CNC(=O)CC(c1cccnc1)N Amb17233543 [0,2,0,0,0,0|2,0,0]=4 8815 B13R1.11 CNC(=O)CS(=O)c1ccccc1 Amb25807172 [0,2,0,0,0,0|2,0,0]=4 8816 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,2,0,0,0,0|1,0,0]=3 8817 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,2,0,0,0,0|0,0,0]=2 8818 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,2,0,0,0,0|1,0,0]=3 8819 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,2,0,0,0,0|1,0,0]=3 8820 B13R1.11 CNC(=O)NC(C)c1cc[n]cc1 Amb25153495 [0,2,0,0,0,0|1,0,1]=4 8821 B13R1.11 CNC(=O)NC(C)c1ccc[n]c1 Amb25190371 [0,2,0,0,0,0|1,0,1]=4 8822 B13R1.11 CNC(=O)NC(C)c1cccc[n]1 Amb25128617 [0,2,0,0,0,0|1,0,1]=4 8823 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,2,0,0,0,0|0,0,1]=3 8824 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,2,0,0,0,0|1,0,1]=4 8825 B13R1.11 CNC(=O)N[C@@H](C)c1ccc[n]c1 Amb25730920 [0,2,0,0,0,0|1,0,1]=4 8826 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,2,0,0,0,0|0,0,1]=3 8827 B13R1.11 CNC(=S)NC(C)c1cc[n]cc1 Amb23465377 [0,2,0,0,0,0|1,0,1]=4 8828 B13R1.11 CNC(=S)NC(C)c1cccc[n]1 Amb25155802 [0,2,0,0,0,0|1,0,1]=4 8829 B13R1.11 CNC(=S)N[C@@H](C)c1ccccc1 Amb24414685 [0,2,0,0,0,0|0,0,1]=3 8830 B13R1.11 CNC(=S)N[C@H](C)c1ccc[n]c1 Amb24450747 [0,2,0,0,0,0|1,0,1]=4 8831 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,2,0,0,0,0|1,0,0]=3 8832 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,2,0,0,0,0|2,0,0]=4 8833 B13R1.11 COC(=O)CC(c1ccccc1)N Amb1221582 [0,2,0,0,0,0|2,0,0]=4 8834 B13R1.11 COC(=O)CC(c1ccccc1)N Amb2371447 [0,2,0,0,0,0|2,0,0]=4 8835 B13R1.11 COC(=O)C[C@@H](C)c1ccccc1 Amb22363030 [0,2,0,0,0,0|1,0,0]=3 8836 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,2,0,0,0,0|2,0,0]=4 8837 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,2,0,0,0,0|2,0,0]=4 8838 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N Amb17617178 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.11 COC(=O)NC(c1ccccc1)C Amb10568146 [0,2,0,0,0,0|1,0,1]=4 8841 B13R1.11 COC(=O)N[C@@H](C)c1ccccc1 Amb24611219 [0,2,0,0,0,0|1,0,1]=4 8842 B13R1.11 COC(=O)N[C@H](C)c1ccccc1 Amb24666677 [0,2,0,0,0,0|1,0,1]=4 8843 B13R1.11 CSC(=O)NC(C)c1ccccc1 Amb25292316 [0,2,0,0,0,0|1,0,1]=4 8844 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,2,0,0,0,0|1,0,0]=3 8845 B13R1.11 C[C@@H](C[C@H](O)C#N)c1ccccc1 Amb24466320 [0,2,0,0,0,0|1,0,1]=4 8846 B13R1.11 C[C@@H](NC(=O)CO)c1ccccc1 Amb25324160 [0,2,0,0,0,0|2,0,0]=4 8847 B13R1.11 C[C@@H](N[C@@H](C)C#N)c1ccccc1 Amb25752018 [0,2,0,0,0,0|2,0,0]=4 8848 B13R1.11 C[C@@H](N[C@H](C)C#C)c1ccccc1 Amb25758951 [0,2,0,0,0,0|1,0,1]=4 8849 B13R1.11 C[C@H](C[C@H](O)C#N)c1ccccc1 Amb25734423 [0,2,0,0,0,0|1,0,1]=4 8850 B13R1.11 C[C@H](NC(=O)CBr)c1ccccc1 Amb25291312 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.11 C[C@H](NC(=O)CS)c1ccccc1 Amb25698363 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.11 C[C@H](NC(=O)NN)c1ccccc1 Amb22356343 [0,2,0,0,0,0|1,0,1]=4 8853 B13R1.11 C[C@H](NC(C)C#C)c1ccccc1 Amb25195849 [0,2,0,0,0,0|1,0,1]=4 8854 B13R1.11 C[C@H](N[C@@H](C)C#N)c1ccccc1 Amb24417915 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.11 C[C@H](N[C@H](C)C#C)c1ccccc1 Amb25041022 [0,2,0,0,0,0|1,0,1]=4 8856 B13R1.11 C[C@H](N[C@H](C)C#N)c1ccccc1 Amb25731977 [0,2,0,0,0,0|2,0,0]=4 8857 B13R1.11 C\C(=C/C(C)NC)\c1ccccc1 Amb23555670 [0,2,0,0,0,0|0,0,1]=3 8858 B13R1.11 C\C(=C\C(=O)NC)\c1ccccc1 Amb24369890 [0,2,0,0,0,0|0,0,2]=4 8859 B13R1.11 C\C(=C\C(O)CC)\c1ccccc1 Amb24719717 [0,2,0,0,0,0|1,0,1]=4 8860 B13R1.11 C\C(\C=O)=C/C(C)c1ccccc1 Amb18647861 [0,2,0,0,0,0|1,0,1]=4 8861 B13R1.11 C\C(\CC(C)c1ccccc1)=N/O Amb25255452 [0,2,0,0,0,0|1,0,0]=3 8862 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,2,0,0,0,0|2,0,0]=4 8863 B13R1.11 C\C(\CC(O)c1ccccc1)=C\Cl Amb25794461 [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.11 C\C(\CCl)=C\C(C)c1ccccc1 Amb25840684 [0,2,0,0,0,0|1,0,1]=4 8865 B13R1.11 C\C(\CO)=C\C(C)c1ccccc1 Amb24495198 [0,2,0,0,0,0|1,0,1]=4 8866 B13R1.11 C\C=C(/F)\CN(C)c1ccccc1 Amb22546801 [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.11 ClCC(=O)NC(c1ccccc1)C Amb1643934 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.11 ClCC(=O)N[C@@H](c1ccccc1)C Amb10844688 [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.11 ClCC(=O)N[C@H](c1ccccc1)C Amb10844690 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.11 NC(CC(=O)NO)c1ccccc1 Amb25118570 [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.11 NCC(=O)NC(c1ccccc1)C Amb10767123 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.11 NCC(CN(c1ccccc1)C)O Amb1137408 [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.11 N[C@H](CC(=O)NO)c1ccccc1 Amb24586364 [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.11 OC(c1ccccc1)CC(C#N)C Amb17335052 [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.11 OCC(=O)NC(c1ccccc1)C Amb1110697 [0,2,0,0,0,0|2,0,0]=4 8878 B13R1.11 OCC(CN(c1ccccc1)C)O Amb17335487 [0,2,0,0,0,0|2,0,0]=4 8879 B13R1.24 C=CCCNC(c1ccccc1)C Amb10568493 [0,2,0,0,0,0|1,0,1]=4 8880 B13R1.24 C=CCNCC(c1ccccc1)C Amb2119615 [0,2,0,0,0,0|0,0,0]=2 8881 B13R1.24 CC#CCCC(O)c1ccccc1 Amb18804027 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.24 CC#CCNC(C)c1c[n]ccc1 Amb18183864 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.24 CC#CCNC(C)c1cc[n]cc1 Amb18804161 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.24 CC#CCNC(C)c1cccc[n]1 Amb18804162 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.24 CC#CCNC(C)c1ccccc1 Amb18183770 [0,2,0,0,0,0|1,0,0]=3 8886 B13R1.24 CC#CCN[C@@H](C)c1c[n]ccc1 Amb24489255 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.24 CC#CCN[C@@H](C)c1cc[n]cc1 Amb25798806 [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.24 CC#CCN[C@@H](C)c1cccc[n]1 Amb25310867 [0,2,0,0,0,0|2,0,0]=4 8889 B13R1.24 CC#CCN[C@@H](C)c1ccccc1 Amb25815428 [0,2,0,0,0,0|1,0,0]=3 8890 B13R1.24 CC#CCN[C@H](C)c1cc[n]cc1 Amb24709644 [0,2,0,0,0,0|2,0,0]=4 8891 B13R1.24 CC#CCN[C@H](C)c1cccc[n]1 Amb25108880 [0,2,0,0,0,0|2,0,0]=4 8892 B13R1.24 CC#CCSC(C)c1ccccc1 Amb25077761 [0,2,0,0,0,0|1,0,0]=3 8893 B13R1.24 CC(NCCCO)c1c[n]ccc1 Amb21880109 [0,2,0,0,0,0|2,0,0]=4 8894 B13R1.24 CC(NCCCO)c1cccc[n]1 Amb22283685 [0,2,0,0,0,0|2,0,0]=4 8895 B13R1.24 CC=C=CCC(O)c1ccccc1 Amb24533588 [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.24 CCC#CCC(N)c1ccccc1 Amb25373904 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.24 CCCCC[C@@H](N)c1ccccc1 Amb22288650 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.24 CCCNCC(c1ccccc1)C Amb2119487 [0,2,0,0,0,0|0,0,0]=2 8899 B13R1.24 CCCOCC(O)c1ccccc1 Amb18809348 [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.24 CCNCCN(C)c1ccccc1 Amb18186271 [0,2,0,0,0,0|1,0,0]=3 8901 B13R1.24 CN(CC#CCO)c1ccccc1 Amb25079222 [0,2,0,0,0,0|2,0,0]=4 8902 B13R1.24 CNCCCC(c1cccnc1)O Amb17617181 [0,2,0,0,0,0|2,0,0]=4 8903 B13R1.24 CNCCC[13CH]([13c]1[13cH][13cH][13cH]n[13cH]1)O Amb17617182 [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.24 CNCCNC(=O)c1ccccc1 Amb19028050 [0,2,0,0,0,0|1,0,1]=4 8905 B13R1.24 CNCCNC(C)c1ccccc1 Amb18648173 [0,2,0,0,0,0|0,0,0]=2 8906 B13R1.24 COCC#C[C@H](O)c1ccccc1 Amb25346279 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.24 C\C(=C/CCCN)\c1ccccc1 Amb18065585 [0,2,0,0,0,0|1,0,1]=4 8908 B13R1.24 NCCCNC(c1ccccc1)C Amb17315288 [0,2,0,0,0,0|1,0,0]=3 8909 B13R1.24 NCCCOC(c1ccccc1)C Amb1217768 [0,2,0,0,0,0|1,0,0]=3 8910 B13R1.24 NCCCSC(c1ccccc1)C Amb17500696 [0,2,0,0,0,0|1,0,0]=3 8911 B13R1.24 NCCNCC(O)c1ccccc1 Amb18796312 [0,2,0,0,0,0|1,0,0]=3 8912 B13R1.24 OCC#CCC(O)c1ccccc1 Amb25346105 [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.24 OCCCNC(c1ccccn1)C Amb1071370 [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.24 OCCCNC(c1cccnc1)C Amb1070102 [0,2,0,0,0,0|2,0,0]=4 8915 B13R1.24 OCCNCC(c1ccccc1)C Amb1851160 [0,2,0,0,0,0|0,0,0]=2 8916 B13R1.45 CC(=CCC(C)=O)c1ccccc1 Amb24090254 [0,2,0,0,0,0|1,0,1]=4 8917 B13R1.45 CC(=O)C=CC(C)c1ccccc1 Amb24090253 [0,2,0,0,0,0|1,0,1]=4 8918 B13R1.45 CC(=O)NCC(C)c1cc[n]cc1 Amb25167442 [0,2,0,0,0,0|1,0,0]=3 8919 B13R1.45 CC(=O)NCC(O)c1ccc[n]c1 Amb25091917 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 Amb25311245 [0,2,0,0,0,0|0,0,0]=2 8921 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 Amb24435357 [0,2,0,0,0,0|1,0,0]=3 8922 B13R1.45 CC(=O)NC[C@H](N)c1ccccc1 Amb25752007 [0,2,0,0,0,0|1,0,0]=3 8923 B13R1.45 CC(=O)NNC(C)c1ccccc1 Amb24573888 [0,2,0,0,0,0|1,0,0]=3 8924 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb25292084 [0,2,0,0,0,0|1,0,1]=4 8925 B13R1.45 CC(=O)\C=C\[C@H](C)c1ccccc1 Amb25059669 [0,2,0,0,0,0|1,0,1]=4 8926 B13R1.45 CC(C#CC(C)O)c1ccccc1 Amb25191741 [0,2,0,0,0,0|1,0,1]=4 8927 B13R1.45 CC(C)=CCN(C)c1ccccc1 Amb22546825 [0,2,0,0,0,0|2,0,0]=4 8928 B13R1.45 CC(C)=CC[C@@H](N)c1ccccc1 Amb25188074 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.45 CC(C)=NCC(O)c1ccccc1 Amb25670758 [0,2,0,0,0,0|1,0,1]=4 8930 B13R1.45 CC(C)NCC(O)c1ccccc1 Amb22496618 [0,2,0,0,0,0|1,0,0]=3 8931 B13R1.45 CC(CNC(N)=N)c1ccccc1 Amb25286782 [0,2,0,0,0,0|0,0,1]=3 8932 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [0,2,0,0,0,0|0,0,1]=3 8933 B13R1.45 CC(CSC(N)=N)c1ccccc1 Amb20676022 [0,2,0,0,0,0|1,0,1]=4 8934 B13R1.45 CC(NCC(c1ccccn1)O)C Amb17138984 [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.45 CC(NCC(c1cccnc1)O)C Amb17138985 [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.45 CC(NNC(N)=O)c1ccccc1 Amb24070020 [0,2,0,0,0,0|1,0,1]=4 8937 B13R1.45 CC(NNC(N)=S)c1ccccc1 Amb24693853 [0,2,0,0,0,0|1,0,1]=4 8938 B13R1.45 CC(SCC(O)=O)c1ccccc1 Amb22275729 [0,2,0,0,0,0|2,0,0]=4 8939 B13R1.45 CC(\C=C\C(C)O)c1ccccc1 Amb25797120 [0,2,0,0,0,0|1,0,1]=4 8940 B13R1.45 CC(\N=C\C(C)Cl)c1ccccc1 Amb24677854 [0,2,0,0,0,0|1,0,1]=4 8941 B13R1.45 CC(\N=C\N(C)C)c1ccccc1 Amb25284094 [0,2,0,0,0,0|0,0,1]=3 8942 B13R1.45 CC(c1ccccc1)CNC(C)C Amb2119052 [0,2,0,0,0,0|0,0,0]=2 8943 B13R1.45 CC(c1ccccc1)NCC(=O)N Amb1114995 [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.45 CC(c1ccccc1)NCC(F)F Amb16229907 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [0,2,0,0,0,0|1,0,0]=3 8946 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 Amb24181885 [0,2,0,0,0,0|1,0,0]=3 8947 B13R1.45 CN(C)CNC(=S)c1ccccc1 Amb24489129 [0,2,0,0,0,0|1,0,1]=4 8948 B13R1.45 CN(C)\C=N\N(C)c1ccccc1 Amb24587280 [0,2,0,0,0,0|1,0,1]=4 8949 B13R1.45 CN(CCC(=C)c1ccccc1)C Amb10976100 [0,2,0,0,0,0|0,0,2]=4 8950 B13R1.45 CN(CCC(=O)c1ccccc1)C Amb1106335 [0,2,0,0,0,0|1,0,1]=4 8951 B13R1.45 CN(CCC(=O)c1ccccc1)C Amb1197569 [0,2,0,0,0,0|1,0,1]=4 8952 B13R1.45 CN(CCC(c1cccnc1)O)C Amb2432417 [0,2,0,0,0,0|2,0,0]=4 8953 B13R1.45 CN(CNC(=O)c1ccccc1)C Amb10565604 [0,2,0,0,0,0|1,0,1]=4 8954 B13R1.45 CN(O)CCC(=O)c1ccccc1 Amb22228994 [0,2,0,0,0,0|1,0,1]=4 8955 B13R1.45 CN(c1ccccc1)CCN(C)C Amb17233495 [0,2,0,0,0,0|1,0,0]=3 8956 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.45 C[C@@H](NCC(O)=O)c1ccccc1 Amb17935709 [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.45 C[C@@H](\N=C\C(F)F)c1ccccc1 Amb19883867 [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.45 C[C@@H](\N=C\[C@H](C)Cl)c1ccccc1 Amb24635636 [0,2,0,0,0,0|1,0,1]=4 8960 B13R1.45 C[C@H](NCC(O)=O)c1ccccc1 Amb17935708 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.45 C[C@H](\N=C\C(F)F)c1ccccc1 Amb19883868 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.45 C[C@H](c1ccccc1)\N=C\C(C)C Amb10562654 [0,2,0,0,0,0|1,0,1]=4 8963 B13R1.45 C\C(=C\CC(C)=O)\c1ccccc1 Amb24392921 [0,2,0,0,0,0|1,0,1]=4 8964 B13R1.45 C\C(=N/NC(=O)C)\c1ccccc1 Amb1834900 [0,2,0,0,0,0|1,0,1]=4 8965 B13R1.45 C\C(=N\CC(C)O)\c1ccccc1 Amb25180193 [0,2,0,0,0,0|1,0,1]=4 8966 B13R1.45 C\C(\Cl)=C\CC(O)c1ccccc1 Amb24752308 [0,2,0,0,0,0|2,0,0]=4 8967 B13R1.45 ClC(c1ccccc1)CCC(=O)C Amb17402167 [0,2,0,0,0,0|2,0,0]=4 8968 B13R1.45 NC(=N)NCC(O)c1ccccc1 Amb18804880 [0,2,0,0,0,0|1,0,1]=4 8969 B13R1.45 NC(c1ccccc1)CCN(C)C Amb13949100 [0,2,0,0,0,0|1,0,0]=3 8970 B13R1.45 N[C@@H](c1ccccc1)COC(C)C Amb17061653 [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.45 O=C(c1ccccc1)CNC(=O)C Amb17335159 [0,2,0,0,0,0|1,0,1]=4 8972 B13R1.45 OC(c1ccncc1)CNC(C)C Amb17138987 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.122 CC(Br)(OCCCl)c1ccccc1 Amb22755485 [0,2,0,0,0,0|2,0,0]=4 8974 B13R1.122 CC(C)(CCC#N)c1ccccc1 Amb18127124 [0,2,0,0,0,0|1,0,1]=4 8975 B13R1.122 CC(C)(CNC#N)c1ccccc1 Amb18185838 [0,2,0,0,0,0|0,0,1]=3 8976 B13R1.122 CC(C)(CNC=O)c1ccccc1 Amb17940315 [0,2,0,0,0,0|0,0,1]=3 8977 B13R1.122 CC(C)(NCC#N)c1ccccc1 Amb24433336 [0,2,0,0,0,0|2,0,0]=4 8978 B13R1.122 CC(C)(OCC=C)c1ccccc1 Amb24101152 [0,2,0,0,0,0|1,0,1]=4 8979 B13R1.122 CC(C)(SCC#C)c1ccccc1 Amb24749276 [0,2,0,0,0,0|1,0,1]=4 8980 B13R1.122 CC(O)(CN=[N+]=[N-])c1ccccc1 Amb18184147 [0,2,0,0,0,0|1,0,1]=4 8981 B13R1.122 CC(O)(C\C=C\Cl)c1ccccc1 Amb25363240 [0,2,0,0,0,0|1,0,1]=4 8982 B13R1.122 CC(O)(\C=C\CCl)c1ccccc1 Amb24677585 [0,2,0,0,0,0|1,0,1]=4 8983 B13R1.122 CCCOC(C)(C)c1ccccc1 Amb24079810 [0,2,0,0,0,0|1,0,0]=3 8984 B13R1.122 CCNCC(C)(O)c1c[n]ccc1 Amb18064574 [0,2,0,0,0,0|1,0,0]=3 8985 B13R1.122 CCNCC(C)(O)c1cc[n]cc1 Amb18064912 [0,2,0,0,0,0|1,0,0]=3 8986 B13R1.122 CCNCC(C)(O)c1cccc[n]1 Amb18064959 [0,2,0,0,0,0|1,0,0]=3 8987 B13R1.122 CCNCC(c1ccccc1)(O)C Amb17138914 [0,2,0,0,0,0|0,0,0]=2 8988 B13R1.122 CC[NH2+]CC(C)(O)c1ccccc1 Amb19848968 [0,2,0,0,0,0|0,0,1]=3 8989 B13R1.122 C[C@@](O)(\C=C\CO)c1ccccc1 Amb25839572 [0,2,0,0,0,0|1,0,1]=4 8990 B13R1.122 C[C@](O)(CN=[N+]=[N-])c1ccccc1 Amb25351493 [0,2,0,0,0,0|1,0,1]=4 8991 B13R1.122 C[C@](O)(\C=C\CO)c1ccccc1 Amb24467421 [0,2,0,0,0,0|1,0,1]=4 8992 B13R1.122 NCCCC(c1ccccc1)(C)C Amb17078754 [0,2,0,0,0,0|1,0,0]=3 8993 B13R1.122 NCCOC(c1ccccc1)(C)C Amb10790060 [0,2,0,0,0,0|2,0,0]=4 8994 B13R1.122 O=C=NCC(c1ccccc1)(C)C Amb10071838 [0,2,0,0,0,0|0,0,2]=4 8995 B13R1.122 OCCC[Si](c1ccccc1)(C)C Amb2389336 [0,2,0,0,0,0|1,1,0]=4 8996 B13R1.122 S=C=NCC(c1ccccc1)(C)C Amb10071836 [0,2,0,0,0,0|0,0,2]=4 8997 B13R1.674 CC#CCC(N)c1ccccc1Cl Amb19062409 [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.674 CC#CCC(N)c1ccccc1F Amb19002608 [0,2,0,0,0,0|2,0,0]=4 8999 B13R1.674 CC#CCC(N)c1ccccc1I Amb25857814 [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.674 CC#CCC(O)c1ccccc1Cl Amb18324827 [0,2,0,0,0,0|2,0,0]=4 9001 B13R1.674 CC#CCC(O)c1ccccc1F Amb18178533 [0,2,0,0,0,0|2,0,0]=4 9002 B13R1.674 CC#CCC(O)c1ccccc1O Amb24364172 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.674 CC#CCN(C)c1ccccc1O Amb25136837 [0,2,0,0,0,0|2,0,0]=4 9004 B13R1.674 CC(CN=C=O)c1ccccc1Br Amb25039031 [0,2,0,0,0,0|0,0,2]=4 9005 B13R1.674 CC(NCC#N)c1ccccc1Br Amb24706533 [0,2,0,0,0,0|2,0,0]=4 9006 B13R1.674 CC(NCC#N)c1ccccc1Cl Amb18292002 [0,2,0,0,0,0|2,0,0]=4 9007 B13R1.674 CC(NCC#N)c1ccccc1F Amb18977436 [0,2,0,0,0,0|2,0,0]=4 9008 B13R1.674 CC(NCC#N)c1ccccc1O Amb25057585 [0,2,0,0,0,0|2,0,0]=4 9009 B13R1.674 CC(NCCN)c1ccccc1Br Amb18304123 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.674 CC(NCCO)c1ccccc1O Amb21955206 [0,2,0,0,0,0|2,0,0]=4 9011 B13R1.674 CCNCC(O)c1[n]cccc1Br Amb23586112 [0,2,0,0,0,0|2,0,0]=4 9012 B13R1.674 CCNCC(c1ccccc1C)O Amb17138909 [0,2,0,0,0,0|1,0,0]=3 9013 B13R1.674 CCNCC(c1ccccc1Cl)O Amb17139771 [0,2,0,0,0,0|1,0,0]=3 9014 B13R1.674 CCNCC(c1ccccc1F)O Amb17139058 [0,2,0,0,0,0|1,0,0]=3 9015 B13R1.674 CC\C=C\C(C)c1ccccc1N Amb24470012 [0,2,0,0,0,0|1,0,1]=4 9016 B13R1.674 CC\C=C\C(C)c1ccccc1O Amb24670421 [0,2,0,0,0,0|1,0,1]=4 9017 B13R1.674 CN(CCNC)c1[n]cccc1Br Amb19025579 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.674 CN(CCNC)c1cc[n]cc1Br Amb24769222 [0,2,0,0,0,0|2,0,0]=4 9019 B13R1.674 CNCCC(c1ccccc1C)C Amb17233360 [0,2,0,0,0,0|0,0,0]=2 9020 B13R1.674 CNCCC(c1ccccc1Cl)C Amb17236705 [0,2,0,0,0,0|0,0,0]=2 9021 B13R1.674 CNCCC(c1ccccc1F)C Amb17233840 [0,2,0,0,0,0|0,0,0]=2 9022 B13R1.674 C[C@@H](NCC#C)c1ccccc1Br Amb24489300 [0,2,0,0,0,0|1,0,1]=4 9023 B13R1.674 C[C@@H](NCC#C)c1ccccc1Cl Amb24692368 [0,2,0,0,0,0|1,0,1]=4 9024 B13R1.674 C[C@H](NCC#C)c1ccccc1Cl Amb24416940 [0,2,0,0,0,0|1,0,1]=4 9025 B13R1.674 C[C@H](NCC#N)c1ccccc1Cl Amb24739133 [0,2,0,0,0,0|2,0,0]=4 9026 B13R1.674 C\C(=C\CNC)\c1ccccc1F Amb25682650 [0,2,0,0,0,0|0,0,1]=3 9027 B13R1.674 C\C=C\CC(O)c1ccccc1Cl Amb25069733 [0,2,0,0,0,0|2,0,0]=4 9028 B13R1.674 C\C=C\CC(O)c1ccccc1O Amb24690502 [0,2,0,0,0,0|2,0,0]=4 9029 B13R1.674 C\C=C\CN(C)c1ccccc1I Amb25681078 [0,2,0,0,0,0|2,0,0]=4 9030 B13R1.674 Cc1ccccc1C(C)NCC#N Amb18291999 [0,2,0,0,0,0|2,0,0]=4 9031 B13R1.674 Cc1ccccc1C(N)CC#CC Amb18183778 [0,2,0,0,0,0|2,0,0]=4 9032 B13R1.674 Cc1ccccc1C(O)CC#CC Amb18183852 [0,2,0,0,0,0|2,0,0]=4 9033 B13R1.674 Cc1ccccc1[C@@H](C)NCC#N Amb25098066 [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.674 Cc1ccccc1[C@H](C)NCC#C Amb25842272 [0,2,0,0,0,0|1,0,1]=4 9035 B13R1.674 Cc1ccccc1[C@H](C)NCC#N Amb24692375 [0,2,0,0,0,0|2,0,0]=4 9036 B13R1.674 ClCCCN(c1ccccc1Br)C Amb17359053 [0,2,0,0,0,0|2,0,0]=4 9037 B13R1.674 ClCCCN(c1ccccc1C)C Amb17337269 [0,2,0,0,0,0|2,0,0]=4 9038 B13R1.674 ClCCCN(c1ccccc1Cl)C Amb17340957 [0,2,0,0,0,0|2,0,0]=4 9039 B13R1.674 ClCCCN(c1ccccc1F)C Amb17337712 [0,2,0,0,0,0|2,0,0]=4 9040 B13R1.674 NCCCC(O)c1ccccc1Br Amb18577254 [0,2,0,0,0,0|2,0,0]=4 9041 B13R1.674 NCCCC(c1ccccc1C)O Amb17233564 [0,2,0,0,0,0|2,0,0]=4 9042 B13R1.674 NCCCC(c1ccccc1Cl)O Amb17237033 [0,2,0,0,0,0|2,0,0]=4 9043 B13R1.674 NCCCC(c1ccccc1F)O Amb17233987 [0,2,0,0,0,0|2,0,0]=4 9044 B13R1.674 NCCCN(c1ccccc1Br)C Amb17059826 [0,2,0,0,0,0|2,0,0]=4 9045 B13R1.674 NCCCN(c1ccccc1Cl)C Amb17059626 [0,2,0,0,0,0|2,0,0]=4 9046 B13R1.674 OCCCN(c1ccccc1Br)C Amb17349692 [0,2,0,0,0,0|2,0,0]=4 9047 B13R1.674 OCCCN(c1ccccc1C)C Amb17335358 [0,2,0,0,0,0|2,0,0]=4 9048 B13R1.674 OCCCN(c1ccccc1Cl)C Amb17337502 [0,2,0,0,0,0|2,0,0]=4 9049 B13R1.674 OCCCN(c1ccccc1F)C Amb17335627 [0,2,0,0,0,0|2,0,0]=4 9050 B13R1.86 CC(C(C#N)NC)c1ccccc1 Amb18975499 [0,2,0,0,0,0|0,0,0]=2 9051 B13R1.86 CC(C(C#N)OC)c1ccccc1 Amb24534007 [0,2,0,0,0,0|1,0,0]=3 9052 B13R1.86 CC(C(OC)OC)c1ccccc1 Amb22336595 [0,2,0,0,0,0|1,0,0]=3 9053 B13R1.86 CCC(C#N)C(O)c1ccccc1 Amb25083808 [0,2,0,0,0,0|2,0,0]=4 9054 B13R1.86 CCC(C(=O)c1ccccc1)NC Amb17621424 [0,2,0,0,0,0|1,0,1]=4 9055 B13R1.86 CCC(NC)C(O)c1ccccc1 Amb18604539 [0,2,0,0,0,0|1,0,0]=3 9056 B13R1.86 CC[C@@H](NC)[C@H](O)c1ccccc1 Amb19133210 [0,2,0,0,0,0|1,0,0]=3 9057 B13R1.86 CC[C@H](C#N)[C@@H](O)c1ccccc1 Amb25069704 [0,2,0,0,0,0|2,0,0]=4 9058 B13R1.86 CN(\C(\NC)=N/N)c1ccccc1 Amb25307805 [0,2,0,0,0,0|1,0,1]=4 9059 B13R1.86 CN(\C(\NC)=N/O)c1ccccc1 Amb24489114 [0,2,0,0,0,0|1,0,1]=4 9060 B13R1.86 CNC(C#N)C(O)c1ccccc1 Amb25752020 [0,2,0,0,0,0|1,0,0]=3 9061 B13R1.86 CNC(C#N)[C@H](O)c1ccccc1 Amb24558381 [0,2,0,0,0,0|1,0,0]=3 9062 B13R1.86 CN[C@@H](C#N)[C@@H](O)c1ccccc1 Amb24310254 [0,2,0,0,0,0|1,0,0]=3 9063 B13R1.86 CN\C(=N\N)\C(C)c1ccccc1 Amb24427117 [0,2,0,0,0,0|0,0,1]=3 9064 B13R1.152 CC(=C)C(C)C(O)c1ccccc1 Amb24495101 [0,2,0,0,0,0|2,0,0]=4 9065 B13R1.152 CC(=C)C(N)C(C)c1ccccc1 Amb25180112 [0,2,0,0,0,0|1,0,0]=3 9066 B13R1.152 CC(=C)[C@@H](O)[C@@H](C)c1ccccc1 Amb25092087 [0,2,0,0,0,0|1,0,0]=3 9067 B13R1.152 CC(=N)N(C)C(C)c1ccccc1 Amb25258088 [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.152 CC(=O)C(=O)C(C)c1ccccc1 Amb24492525 [0,2,0,0,0,0|1,0,1]=4 9069 B13R1.152 CC(=O)C(C)C(C)c1ccccc1 Amb25087204 [0,2,0,0,0,0|1,0,0]=3 9070 B13R1.152 CC(=O)C(C)C(N)c1ccccc1 Amb25041504 [0,2,0,0,0,0|2,0,0]=4 9071 B13R1.152 CC(=O)C(Cl)C(N)c1ccccc1 Amb25300345 [0,2,0,0,0,0|2,0,0]=4 9072 B13R1.152 CC(=O)C(N)C(O)c1ccccc1 Amb25066908 [0,2,0,0,0,0|2,0,0]=4 9073 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 Amb25731265 [0,2,0,0,0,0|2,0,0]=4 9074 B13R1.152 CC(=O)[C@@H](C)[C@@H](C)c1ccccc1 Amb25086639 [0,2,0,0,0,0|1,0,0]=3 9075 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24467544 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb25290208 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.152 CC(=O)[C@@H](O)[C@@H](O)c1ccccc1 Amb24704823 [0,2,0,0,0,0|2,0,0]=4 9078 B13R1.152 CC(=O)[C@H](C)[C@H](O)c1ccccc1 Amb24492637 [0,2,0,0,0,0|2,0,0]=4 9079 B13R1.152 CC(=O)[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb24574713 [0,2,0,0,0,0|2,0,0]=4 9080 B13R1.152 CC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb24652637 [0,2,0,0,0,0|2,0,0]=4 9081 B13R1.152 CC(=O)[C@H](O)[C@H](O)c1ccccc1 Amb24752230 [0,2,0,0,0,0|2,0,0]=4 9082 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb17613282 [0,2,0,0,0,0|1,0,1]=4 9083 B13R1.152 CC(C(Br)C(O)=O)c1ccccc1 Amb24396296 [0,2,0,0,0,0|2,0,0]=4 9084 B13R1.152 CC(C(C(=O)O)N)c1ccccc1 Amb10072242 [0,2,0,0,0,0|2,0,0]=4 9085 B13R1.152 CC(C(C(=O)O)O)c1ccccc1 Amb10549583 [0,2,0,0,0,0|2,0,0]=4 9086 B13R1.152 CC(C(C)c1ccccc1)C(=O)Cl Amb25197974 [0,2,0,0,0,0|2,0,0]=4 9087 B13R1.152 CC(C(Cl)C(N)=O)c1ccccc1 Amb18330991 [0,2,0,0,0,0|2,0,0]=4 9088 B13R1.152 CC(C(Cl)C(O)=O)c1ccccc1 Amb25773999 [0,2,0,0,0,0|2,0,0]=4 9089 B13R1.152 CC(C(F)C(O)=O)c1ccccc1 Amb24674555 [0,2,0,0,0,0|2,0,0]=4 9090 B13R1.152 CC(C(N)C(N)=O)c1ccccc1 Amb18975500 [0,2,0,0,0,0|2,0,0]=4 9091 B13R1.152 CC(C(O)C(C)N)c1ccccc1 Amb25311051 [0,2,0,0,0,0|1,0,0]=3 9092 B13R1.152 CC(C(O)C(N)=O)c1ccccc1 Amb18809180 [0,2,0,0,0,0|2,0,0]=4 9093 B13R1.152 CC(C(O)N(C)N)c1ccccc1 Amb25296272 [0,2,0,0,0,0|0,0,0]=2 9094 B13R1.152 CC(C(O)c1cc[n]cc1)N(C)C Amb24466284 [0,2,0,0,0,0|2,0,0]=4 9095 B13R1.152 CC(C(O)c1ccccc1)N(C)C Amb22731613 [0,2,0,0,0,0|1,0,0]=3 9096 B13R1.152 CC(C(O)c1ccccc1)N(C)N Amb18648407 [0,2,0,0,0,0|1,0,0]=3 9097 B13R1.152 CC(C(O)c1ccccc1)N(F)F Amb24719791 [0,2,0,0,0,0|2,0,0]=4 9098 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 Amb24400185 [0,2,0,0,0,0|1,0,1]=4 9099 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 Amb24408301 [0,2,0,0,0,0|1,0,1]=4 9100 B13R1.152 CC(C)C(C)C(Br)c1ccccc1 Amb25734752 [0,2,0,0,0,0|2,0,0]=4 9101 B13R1.152 CC(C)C(C)C(O)c1ccccc1 Amb25252696 [0,2,0,0,0,0|2,0,0]=4 9102 B13R1.152 CC(C)C(Cl)C(C)c1cc[n]cc1 Amb24657013 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.152 CC(C)C(N)C(C)c1cc[n]cc1 Amb25117537 [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.152 CC(C)C(N)C(C)c1ccccc1 Amb23536663 [0,2,0,0,0,0|1,0,0]=3 9105 B13R1.152 CC(C)C(N)C(F)c1ccccc1 Amb24459748 [0,2,0,0,0,0|2,0,0]=4 9106 B13R1.152 CC(C)C(O)C(C)c1ccccc1 Amb24704769 [0,2,0,0,0,0|1,0,0]=3 9107 B13R1.152 CC(C)[C@@H](C)[C@H](O)c1ccccc1 Amb25334712 [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.152 CC(C)[C@@H](N)[C@H](N)c1ccccc1 Amb24491912 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.152 CC(C)[C@@H](O)[C@@H](N)c1ccccc1 Amb25100965 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.152 CC(C)[C@H](N)[C@@H](N)c1ccccc1 Amb25142135 [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.152 CC(C)[C@H](O)[C@@H](C)c1ccccc1 Amb24495041 [0,2,0,0,0,0|1,0,0]=3 9112 B13R1.152 CC(C)[C@H](O)[C@H](N)c1ccccc1 Amb25132995 [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.152 CC(Cl)C(Cl)C(O)c1ccccc1 Amb24587114 [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.152 CC(Cl)C(O)C(O)c1ccccc1 Amb25798339 [0,2,0,0,0,0|2,0,0]=4 9115 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,2,0,0,0,0|2,0,0]=4 9116 B13R1.152 CC(O)C(C)C(C)c1ccccc1 Amb25332510 [0,2,0,0,0,0|1,0,0]=3 9117 B13R1.152 CC(O)C(C)C(O)c1ccccc1 Amb25741415 [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.152 CC(O)C(N)C(O)c1ccccc1 Amb25276453 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.152 CC(O)C(O)C(N)c1ccccc1 Amb25264393 [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.152 CC(O)[C@H](N)[C@@H](O)c1ccccc1 Amb24431996 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.152 CC([C@@H](N)C(O)=O)c1ccccc1 Amb24107545 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.152 CC([C@H](O)[C@H](C)N)c1ccccc1 Amb24697327 [0,2,0,0,0,0|1,0,0]=3 9123 B13R1.152 CN(C(=O)N(C)O)c1ccccc1 Amb25354711 [0,2,0,0,0,0|1,0,1]=4 9124 B13R1.152 CN(C)C(=O)N(C)c1ccccc1 Amb24351829 [0,2,0,0,0,0|1,0,1]=4 9125 B13R1.152 CN(C)C(=O)[C@@H](C)c1ccccc1 Amb25370071 [0,2,0,0,0,0|0,0,1]=3 9126 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb24056498 [0,2,0,0,0,0|1,0,1]=4 9127 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,2,0,0,0,0|1,0,1]=4 9128 B13R1.152 CN(C)C(=O)[C@H](C)c1ccccc1 Amb25093411 [0,2,0,0,0,0|0,0,1]=3 9129 B13R1.152 CN(C)C(=O)[C@H](N)c1ccccc1 Amb25291302 [0,2,0,0,0,0|1,0,1]=4 9130 B13R1.152 CN(C)C(=S)C(Cl)c1ccccc1 Amb25733493 [0,2,0,0,0,0|1,0,1]=4 9131 B13R1.152 CN(C)C(=S)C(O)c1ccccc1 Amb24533590 [0,2,0,0,0,0|1,0,1]=4 9132 B13R1.152 CN(C)C(C)C(C)c1ccccc1 Amb24653657 [0,2,0,0,0,0|0,0,0]=2 9133 B13R1.152 CN(C)C(N)C(O)c1ccccc1 Amb25266702 [0,2,0,0,0,0|1,0,0]=3 9134 B13R1.152 CN(C)[C@@H](N)[C@H](O)c1ccccc1 Amb25769450 [0,2,0,0,0,0|1,0,0]=3 9135 B13R1.152 CN(C)[C@H](C)C(=O)c1ccccc1 Amb24690735 [0,2,0,0,0,0|1,0,1]=4 9136 B13R1.152 C[C@@H](C(=O)[C@H](C)N)c1ccccc1 Amb24561937 [0,2,0,0,0,0|1,0,1]=4 9137 B13R1.152 C[C@@H](C(N)c1ccccc1)[C@H](C)O Amb25374921 [0,2,0,0,0,0|2,0,0]=4 9138 B13R1.152 C[C@@H]([C@@H](C)c1ccccc1)C(N)=O Amb25765701 [0,2,0,0,0,0|2,0,0]=4 9139 B13R1.152 C[C@@H]([C@@H](N)C(O)=O)c1ccccc1 Amb22801136 [0,2,0,0,0,0|2,0,0]=4 9140 B13R1.152 C[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25697174 [0,2,0,0,0,0|2,0,0]=4 9141 B13R1.152 C[C@@H]([C@@H](O)[C@H](C)N)c1ccccc1 Amb25040764 [0,2,0,0,0,0|1,0,0]=3 9142 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)N(C)N Amb25320408 [0,2,0,0,0,0|1,0,0]=3 9143 B13R1.152 C[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb25708376 [0,2,0,0,0,0|2,0,0]=4 9144 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)C Amb19133124 [0,2,0,0,0,0|1,0,0]=3 9145 B13R1.152 C[C@H](C(N)c1ccccc1)[C@H](C)O Amb24428937 [0,2,0,0,0,0|2,0,0]=4 9146 B13R1.152 C[C@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24420803 [0,2,0,0,0,0|2,0,0]=4 9147 B13R1.152 C[C@H](O)[C@H](Br)[C@H](O)c1ccccc1 Amb25722160 [0,2,0,0,0,0|2,0,0]=4 9148 B13R1.152 C[C@H](O)[C@H](C)[C@H](O)c1ccccc1 Amb25058514 [0,2,0,0,0,0|2,0,0]=4 9149 B13R1.152 C[C@H]([C@@H](C(=O)O)C)c1ccccc1 Amb10844123 [0,2,0,0,0,0|2,0,0]=4 9150 B13R1.152 C[C@H]([C@@H](C)O)N(C)c1ccccc1 Amb24379882 [0,2,0,0,0,0|2,0,0]=4 9151 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb19890909 [0,2,0,0,0,0|2,0,0]=4 9152 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb25101600 [0,2,0,0,0,0|2,0,0]=4 9153 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)[C@@H](C)O Amb24366647 [0,2,0,0,0,0|2,0,0]=4 9154 B13R1.152 C[C@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25363181 [0,2,0,0,0,0|2,0,0]=4 9155 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)N(C)N Amb25043845 [0,2,0,0,0,0|1,0,0]=3 9156 B13R1.152 C[C@H]([C@H](Cl)c1ccccc1)N(C)C Amb25347759 [0,2,0,0,0,0|1,0,0]=3 9157 B13R1.152 C\C(\c1ccccc1)=C(/Cl)\N(C)C Amb25061635 [0,2,0,0,0,0|0,0,2]=4 9158 B13R1.152 ClC(C(=O)N(C)C)c1ccccc1 Amb1106097 [0,2,0,0,0,0|1,0,1]=4 9159 B13R1.152 NC(C(=O)N(C)C)c1ccccc1 Amb10609379 [0,2,0,0,0,0|1,0,1]=4 9160 B13R1.152 NC(C(N(C)C)C)c1ccccc1 Amb1138452 [0,2,0,0,0,0|1,0,0]=3 9161 B13R1.152 N[C@H](C(=O)N(C)C)c1ccccc1 Amb17233442 [0,2,0,0,0,0|1,0,1]=4 9162 B13R1.152 OC(C(=O)N(C)C)c1ccccc1 Amb17400708 [0,2,0,0,0,0|1,0,1]=4 9163 B13R1.152 OC(C(C(=O)C)C)c1ccccc1 Amb17594547 [0,2,0,0,0,0|2,0,0]=4 9164 B13R1.152 OC(C(N(C)C)C)c1ccccc1 Amb2099658 [0,2,0,0,0,0|1,0,0]=3 9165 B13R1.152 OC(c1ccccc1)C(C(C)C)N Amb17138913 [0,2,0,0,0,0|2,0,0]=4 9166 B13R1.152 O[C@@H]([C@@H]([NH+](C)C)C)c1ccccc1 Amb2388354 [0,2,0,0,0,0|1,0,1]=4 9167 B13R1.152 O[C@H]([C@@H](N(C)C)C)c1ccccc1 Amb10844736 [0,2,0,0,0,0|1,0,0]=3 9168 B13R1.263 CC(C(C#N)(C)C)c1ccccc1 Amb17333812 [0,2,0,0,0,0|2,0,0]=4 9169 B13R1.263 CC(C)(NO)C(O)c1ccccc1 Amb24376632 [0,2,0,0,0,0|2,0,0]=4 9170 B13R1.263 CC(c1ccccc1)C(C)(C)C=C Amb25674649 [0,2,0,0,0,0|1,0,1]=4 9171 B13R1.263 CC(c1ccccc1)C(C)(C)C=O Amb25125280 [0,2,0,0,0,0|2,0,0]=4 9172 B13R1.263 CCC(C)(C)C(Br)c1ccccc1 Amb25357975 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.263 CCC(C)(C)C(N)c1ccccc1 Amb18994907 [0,2,0,0,0,0|2,0,0]=4 9174 B13R1.263 CCC(C)(C)C(O)c1ccccc1 Amb18184437 [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.263 CCC(C)(C)[C@@H](N)c1ccccc1 Amb25376903 [0,2,0,0,0,0|2,0,0]=4 9176 B13R1.263 CCC(C)(O)C(N)c1ccccc1 Amb25336525 [0,2,0,0,0,0|2,0,0]=4 9177 B13R1.263 CC[C@@](C)(N)[C@H](F)c1ccccc1 Amb25732708 [0,2,0,0,0,0|2,0,0]=4 9178 B13R1.263 CC[C@](C)(N)[C@H](F)c1ccccc1 Amb25309168 [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.263 CC[C@](C)(O)[C@@H](O)c1ccccc1 Amb25226363 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.263 CNC(C)(C)C(Cl)c1ccccc1 Amb25708479 [0,2,0,0,0,0|1,0,0]=3 9181 B13R1.263 CNC(C)(C)C(F)c1c[n]ccc1 Amb25138844 [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.263 CNC(C)(C)[C@@H](O)c1ccccc1 Amb24589661 [0,2,0,0,0,0|1,0,0]=3 9183 B13R1.263 CNS(=O)(=O)C(C)c1cccc[n]1 Amb22301399 [0,2,0,0,0,0|2,0,0]=4 9184 B13R1.263 CNS(=O)(=O)N(c1ccccc1)C Amb16962773 [0,2,0,0,0,0|2,0,0]=4 9185 B13R1.263 COC(C)(N)C(O)c1ccccc1 Amb24606141 [0,2,0,0,0,0|2,0,0]=4 9186 B13R1.263 COC(F)(F)C(Cl)c1ccccc1 Amb25756211 [0,2,0,0,0,0|2,0,0]=4 9187 B13R1.263 CO[C@](C)(N)[C@@H](O)c1ccccc1 Amb24382550 [0,2,0,0,0,0|2,0,0]=4 9188 B13R1.263 CSC(C)(C)C(O)c1ccccc1 Amb24430919 [0,2,0,0,0,0|2,0,0]=4 9189 B13R1.263 CSC(C)(C)[C@@H](O)c1ccccc1 Amb25837895 [0,2,0,0,0,0|2,0,0]=4 9190 B13R1.263 NCC(C(c1ccccc1)C)(C)C Amb17333855 [0,2,0,0,0,0|2,0,0]=4 9191 B13R1.696 CC(C(Br)CC)c1ccccc1Cl Amb25217479 [0,2,0,0,0,0|1,0,0]=3 9192 B13R1.696 CC(C(Cl)C#N)c1ccccc1F Amb24355380 [0,2,0,0,0,0|2,0,0]=4 9193 B13R1.696 CC(C(Cl)CC)c1ccccc1Cl Amb24520767 [0,2,0,0,0,0|1,0,0]=3 9194 B13R1.696 CC(C(Cl)CC)c1ccccc1F Amb24599346 [0,2,0,0,0,0|1,0,0]=3 9195 B13R1.696 CC(C(N)CC)c1[n]cccc1Cl Amb25857779 [0,2,0,0,0,0|2,0,0]=4 9196 B13R1.696 CC(C(N)CC)c1ccccc1Br Amb25351380 [0,2,0,0,0,0|1,0,0]=3 9197 B13R1.696 CC(C(N)CC)c1ccccc1F Amb18824068 [0,2,0,0,0,0|1,0,0]=3 9198 B13R1.696 CC(C(N)CO)c1ccccc1O Amb24569521 [0,2,0,0,0,0|2,0,0]=4 9199 B13R1.696 CC(C(O)CC)c1ccccc1Br Amb25180904 [0,2,0,0,0,0|1,0,0]=3 9200 B13R1.696 CC(C(O)CC)c1ccccc1Cl Amb24454174 [0,2,0,0,0,0|1,0,0]=3 9201 B13R1.696 CC(C(O)CC)c1ccccc1F Amb25229801 [0,2,0,0,0,0|1,0,0]=3 9202 B13R1.696 CC(CC)C(C)c1c[n]ccc1N Amb25061605 [0,2,0,0,0,0|2,0,0]=4 9203 B13R1.696 CC(CC)C(C)c1ccc[n]c1N Amb25765991 [0,2,0,0,0,0|2,0,0]=4 9204 B13R1.696 CC(CC)C(N)c1ccccc1F Amb25801292 [0,2,0,0,0,0|2,0,0]=4 9205 B13R1.696 CC(CC)C(N)c1ccccc1I Amb25726724 [0,2,0,0,0,0|2,0,0]=4 9206 B13R1.696 CC(CC)C(O)c1ccccc1Br Amb25739229 [0,2,0,0,0,0|2,0,0]=4 9207 B13R1.696 CC(CC)C(O)c1ccccc1Cl Amb25772042 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.696 CC(CC)C(O)c1ccccc1F Amb25732205 [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.696 CC(CC)C(O)c1ccccc1I Amb25787566 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.696 CC(CC)C(O)c1ccccc1N Amb24669631 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.696 CC(CC)[C@H](N)c1ccccc1Br Amb24610185 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.696 CC(NC)C(C)c1ccccc1F Amb24639929 [0,2,0,0,0,0|0,0,0]=2 9213 B13R1.696 CC(NC)C(O)c1ccccc1Cl Amb24488847 [0,2,0,0,0,0|1,0,0]=3 9214 B13R1.696 CCC(=O)C(C)c1ccccc1F Amb24590756 [0,2,0,0,0,0|1,0,1]=4 9215 B13R1.696 CCC(C(n1ccccc1=O)C)N Amb1137295 [0,2,0,0,0,0|2,0,0]=4 9216 B13R1.696 CCC(N)C(N)c1ccccc1Cl Amb25200306 [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.696 CCC(N)C(O)c1ccccc1F Amb19149127 [0,2,0,0,0,0|2,0,0]=4 9218 B13R1.696 CCC(N)C(O)c1ccccc1O Amb18824101 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.696 CCC(O)C(N)c1ccccc1O Amb25739716 [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.696 CCC(O)C(O)c1ccccc1Cl Amb25225440 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.696 CCC(O)C(O)c1ccccc1F Amb24496070 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.696 CCS(=O)C(C)c1ccccc1Cl Amb24510086 [0,2,0,0,0,0|2,0,0]=4 9223 B13R1.696 CCS(=O)C(C)c1ccccc1F Amb25072307 [0,2,0,0,0,0|2,0,0]=4 9224 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1N Amb25258564 [0,2,0,0,0,0|2,0,0]=4 9225 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1O Amb24566282 [0,2,0,0,0,0|2,0,0]=4 9226 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1Cl Amb24742405 [0,2,0,0,0,0|2,0,0]=4 9227 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1Cl Amb25739636 [0,2,0,0,0,0|2,0,0]=4 9228 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1I Amb25826260 [0,2,0,0,0,0|2,0,0]=4 9229 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1Br Amb24694474 [0,2,0,0,0,0|2,0,0]=4 9230 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1N Amb25326716 [0,2,0,0,0,0|2,0,0]=4 9231 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1F Amb24652764 [0,2,0,0,0,0|2,0,0]=4 9232 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1N Amb24542906 [0,2,0,0,0,0|2,0,0]=4 9233 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1Br Amb24662628 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1Cl Amb24463839 [0,2,0,0,0,0|2,0,0]=4 9235 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1F Amb25191591 [0,2,0,0,0,0|2,0,0]=4 9236 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1I Amb25158280 [0,2,0,0,0,0|2,0,0]=4 9237 B13R1.696 CN(C(=N)NC)c1ccccc1F Amb18805221 [0,2,0,0,0,0|1,0,1]=4 9238 B13R1.696 CN(C(=S)NC)c1ccccc1F Amb25820151 [0,2,0,0,0,0|1,0,1]=4 9239 B13R1.696 CN(CC)C(C)c1ccccc1Br Amb25681092 [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.696 CN(CC)C(C)c1ccccc1Cl Amb25663458 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.696 CN(CC)C(C)c1ccccc1O Amb24491373 [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.696 CNC(=O)C(Cl)c1ccccc1Br Amb24449759 [0,2,0,0,0,0|1,0,1]=4 9243 B13R1.696 CNC(=O)C(Cl)c1ccccc1Cl Amb25198433 [0,2,0,0,0,0|1,0,1]=4 9244 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,2,0,0,0,0|1,0,1]=4 9245 B13R1.696 CNC(=O)C(c1ccccc1Cl)C Amb2444727 [0,2,0,0,0,0|0,0,1]=3 9246 B13R1.696 CNC(=S)N(c1ccccc1I)C Amb12197138 [0,2,0,0,0,0|1,0,1]=4 9247 B13R1.696 CNC(C(=O)c1ccccc1C)C Amb17617550 [0,2,0,0,0,0|1,0,1]=4 9248 B13R1.696 CNC(C)C(=O)c1ccccc1Cl Amb25731975 [0,2,0,0,0,0|1,0,1]=4 9249 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb22055293 [0,2,0,0,0,0|1,0,1]=4 9250 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,2,0,0,0,0|1,0,1]=4 9251 B13R1.696 COC(=O)C(C)c1ccccc1Br Amb24597051 [0,2,0,0,0,0|1,0,1]=4 9252 B13R1.696 COC(=O)C(C)c1ccccc1Cl Amb19084563 [0,2,0,0,0,0|1,0,1]=4 9253 B13R1.696 COC(=O)C(C)c1ccccc1F Amb18187069 [0,2,0,0,0,0|1,0,1]=4 9254 B13R1.696 COC(=O)C(C)c1ccccc1I Amb24341288 [0,2,0,0,0,0|1,0,1]=4 9255 B13R1.696 COC(=O)C(C)c1ccccc1N Amb24634329 [0,2,0,0,0,0|1,0,1]=4 9256 B13R1.696 COC(=O)C(C)c1ccccc1O Amb24343860 [0,2,0,0,0,0|1,0,1]=4 9257 B13R1.696 C[C@@H](NC)[C@@H](O)c1ccccc1O Amb24664354 [0,2,0,0,0,0|1,0,0]=3 9258 B13R1.696 C[C@@H](OC)[C@@H](C)c1ccccc1N Amb25794161 [0,2,0,0,0,0|1,0,0]=3 9259 B13R1.696 C[C@@H](OC)[C@H](C)c1ccccc1N Amb24433240 [0,2,0,0,0,0|1,0,0]=3 9260 B13R1.696 C\C=C(\Cl)/C(C)c1ccccc1N Amb24665072 [0,2,0,0,0,0|1,0,1]=4 9261 B13R1.696 Cc1ccccc1C(=O)C(C)NC Amb25836669 [0,2,0,0,0,0|1,0,1]=4 9262 B13R1.696 Cc1ccccc1C(C)C(=O)OC Amb18184315 [0,2,0,0,0,0|1,0,1]=4 9263 B13R1.696 Cc1ccccc1C(C)C(Br)CC Amb24409402 [0,2,0,0,0,0|1,0,0]=3 9264 B13R1.696 Cc1ccccc1C(C)C(C)CN Amb25068214 [0,2,0,0,0,0|2,0,0]=4 9265 B13R1.696 Cc1ccccc1C(C)C(C)NC Amb25118909 [0,2,0,0,0,0|0,0,0]=2 9266 B13R1.696 Cc1ccccc1C(C)N(C)CC Amb24430722 [0,2,0,0,0,0|2,0,0]=4 9267 B13R1.696 Cc1ccccc1C(Cl)C(=O)NC Amb18330995 [0,2,0,0,0,0|1,0,1]=4 9268 B13R1.696 Cc1ccccc1C(N)C(=O)NC Amb25127837 [0,2,0,0,0,0|1,0,1]=4 9269 B13R1.696 Cc1ccccc1C(N)C(C)CC Amb25682854 [0,2,0,0,0,0|2,0,0]=4 9270 B13R1.696 Cc1ccccc1C(N)C(C)OC Amb25306982 [0,2,0,0,0,0|2,0,0]=4 9271 B13R1.696 Cc1ccccc1C(N)C(O)CC Amb25787351 [0,2,0,0,0,0|2,0,0]=4 9272 B13R1.696 Cc1ccccc1C(O)C(C)CC Amb25137663 [0,2,0,0,0,0|2,0,0]=4 9273 B13R1.696 Cc1ccccc1C(O)C(O)CC Amb25277907 [0,2,0,0,0,0|2,0,0]=4 9274 B13R1.696 Cc1ccccc1N(C)C(=N)NC Amb18184202 [0,2,0,0,0,0|1,0,1]=4 9275 B13R1.696 Cc1ccccc1N(C)C(=O)NC Amb25323417 [0,2,0,0,0,0|1,0,1]=4 9276 B13R1.696 Cc1ccccc1N(C)C(=S)NC Amb25155854 [0,2,0,0,0,0|1,0,1]=4 9277 B13R1.696 Cc1ccccc1[C@@H](N)C(C)CC Amb25227944 [0,2,0,0,0,0|2,0,0]=4 9278 B13R1.696 Cc1ccccc1[C@@H](O)C(C)CC Amb25846942 [0,2,0,0,0,0|2,0,0]=4 9279 B13R1.696 Cc1ccccc1[C@@H](O)[C@@H](N)CC Amb25201744 [0,2,0,0,0,0|2,0,0]=4 9280 B13R1.696 Cc1ccccc1[C@H](N)C(C)CC Amb24598947 [0,2,0,0,0,0|2,0,0]=4 9281 B13R1.696 Cc1ccccc1[C@H](O)[C@@H](N)CC Amb25242663 [0,2,0,0,0,0|2,0,0]=4 9282 B13R1.696 Cc1ccccc1[C@H](O)[C@H](C)CC Amb25741360 [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.708 CC(Br)(C(=O)OC)c1ccccc1 Amb23537917 [0,2,0,0,0,0|1,0,1]=4 9284 B13R1.708 CC(C)(C(=N)OC)c1ccccc1 Amb18790848 [0,2,0,0,0,0|1,0,1]=4 9285 B13R1.708 CC(C)(C(=O)CC)c1ccccc1 Amb18790765 [0,2,0,0,0,0|1,0,1]=4 9286 B13R1.708 CC(C)(C(N)CO)c1ccccc1 Amb25829518 [0,2,0,0,0,0|2,0,0]=4 9287 B13R1.708 CC(C)([C@@H](O)C#C)c1ccccc1 Amb25373478 [0,2,0,0,0,0|1,0,1]=4 9288 B13R1.708 CC(C=C)C(C)(N)c1ccccc1 Amb25695897 [0,2,0,0,0,0|1,0,1]=4 9289 B13R1.708 CC(Cl)(C(=O)NC)c1ccccc1 Amb24492676 [0,2,0,0,0,0|0,0,1]=3 9290 B13R1.708 CC(N)(C(=O)CC)c1ccccc1 Amb25843629 [0,2,0,0,0,0|1,0,1]=4 9291 B13R1.708 CC(N)(C(=O)NC)c1ccccc1 Amb18961972 [0,2,0,0,0,0|0,0,1]=3 9292 B13R1.708 CC(N)(C(=O)NO)c1ccccc1 Amb25772043 [0,2,0,0,0,0|1,0,1]=4 9293 B13R1.708 CC(N)(C(=O)OC)c1ccccc1 Amb19373026 [0,2,0,0,0,0|1,0,1]=4 9294 B13R1.708 CC(NN)C(C)(C)c1ccccc1 Amb24618175 [0,2,0,0,0,0|1,0,0]=3 9295 B13R1.708 CC(O)(C(=O)NC)c1cccc[n]1 Amb25369257 [0,2,0,0,0,0|1,0,1]=4 9296 B13R1.708 CC(O)(C(=O)OC)c1ccccc1 Amb18186543 [0,2,0,0,0,0|1,0,1]=4 9297 B13R1.708 CC(O)(C(O)C#C)c1ccccc1 Amb24495708 [0,2,0,0,0,0|1,0,1]=4 9298 B13R1.708 CC(O)(C(O)C=C)c1ccccc1 Amb24379798 [0,2,0,0,0,0|1,0,1]=4 9299 B13R1.708 CCC(C)C(C)(N)c1c[n]ccc1 Amb18970012 [0,2,0,0,0,0|2,0,0]=4 9300 B13R1.708 CCC(C)C(C)(N)c1ccccc1 Amb18969892 [0,2,0,0,0,0|1,0,0]=3 9301 B13R1.708 CCC(C)C(C)(O)c1c[n]ccc1 Amb18796159 [0,2,0,0,0,0|2,0,0]=4 9302 B13R1.708 CCC(C)C(C)(O)c1ccccc1 Amb18180852 [0,2,0,0,0,0|1,0,0]=3 9303 B13R1.708 CCC(N)C(C)(C)c1ccccc1 Amb18303249 [0,2,0,0,0,0|1,0,0]=3 9304 B13R1.708 CCC(O)C(C)(C)c1ccccc1 Amb18178607 [0,2,0,0,0,0|1,0,0]=3 9305 B13R1.708 CCC(O)C(C)(O)c1cc[n]cc1 Amb24495107 [0,2,0,0,0,0|2,0,0]=4 9306 B13R1.708 CCC(O)C(C)(O)c1cccc[n]1 Amb24475807 [0,2,0,0,0,0|2,0,0]=4 9307 B13R1.708 CCC(O)C(C)(O)c1ccccc1 Amb25332126 [0,2,0,0,0,0|1,0,0]=3 9308 B13R1.708 CCC(O)[Si](C)(C)c1ccccc1 Amb25714492 [0,2,0,0,0,0|1,1,0]=4 9309 B13R1.708 CCN(C)C(C)(C)c1ccccc1 Amb25856258 [0,2,0,0,0,0|2,0,0]=4 9310 B13R1.708 CCS(=O)C(C)(C)c1ccccc1 Amb24510228 [0,2,0,0,0,0|2,0,0]=4 9311 B13R1.708 CC[C@@H](N)C(C)(C)c1ccccc1 Amb25772208 [0,2,0,0,0,0|1,0,0]=3 9312 B13R1.708 CC[C@@H](O)[Si](C)(C)c1ccccc1 Amb24355235 [0,2,0,0,0,0|1,1,0]=4 9313 B13R1.708 CC[C@H](N)C(C)(C)c1ccccc1 Amb24451438 [0,2,0,0,0,0|1,0,0]=3 9314 B13R1.708 CC[C@H](O)C(C)(C)c1ccccc1 Amb25859042 [0,2,0,0,0,0|1,0,0]=3 9315 B13R1.708 CNC(=O)C(F)(Cl)c1ccccc1 Amb25307221 [0,2,0,0,0,0|1,0,1]=4 9316 B13R1.708 CNC(C)C(C)(C)c1ccccc1 Amb19002601 [0,2,0,0,0,0|0,0,0]=2 9317 B13R1.708 CN[C@@H](C)C(C)(O)c1ccccc1 Amb25377136 [0,2,0,0,0,0|0,0,0]=2 9318 B13R1.708 CN[C@@H](C)[C@](C)(O)c1ccccc1 Amb24542841 [0,2,0,0,0,0|0,0,0]=2 9319 B13R1.708 COC(=O)C(c1ccccc1)(N)C Amb17400717 [0,2,0,0,0,0|1,0,1]=4 9320 B13R1.708 COC(C)C(C)(O)c1ccccc1 Amb25834742 [0,2,0,0,0,0|1,0,0]=3 9321 B13R1.708 C[C@@](N)(C(=O)OC)c1ccccc1 Amb25251449 [0,2,0,0,0,0|1,0,1]=4 9322 B13R1.708 C[C@@](O)(C(=O)CC)c1ccccc1 Amb24633433 [0,2,0,0,0,0|1,0,1]=4 9323 B13R1.708 C[C@@](O)([C@@H](O)C#C)c1ccccc1 Amb25334731 [0,2,0,0,0,0|1,0,1]=4 9324 B13R1.708 C[C@H](CO)[C@@](C)(O)c1ccccc1 Amb24495489 [0,2,0,0,0,0|2,0,0]=4 9325 B13R1.708 C[C@H](CO)[C@](C)(O)c1ccccc1 Amb24370043 [0,2,0,0,0,0|2,0,0]=4 9326 B13R1.708 C[C@](O)(C(=O)CC)c1ccccc1 Amb24534294 [0,2,0,0,0,0|1,0,1]=4 9327 B13R1.347 CC(=N)NC(C)(C)c1ccccc1 Amb24529846 [0,2,0,0,0,0|2,0,0]=4 9328 B13R1.347 CC(=O)C[C@](C)(O)c1ccccc1 Amb25735198 [0,2,0,0,0,0|1,0,0]=3 9329 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 Amb25041071 [0,2,0,0,0,0|2,0,0]=4 9330 B13R1.347 CC(Br)CC(C)(C)c1c[n]ccc1 Amb24383746 [0,2,0,0,0,0|2,0,0]=4 9331 B13R1.347 CC(C)C[C@@](C)(N)c1ccccc1 Amb19889808 [0,2,0,0,0,0|1,0,0]=3 9332 B13R1.347 CC(C)NC(C)(C)c1ccccc1 Amb24346833 [0,2,0,0,0,0|2,0,0]=4 9333 B13R1.347 CC(CC(c1ccccc1)(C)C)N Amb17622184 [0,2,0,0,0,0|1,0,0]=3 9334 B13R1.347 CC(Cl)CC(C)(C)c1ccccc1 Amb25096500 [0,2,0,0,0,0|1,0,0]=3 9335 B13R1.347 CC(Cl)CC(F)(F)c1ccccc1 Amb25291723 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.347 CC(N)CC(C)(C)c1c[n]ccc1 Amb25281543 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.347 CC(O)(CC(N)=O)c1ccccc1 Amb25138678 [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.347 CC(O)CC(C)(O)c1ccccc1 Amb24387704 [0,2,0,0,0,0|1,0,0]=3 9339 B13R1.347 CN(C)CC(C)(C)c1ccccc1 Amb24665711 [0,2,0,0,0,0|0,0,0]=2 9340 B13R1.347 CN(C)CC(C)(O)c1ccccc1 Amb18184561 [0,2,0,0,0,0|0,0,0]=2 9341 B13R1.347 CN(C)CC(F)(F)c1ccccc1 Amb24469826 [0,2,0,0,0,0|1,0,0]=3 9342 B13R1.347 C[C@@](N)(CC(O)=O)c1ccccc1 Amb25707764 [0,2,0,0,0,0|2,0,0]=4 9343 B13R1.347 C[C@@](O)(CC(O)=O)c1ccccc1 Amb24634119 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.347 C[C@H](O)C[C@@](C)(O)c1ccccc1 Amb24748423 [0,2,0,0,0,0|1,0,0]=3 9345 B13R1.347 C[C@H](O)C[C@](C)(O)c1ccccc1 Amb25204745 [0,2,0,0,0,0|1,0,0]=3 9346 B13R1.347 C[C@](O)(CC(O)=O)c1ccccc1 Amb25039552 [0,2,0,0,0,0|2,0,0]=4 9347 B13R1.347 OC(=O)CC(c1ccccc1)(N)C Amb17470595 [0,2,0,0,0,0|2,0,0]=4 9348 B13R1.347 OC(=O)CC(c1ccccc1)(O)C Amb17138952 [0,2,0,0,0,0|2,0,0]=4 9349 B13R1.2819 CC#CC(C)(C)c1ccccc1O Amb25373190 [0,2,0,0,0,0|1,0,1]=4 9350 B13R1.2819 CC#CC(C)(O)c1ccccc1F Amb24376019 [0,2,0,0,0,0|1,0,1]=4 9351 B13R1.2819 CC(C)(CC#N)c1ccccc1F Amb24742775 [0,2,0,0,0,0|2,0,0]=4 9352 B13R1.2819 CC(C)(CCO)c1ccccc1Br Amb25196158 [0,2,0,0,0,0|2,0,0]=4 9353 B13R1.2819 CC(C)(CCO)c1ccccc1O Amb25130610 [0,2,0,0,0,0|2,0,0]=4 9354 B13R1.2819 CC(C)(CCO)c1ccccc1S Amb25077978 [0,2,0,0,0,0|2,0,0]=4 9355 B13R1.2819 CC(C)(CNC)c1ccccc1Br Amb24699164 [0,2,0,0,0,0|0,0,0]=2 9356 B13R1.2819 CC(C)(COC)c1ccccc1N Amb24488759 [0,2,0,0,0,0|1,0,0]=3 9357 B13R1.2819 CC(C)(NCC)c1ccccc1F Amb25854109 [0,2,0,0,0,0|2,0,0]=4 9358 B13R1.2819 CC(F)(CCN)c1ccccc1F Amb24644235 [0,2,0,0,0,0|2,0,0]=4 9359 B13R1.2819 CC(N)(CC#N)c1ccccc1Cl Amb25095240 [0,2,0,0,0,0|2,0,0]=4 9360 B13R1.2819 CC(N)(CC#N)c1ccccc1F Amb25275285 [0,2,0,0,0,0|2,0,0]=4 9361 B13R1.2819 CC(N)(CCO)c1ccccc1Br Amb24400030 [0,2,0,0,0,0|2,0,0]=4 9362 B13R1.2819 CC(N)(CCO)c1ccccc1Cl Amb18864252 [0,2,0,0,0,0|2,0,0]=4 9363 B13R1.2819 CC(N)(CCO)c1ccccc1F Amb18224778 [0,2,0,0,0,0|2,0,0]=4 9364 B13R1.2819 CC(N)(CCO)c1ccccc1S Amb24341317 [0,2,0,0,0,0|2,0,0]=4 9365 B13R1.2819 CC(N)(COC)c1cc[n]cc1F Amb25706377 [0,2,0,0,0,0|2,0,0]=4 9366 B13R1.2819 CC(N)(COC)c1ccccc1Cl Amb18299363 [0,2,0,0,0,0|1,0,0]=3 9367 B13R1.2819 CC(N)(COC)c1ccccc1F Amb18299362 [0,2,0,0,0,0|1,0,0]=3 9368 B13R1.2819 CC(O)(CC#C)c1ccccc1Br Amb24731154 [0,2,0,0,0,0|1,0,1]=4 9369 B13R1.2819 CC(O)(CC#C)c1ccccc1F Amb24554529 [0,2,0,0,0,0|1,0,1]=4 9370 B13R1.2819 CC(O)(CC=C)c1ccccc1Cl Amb25115306 [0,2,0,0,0,0|1,0,1]=4 9371 B13R1.2819 CC(O)(CC=C)c1ccccc1O Amb25773323 [0,2,0,0,0,0|1,0,1]=4 9372 B13R1.2819 CC(O)(CC=O)c1ccccc1Cl Amb25304731 [0,2,0,0,0,0|2,0,0]=4 9373 B13R1.2819 CC(O)(CCN)c1ccccc1Cl Amb18066530 [0,2,0,0,0,0|2,0,0]=4 9374 B13R1.2819 CC(O)(CCN)c1ccccc1F Amb18909327 [0,2,0,0,0,0|2,0,0]=4 9375 B13R1.2819 CC(O)(CNC)c1c[n]ccc1N Amb25828749 [0,2,0,0,0,0|1,0,0]=3 9376 B13R1.2819 CC(O)(CNC)c1cc[n]cc1F Amb25706378 [0,2,0,0,0,0|1,0,0]=3 9377 B13R1.2819 CC(O)(CNC)c1ccccc1Br Amb18301257 [0,2,0,0,0,0|0,0,0]=2 9378 B13R1.2819 CC(O)(CNC)c1ccccc1Cl Amb18997531 [0,2,0,0,0,0|0,0,0]=2 9379 B13R1.2819 CC(O)(CNC)c1ccccc1F Amb18301259 [0,2,0,0,0,0|0,0,0]=2 9380 B13R1.2819 CC(O)(COC)c1c[n]ccc1N Amb25060645 [0,2,0,0,0,0|2,0,0]=4 9381 B13R1.2819 CC(O)(COC)c1ccccc1Br Amb25823879 [0,2,0,0,0,0|1,0,0]=3 9382 B13R1.2819 CC(O)(COC)c1ccccc1Cl Amb18333908 [0,2,0,0,0,0|1,0,0]=3 9383 B13R1.2819 CC(O)(COC)c1ccccc1F Amb19074708 [0,2,0,0,0,0|1,0,0]=3 9384 B13R1.2819 CCCC(C)(C)c1ccccc1N Amb25279359 [0,2,0,0,0,0|1,0,0]=3 9385 B13R1.2819 CCCC(C)(C)c1ccccc1O Amb25768537 [0,2,0,0,0,0|1,0,0]=3 9386 B13R1.2819 CCCC(C)(O)c1cc[n]cc1F Amb25372202 [0,2,0,0,0,0|2,0,0]=4 9387 B13R1.2819 CNCC(c1ccccc1C)(C)C Amb17233329 [0,2,0,0,0,0|0,0,0]=2 9388 B13R1.2819 CNCC(c1ccccc1Cl)(C)C Amb17236690 [0,2,0,0,0,0|0,0,0]=2 9389 B13R1.2819 CNCC(c1ccccc1F)(C)C Amb17233828 [0,2,0,0,0,0|0,0,0]=2 9390 B13R1.2819 COCC(F)(F)c1ccccc1O Amb25675487 [0,2,0,0,0,0|2,0,0]=4 9391 B13R1.2819 C[C@@](N)(CC#N)c1ccccc1F Amb24438250 [0,2,0,0,0,0|2,0,0]=4 9392 B13R1.2819 C[C@@](N)(CC=C)c1ccccc1Cl Amb25265706 [0,2,0,0,0,0|1,0,1]=4 9393 B13R1.2819 C[C@@](N)(CCO)c1ccccc1F Amb25798461 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.2819 C[C@@](N)(CCO)c1ccccc1O Amb25726970 [0,2,0,0,0,0|2,0,0]=4 9395 B13R1.2819 C[C@](N)(CC#N)c1ccccc1Br Amb25364216 [0,2,0,0,0,0|2,0,0]=4 9396 B13R1.2819 C[C@](N)(CC#N)c1ccccc1F Amb24659298 [0,2,0,0,0,0|2,0,0]=4 9397 B13R1.2819 C[C@](N)(CC=C)c1ccccc1Cl Amb25786442 [0,2,0,0,0,0|1,0,1]=4 9398 B13R1.2819 C[C@](N)(CC=C)c1ccccc1O Amb25265695 [0,2,0,0,0,0|1,0,1]=4 9399 B13R1.2819 C[C@](N)(CCO)c1ccccc1N Amb25230101 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.2819 C[C@](N)(CCO)c1ccccc1S Amb25859066 [0,2,0,0,0,0|2,0,0]=4 9401 B13R1.2819 C[C@](O)(CC=C)c1ccccc1O Amb24725313 [0,2,0,0,0,0|1,0,1]=4 9402 B13R1.2819 Cc1cc[n]cc1C(C)(N)COC Amb25154942 [0,2,0,0,0,0|2,0,0]=4 9403 B13R1.2819 Cc1ccccc1C(C)(N)CC#N Amb25108305 [0,2,0,0,0,0|2,0,0]=4 9404 B13R1.2819 Cc1ccccc1C(C)(N)CC=C Amb25826064 [0,2,0,0,0,0|1,0,1]=4 9405 B13R1.2819 Cc1ccccc1C(C)(N)CCO Amb18862950 [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.2819 Cc1ccccc1C(C)(N)COC Amb18299358 [0,2,0,0,0,0|1,0,0]=3 9407 B13R1.2819 Cc1ccccc1C(C)(O)C#CC Amb25726127 [0,2,0,0,0,0|1,0,1]=4 9408 B13R1.2819 Cc1ccccc1C(C)(O)CC#C Amb25070803 [0,2,0,0,0,0|1,0,1]=4 9409 B13R1.2819 Cc1ccccc1C(C)(O)CC=O Amb25734632 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.2819 Cc1ccccc1C(C)(O)CCN Amb18065880 [0,2,0,0,0,0|2,0,0]=4 9411 B13R1.2819 Cc1ccccc1C(C)(O)CNC Amb18997533 [0,2,0,0,0,0|0,0,0]=2 9412 B13R1.2819 Cc1ccccc1C(C)(O)COC Amb18186608 [0,2,0,0,0,0|1,0,0]=3 9413 B13R1.2819 Cc1ccccc1[C@@](C)(N)CC#N Amb25667712 [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.2819 Cc1ccccc1[C@@](C)(N)CCO Amb25337526 [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.2819 Cc1ccccc1[C@](C)(N)CC#N Amb25378531 [0,2,0,0,0,0|2,0,0]=4 9416 B13R1.2819 Cc1ccccc1[C@](C)(N)CC=C Amb24490500 [0,2,0,0,0,0|1,0,1]=4 9417 B13R1.2819 Cc1ccccc1[C@](C)(N)CCO Amb25097039 [0,2,0,0,0,0|2,0,0]=4 9418 B13R1.2819 NCCC(c1ccccc1C)(C)C Amb17233328 [0,2,0,0,0,0|2,0,0]=4 9419 B13R1.2819 NCCC(c1ccccc1Cl)(C)C Amb17236689 [0,2,0,0,0,0|2,0,0]=4 9420 B13R1.2819 NCCC(c1ccccc1F)(C)C Amb17233827 [0,2,0,0,0,0|2,0,0]=4 9421 B13R1.201 CC(=C)CC(N)c1ccccc1Br Amb24720414 [0,2,0,0,0,0|2,0,0]=4 9422 B13R1.201 CC(=C)CC(N)c1ccccc1Cl Amb24388867 [0,2,0,0,0,0|2,0,0]=4 9423 B13R1.201 CC(=C)CC(N)c1ccccc1O Amb24562577 [0,2,0,0,0,0|2,0,0]=4 9424 B13R1.201 CC(=C)CC(O)c1ccccc1Cl Amb25297598 [0,2,0,0,0,0|2,0,0]=4 9425 B13R1.201 CC(=C)CC(O)c1ccccc1I Amb24447342 [0,2,0,0,0,0|2,0,0]=4 9426 B13R1.201 CC(=C)CC(O)c1ccccc1N Amb25047091 [0,2,0,0,0,0|2,0,0]=4 9427 B13R1.201 CC(=C)CN(C)c1ccccc1F Amb25742089 [0,2,0,0,0,0|2,0,0]=4 9428 B13R1.201 CC(=C)CN(C)c1ccccc1I Amb24676281 [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.201 CC(=C)C[C@@H](N)c1ccccc1Br Amb24598973 [0,2,0,0,0,0|2,0,0]=4 9430 B13R1.201 CC(=C)C[C@@H](N)c1ccccc1O Amb25258962 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.201 CC(=C)C[C@H](N)c1ccccc1F Amb24550709 [0,2,0,0,0,0|2,0,0]=4 9432 B13R1.201 CC(=N)NC(C)c1ccccc1F Amb25142754 [0,2,0,0,0,0|2,0,0]=4 9433 B13R1.201 CC(=O)CC(O)c1ccccc1Br Amb25080258 [0,2,0,0,0,0|2,0,0]=4 9434 B13R1.201 CC(=O)CC(O)c1ccccc1Cl Amb24495104 [0,2,0,0,0,0|2,0,0]=4 9435 B13R1.201 CC(=O)CN(C)c1ccccc1F Amb18791227 [0,2,0,0,0,0|2,0,0]=4 9436 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1Br Amb25079139 [0,2,0,0,0,0|2,0,0]=4 9437 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1F Amb25191723 [0,2,0,0,0,0|2,0,0]=4 9438 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1O Amb24357147 [0,2,0,0,0,0|2,0,0]=4 9439 B13R1.201 CC(=O)C[C@H](O)c1ccccc1Br Amb25772540 [0,2,0,0,0,0|2,0,0]=4 9440 B13R1.201 CC(=O)C[C@H](O)c1ccccc1Cl Amb24495406 [0,2,0,0,0,0|2,0,0]=4 9441 B13R1.201 CC(=O)C[C@H](O)c1ccccc1F Amb25037120 [0,2,0,0,0,0|2,0,0]=4 9442 B13R1.201 CC(=O)C[C@H](O)c1ccccc1O Amb25752693 [0,2,0,0,0,0|2,0,0]=4 9443 B13R1.201 CC(=O)NC(C)c1ccccc1F Amb25092387 [0,2,0,0,0,0|2,0,0]=4 9444 B13R1.201 CC(=O)NC(C)c1ccccc1O Amb25275237 [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.201 CC(=O)NC(c1ccccc1Br)C Amb13955929 [0,2,0,0,0,0|2,0,0]=4 9446 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1Br Amb25830780 [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1Cl Amb25180661 [0,2,0,0,0,0|2,0,0]=4 9448 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1O Amb24391637 [0,2,0,0,0,0|2,0,0]=4 9449 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Br Amb25200879 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Cl Amb24489218 [0,2,0,0,0,0|2,0,0]=4 9451 B13R1.201 CC(=O)OC(C)c1ccccc1N Amb24652367 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.201 CC(=O)O[C@@H](C)c1ccccc1Br Amb25749645 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.201 CC(=O)O[C@H](C)c1ccccc1Cl Amb25749554 [0,2,0,0,0,0|2,0,0]=4 9454 B13R1.201 CC(Br)CC(C)c1cc[n]cc1F Amb25141327 [0,2,0,0,0,0|2,0,0]=4 9455 B13R1.201 CC(Br)CC(C)c1ccccc1Cl Amb24601419 [0,2,0,0,0,0|1,0,0]=3 9456 B13R1.201 CC(C)CC(Cl)c1ccccc1Cl Amb25206809 [0,2,0,0,0,0|2,0,0]=4 9457 B13R1.201 CC(C)CC(N)c1ccccc1I Amb25782680 [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.201 CC(C)CC(O)c1ccccc1Br Amb25817415 [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.201 CC(C)CC(O)c1ccccc1I Amb24723757 [0,2,0,0,0,0|2,0,0]=4 9460 B13R1.201 CC(C)CC(O)c1ccccc1N Amb24409836 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.201 CC(C)C[C@@H](N)c1ccccc1F Amb24642029 [0,2,0,0,0,0|2,0,0]=4 9462 B13R1.201 CC(C)C[C@H](N)c1ccccc1F Amb25291100 [0,2,0,0,0,0|2,0,0]=4 9463 B13R1.201 CC(C)NC(C)c1ccccc1I Amb24393694 [0,2,0,0,0,0|2,0,0]=4 9464 B13R1.201 CC(C)NC(C)c1ccccc1N Amb23557748 [0,2,0,0,0,0|2,0,0]=4 9465 B13R1.201 CC(C)N[C@@H](C)c1ccccc1Br Amb25235148 [0,2,0,0,0,0|2,0,0]=4 9466 B13R1.201 CC(C)N[C@H](C)c1ccccc1Br Amb25192058 [0,2,0,0,0,0|2,0,0]=4 9467 B13R1.201 CC(C)SC(C)c1ccccc1Cl Amb24458327 [0,2,0,0,0,0|2,0,0]=4 9468 B13R1.201 CC(CC(C)N)c1cc[n]cc1F Amb24418786 [0,2,0,0,0,0|2,0,0]=4 9469 B13R1.201 CC(CC(C)N)c1ccccc1Cl Amb25803024 [0,2,0,0,0,0|1,0,0]=3 9470 B13R1.201 CC(CC(C)N)c1ccccc1F Amb24613466 [0,2,0,0,0,0|1,0,0]=3 9471 B13R1.201 CC(CC(C)O)c1ccccc1F Amb24362824 [0,2,0,0,0,0|1,0,0]=3 9472 B13R1.201 CC(CC(N)=N)c1ccccc1Br Amb24757079 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.201 CC(CC(N)=O)c1ccccc1O Amb25055113 [0,2,0,0,0,0|2,0,0]=4 9474 B13R1.201 CC(CC(O)=O)c1ccccc1Br Amb19293241 [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.201 CC(CC(O)=O)c1ccccc1O Amb25779942 [0,2,0,0,0,0|2,0,0]=4 9476 B13R1.201 CC(CC(c1ccccc1C)N)C Amb17233357 [0,2,0,0,0,0|2,0,0]=4 9477 B13R1.201 CC(CC(c1ccccc1C)O)C Amb17233447 [0,2,0,0,0,0|2,0,0]=4 9478 B13R1.201 CC(CC(c1ccccc1Cl)N)C Amb17236702 [0,2,0,0,0,0|2,0,0]=4 9479 B13R1.201 CC(CC(c1ccccc1Cl)O)C Amb17236852 [0,2,0,0,0,0|2,0,0]=4 9480 B13R1.201 CC(CC(c1ccccc1F)N)C Amb17233837 [0,2,0,0,0,0|2,0,0]=4 9481 B13R1.201 CC(CC(c1ccccc1F)O)C Amb17233911 [0,2,0,0,0,0|2,0,0]=4 9482 B13R1.201 CC(CC(c1ccccc1N)N)C Amb17608154 [0,2,0,0,0,0|2,0,0]=4 9483 B13R1.201 CC(CN(c1ccccc1Br)C)O Amb17349691 [0,2,0,0,0,0|2,0,0]=4 9484 B13R1.201 CC(CN(c1ccccc1C)C)N Amb17059697 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.201 CC(CN(c1ccccc1C)C)O Amb17335357 [0,2,0,0,0,0|2,0,0]=4 9486 B13R1.201 CC(CN(c1ccccc1Cl)C)N Amb17059703 [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.201 CC(CN(c1ccccc1Cl)C)O Amb17337501 [0,2,0,0,0,0|2,0,0]=4 9488 B13R1.201 CC(CN(c1ccccc1F)C)N Amb17059700 [0,2,0,0,0,0|2,0,0]=4 9489 B13R1.201 CC(CN(c1ccccc1F)C)O Amb17335626 [0,2,0,0,0,0|2,0,0]=4 9490 B13R1.201 CC(Cl)CC(C)c1c[n]ccc1N Amb24404041 [0,2,0,0,0,0|2,0,0]=4 9491 B13R1.201 CC(Cl)CC(C)c1cc[n]cc1F Amb24529580 [0,2,0,0,0,0|2,0,0]=4 9492 B13R1.201 CC(N)CC(O)c1ccccc1F Amb24723229 [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.201 CC(O)CN(C)c1ccccc1O Amb24352734 [0,2,0,0,0,0|2,0,0]=4 9494 B13R1.201 CN(C)CC(=O)c1ccccc1O Amb25160635 [0,2,0,0,0,0|1,0,1]=4 9495 B13R1.201 CN(C)CC(N)c1c[n]ccc1N Amb24696007 [0,2,0,0,0,0|2,0,0]=4 9496 B13R1.201 CN(C)CC(N)c1ccccc1Br Amb25071594 [0,2,0,0,0,0|1,0,0]=3 9497 B13R1.201 CN(C)CC(N)c1ccccc1Cl Amb24489845 [0,2,0,0,0,0|1,0,0]=3 9498 B13R1.201 CN(C)CC(O)c1c[n]ccc1N Amb25180720 [0,2,0,0,0,0|2,0,0]=4 9499 B13R1.201 CN(C)CC(O)c1ccc[n]c1N Amb24362948 [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.201 CN(C)NC(C)c1ccccc1Br Amb24363397 [0,2,0,0,0,0|1,0,0]=3 9501 B13R1.201 CN(C)NC(C)c1ccccc1N Amb25138711 [0,2,0,0,0,0|1,0,0]=3 9502 B13R1.201 CN(C)NC(C)c1ccccc1O Amb25774560 [0,2,0,0,0,0|1,0,0]=3 9503 B13R1.201 CN(CC(C)C)c1ccccc1O Amb24721659 [0,2,0,0,0,0|2,0,0]=4 9504 B13R1.201 CN(CC(C)O)c1ccccc1N Amb18297017 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.201 CN(CC(c1ccccc1C)N)C Amb1125486 [0,2,0,0,0,0|1,0,0]=3 9506 B13R1.201 CN(CC(c1ccccc1C)O)C Amb17104282 [0,2,0,0,0,0|1,0,0]=3 9507 B13R1.201 CN(CC(c1ccccc1F)N)C Amb1130761 [0,2,0,0,0,0|1,0,0]=3 9508 B13R1.201 CN(CC(c1ccccc1F)O)C Amb17104285 [0,2,0,0,0,0|1,0,0]=3 9509 B13R1.201 CN(CC(c1ccccc1O)O)C Amb17307603 [0,2,0,0,0,0|1,0,0]=3 9510 B13R1.201 CN(C[C@H](C)O)c1ccccc1F Amb24554876 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.201 CS(=O)CC(O)c1ccccc1Cl Amb22446242 [0,2,0,0,0,0|2,0,0]=4 9512 B13R1.201 C[C@@H](CC(O)=O)c1ccccc1O Amb25088403 [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.201 C\C(=N/N(C)C)\c1ccccc1O Amb25205396 [0,2,0,0,0,0|1,0,1]=4 9514 B13R1.201 C\C(=N\N(C)C)\c1ccccc1Cl Amb25762764 [0,2,0,0,0,0|1,0,1]=4 9515 B13R1.201 C\C(=N\N(C)C)\c1ccccc1N Amb24470170 [0,2,0,0,0,0|1,0,1]=4 9516 B13R1.201 Cc1cc[n]cc1C(C)CC(C)=O Amb25119429 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.201 Cc1cc[n]cc1C(C)CC(C)Cl Amb25154941 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.201 Cc1ccccc1C(C)CC(=O)Cl Amb25260778 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.201 Cc1ccccc1C(C)CC(C)=O Amb25294687 [0,2,0,0,0,0|1,0,0]=3 9520 B13R1.201 Cc1ccccc1C(C)CC(C)N Amb25780550 [0,2,0,0,0,0|1,0,0]=3 9521 B13R1.201 Cc1ccccc1C(C)NC(C)=O Amb24493712 [0,2,0,0,0,0|2,0,0]=4 9522 B13R1.201 Cc1ccccc1C(C)SC(C)=O Amb25173983 [0,2,0,0,0,0|2,0,0]=4 9523 B13R1.201 Cc1ccccc1C(C)SC(C)C Amb24751835 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.201 Cc1ccccc1C(Cl)CN(C)C Amb24648973 [0,2,0,0,0,0|1,0,0]=3 9525 B13R1.201 Cc1ccccc1C(N)CC(C)=C Amb24641326 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.201 Cc1ccccc1C(N)CS(C)=O Amb24763147 [0,2,0,0,0,0|2,0,0]=4 9527 B13R1.201 Cc1ccccc1C(O)CS(C)=O Amb22450121 [0,2,0,0,0,0|2,0,0]=4 9528 B13R1.201 Cc1ccccc1N(C)CC(C)=O Amb18790845 [0,2,0,0,0,0|2,0,0]=4 9529 B13R1.201 Cc1ccccc1N(C)C[C@H](C)N Amb25766760 [0,2,0,0,0,0|2,0,0]=4 9530 B13R1.201 Cc1ccccc1[C@@H](C)CC(C)=O Amb25767839 [0,2,0,0,0,0|1,0,0]=3 9531 B13R1.201 Cc1ccccc1[C@@H](C)NC(C)=O Amb24735511 [0,2,0,0,0,0|2,0,0]=4 9532 B13R1.201 Cc1ccccc1[C@@H](C)OC(C)=O Amb25749567 [0,2,0,0,0,0|2,0,0]=4 9533 B13R1.201 Cc1ccccc1[C@@H](O)CC(C)=O Amb24658732 [0,2,0,0,0,0|2,0,0]=4 9534 B13R1.201 Cc1ccccc1[C@H](C)NC(C)=O Amb25772447 [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.201 Cc1ccccc1[C@H](C)NC(C)C Amb24701074 [0,2,0,0,0,0|2,0,0]=4 9536 B13R1.201 Cc1ccccc1[C@H](C)OC(C)=O Amb25323394 [0,2,0,0,0,0|2,0,0]=4 9537 B13R1.201 Cc1ccccc1[C@H](N)CC(C)=C Amb24597120 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.201 Cc1ccccc1\C(\C)=N/N(C)C Amb24335238 [0,2,0,0,0,0|1,0,1]=4 9539 B13R1.201 NC(=O)CC(c1ccccc1C)C Amb17233287 [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.201 NC(=O)CC(c1ccccc1Cl)C Amb17236668 [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.201 NC(=O)CC(c1ccccc1F)C Amb17233789 [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.201 OC(=O)CC(c1ccccc1Cl)C Amb17236833 [0,2,0,0,0,0|2,0,0]=4 9543 B13R1.201 OC(=O)CC(c1ccccc1I)C Amb16210922 [0,2,0,0,0,0|2,0,0]=4 9544 B13R1.352 CC(C)(C)CC(Br)c1ccccc1 Amb24751392 [0,2,0,0,0,0|2,0,0]=4 9545 B13R1.352 CC(C)(C)CC(Cl)c1ccccc1 Amb25187998 [0,2,0,0,0,0|2,0,0]=4 9546 B13R1.352 CC(C)(C)C[C@@H](Cl)c1ccccc1 Amb25039551 [0,2,0,0,0,0|2,0,0]=4 9547 B13R1.352 CC(C)(C)C[C@@H](O)c1ccccc1 Amb25730967 [0,2,0,0,0,0|2,0,0]=4 9548 B13R1.352 CC(C)(C)C[C@H](Cl)c1ccccc1 Amb24470101 [0,2,0,0,0,0|2,0,0]=4 9549 B13R1.352 CC(C)(C)C[C@H](O)c1ccccc1 Amb25058564 [0,2,0,0,0,0|2,0,0]=4 9550 B13R1.352 CC(C)(N)CC(O)c1ccccc1 Amb18194410 [0,2,0,0,0,0|2,0,0]=4 9551 B13R1.352 CC(CC(C)(C)O)c1ccccc1 Amb25175754 [0,2,0,0,0,0|1,0,0]=3 9552 B13R1.352 CC(CC(F)(F)F)c1ccccc1 Amb20669795 [0,2,0,0,0,0|2,0,0]=4 9553 B13R1.352 CC(CS(=O)(=O)Cl)c1ccccc1 Amb18985655 [0,2,0,0,0,0|2,0,0]=4 9554 B13R1.352 CC(CS(N)(=O)=O)c1ccccc1 Amb18332333 [0,2,0,0,0,0|2,0,0]=4 9555 B13R1.352 CC(C[Si](C)(Cl)Cl)c1ccccc1 Amb19893953 [0,2,0,0,0,0|1,0,0]=3 9556 B13R1.352 CC(C[Si](Cl)(Cl)Cl)c1ccccc1 Amb19893951 [0,2,0,0,0,0|2,0,0]=4 9557 B13R1.352 CC(F)(F)CC(Br)c1ccccc1 Amb25204020 [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.352 CC(F)(F)CC(Cl)c1ccccc1 Amb24633763 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.352 CC(F)(F)CC(O)c1ccccc1 Amb24653265 [0,2,0,0,0,0|2,0,0]=4 9560 B13R1.352 CC(SC(C)(C)C)c1ccccc1 Amb25356846 [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.352 CN(c1ccccc1)CC(C)(C)C Amb17233321 [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.352 CN(c1ccccc1)CC(N)(C)C Amb17082659 [0,2,0,0,0,0|2,0,0]=4 9563 B13R1.352 CN(c1ccccc1)CC(O)(C)C Amb17138934 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.352 CS(=O)(=O)CC(Br)c1ccccc1 Amb24692327 [0,2,0,0,0,0|2,0,0]=4 9565 B13R1.352 CS(=O)(=O)CC(Cl)c1ccccc1 Amb24493976 [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.352 CS(=O)(=O)CC(N)c1ccccc1 Amb20623795 [0,2,0,0,0,0|2,0,0]=4 9567 B13R1.352 CS(=O)(=O)C[C@@H](N)c1ccccc1 Amb25244157 [0,2,0,0,0,0|2,0,0]=4 9568 B13R1.352 CS(=O)(=O)C[C@H](Cl)c1ccccc1 Amb25192673 [0,2,0,0,0,0|2,0,0]=4 9569 B13R1.352 C[C@H](NS(C)(=O)=O)c1ccccc1 Amb25675397 [0,2,0,0,0,0|2,0,0]=4 9570 B13R1.352 C[N+](C)(C)CC(O)c1ccccc1 Amb22442771 [0,2,0,0,0,0|1,0,1]=4 9571 B13R1.352 C[Si](C)(C)CC(O)c1ccccc1 Amb24439509 [0,2,0,0,0,0|2,0,0]=4 9572 B13R1.352 NC(c1ccccc1)CS(=O)(=O)C Amb13951879 [0,2,0,0,0,0|2,0,0]=4 9573 B13R1.464 BrCCC(c1ccccc1OC)C Amb17256442 [0,2,0,0,0,0|2,0,0]=4 9574 B13R1.464 CCCC(N)c1ccccc1C#N Amb25744581 [0,2,0,0,0,0|2,0,0]=4 9575 B13R1.464 CCCC(c1ccccc1OC)Cl Amb17139741 [0,2,0,0,0,0|2,0,0]=4 9576 B13R1.464 CCCC(c1ccccc1OC)N Amb17233600 [0,2,0,0,0,0|2,0,0]=4 9577 B13R1.464 CCCC(c1ccccc1OC)O Amb17138973 [0,2,0,0,0,0|2,0,0]=4 9578 B13R1.464 CCC[C@@H](N)c1ccccc1C#N Amb22746904 [0,2,0,0,0,0|2,0,0]=4 9579 B13R1.464 CCC[C@H](N)c1ccccc1C#N Amb22288726 [0,2,0,0,0,0|2,0,0]=4 9580 B13R1.464 CCC[C@H](N)c1ccccc1C#N Amb25269914 [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.464 CNCC(=O)c1ccccc1OC Amb17233535 [0,2,0,0,0,0|1,0,1]=4 9582 B13R1.464 CNCC(C)c1ccccc1OC Amb24089668 [0,2,0,0,0,0|0,0,0]=2 9583 B13R1.464 CNCC(c1ccccc1OC)C Amb17233593 [0,2,0,0,0,0|0,0,0]=2 9584 B13R1.464 CNc1ccccc1C(O)CNC Amb24423871 [0,2,0,0,0,0|1,0,0]=3 9585 B13R1.464 COC[C@H](N)c1ccccc1C#N Amb25121092 [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.464 C\C=C\C(C)c1ccccc1NC Amb25691456 [0,2,0,0,0,0|1,0,1]=4 9587 B13R1.464 ClCCC(c1ccccc1OC)C Amb17236871 [0,2,0,0,0,0|2,0,0]=4 9588 B13R1.464 NCCC(c1ccccc1OC)C Amb17226682 [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.464 NNCC(c1ccccc1OC)O Amb17233903 [0,2,0,0,0,0|2,0,0]=4 9590 B13R1.464 OCCC(c1ccccc1OC)C Amb17233700 [0,2,0,0,0,0|2,0,0]=4 9591 B13R1.464 ONCC(c1ccccc1OC)O Amb17335611 [0,2,0,0,0,0|2,0,0]=4 9592 B13R1.4453 CC(CCN)c1c(Cl)cccc1Br Amb24444131 [0,2,0,0,0,0|2,0,0]=4 9593 B13R1.4453 CCCC(C)c1c(O)cccc1O Amb25205787 [0,2,0,0,0,0|1,0,0]=3 9594 B13R1.4453 CCCC(Cl)c1c(Cl)cccc1Br Amb25100339 [0,2,0,0,0,0|2,0,0]=4 9595 B13R1.4453 CCCC(N)c1c(C)cccc1C Amb24401002 [0,2,0,0,0,0|2,0,0]=4 9596 B13R1.4453 CCCC(N)c1c(Cl)cccc1Br Amb24713557 [0,2,0,0,0,0|2,0,0]=4 9597 B13R1.4453 CCCC(N)c1c(Cl)cccc1Cl Amb25328088 [0,2,0,0,0,0|2,0,0]=4 9598 B13R1.4453 CCCC(N)c1c(Cl)cccc1I Amb24445322 [0,2,0,0,0,0|2,0,0]=4 9599 B13R1.4453 CCCC(N)c1c(F)cccc1Cl Amb25790527 [0,2,0,0,0,0|2,0,0]=4 9600 B13R1.4453 CCCC(N)c1c(F)cccc1F Amb18191402 [0,2,0,0,0,0|2,0,0]=4 9601 B13R1.4453 CCCC(N)c1c(F)cccc1I Amb25102625 [0,2,0,0,0,0|2,0,0]=4 9602 B13R1.4453 CCCC(N)c1c(N)cccc1Br Amb25330824 [0,2,0,0,0,0|2,0,0]=4 9603 B13R1.4453 CCCC(N)c1c(N)cccc1F Amb25293509 [0,2,0,0,0,0|2,0,0]=4 9604 B13R1.4453 CCCC(N)c1c(O)cccc1Br Amb25034218 [0,2,0,0,0,0|2,0,0]=4 9605 B13R1.4453 CCCC(O)c1c(C)cccc1C Amb25708335 [0,2,0,0,0,0|2,0,0]=4 9606 B13R1.4453 CCCC(O)c1c(Cl)cccc1Br Amb25848869 [0,2,0,0,0,0|2,0,0]=4 9607 B13R1.4453 CCCC(O)c1c(Cl)cccc1Cl Amb24465628 [0,2,0,0,0,0|2,0,0]=4 9608 B13R1.4453 CCCC(c1c(F)cccc1Cl)O Amb17237578 [0,2,0,0,0,0|2,0,0]=4 9609 B13R1.4453 CCCN(C)c1c(F)cccc1F Amb25680452 [0,2,0,0,0,0|2,0,0]=4 9610 B13R1.4453 CCC[C@@H](N)c1c(Cl)cccc1Br Amb25805290 [0,2,0,0,0,0|2,0,0]=4 9611 B13R1.4453 CCC[C@@H](N)c1c(F)cccc1F Amb24493909 [0,2,0,0,0,0|2,0,0]=4 9612 B13R1.4453 CCC[C@@H](N)c1c(N)cccc1Br Amb24410195 [0,2,0,0,0,0|2,0,0]=4 9613 B13R1.4453 CCC[C@@H](N)c1c(N)cccc1Cl Amb25121268 [0,2,0,0,0,0|2,0,0]=4 9614 B13R1.4453 CCC[C@@H](O)c1c(C)cccc1C Amb24620443 [0,2,0,0,0,0|2,0,0]=4 9615 B13R1.4453 CCC[C@@H](O)c1c(F)cccc1Br Amb24682417 [0,2,0,0,0,0|2,0,0]=4 9616 B13R1.4453 CCC[C@H](N)c1c(F)cccc1I Amb24578712 [0,2,0,0,0,0|2,0,0]=4 9617 B13R1.4453 CCC[C@H](N)c1c(N)cccc1F Amb25373917 [0,2,0,0,0,0|2,0,0]=4 9618 B13R1.4453 CCC[C@H](N)c1c(O)cccc1Cl Amb24745591 [0,2,0,0,0,0|2,0,0]=4 9619 B13R1.4453 CCNC(C)c1c(F)cccc1Br Amb25159142 [0,2,0,0,0,0|2,0,0]=4 9620 B13R1.4453 CCNC(C)c1c(F)cccc1Cl Amb25159222 [0,2,0,0,0,0|2,0,0]=4 9621 B13R1.4453 CNCC(=O)c1c(Cl)cccc1Br Amb25845605 [0,2,0,0,0,0|1,0,1]=4 9622 B13R1.4453 CNCC(=O)c1c(F)cccc1Cl Amb25381392 [0,2,0,0,0,0|1,0,1]=4 9623 B13R1.4453 CNCC(C)c1c(C)[n]c[n]c1C Amb18998104 [0,2,0,0,0,0|2,0,0]=4 9624 B13R1.4453 CNCC(C)c1c(F)cccc1Cl Amb24344274 [0,2,0,0,0,0|0,0,0]=2 9625 B13R1.4453 CNCC(N)c1c(Cl)cccc1Cl Amb25324530 [0,2,0,0,0,0|1,0,0]=3 9626 B13R1.4453 CNCC(O)c1c(Br)c[n]cc1Br Amb24536315 [0,2,0,0,0,0|2,0,0]=4 9627 B13R1.4453 CNCC(O)c1c(C)cccc1C Amb24534303 [0,2,0,0,0,0|1,0,0]=3 9628 B13R1.4453 CNCC(O)c1c(Cl)cccc1Br Amb24399691 [0,2,0,0,0,0|1,0,0]=3 9629 B13R1.4453 CNCC(O)c1c(Cl)cccc1Cl Amb18997469 [0,2,0,0,0,0|1,0,0]=3 9630 B13R1.4453 CNCC(O)c1c(F)cccc1Br Amb24536637 [0,2,0,0,0,0|1,0,0]=3 9631 B13R1.4453 CNCC(O)c1c(F)cccc1F Amb18289719 [0,2,0,0,0,0|1,0,0]=3 9632 B13R1.4453 COCC(N)c1c(Br)cccc1Br Amb25687615 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.4453 COCC(N)c1c(C)cccc1C Amb25840283 [0,2,0,0,0,0|2,0,0]=4 9634 B13R1.4453 COCC(N)c1c(Cl)cccc1Cl Amb25293504 [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.4453 COCC(N)c1c(F)cccc1I Amb24490577 [0,2,0,0,0,0|2,0,0]=4 9636 B13R1.4453 COCC(N)c1c(F)cccc1N Amb25368343 [0,2,0,0,0,0|2,0,0]=4 9637 B13R1.4453 COCC(N)c1c(O)cccc1Br Amb24492323 [0,2,0,0,0,0|2,0,0]=4 9638 B13R1.4453 COCC(N)c1c(O)cccc1O Amb24490787 [0,2,0,0,0,0|2,0,0]=4 9639 B13R1.4453 COCC(O)c1c(Cl)cccc1Br Amb24637663 [0,2,0,0,0,0|2,0,0]=4 9640 B13R1.4453 COCC(c1c(F)cccc1F)N Amb1127903 [0,2,0,0,0,0|2,0,0]=4 9641 B13R1.4453 COC[C@@H](N)c1c(F)cccc1Br Amb25154981 [0,2,0,0,0,0|2,0,0]=4 9642 B13R1.4453 COC[C@H](N)c1c(Br)cccc1N Amb25330992 [0,2,0,0,0,0|2,0,0]=4 9643 B13R1.4453 COC[C@H](N)c1c(Cl)cccc1I Amb25133656 [0,2,0,0,0,0|2,0,0]=4 9644 B13R1.4453 COC[C@H](N)c1c(F)cccc1Br Amb24745481 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.4453 COC[C@H](N)c1c(F)cccc1Cl Amb24714591 [0,2,0,0,0,0|2,0,0]=4 9646 B13R1.4453 CONC(C)c1c(Cl)cccc1Cl Amb24568645 [0,2,0,0,0,0|2,0,0]=4 9647 B13R1.4453 CONC(C)c1c(F)cccc1Cl Amb25753260 [0,2,0,0,0,0|2,0,0]=4 9648 B13R1.4453 CSCC(N)c1c(F)cccc1F Amb25667844 [0,2,0,0,0,0|2,0,0]=4 9649 B13R1.4453 CSCC(O)c1c(F)cccc1Cl Amb25353200 [0,2,0,0,0,0|2,0,0]=4 9650 B13R1.4453 CSCC(O)c1c(F)cccc1F Amb25688939 [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.4453 C\C(=N/NC)\c1c(O)cccc1O Amb24690690 [0,2,0,0,0,0|1,0,1]=4 9652 B13R1.4453 C\C(=N\NC)\c1c(F)cccc1F Amb25332051 [0,2,0,0,0,0|1,0,1]=4 9653 B13R1.4453 C\C=C\C(C)c1c(N)cccc1F Amb25289000 [0,2,0,0,0,0|1,0,1]=4 9654 B13R1.4453 C\C=C\C(C)c1c(O)cccc1Cl Amb24378362 [0,2,0,0,0,0|1,0,1]=4 9655 B13R1.4453 Cc1cc[n]c(N)c1C(C)COC Amb25727295 [0,2,0,0,0,0|2,0,0]=4 9656 B13R1.4453 Cc1cccc(Br)c1C(C)NCC Amb25230541 [0,2,0,0,0,0|2,0,0]=4 9657 B13R1.4453 Cc1cccc(Br)c1C(O)CCC Amb24400326 [0,2,0,0,0,0|2,0,0]=4 9658 B13R1.4453 Cc1cccc(Br)c1C(O)COC Amb25672054 [0,2,0,0,0,0|2,0,0]=4 9659 B13R1.4453 Cc1cccc(Br)c1[C@@H](O)CCC Amb25155283 [0,2,0,0,0,0|2,0,0]=4 9660 B13R1.4453 Cc1cccc(Br)c1[C@H](O)CCC Amb25068991 [0,2,0,0,0,0|2,0,0]=4 9661 B13R1.4453 Cc1cccc(Cl)c1C(N)CCC Amb25843801 [0,2,0,0,0,0|2,0,0]=4 9662 B13R1.4453 Cc1cccc(Cl)c1C(N)COC Amb24459579 [0,2,0,0,0,0|2,0,0]=4 9663 B13R1.4453 Cc1cccc(Cl)c1C(O)CCC Amb24552371 [0,2,0,0,0,0|2,0,0]=4 9664 B13R1.4453 Cc1cccc(Cl)c1[C@@H](N)CCC Amb24671269 [0,2,0,0,0,0|2,0,0]=4 9665 B13R1.4453 Cc1cccc(Cl)c1[C@@H](O)CCC Amb24581146 [0,2,0,0,0,0|2,0,0]=4 9666 B13R1.4453 Cc1cccc(Cl)c1[C@H](N)CCC Amb25063030 [0,2,0,0,0,0|2,0,0]=4 9667 B13R1.4453 Cc1cccc(F)c1C(=O)CNC Amb24578587 [0,2,0,0,0,0|1,0,1]=4 9668 B13R1.4453 Cc1cccc(F)c1C(N)COC Amb24568890 [0,2,0,0,0,0|2,0,0]=4 9669 B13R1.4453 Cc1cccc(N)c1C(N)CCC Amb24374735 [0,2,0,0,0,0|2,0,0]=4 9670 B13R1.4453 Cc1cccc(N)c1[C@@H](N)CCC Amb25674738 [0,2,0,0,0,0|2,0,0]=4 9671 B13R1.4453 Cc1cccc(N)c1[C@H](N)COC Amb24386537 [0,2,0,0,0,0|2,0,0]=4 9672 B13R1.4453 Cc1cccc(O)c1C(C)\C=C/C Amb25142723 [0,2,0,0,0,0|1,0,1]=4 9673 B13R1.4453 Cc1cccc(O)c1C(C)\C=C\C Amb24467102 [0,2,0,0,0,0|1,0,1]=4 9674 B13R1.4453 Cc1cccc(O)c1[C@H](N)CCC Amb25731198 [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.4453 NNCC(c1c(F)cccc1Cl)O Amb17238276 [0,2,0,0,0,0|2,0,0]=4 9676 B13R1.4453 ONCC(c1c(F)cccc1Cl)O Amb17338415 [0,2,0,0,0,0|2,0,0]=4 9677 B11R1.4 O=C\C=C\C=C\C1CCCC1 Amb25834404 [0,0,1,1,0,0|2,0,0]=4 9678 B11R1.30 CNCC(C)Cc1c[s]cc1 Amb19023884 [0,0,1,1,0,0|1,0,1]=4 9679 B11R1.30 CNCC(C)Cc1ccc[s]1 Amb19023880 [0,0,1,1,0,0|1,0,1]=4 9680 B11R1.30 CNCC(C)Cc1ccco1 Amb18315958 [0,0,1,1,0,0|1,0,1]=4 9681 B11R1.30 CNCC(C)Sc1ccc[s]1 Amb19025497 [0,0,1,1,0,0|2,0,0]=4 9682 B11R1.30 C\C(\CNC)=C/c1c[s]cc1 Amb24340343 [0,0,1,1,0,0|1,0,1]=4 9683 B11R1.229 C=C\C=C/C=C/[C@@H]1C[C@@H]1C=O Amb24766800 [0,0,1,1,0,0|2,0,0]=4 9684 B11R1.229 C=C\C=C\C=CC1CC1C=O Amb25383923 [0,0,1,1,0,0|2,0,0]=4 9685 B11R1.41 CNCc1ccccc1C=C Amb18124855 [0,0,1,1,0,0|0,0,2]=4 9686 B11R2.1 BN1CCc2ccccc12 Amb25180693 [1,0,0,1,0,0|2,0,0]=4 9687 B11R2.1 BrC1NCc2ccccc21 Amb22500144 [1,0,0,1,0,0|1,0,0]=3 9688 B11R2.1 C=C1CCc2ccccc21 Amb24458532 [1,0,0,1,0,0|0,0,2]=4 9689 B11R2.1 CC1=CCc2ccccc12 Amb17778909 [1,0,0,1,0,0|0,0,2]=4 9690 B11R2.1 CC1C=Cc2ccccc12 Amb17844052 [1,0,0,1,0,0|0,0,2]=4 9691 B11R2.1 CC1CCc2[n]cccc21 Amb24071595 [1,0,0,1,0,0|1,0,0]=3 9692 B11R2.1 CC1CCc2c[n]ccc21 Amb25691244 [1,0,0,1,0,0|1,0,0]=3 9693 B11R2.1 CC1CNc2ccccc21 Amb20241016 [1,0,0,1,0,0|0,0,0]=2 9694 B11R2.1 CC1COc2ccc[n]c21 Amb24102372 [1,0,0,1,0,0|2,0,0]=4 9695 B11R2.1 CC1CSc2ccccc12 Amb17939280 [1,0,0,1,0,0|1,0,0]=3 9696 B11R2.1 CC1NCc2[n]c[n]cc21 Amb24071597 [1,0,0,1,0,0|2,0,0]=4 9697 B11R2.1 CC1NCc2c[n]c[n]c21 Amb24476034 [1,0,0,1,0,0|2,0,0]=4 9698 B11R2.1 CC1NCc2ccccc21 Amb20623497 [1,0,0,1,0,0|0,0,0]=2 9699 B11R2.1 CC1OCc2cc[n]cc21 Amb24102361 [1,0,0,1,0,0|2,0,0]=4 9700 B11R2.1 CC1SCc2ccccc21 Amb24092837 [1,0,0,1,0,0|1,0,0]=3 9701 B11R2.1 CN1CC[n+]2c1cccc2 Amb10565842 [1,0,0,1,0,0|2,0,0]=4 9702 B11R2.1 CN1CCc2c1cccc2 Amb15691717 [1,0,0,1,0,0|1,0,0]=3 9703 B11R2.1 CN1CCc2c[n]ccc12 Amb25836379 [1,0,0,1,0,0|2,0,0]=4 9704 B11R2.1 CN1CNc2ccccc12 Amb25260683 [1,0,0,1,0,0|1,0,0]=3 9705 B11R2.1 C[C@@H]1CNc2ccccc21 Amb25069285 [1,0,0,1,0,0|0,0,0]=2 9706 B11R2.1 C[C@@H]1NCc2ccccc21 Amb25353679 [1,0,0,1,0,0|0,0,0]=2 9707 B11R2.1 C[N+]1=CCc2c1cccc2 Amb10553677 [1,0,0,1,0,0|1,0,1]=4 9708 B11R2.1 C[SiH]1CCc2ccccc12 Amb24065297 [1,0,0,1,0,0|0,1,0]=3 9709 B11R2.1 Cc1[nH][n]c2ccccc21 Amb19316313 [1,0,0,1,0,0|1,0,1]=4 9710 B11R2.1 Cc1[nH]nc2c1cccc2 Amb15691959 [1,0,0,1,0,0|1,0,1]=4 9711 B11R2.1 Cc1c[nH]c2c1cccc2 Amb1786299 [1,0,0,1,0,0|0,0,2]=4 9712 B11R2.1 ClC1CCc2[n]cccc21 Amb25321724 [1,0,0,1,0,0|2,0,0]=4 9713 B11R2.1 FC1CCc2ccccc21 Amb25311534 [1,0,0,1,0,0|1,0,0]=3 9714 B11R2.1 FC1CNc2ccccc21 Amb20242176 [1,0,0,1,0,0|1,0,0]=3 9715 B11R2.1 FC1NCc2ccccc21 Amb22504231 [1,0,0,1,0,0|1,0,0]=3 9716 B11R2.1 N=S1CNc2ccccc12 Amb24465157 [1,0,0,1,0,0|2,0,0]=4 9717 B11R2.1 NC1CCc2[n]cccc21 Amb21858247 [1,0,0,1,0,0|2,0,0]=4 9718 B11R2.1 NC1CCc2[n]cccc21 Amb22490383 [1,0,0,1,0,0|2,0,0]=4 9719 B11R2.1 NC1CCc2c1cccc2 Amb1158023 [1,0,0,1,0,0|1,0,0]=3 9720 B11R2.1 NC1CCc2c1cccc2 Amb16233857 [1,0,0,1,0,0|1,0,0]=3 9721 B11R2.1 NC1CCc2c[n]ccc21 Amb22900659 [1,0,0,1,0,0|2,0,0]=4 9722 B11R2.1 NC1CCc2cc[n]cc21 Amb24738463 [1,0,0,1,0,0|2,0,0]=4 9723 B11R2.1 NC1CCc2ccc[n]c21 Amb21858242 [1,0,0,1,0,0|2,0,0]=4 9724 B11R2.1 NC1CCc2ccc[n]c21 Amb22436792 [1,0,0,1,0,0|2,0,0]=4 9725 B11R2.1 NC1CCc2ccccc21 Amb24078253 [1,0,0,1,0,0|1,0,0]=3 9726 B11R2.1 NC1CNc2ccccc21 Amb24555894 [1,0,0,1,0,0|1,0,0]=3 9727 B11R2.1 NC1COc2c1cccc2 Amb13951643 [1,0,0,1,0,0|2,0,0]=4 9728 B11R2.1 NC1COc2c1cccc2 Amb2383232 [1,0,0,1,0,0|2,0,0]=4 9729 B11R2.1 N[C@@H]1CCc2c1cccc2 Amb16233854 [1,0,0,1,0,0|1,0,0]=3 9730 B11R2.1 N[C@@H]1CCc2ccc[n]c21 Amb22748121 [1,0,0,1,0,0|2,0,0]=4 9731 B11R2.1 N[C@@H]1COc2ccccc21 Amb23440344 [1,0,0,1,0,0|2,0,0]=4 9732 B11R2.1 N[C@@H]1COc2ccccc21 Amb24426876 [1,0,0,1,0,0|2,0,0]=4 9733 B11R2.1 N[C@H]1CCc2cc[n]cc21 Amb24502269 [1,0,0,1,0,0|2,0,0]=4 9734 B11R2.1 N[C@H]1CCc2ccccc21 Amb20242239 [1,0,0,1,0,0|1,0,0]=3 9735 B11R2.1 N[C@H]1COc2ccccc21 Amb25147252 [1,0,0,1,0,0|2,0,0]=4 9736 B11R2.1 O=C1CNc2c1cccc2 Amb17593399 [1,0,0,1,0,0|1,0,1]=4 9737 B11R2.1 O=C1CNc2ccccc21 Amb22899450 [1,0,0,1,0,0|1,0,1]=4 9738 B11R2.1 O=S1CNc2ccccc12 Amb24091032 [1,0,0,1,0,0|2,0,0]=4 9739 B11R2.1 OC1CCc2c1cccn2 Amb16231393 [1,0,0,1,0,0|2,0,0]=4 9740 B11R2.1 OC1CCc2ccc[n]c21 Amb19958431 [1,0,0,1,0,0|2,0,0]=4 9741 B11R2.1 OC1COc2ccccc21 Amb24104532 [1,0,0,1,0,0|2,0,0]=4 9742 B11R2.1 OC1OCc2ccccc21 Amb21858794 [1,0,0,1,0,0|2,0,0]=4 9743 B11R2.1 O[C@@H]1CCc2[n]cccc21 Amb24511690 [1,0,0,1,0,0|2,0,0]=4 9744 B11R2.1 O[C@@H]1CCc2c1cccc2 Amb13953023 [1,0,0,1,0,0|1,0,0]=3 9745 B11R2.1 O[C@@H]1CCc2ccc[n]c21 Amb22745812 [1,0,0,1,0,0|2,0,0]=4 9746 B11R2.1 O[C@H]1CCc2c1cccc2 Amb13953022 [1,0,0,1,0,0|1,0,0]=3 9747 B11R2.1 O[C@H]1CSc2ccccc21 Amb25356604 [1,0,0,1,0,0|2,0,0]=4 9748 B11R2.1 S=C1NCc2ccccc21 Amb24662530 [1,0,0,1,0,0|1,0,1]=4 9749 B11R2.1 SC1CCc2ccc[n]c21 Amb24071779 [1,0,0,1,0,0|2,0,0]=4 9750 B11R2.4 BrC1CC1c2ccc[n]c2 Amb24411334 [1,0,0,1,0,0|2,0,0]=4 9751 B11R2.4 BrC1CC1c2ccccc2 Amb23454923 [1,0,0,1,0,0|1,0,0]=3 9752 B11R2.4 Br[C@@H]1C[C@H]1c2cc[n]cc2 Amb24673977 [1,0,0,1,0,0|2,0,0]=4 9753 B11R2.4 Br[C@@H]1C[C@H]1c2cccc[n]2 Amb25840547 [1,0,0,1,0,0|2,0,0]=4 9754 B11R2.4 Br[C@@H]1C[C@H]1c2ccccc2 Amb25791511 [1,0,0,1,0,0|1,0,0]=3 9755 B11R2.4 C=C1CC1c2ccccc2 Amb22733871 [1,0,0,1,0,0|0,0,2]=4 9756 B11R2.4 CC1CC1c2ccccc2 Amb16236859 [1,0,0,1,0,0|0,0,0]=2 9757 B11R2.4 CC1NC1c2ccccc2 Amb24056775 [1,0,0,1,0,0|1,0,0]=3 9758 B11R2.4 CC1OC1c2ccccc2 Amb1129298 [1,0,0,1,0,0|1,0,0]=3 9759 B11R2.4 CN1NC1c2ccccc2 Amb25766657 [1,0,0,1,0,0|1,0,0]=3 9760 B11R2.4 CN1OC1c2cccc[n]2 Amb24586710 [1,0,0,1,0,0|2,0,0]=4 9761 B11R2.4 C[C@@H]1O[C@H]1c2ccccc2 Amb22367029 [1,0,0,1,0,0|1,0,0]=3 9762 B11R2.4 C[C@H]1O[C@@H]1c2ccccc2 Amb22224838 [1,0,0,1,0,0|1,0,0]=3 9763 B11R2.4 ClC1OC1c2ccccc2 Amb24372881 [1,0,0,1,0,0|2,0,0]=4 9764 B11R2.4 FC1CC1c2ccccc2 Amb25267358 [1,0,0,1,0,0|1,0,0]=3 9765 B11R2.4 F[C@@H]1C[C@@H]1c2ccccc2 Amb24600206 [1,0,0,1,0,0|1,0,0]=3 9766 B11R2.4 F[C@@H]1C[C@H]1c2ccccc2 Amb24538986 [1,0,0,1,0,0|1,0,0]=3 9767 B11R2.4 NC1CC1c2ccccc2 Amb19514914 [1,0,0,1,0,0|0,0,0]=2 9768 B11R2.4 NC1CC1c2ccccc2 Amb22729761 [1,0,0,1,0,0|0,0,0]=2 9769 B11R2.4 NC1OC1c2ccccc2 Amb25724793 [1,0,0,1,0,0|1,0,0]=3 9770 B11R2.4 NN1CC1c2ccccc2 Amb17593419 [1,0,0,1,0,0|1,0,0]=3 9771 B11R2.4 N[C@@H]1CC1c2ccccc2 Amb25077262 [1,0,0,1,0,0|0,0,0]=2 9772 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24183509 [1,0,0,1,0,0|0,0,0]=2 9773 B11R2.4 N[C@@H]1C[C@@H]1c2ccccc2 Amb24579866 [1,0,0,1,0,0|0,0,0]=2 9774 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 Amb22231696 [1,0,0,1,0,0|0,0,0]=2 9775 B11R2.4 N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24604839 [1,0,0,1,0,0|1,0,0]=3 9776 B11R2.4 N[C@H]1C[C@@H]1c2ccccc2 Amb22735917 [1,0,0,1,0,0|0,0,0]=2 9777 B11R2.4 O=C1CC1c2ccccc2 Amb25689197 [1,0,0,1,0,0|1,0,1]=4 9778 B11R2.4 OC1CC1c2ccccc2 Amb17593413 [1,0,0,1,0,0|1,0,0]=3 9779 B11R2.4 O[C@H]1C[C@@H]1c2ccccc2 Amb17689138 [1,0,0,1,0,0|1,0,0]=3 9780 B11R2.40 BrC1(CC1)c2cccc[n]2 Amb22755879 [1,0,0,1,0,0|2,0,0]=4 9781 B11R2.40 BrC1(CC1)c2ccccc2 Amb24743023 [1,0,0,1,0,0|1,0,0]=3 9782 B11R2.40 CC1(CC1)c2c[n][n]cc2 Amb25229625 [1,0,0,1,0,0|2,0,0]=4 9783 B11R2.40 CC1(CC1)c2ccccc2 Amb24613075 [1,0,0,1,0,0|0,0,0]=2 9784 B11R2.40 CC1(CO1)c2c[n]ccc2 Amb25683724 [1,0,0,1,0,0|2,0,0]=4 9785 B11R2.40 CC1(CO1)c2cccc[n]2 Amb24070157 [1,0,0,1,0,0|2,0,0]=4 9786 B11R2.40 ClC1(CC1)c2ccccc2 Amb17872674 [1,0,0,1,0,0|1,0,0]=3 9787 B11R2.40 NC1(CC1)c2c[n]ccc2 Amb22490380 [1,0,0,1,0,0|2,0,0]=4 9788 B11R2.40 NC1(CC1)c2cc[n]cc2 Amb18280388 [1,0,0,1,0,0|2,0,0]=4 9789 B11R2.40 NC1(CC1)c2cc[n]cc2 Amb22736629 [1,0,0,1,0,0|2,0,0]=4 9790 B11R2.40 NC1(CC1)c2cc[n]cc2 Amb24053191 [1,0,0,1,0,0|2,0,0]=4 9791 B11R2.40 NC1(CC1)c2cccc[n]2 Amb21858032 [1,0,0,1,0,0|2,0,0]=4 9792 B11R2.40 NC1(CC1)c2cccc[n]2 Amb21963993 [1,0,0,1,0,0|2,0,0]=4 9793 B11R2.40 NC1(CC1)c2ccccc2 Amb1095038 [1,0,0,1,0,0|1,0,0]=3 9794 B11R2.40 NC1(CC1)c2cccnc2 Amb10602476 [1,0,0,1,0,0|2,0,0]=4 9795 B11R2.40 OC1(CC1)c2cc[n]cc2 Amb25235214 [1,0,0,1,0,0|2,0,0]=4 9796 B11R2.40 OC1(CC1)c2cccc[n]2 Amb25682150 [1,0,0,1,0,0|2,0,0]=4 9797 B11R2.40 OC1(CC1)c2ccccc2 Amb19374887 [1,0,0,1,0,0|1,0,0]=3 9798 B11R2.54 CC1C(O)c2ccccc21 Amb25686146 [1,0,0,1,0,0|1,0,0]=3 9799 B11R2.54 Cl[C@@H]1[C@@H](Cl)c2ccccc21 Amb25320925 [1,0,0,1,0,0|2,0,0]=4 9800 B11R2.54 Cl[C@@H]1[C@H](Cl)c2ccccc21 Amb25798902 [1,0,0,1,0,0|2,0,0]=4 9801 B11R2.54 Cl[C@H]1[C@H](Cl)c2ccccc21 Amb25245323 [1,0,0,1,0,0|2,0,0]=4 9802 B11R2.239 C1CC(N1)c2cc[n]c[n]2 Amb25274242 [1,0,0,1,0,0|2,0,0]=4 9803 B11R2.239 C1CC(N1)c2ccc[n][n]2 Amb25229662 [1,0,0,1,0,0|2,0,0]=4 9804 B11R2.239 C1CC(N1)c2cccc[n]2 Amb25849292 [1,0,0,1,0,0|1,0,0]=3 9805 B11R2.239 C1CC(O1)c2ccccc2 Amb22298601 [1,0,0,1,0,0|1,0,0]=3 9806 B11R2.239 C1CCC1c2cc[n]cc2 Amb22898826 [1,0,0,1,0,0|1,0,0]=3 9807 B11R2.239 C1CCN1c2cccc[n]2 Amb24069933 [1,0,0,1,0,0|2,0,0]=4 9808 B11R2.239 C1C[C@@H](N1)c2c[n]cc[n]2 Amb24657231 [1,0,0,1,0,0|2,0,0]=4 9809 B11R2.239 C1C[C@@H](N1)c2cc[n]cc2 Amb25761359 [1,0,0,1,0,0|1,0,0]=3 9810 B11R2.239 C1C[C@@H](O1)c2ccccc2 Amb24479262 [1,0,0,1,0,0|1,0,0]=3 9811 B11R2.239 C1C[C@H](N1)c2c[n]cc[n]2 Amb25791186 [1,0,0,1,0,0|2,0,0]=4 9812 B11R2.239 C1C[C@H](N1)c2cccc[n]2 Amb24732378 [1,0,0,1,0,0|1,0,0]=3 9813 B11R2.239 C1C[C@H](O1)c2ccccc2 Amb25721124 [1,0,0,1,0,0|1,0,0]=3 9814 B11R2.239 C1NCC1c2c[n]ccc2 Amb19516797 [1,0,0,1,0,0|1,0,0]=3 9815 B11R2.239 C1NCC1c2c[n]ccc2 Amb20620349 [1,0,0,1,0,0|1,0,0]=3 9816 B11R2.239 C1NCC1c2cc[n]c[n]2 Amb23401381 [1,0,0,1,0,0|2,0,0]=4 9817 B11R2.239 C1NCC1c2cc[n]cc2 Amb19516821 [1,0,0,1,0,0|1,0,0]=3 9818 B11R2.239 C1NCC1c2cc[n]cc2 Amb20620350 [1,0,0,1,0,0|1,0,0]=3 9819 B11R2.239 C1NCC1c2cc[n]cc2 Amb22749029 [1,0,0,1,0,0|1,0,0]=3 9820 B11R2.239 C1NCC1c2ccc[n][n]2 Amb25786757 [1,0,0,1,0,0|2,0,0]=4 9821 B11R2.239 C1NCC1c2cccc[n]2 Amb19516701 [1,0,0,1,0,0|1,0,0]=3 9822 B11R2.239 C1OCC1c2cccc[n]2 Amb24100566 [1,0,0,1,0,0|2,0,0]=4 9823 B11R2.239 C1OCC1c2ccccc2 Amb21963191 [1,0,0,1,0,0|1,0,0]=3 9824 B11R2.239 N1CC(C1)c2ccccc2 Amb10603719 [1,0,0,1,0,0|0,0,0]=2 9825 B11R2.239 N1CC(C1)c2ccccn2 Amb15695195 [1,0,0,1,0,0|1,0,0]=3 9826 B11R2.988 C=CC1Cc2ccccc12 Amb17778869 [1,0,0,1,0,0|0,0,2]=4 9827 B11R2.988 CCC1Cc2ccccc21 Amb24647895 [1,0,0,1,0,0|0,0,0]=2 9828 B11R2.988 COC1Cc2ccccc21 Amb24455687 [1,0,0,1,0,0|1,0,0]=3 9829 B11R2.988 ClCC1Cc2ccccc21 Amb24588110 [1,0,0,1,0,0|1,0,0]=3 9830 B11R2.988 ICC1Cc2ccccc21 Amb24354685 [1,0,0,1,0,0|1,0,0]=3 9831 B11R2.988 NCC1=Cc2ccccc21 Amb24596883 [1,0,0,1,0,0|0,0,2]=4 9832 B11R2.988 NCC1Cc2c1cccc2 Amb10609227 [1,0,0,1,0,0|0,0,0]=2 9833 B11R2.988 NC[C@@H]1Cc2ccccc21 Amb24182000 [1,0,0,1,0,0|0,0,0]=2 9834 B11R2.988 NNC1Cc2ccccc21 Amb25326415 [1,0,0,1,0,0|1,0,0]=3 9835 B11R2.988 O=CC1Cc2c1cccc2 Amb16230472 [1,0,0,1,0,0|1,0,1]=4 9836 B11R2.20 C1=Cc2c(CC1)cccc2 Amb1162229 [1,0,0,1,0,0|1,0,1]=4 9837 B11R2.20 C1=Nc2c(CN1)cccc2 Amb10552960 [1,0,0,1,0,0|1,0,1]=4 9838 B11R2.20 C1CCCc2ccccc21 Amb22351371 [1,0,0,1,0,0|1,0,0]=3 9839 B11R2.20 C1CCc2c(C1)nccc2 Amb2390042 [1,0,0,1,0,0|2,0,0]=4 9840 B11R2.20 C1CCc2c(N1)cccc2 Amb10072811 [1,0,0,1,0,0|2,0,0]=4 9841 B11R2.20 C1CCc2c(N1)cccc2 Amb1869492 [1,0,0,1,0,0|2,0,0]=4 9842 B11R2.20 C1CCc2c(S1)cccc2 Amb2237019 [1,0,0,1,0,0|2,0,0]=4 9843 B11R2.20 C1CNNc2ccccc21 Amb24564127 [1,0,0,1,0,0|1,0,0]=3 9844 B11R2.20 C1C[NH+]=Cc2ccccc21 Amb23569648 [1,0,0,1,0,0|0,0,2]=4 9845 B11R2.20 C1NCCc2[n]c[n]cc21 Amb19515826 [1,0,0,1,0,0|2,0,0]=4 9846 B11R2.20 C1NCCc2[n]c[n]cc21 Amb19957549 [1,0,0,1,0,0|2,0,0]=4 9847 B11R2.20 C1NCCc2[n]c[n]cc21 Amb22728973 [1,0,0,1,0,0|2,0,0]=4 9848 B11R2.20 C1NCCc2[n]cc[n]c21 Amb24081290 [1,0,0,1,0,0|2,0,0]=4 9849 B11R2.20 C1NCCc2[n]cccc21 Amb19373278 [1,0,0,1,0,0|1,0,0]=3 9850 B11R2.20 C1NCCc2[n]cccc21 Amb19958501 [1,0,0,1,0,0|1,0,0]=3 9851 B11R2.20 C1NCCc2[n]cccc21 Amb22002369 [1,0,0,1,0,0|1,0,0]=3 9852 B11R2.20 C1NCCc2c[n]c[n]c21 Amb18832496 [1,0,0,1,0,0|2,0,0]=4 9853 B11R2.20 C1NCCc2c[n]c[n]c21 Amb22494240 [1,0,0,1,0,0|2,0,0]=4 9854 B11R2.20 C1NCCc2c[n]ccc21 Amb18124435 [1,0,0,1,0,0|1,0,0]=3 9855 B11R2.20 C1NCCc2c[n]ccc21 Amb20075877 [1,0,0,1,0,0|1,0,0]=3 9856 B11R2.20 C1NCCc2c[n]ccc21 Amb22752076 [1,0,0,1,0,0|1,0,0]=3 9857 B11R2.20 C1NCCc2cc[n]cc21 Amb19958148 [1,0,0,1,0,0|1,0,0]=3 9858 B11R2.20 C1NCCc2cc[n]cc21 Amb21858409 [1,0,0,1,0,0|1,0,0]=3 9859 B11R2.20 C1NCCc2ccc[n]c21 Amb21858385 [1,0,0,1,0,0|1,0,0]=3 9860 B11R2.20 C1NCCc2ccc[n]c21 Amb22436767 [1,0,0,1,0,0|1,0,0]=3 9861 B11R2.20 C1NCNc2[n]cccc21 Amb24746456 [1,0,0,1,0,0|2,0,0]=4 9862 B11R2.20 C1NCNc2ccccc21 Amb25147572 [1,0,0,1,0,0|1,0,0]=3 9863 B11R2.20 C1NCOc2ccccc21 Amb24087478 [1,0,0,1,0,0|1,0,0]=3 9864 B11R2.20 C1NCc2c(C1)nccc2 Amb10608993 [1,0,0,1,0,0|1,0,0]=3 9865 B11R2.20 C1NCc2c(C1)ncnc2 Amb17072186 [1,0,0,1,0,0|2,0,0]=4 9866 B11R2.20 C1NNCc2ccccc21 Amb22497223 [1,0,0,1,0,0|1,0,0]=3 9867 B11R2.20 C1OCCc2ccc[n]c21 Amb24070918 [1,0,0,1,0,0|2,0,0]=4 9868 B11R2.20 C1OCOc2ccccc21 Amb24066080 [1,0,0,1,0,0|2,0,0]=4 9869 B11R2.20 C1PCNc2ccccc21 Amb25737691 [1,0,0,1,0,0|1,1,0]=4 9870 B11R2.20 C1SCCc2ccccc21 Amb24085482 [1,0,0,1,0,0|1,0,0]=3 9871 B11R2.20 C1SSCc2ccccc21 Amb25839327 [1,0,0,1,0,0|2,0,0]=4 9872 B11R2.20 N1CCc2c(C1)cccc2 Amb2383348 [1,0,0,1,0,0|0,0,0]=2 9873 B11R2.20 c1ccc2c(c1)C=NCC2 Amb10603654 [1,0,0,1,0,0|0,0,2]=4 9874 B11R2.20 c1ccc2c(c1)C=[NH+]CC2 Amb10553686 [1,0,0,1,0,0|0,0,2]=4 9875 B11R2.238 C(C1CC1)c2ccccc2 Amb22490220 [1,0,0,1,0,0|1,0,0]=3 9876 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554474 [1,0,0,1,0,0|2,0,0]=4 9877 B11R2.238 C1CC1C[n+]2ccccc2 Amb10554486 [1,0,0,1,0,0|2,0,0]=4 9878 B11R2.238 C1CC1Nc2ccccc2 Amb18270529 [1,0,0,1,0,0|2,0,0]=4 9879 B11R2.238 C1N=C1Cc2ccccc2 Amb22498074 [1,0,0,1,0,0|0,0,2]=4 9880 B11R2.238 C1OC1Cc2cc[n]cc2 Amb24677560 [1,0,0,1,0,0|2,0,0]=4 9881 B11R2.238 C1OC1Cc2cccc[n]2 Amb24649901 [1,0,0,1,0,0|2,0,0]=4 9882 B11R2.238 N1CC1Cc2ccccc2 Amb10072810 [1,0,0,1,0,0|0,0,0]=2 9883 B11R2.238 N1C[C@@H]1Cc2ccccc2 Amb15690958 [1,0,0,1,0,0|0,0,0]=2 9884 B11R2.238 N1C[C@H]1Cc2ccccc2 Amb10603217 [1,0,0,1,0,0|0,0,0]=2 9885 B11R2.2 C1CCCC1c2ccc[nH]2 Amb24478843 [0,0,0,1,1,0|2,0,0]=4 9886 B11R2.2 C1CCCC1c2ccc[s]2 Amb25686968 [0,0,0,1,1,0|2,0,0]=4 9887 B11R2.2 C1NCC(C1)c2ccco2 Amb17104482 [0,0,0,1,1,0|1,0,0]=3 9888 B11R2.2 C1NCC(C1)n2cccn2 Amb16186649 [0,0,0,1,1,0|2,0,0]=4 9889 B11R2.2 C1NCC(C1)n2cncc2 Amb10607851 [0,0,0,1,1,0|2,0,0]=4 9890 B11R2.2 C1NCC(O1)c2c[nH]cc2 Amb18860788 [0,0,0,1,1,0|2,0,0]=4 9891 B11R2.2 C1NCC(O1)c2ccc[s]2 Amb18065443 [0,0,0,1,1,0|2,0,0]=4 9892 B11R2.2 C1NCC(O1)c2ccco2 Amb18064797 [0,0,0,1,1,0|2,0,0]=4 9893 B11R2.2 C1NCCC1[n]2c[n]cc2 Amb22587032 [0,0,0,1,1,0|2,0,0]=4 9894 B11R2.2 C1NCCC1[n]2c[n]cc2 Amb22831512 [0,0,0,1,1,0|2,0,0]=4 9895 B11R2.2 C1NCCC1[n]2ccc[n]2 Amb19889137 [0,0,0,1,1,0|2,0,0]=4 9896 B11R2.2 C1NCCC1[n]2cccc2 Amb18947347 [0,0,0,1,1,0|1,0,0]=3 9897 B11R2.2 C1NCCC1c2[n]cc[s]2 Amb18830930 [0,0,0,1,1,0|2,0,0]=4 9898 B11R2.2 C1NCCC1c2[n]cco2 Amb18832173 [0,0,0,1,1,0|2,0,0]=4 9899 B11R2.2 C1NCCC1c2c[nH][n]c2 Amb18832285 [0,0,0,1,1,0|2,0,0]=4 9900 B11R2.2 C1NCCC1c2c[nH]c[n]2 Amb22304832 [0,0,0,1,1,0|2,0,0]=4 9901 B11R2.2 C1NCCC1c2c[nH]c[n]2 Amb22587571 [0,0,0,1,1,0|2,0,0]=4 9902 B11R2.2 C1NCCC1c2c[nH]cc2 Amb18893349 [0,0,0,1,1,0|1,0,0]=3 9903 B11R2.2 C1NCCC1c2c[n]c[s]2 Amb18200460 [0,0,0,1,1,0|2,0,0]=4 9904 B11R2.2 C1NCCC1c2c[n]co2 Amb18832174 [0,0,0,1,1,0|2,0,0]=4 9905 B11R2.2 C1NCCC1c2c[n]oc2 Amb18832172 [0,0,0,1,1,0|2,0,0]=4 9906 B11R2.2 C1NCCC1c2c[s]c[n]2 Amb18830943 [0,0,0,1,1,0|2,0,0]=4 9907 B11R2.2 C1NCCC1c2c[s]cc2 Amb18200904 [0,0,0,1,1,0|1,0,0]=3 9908 B11R2.2 C1NCCC1c2cc[nH][n]2 Amb18832310 [0,0,0,1,1,0|2,0,0]=4 9909 B11R2.2 C1NCCC1c2cc[nH][n]2 Amb22587594 [0,0,0,1,1,0|2,0,0]=4 9910 B11R2.2 C1NCCC1c2cc[n]o2 Amb18832199 [0,0,0,1,1,0|2,0,0]=4 9911 B11R2.2 C1NCCC1c2ccco2 Amb18364064 [0,0,0,1,1,0|1,0,0]=3 9912 B11R2.2 C1NCCC1c2cco[n]2 Amb18832175 [0,0,0,1,1,0|2,0,0]=4 9913 B11R2.2 C1NCCC1c2coc[n]2 Amb18832171 [0,0,0,1,1,0|2,0,0]=4 9914 B11R2.2 C1NCCC1c2cocc2 Amb18203044 [0,0,0,1,1,0|1,0,0]=3 9915 B11R2.2 C1NCC[C@@H]1[n]2c[n]cc2 Amb25836392 [0,0,0,1,1,0|2,0,0]=4 9916 B11R2.2 C1NCC[C@@H]1c2ccco2 Amb25348481 [0,0,0,1,1,0|1,0,0]=3 9917 B11R2.2 C1NCC[C@@H]1c2cocc2 Amb24425455 [0,0,0,1,1,0|1,0,0]=3 9918 B11R2.2 C1NCC[C@H]1c2ccco2 Amb25831175 [0,0,0,1,1,0|1,0,0]=3 9919 B11R2.2 C1NCC[C@H]1c2cocc2 Amb24708332 [0,0,0,1,1,0|1,0,0]=3 9920 B11R2.2 C1SCCC1[n]2cccc2 Amb24704095 [0,0,0,1,1,0|2,0,0]=4 9921 B11R2.11 CC1CC(C1)[n]2cccc2 Amb25124595 [0,0,0,1,1,0|2,0,0]=4 9922 B11R2.11 CN1CC(C1)[n]2cccc2 Amb25837876 [0,0,0,1,1,0|1,0,0]=3 9923 B11R2.57 CC1(CCC1)[n]2cccc2 Amb24724978 [0,0,0,1,1,0|2,0,0]=4 9924 B11R2.57 CC1(CCC1)c2ccc[s]2 Amb24527761 [0,0,0,1,1,0|2,0,0]=4 9925 B11R2.57 FC1(CNC1)c2c[s]cc2 Amb24461108 [0,0,0,1,1,0|2,0,0]=4 9926 B11R2.57 OC1(CNC1)c2c[s]cc2 Amb24529328 [0,0,0,1,1,0|2,0,0]=4 9927 B11R2.106 CC1CNCc2[nH]c[n]c21 Amb24479602 [0,0,0,1,1,0|2,0,0]=4 9928 B11R2.106 CC1CNCc2[nH]ccc21 Amb18832424 [0,0,0,1,1,0|1,0,0]=3 9929 B11R2.106 CC1CNCc2[n]c[s]c21 Amb25221928 [0,0,0,1,1,0|2,0,0]=4 9930 B11R2.106 CC1CNCc2[s]ccc21 Amb18200895 [0,0,0,1,1,0|1,0,0]=3 9931 B11R2.106 CC1CNCc2cc[nH]c21 Amb25091552 [0,0,0,1,1,0|1,0,0]=3 9932 B11R2.106 CC1CNCc2cc[n][n]21 Amb23439510 [0,0,0,1,1,0|2,0,0]=4 9933 B11R2.106 CC1CNCc2cc[s]c21 Amb24092193 [0,0,0,1,1,0|1,0,0]=3 9934 B11R2.106 CC1CNCc2ccoc21 Amb24478524 [0,0,0,1,1,0|1,0,0]=3 9935 B11R2.106 FC1CNCc2cc[s]c21 Amb24403033 [0,0,0,1,1,0|2,0,0]=4 9936 B11R2.106 OC1CNCc2c1ccs2 Amb17194237 [0,0,0,1,1,0|2,0,0]=4 9937 B11R2.106 OC1CNCc2cc[s]c21 Amb18644751 [0,0,0,1,1,0|2,0,0]=4 9938 B13R2.15 CC1CCCN1c2cc[n]cc2 Amb24473548 [0,0,0,1,0,1|2,0,0]=4 9939 B13R2.15 CC1CCCN1c2cccc[n]2 Amb25749418 [0,0,0,1,0,1|2,0,0]=4 9940 B13R2.15 CC1CNCC1c2c[n]c[n]c2 Amb24681466 [0,0,0,1,0,1|2,0,0]=4 9941 B13R2.15 CC1CNCC1c2ccccc2 Amb24312553 [0,0,0,1,0,1|0,0,0]=2 9942 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [0,0,0,1,0,1|2,0,0]=4 9943 B13R2.15 CC1NCCP1c2ccccc2 Amb25075554 [0,0,0,1,0,1|2,0,0]=4 9944 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [0,0,0,1,0,1|2,0,0]=4 9945 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccc2 Amb18829884 [0,0,0,1,0,1|2,0,0]=4 9946 B13R2.15 C[C@H]1CCN[C@H]1c2ccccc2 Amb24741661 [0,0,0,1,0,1|2,0,0]=4 9947 B13R2.15 C[C@H]1CNC[C@@H]1c2ccccc2 Amb25238338 [0,0,0,1,0,1|0,0,0]=2 9948 B13R2.15 C[C@H]1NCC[C@H]1c2ccccc2 Amb24607383 [0,0,0,1,0,1|2,0,0]=4 9949 B13R2.15 C[N+]1=C(CCC1)c2ccccc2 Amb10553497 [0,0,0,1,0,1|2,0,0]=4 9950 B13R2.15 ClC1CCCC1c2ccccc2 Amb18184968 [0,0,0,1,0,1|2,0,0]=4 9951 B13R2.15 FC1CNCC1c2cc[n]cc2 Amb24716723 [0,0,0,1,0,1|2,0,0]=4 9952 B13R2.15 NC1CCCC1c2ccccc2 Amb17506307 [0,0,0,1,0,1|2,0,0]=4 9953 B13R2.15 NC1CCCN1c2ccccc2 Amb25242311 [0,0,0,1,0,1|2,0,0]=4 9954 B13R2.15 NC1CNCC1c2ccccc2 Amb24432765 [0,0,0,1,0,1|1,0,0]=3 9955 B13R2.15 NC1CSCC1c2ccccc2 Amb25208166 [0,0,0,1,0,1|2,0,0]=4 9956 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb22745600 [0,0,0,1,0,1|2,0,0]=4 9957 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb25168925 [0,0,0,1,0,1|2,0,0]=4 9958 B13R2.15 N[C@H]1COC[C@@H]1c2ccccc2 Amb25122865 [0,0,0,1,0,1|2,0,0]=4 9959 B13R2.15 O=C1CNCN1c2ccccc2 Amb24664160 [0,0,0,1,0,1|1,0,1]=4 9960 B13R2.15 OC1CCCC1c2ccccc2 Amb18798120 [0,0,0,1,0,1|2,0,0]=4 9961 B13R2.15 OC1CNCC1c2ccccc2 Amb18829263 [0,0,0,1,0,1|1,0,0]=3 9962 B13R2.15 OC1COCC1c2ccccc2 Amb23448389 [0,0,0,1,0,1|2,0,0]=4 9963 B13R2.15 O[C@@H]1CCCC1c2ccccc2 Amb25788104 [0,0,0,1,0,1|2,0,0]=4 9964 B13R2.15 O[C@@H]1CCC[C@H]1c2ccccc2 Amb24678146 [0,0,0,1,0,1|2,0,0]=4 9965 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb10603153 [0,0,0,1,0,1|1,0,0]=3 9966 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb22405991 [0,0,0,1,0,1|1,0,0]=3 9967 B13R2.15 O[C@@H]1CNC[C@H]1c2ccccc2 Amb22899740 [0,0,0,1,0,1|1,0,0]=3 9968 B13R2.15 O[C@H]1CCC[C@@H]1c2ccccc2 Amb25236019 [0,0,0,1,0,1|2,0,0]=4 9969 B13R2.15 O[C@H]1CNC[C@H]1c2ccccc2 Amb24725624 [0,0,0,1,0,1|1,0,0]=3 9970 B13R2.25 BrCCC1CC1c2ccccc2 Amb24525097 [0,0,0,1,0,1|2,0,0]=4 9971 B13R2.25 CCNC1CC1c2ccccc2 Amb18983170 [0,0,0,1,0,1|2,0,0]=4 9972 B13R2.25 CNCC1CC1c2cc[n]cc2 Amb18300514 [0,0,0,1,0,1|1,0,0]=3 9973 B13R2.25 CNCC1CC1c2ccc[n]c2 Amb18300513 [0,0,0,1,0,1|1,0,0]=3 9974 B13R2.25 CNCC1CC1c2cccc[n]2 Amb18300515 [0,0,0,1,0,1|1,0,0]=3 9975 B13R2.25 CNCC1CC1c2ccccc2 Amb17568106 [0,0,0,1,0,1|0,0,0]=2 9976 B13R2.25 CNC[C@@H]1CC1c2ccccc2 Amb17605573 [0,0,0,1,0,1|0,0,0]=2 9977 B13R2.25 CNC[C@H]1C[C@@H]1c2ccccc2 Amb24519290 [0,0,0,1,0,1|0,0,0]=2 9978 B13R2.25 ClCCC1CC1c2ccccc2 Amb24442277 [0,0,0,1,0,1|2,0,0]=4 9979 B13R2.25 N#CCC1CC1c2ccccc2 Amb23539347 [0,0,0,1,0,1|2,0,0]=4 9980 B13R2.25 NCCC1CC1c2ccccc2 Amb23539326 [0,0,0,1,0,1|2,0,0]=4 9981 B13R2.25 NCC[C@@H]1C[C@H]1c2ccccc2 Amb24741345 [0,0,0,1,0,1|2,0,0]=4 9982 B13R2.25 NNCC1CC1c2ccccc2 Amb23539331 [0,0,0,1,0,1|1,0,0]=3 9983 B13R2.25 OCC[C@@H]1C[C@H]1c2ccccc2 Amb24515174 [0,0,0,1,0,1|2,0,0]=4 9984 B13R2.26 C#CCC1Cc2ccccc2N1 Amb25667102 [0,0,0,1,0,1|1,0,1]=4 9985 B13R2.26 CCCC1=Cc2c(C1)cccc2 Amb15692407 [0,0,0,1,0,1|1,0,1]=4 9986 B13R2.26 CCCC1Nc2ccccc2S1 Amb24084961 [0,0,0,1,0,1|2,0,0]=4 9987 B13R2.26 CCNC1Cc2c(C1)cccc2 Amb2182885 [0,0,0,1,0,1|2,0,0]=4 9988 B13R2.26 CCNC1Cc2c(C1)cccc2 Amb2209241 [0,0,0,1,0,1|2,0,0]=4 9989 B13R2.26 CCSC1Cc2ccccc2C1 Amb24362469 [0,0,0,1,0,1|2,0,0]=4 9990 B13R2.26 CNCC=1Cc2ccccc2C1 Amb24451114 [0,0,0,1,0,1|0,0,1]=3 9991 B13R2.26 CNC[C@H]1Cc2ccccc2O1 Amb25047611 [0,0,0,1,0,1|0,0,0]=2 9992 B13R2.26 CNCc1[nH]c2ccccc2[n]1 Amb18363957 [0,0,0,1,0,1|1,0,1]=4 9993 B13R2.26 CNCc1[n]c2ccccc2[s]1 Amb21959881 [0,0,0,1,0,1|1,0,1]=4 9994 B13R2.26 CNCc1cc2c(o1)cccc2 Amb10813873 [0,0,0,1,0,1|0,0,2]=4 9995 B13R2.26 CNCc1cc2c(s1)cccc2 Amb1792462 [0,0,0,1,0,1|0,0,2]=4 9996 B13R2.26 CNCc1nc2c([nH]1)cccc2 Amb1760901 [0,0,0,1,0,1|1,0,1]=4 9997 B13R2.26 CNN=C1Cc2ccccc2C1 Amb25717451 [0,0,0,1,0,1|1,0,1]=4 9998 B13R2.26 COCC1Cc2ccccc2N1 Amb25148607 [0,0,0,1,0,1|1,0,0]=3 9999 B13R2.26 COCC1Cc2ccccc2S1 Amb25090874 [0,0,0,1,0,1|1,0,0]=3 10000 B13R2.26 CONC1Cc2ccccc2C1 Amb25287092 [0,0,0,1,0,1|2,0,0]=4 10001 B13R2.26 CSCC1Cc2ccccc2O1 Amb25160647 [0,0,0,1,0,1|1,0,0]=3 10002 B13R2.26 C\C=C\C1Cc2ccccc2N1 Amb24636958 [0,0,0,1,0,1|1,0,1]=4 10003 B13R2.26 ClCCC1Cc2ccccc2C1 Amb25328579 [0,0,0,1,0,1|2,0,0]=4 10004 B13R2.26 N#CCC1Cc2ccccc2N1 Amb25742881 [0,0,0,1,0,1|2,0,0]=4 10005 B13R2.26 N#CCC1Cc2ccccc2S1 Amb24442574 [0,0,0,1,0,1|2,0,0]=4 10006 B13R2.26 NCCC1Cc2c(C1)cccc2 Amb17334539 [0,0,0,1,0,1|2,0,0]=4 10007 B13R2.26 NCCC1Cc2ccccc2O1 Amb18829251 [0,0,0,1,0,1|2,0,0]=4 10008 B13R2.26 NCCC1Cc2ccccc2S1 Amb18194202 [0,0,0,1,0,1|2,0,0]=4 10009 B13R2.26 NNCC1Cc2ccccc2C1 Amb25763204 [0,0,0,1,0,1|1,0,0]=3 10010 B13R2.26 NOCC1Cc2ccccc2O1 Amb25125460 [0,0,0,1,0,1|2,0,0]=4 10011 B13R2.26 O=CCC1Cc2ccccc2O1 Amb25179976 [0,0,0,1,0,1|2,0,0]=4 10012 B13R2.26 OCCC1Cc2c(C1)cccc2 Amb17334570 [0,0,0,1,0,1|2,0,0]=4 10013 B13R2.26 OCCC1Cc2ccccc2N1 Amb25228077 [0,0,0,1,0,1|2,0,0]=4 10014 B13R2.30 CC1CC(=O)C1c2ccccc2 Amb24449010 [0,0,0,1,0,1|2,0,0]=4 10015 B13R2.31 CN1CC(C1)Nc2cc[n]c[n]2 Amb25298098 [0,0,0,1,0,1|2,0,0]=4 10016 B13R2.31 CN1CC(C1)Nc2cc[n]cc2 Amb25032685 [0,0,0,1,0,1|1,0,0]=3 10017 B13R2.31 CN1CC(C1)Nc2cccc[n]2 Amb24582693 [0,0,0,1,0,1|1,0,0]=3 10018 B13R2.31 NC1CC(C1)Nc2ccccc2 Amb25273713 [0,0,0,1,0,1|2,0,0]=4 10019 B13R2.31 NC1CC(C1)Oc2ccccc2 Amb25148808 [0,0,0,1,0,1|2,0,0]=4 10020 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [0,0,0,1,0,1|2,0,0]=4 10021 B13R2.31 N[C@@H]1C[C@@H](C1)Oc2ccccc2 Amb25350924 [0,0,0,1,0,1|2,0,0]=4 10022 B13R2.31 N[C@@H]1C[C@H](C1)Oc2ccccc2 Amb24439570 [0,0,0,1,0,1|2,0,0]=4 10023 B13R2.31 O=C1CC(C1)Oc2ccccc2 Amb23439309 [0,0,0,1,0,1|2,0,0]=4 10024 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [0,0,0,1,0,1|2,0,0]=4 10025 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [0,0,0,1,0,1|2,0,0]=4 10026 B13R2.50 CCC1CC1Nc2cc[n]cc2 Amb25698561 [0,0,0,1,0,1|2,0,0]=4 10027 B13R2.50 NCC1CC1Cc2ccccc2 Amb19001477 [0,0,0,1,0,1|2,0,0]=4 10028 B13R2.50 O=CC1CC1Cc2ccccc2 Amb24537604 [0,0,0,1,0,1|2,0,0]=4 10029 B13R2.50 O=CC1CC1Oc2ccccc2 Amb24706810 [0,0,0,1,0,1|2,0,0]=4 10030 B13R2.50 O=CC1CC1Sc2ccccc2 Amb25707469 [0,0,0,1,0,1|2,0,0]=4 10031 B13R2.50 OCC1CC1Cc2ccccc2 Amb25234915 [0,0,0,1,0,1|2,0,0]=4 10032 B13R2.50 OCC1CC1Oc2ccccc2 Amb25077823 [0,0,0,1,0,1|2,0,0]=4 10033 B13R2.50 OCC1CC1Sc2ccccc2 Amb25057761 [0,0,0,1,0,1|2,0,0]=4 10034 B13R2.50 OC[C@@H]1C[C@@H]1Cc2ccccc2 Amb24540768 [0,0,0,1,0,1|2,0,0]=4 10035 B13R2.50 OC[C@@H]1C[C@H]1Cc2ccccc2 Amb25306402 [0,0,0,1,0,1|2,0,0]=4 10036 B13R2.50 OC[C@@H]1C[C@H]1Sc2ccccc2 Amb24593799 [0,0,0,1,0,1|2,0,0]=4 10037 B13R2.64 C(C1CCCC1)[n+]2ccccc2 Amb24717860 [0,0,0,1,0,1|2,0,0]=4 10038 B13R2.64 C(C1CCCC1)c2ccccc2 Amb25116668 [0,0,0,1,0,1|1,0,0]=3 10039 B13R2.64 C(C1CCCN1)c2ccccc2 Amb17659145 [0,0,0,1,0,1|2,0,0]=4 10040 B13R2.64 C(C1CCN=N1)c2ccccc2 Amb24062003 [0,0,0,1,0,1|1,0,1]=4 10041 B13R2.64 C([C@@H]1CCCN1)c2ccccc2 Amb19883945 [0,0,0,1,0,1|2,0,0]=4 10042 B13R2.64 C(c1ccccc1)C=2CCNN2 Amb25109564 [0,0,0,1,0,1|1,0,1]=4 10043 B13R2.64 C(c1ccccc1)[S+]2CCCC2 Amb24730066 [0,0,0,1,0,1|2,0,0]=4 10044 B13R2.64 C/1NCC\C1=C\c2cc[n]cc2 Amb25051530 [0,0,0,1,0,1|1,0,1]=4 10045 B13R2.64 C/1NCC\C1=C\c2ccccc2 Amb25731960 [0,0,0,1,0,1|0,0,1]=3 10046 B13R2.64 C1CC(Sc2ccccc2)C=C1 Amb17939289 [0,0,0,1,0,1|1,0,1]=4 10047 B13R2.64 C1CCC(=Cc2ccccc2)C1 Amb10606582 [0,0,0,1,0,1|1,0,1]=4 10048 B13R2.64 C1CCC(C1)Oc2ccccc2 Amb17672970 [0,0,0,1,0,1|1,0,0]=3 10049 B13R2.64 C1CCC(C1)Sc2ccccc2 Amb17939235 [0,0,0,1,0,1|1,0,0]=3 10050 B13R2.64 C1CCC(Nc2ccccc2)S1 Amb25160084 [0,0,0,1,0,1|2,0,0]=4 10051 B13R2.64 C1CCC(Oc2ccccc2)O1 Amb22752483 [0,0,0,1,0,1|2,0,0]=4 10052 B13R2.64 C1CCCC1Oc2c[n]ccc2 Amb24085347 [0,0,0,1,0,1|2,0,0]=4 10053 B13R2.64 C1CCCC1Oc2cc[n]cc2 Amb25209413 [0,0,0,1,0,1|2,0,0]=4 10054 B13R2.64 C1CCN(C1)Cc2ccccc2 Amb1829831 [0,0,0,1,0,1|2,0,0]=4 10055 B13R2.64 C1CNC(C1)Cc2ccccc2 Amb1125550 [0,0,0,1,0,1|2,0,0]=4 10056 B13R2.64 C1NC(CO1)Cc2ccccc2 Amb18563410 [0,0,0,1,0,1|2,0,0]=4 10057 B13R2.64 C1NCC(C1)Cc2cccnc2 Amb10068883 [0,0,0,1,0,1|1,0,0]=3 10058 B13R2.64 C1NCC(C1)Cc2cccnc2 Amb10808478 [0,0,0,1,0,1|1,0,0]=3 10059 B13R2.64 C1NCC(C1)Nc2cnccn2 Amb17515647 [0,0,0,1,0,1|2,0,0]=4 10060 B13R2.64 C1NCC(C1)Nc2ncccn2 Amb17515609 [0,0,0,1,0,1|2,0,0]=4 10061 B13R2.64 C1NCC(C1)Sc2ccccc2 Amb17191396 [0,0,0,1,0,1|0,0,0]=2 10062 B13R2.64 C1NCCC1Cc2[n]ccc[n]2 Amb20062033 [0,0,0,1,0,1|2,0,0]=4 10063 B13R2.64 C1NCCC1Cc2c[n]c[n]c2 Amb24428239 [0,0,0,1,0,1|2,0,0]=4 10064 B13R2.64 C1NCCC1Cc2c[n]cc[n]2 Amb24616900 [0,0,0,1,0,1|2,0,0]=4 10065 B13R2.64 C1NCCC1Cc2cc[n]c[n]2 Amb24714436 [0,0,0,1,0,1|2,0,0]=4 10066 B13R2.64 C1NCCC1Cc2cc[n]cc2 Amb18563560 [0,0,0,1,0,1|1,0,0]=3 10067 B13R2.64 C1NCCC1Cc2cccc[n]2 Amb18563559 [0,0,0,1,0,1|1,0,0]=3 10068 B13R2.64 C1NCCC1Cc2cccc[n]2 Amb21960663 [0,0,0,1,0,1|1,0,0]=3 10069 B13R2.64 C1NCCC1Cc2ccccc2 Amb24097496 [0,0,0,1,0,1|0,0,0]=2 10070 B13R2.64 C1NCCC1Nc2[n]ccc[n]2 Amb22272342 [0,0,0,1,0,1|2,0,0]=4 10071 B13R2.64 C1NCCC1Nc2c[n]cc[n]2 Amb22272343 [0,0,0,1,0,1|2,0,0]=4 10072 B13R2.64 C1NCCC1Nc2cc[n]c[n]2 Amb18961196 [0,0,0,1,0,1|2,0,0]=4 10073 B13R2.64 C1NCCC1Nc2cc[n]cc2 Amb18961189 [0,0,0,1,0,1|1,0,0]=3 10074 B13R2.64 C1NCCC1Nc2ccc[n][n]2 Amb18286148 [0,0,0,1,0,1|2,0,0]=4 10075 B13R2.64 C1NCCC1Nc2cccc[n]2 Amb18962021 [0,0,0,1,0,1|1,0,0]=3 10076 B13R2.64 C1NCCC1Nc2cccc[n]2 Amb22272341 [0,0,0,1,0,1|1,0,0]=3 10077 B13R2.64 C1NCCC1Oc2[n]ccc[n]2 Amb18285265 [0,0,0,1,0,1|2,0,0]=4 10078 B13R2.64 C1NCCC1Oc2[n]ccc[n]2 Amb22272349 [0,0,0,1,0,1|2,0,0]=4 10079 B13R2.64 C1NCCC1Oc2c[n]cc[n]2 Amb18285264 [0,0,0,1,0,1|2,0,0]=4 10080 B13R2.64 C1NCCC1Oc2c[n]cc[n]2 Amb22272350 [0,0,0,1,0,1|2,0,0]=4 10081 B13R2.64 C1NCCC1Oc2c[n]ccc2 Amb20634441 [0,0,0,1,0,1|1,0,0]=3 10082 B13R2.64 C1NCCC1Oc2c[n]ccc2 Amb21955070 [0,0,0,1,0,1|1,0,0]=3 10083 B13R2.64 C1NCCC1Oc2c[n]ccc2 Amb21957625 [0,0,0,1,0,1|1,0,0]=3 10084 B13R2.64 C1NCCC1Oc2cc[n]c[n]2 Amb18285229 [0,0,0,1,0,1|2,0,0]=4 10085 B13R2.64 C1NCCC1Oc2cc[n]c[n]2 Amb22737114 [0,0,0,1,0,1|2,0,0]=4 10086 B13R2.64 C1NCCC1Oc2cc[n]cc2 Amb18285255 [0,0,0,1,0,1|1,0,0]=3 10087 B13R2.64 C1NCCC1Oc2cc[n]cc2 Amb22899481 [0,0,0,1,0,1|1,0,0]=3 10088 B13R2.64 C1NCCC1Oc2ccc[n][n]2 Amb18286155 [0,0,0,1,0,1|2,0,0]=4 10089 B13R2.64 C1NCCC1Oc2cccc[n]2 Amb18285220 [0,0,0,1,0,1|1,0,0]=3 10090 B13R2.64 C1NCCC1Oc2cccc[n]2 Amb22234592 [0,0,0,1,0,1|1,0,0]=3 10091 B13R2.64 C1NCCC1Oc2ccccc2 Amb21955028 [0,0,0,1,0,1|0,0,0]=2 10092 B13R2.64 C1NCCC1Pc2ccccc2 Amb24524892 [0,0,0,1,0,1|0,0,0]=2 10093 B13R2.64 C1NCCC1Sc2[n]ccc[n]2 Amb18960217 [0,0,0,1,0,1|2,0,0]=4 10094 B13R2.64 C1NCCC1Sc2[n]ccc[n]2 Amb22272365 [0,0,0,1,0,1|2,0,0]=4 10095 B13R2.64 C1NCCC1Sc2c[n]cc[n]2 Amb22272364 [0,0,0,1,0,1|2,0,0]=4 10096 B13R2.64 C1NCCC1Sc2cc[n]c[n]2 Amb25669573 [0,0,0,1,0,1|2,0,0]=4 10097 B13R2.64 C1NCCC1Sc2cc[n]cc2 Amb22272362 [0,0,0,1,0,1|1,0,0]=3 10098 B13R2.64 C1NCCC1Sc2cccc[n]2 Amb18960214 [0,0,0,1,0,1|1,0,0]=3 10099 B13R2.64 C1NCCC1Sc2cccc[n]2 Amb22272361 [0,0,0,1,0,1|1,0,0]=3 10100 B13R2.64 C1NCCN1Cc2ccccc2 Amb22494689 [0,0,0,1,0,1|1,0,0]=3 10101 B13R2.64 C1NCC[C@@H]1Cc2ccccc2 Amb24484248 [0,0,0,1,0,1|0,0,0]=2 10102 B13R2.64 C1NCC[C@@H]1Nc2[n]ccc[n]2 Amb22272277 [0,0,0,1,0,1|2,0,0]=4 10103 B13R2.64 C1NCC[C@@H]1Nc2[n]ccc[n]2 Amb22736915 [0,0,0,1,0,1|2,0,0]=4 10104 B13R2.64 C1NCC[C@@H]1Nc2c[n]cc[n]2 Amb22272278 [0,0,0,1,0,1|2,0,0]=4 10105 B13R2.64 C1NCC[C@@H]1Nc2c[n]cc[n]2 Amb22736943 [0,0,0,1,0,1|2,0,0]=4 10106 B13R2.64 C1NCC[C@@H]1Nc2cc[n]c[n]2 Amb22736996 [0,0,0,1,0,1|2,0,0]=4 10107 B13R2.64 C1NCC[C@@H]1Nc2cccc[n]2 Amb22272276 [0,0,0,1,0,1|1,0,0]=3 10108 B13R2.64 C1NCC[C@@H]1Nc2cccc[n]2 Amb22736983 [0,0,0,1,0,1|1,0,0]=3 10109 B13R2.64 C1NCC[C@@H]1Oc2[n]ccc[n]2 Amb22272288 [0,0,0,1,0,1|2,0,0]=4 10110 B13R2.64 C1NCC[C@@H]1Oc2[n]ccc[n]2 Amb24561700 [0,0,0,1,0,1|2,0,0]=4 10111 B13R2.64 C1NCC[C@@H]1Oc2c[n]cc[n]2 Amb22272733 [0,0,0,1,0,1|2,0,0]=4 10112 B13R2.64 C1NCC[C@@H]1Oc2c[n]cc[n]2 Amb24710523 [0,0,0,1,0,1|2,0,0]=4 10113 B13R2.64 C1NCC[C@@H]1Oc2cc[n]cc2 Amb22274091 [0,0,0,1,0,1|1,0,0]=3 10114 B13R2.64 C1NCC[C@@H]1Oc2cccc[n]2 Amb22272287 [0,0,0,1,0,1|1,0,0]=3 10115 B13R2.64 C1NCC[C@@H]1Oc2cccc[n]2 Amb22745639 [0,0,0,1,0,1|1,0,0]=3 10116 B13R2.64 C1NCC[C@@H]1Oc2cccc[n]2 Amb24400606 [0,0,0,1,0,1|1,0,0]=3 10117 B13R2.64 C1NCC[C@@H]1Pc2ccccc2 Amb25828974 [0,0,0,1,0,1|0,0,0]=2 10118 B13R2.64 C1NCC[C@@H]1Sc2[n]ccc[n]2 Amb22272301 [0,0,0,1,0,1|2,0,0]=4 10119 B13R2.64 C1NCC[C@@H]1Sc2c[n]cc[n]2 Amb22272300 [0,0,0,1,0,1|2,0,0]=4 10120 B13R2.64 C1NCC[C@@H]1Sc2cc[n]cc2 Amb22272298 [0,0,0,1,0,1|1,0,0]=3 10121 B13R2.64 C1NCC[C@@H]1Sc2cccc[n]2 Amb22272297 [0,0,0,1,0,1|1,0,0]=3 10122 B13R2.64 C1NCC[C@H]1Nc2[n]ccc[n]2 Amb22272307 [0,0,0,1,0,1|2,0,0]=4 10123 B13R2.64 C1NCC[C@H]1Nc2[n]ccc[n]2 Amb22736895 [0,0,0,1,0,1|2,0,0]=4 10124 B13R2.64 C1NCC[C@H]1Nc2c[n]cc[n]2 Amb22272285 [0,0,0,1,0,1|2,0,0]=4 10125 B13R2.64 C1NCC[C@H]1Nc2c[n]cc[n]2 Amb22736896 [0,0,0,1,0,1|2,0,0]=4 10126 B13R2.64 C1NCC[C@H]1Nc2cc[n]c[n]2 Amb22736911 [0,0,0,1,0,1|2,0,0]=4 10127 B13R2.64 C1NCC[C@H]1Nc2cccc[n]2 Amb22272306 [0,0,0,1,0,1|1,0,0]=3 10128 B13R2.64 C1NCC[C@H]1Nc2cccc[n]2 Amb22736980 [0,0,0,1,0,1|1,0,0]=3 10129 B13R2.64 C1NCC[C@H]1Nc2cccc[n]2 Amb25200126 [0,0,0,1,0,1|1,0,0]=3 10130 B13R2.64 C1NCC[C@H]1Oc2[n]ccc[n]2 Amb22272315 [0,0,0,1,0,1|2,0,0]=4 10131 B13R2.64 C1NCC[C@H]1Oc2c[n]cc[n]2 Amb22272552 [0,0,0,1,0,1|2,0,0]=4 10132 B13R2.64 C1NCC[C@H]1Oc2cc[n]cc2 Amb22274090 [0,0,0,1,0,1|1,0,0]=3 10133 B13R2.64 C1NCC[C@H]1Oc2cccc[n]2 Amb22272561 [0,0,0,1,0,1|1,0,0]=3 10134 B13R2.64 C1NCC[C@H]1Oc2ccccc2 Amb25048825 [0,0,0,1,0,1|0,0,0]=2 10135 B13R2.64 C1NCC[C@H]1Sc2[n]ccc[n]2 Amb22272312 [0,0,0,1,0,1|2,0,0]=4 10136 B13R2.64 C1NCC[C@H]1Sc2c[n]cc[n]2 Amb22272325 [0,0,0,1,0,1|2,0,0]=4 10137 B13R2.64 C1NCC[C@H]1Sc2cc[n]cc2 Amb22272323 [0,0,0,1,0,1|1,0,0]=3 10138 B13R2.64 C1NCC[C@H]1Sc2cc[n]cc2 Amb25076129 [0,0,0,1,0,1|1,0,0]=3 10139 B13R2.64 C1NCC[C@H]1Sc2cccc[n]2 Amb22272528 [0,0,0,1,0,1|1,0,0]=3 10140 B13R2.64 C1NCC[C@H]1Sc2cccc[n]2 Amb25125374 [0,0,0,1,0,1|1,0,0]=3 10141 B13R2.64 C1OCCC1Nc2cc[n]cc2 Amb24392690 [0,0,0,1,0,1|2,0,0]=4 10142 B13R2.64 C1OCCC1Nc2ccccc2 Amb25310936 [0,0,0,1,0,1|1,0,0]=3 10143 B13R2.64 C1OCCC1Oc2c[n]ccc2 Amb25118078 [0,0,0,1,0,1|2,0,0]=4 10144 B13R2.64 C1OCCC1Oc2ccccc2 Amb24713722 [0,0,0,1,0,1|1,0,0]=3 10145 B13R2.64 C1OCCC1Sc2cccc[n]2 Amb25822275 [0,0,0,1,0,1|2,0,0]=4 10146 B13R2.64 C1OCCN1Cc2ccccc2 Amb22229191 [0,0,0,1,0,1|2,0,0]=4 10147 B13R2.64 C1SCCC1Nc2cc[n]cc2 Amb24363002 [0,0,0,1,0,1|2,0,0]=4 10148 B13R2.135 CC1Cc2ccccc2C1CN Amb24514651 [0,0,0,1,0,1|2,0,0]=4 10149 B13R2.135 CC1Cc2ccccc2C1NC Amb18279352 [0,0,0,1,0,1|0,0,0]=2 10150 B13R2.135 CC1Nc2ccccc2C1CC Amb24308998 [0,0,0,1,0,1|1,0,0]=3 10151 B13R2.135 CC1Nc2ccccc2C1CO Amb18063470 [0,0,0,1,0,1|2,0,0]=4 10152 B13R2.135 CC1Oc2ccccc2C1C#N Amb25737818 [0,0,0,1,0,1|2,0,0]=4 10153 B13R2.135 CC1Oc2ccccc2C1NC Amb18279367 [0,0,0,1,0,1|0,0,0]=2 10154 B13R2.135 CC1Sc2ccccc2C1NC Amb18279380 [0,0,0,1,0,1|0,0,0]=2 10155 B13R2.135 CCC1C(N)Cc2ccccc21 Amb18645548 [0,0,0,1,0,1|2,0,0]=4 10156 B13R2.135 CCN1C(C)Cc2ccccc12 Amb24343831 [0,0,0,1,0,1|2,0,0]=4 10157 B13R2.135 CCN1C(C)Sc2ccccc12 Amb24654214 [0,0,0,1,0,1|2,0,0]=4 10158 B13R2.135 CNC1C(=O)Nc2c1cccc2 Amb1113865 [0,0,0,1,0,1|1,0,1]=4 10159 B13R2.135 CNC1C(Cl)Cc2ccccc21 Amb24341725 [0,0,0,1,0,1|1,0,0]=3 10160 B13R2.135 CNC1C(F)Cc2ccccc21 Amb24672246 [0,0,0,1,0,1|1,0,0]=3 10161 B13R2.135 CNC1C(O)Cc2ccccc21 Amb25772931 [0,0,0,1,0,1|1,0,0]=3 10162 B13R2.135 CN[C@@H]1[C@H](F)Cc2ccccc21 Amb25249748 [0,0,0,1,0,1|1,0,0]=3 10163 B13R2.135 CN[C@H]1[C@@H](O)Cc2ccccc21 Amb25210881 [0,0,0,1,0,1|1,0,0]=3 10164 B13R2.135 CNc1c2ccccc2[n][n]1C Amb24084321 [0,0,0,1,0,1|1,0,1]=4 10165 B13R2.135 COC1C(Cl)Cc2ccccc21 Amb24104237 [0,0,0,1,0,1|2,0,0]=4 10166 B13R2.135 COC1C(O)Cc2ccccc21 Amb22227971 [0,0,0,1,0,1|2,0,0]=4 10167 B13R2.135 CO[C@@H]1C(O)Cc2c1cccc2 Amb16226980 [0,0,0,1,0,1|2,0,0]=4 10168 B13R2.135 CO[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24744824 [0,0,0,1,0,1|2,0,0]=4 10169 B13R2.135 CO[C@@H]1[C@@H](O)Cc2ccccc21 Amb22757738 [0,0,0,1,0,1|2,0,0]=4 10170 B13R2.135 CO[C@@H]1[C@H](N)Cc2ccccc21 Amb25162040 [0,0,0,1,0,1|2,0,0]=4 10171 B13R2.135 CO[C@H]1[C@@H](N)Cc2ccccc21 Amb24089073 [0,0,0,1,0,1|2,0,0]=4 10172 B13R2.135 CSC1C(Cl)Cc2ccccc21 Amb25124751 [0,0,0,1,0,1|2,0,0]=4 10173 B13R2.135 C[C@H]1Oc2ccccc2[C@H]1C#N Amb24699151 [0,0,0,1,0,1|2,0,0]=4 10174 B13R2.135 Cc1[nH]c2ccccc2c1NC Amb18563502 [0,0,0,1,0,1|0,0,2]=4 10175 B13R2.138 C[C@@H]1[C@H](C=O)[C@H]1c2ccccc2 Amb25212061 [0,0,0,1,0,1|2,0,0]=4 10176 B13R2.138 C[C@H]1[C@@H](C=O)[C@@H]1c2ccccc2 Amb25302243 [0,0,0,1,0,1|2,0,0]=4 10177 B13R2.138 C[C@H]1[C@@H](CO)[C@@H]1c2ccccc2 Amb24719551 [0,0,0,1,0,1|2,0,0]=4 10178 B13R2.138 C[C@H]1[C@H](C=O)[C@@H]1c2ccccc2 Amb24580397 [0,0,0,1,0,1|2,0,0]=4 10179 B13R2.163 CC1CC=Nc2ccccc2N1 Amb25123248 [0,0,0,1,0,1|2,0,0]=4 10180 B13R2.163 CC1CCNc2c(O1)cccc2 Amb17570089 [0,0,0,1,0,1|2,0,0]=4 10181 B13R2.163 CC1CCNc2ccccc2N1 Amb19337570 [0,0,0,1,0,1|2,0,0]=4 10182 B13R2.163 CC1CCOc2ccccc2N1 Amb25100881 [0,0,0,1,0,1|2,0,0]=4 10183 B13R2.163 CC1CCSc2ccccc2N1 Amb25089697 [0,0,0,1,0,1|2,0,0]=4 10184 B13R2.163 CC1CNCc2ccccc2C1 Amb25756998 [0,0,0,1,0,1|0,0,0]=2 10185 B13R2.163 CC1CNCc2ccccc2O1 Amb24177077 [0,0,0,1,0,1|0,0,0]=2 10186 B13R2.163 CC1CNCc2ccccc2S1 Amb25309752 [0,0,0,1,0,1|0,0,0]=2 10187 B13R2.163 CC1Cc2ccccc2NCC1 Amb25765835 [0,0,0,1,0,1|2,0,0]=4 10188 B13R2.163 CN1CCCc2c(C1)cccc2 Amb10572356 [0,0,0,1,0,1|2,0,0]=4 10189 B13R2.163 C[C@@H]1Cc2ccccc2CCN1 Amb24456422 [0,0,0,1,0,1|2,0,0]=4 10190 B13R2.163 ClC1CCCc2ccccc2S1 Amb25363416 [0,0,0,1,0,1|2,0,0]=4 10191 B13R2.163 FC1CNCc2ccccc2C1 Amb22731461 [0,0,0,1,0,1|1,0,0]=3 10192 B13R2.163 NC1CCCc2ccccc2N1 Amb25800137 [0,0,0,1,0,1|2,0,0]=4 10193 B13R2.163 NC1Cc2ccccc2CCC1 Amb24355951 [0,0,0,1,0,1|2,0,0]=4 10194 B13R2.163 N[C@H]1Cc2ccccc2CCC1 Amb25151132 [0,0,0,1,0,1|2,0,0]=4 10195 B13R2.163 O=C1CNCc2c(N1)cccc2 Amb17606145 [0,0,0,1,0,1|1,0,1]=4 10196 B13R2.163 OC1CNCc2ccccc2C1 Amb25148562 [0,0,0,1,0,1|1,0,0]=3 10197 B13R2.197 CC1(CC1N)Cc2ccccc2 Amb18966916 [0,0,0,1,0,1|2,0,0]=4 10198 B13R2.197 CC1(CC1N)Oc2ccccc2 Amb24084638 [0,0,0,1,0,1|2,0,0]=4 10199 B13R2.221 CC1(CCC1)Nc2cc[n]cc2 Amb25238192 [0,0,0,1,0,1|2,0,0]=4 10200 B13R2.221 CC1(CNC1)Cc2ccccc2 Amb17334538 [0,0,0,1,0,1|0,0,0]=2 10201 B13R2.221 CC1(CNC1)Nc2ccc[n][n]2 Amb24629489 [0,0,0,1,0,1|2,0,0]=4 10202 B13R2.221 CC1(CNC1)Oc2ccccc2 Amb24077480 [0,0,0,1,0,1|0,0,0]=2 10203 B13R2.221 CC1(CNC1)Oc2ccccc2 Amb25713338 [0,0,0,1,0,1|0,0,0]=2 10204 B13R2.221 NC1(COC1)Cc2ccccc2 Amb23439404 [0,0,0,1,0,1|2,0,0]=4 10205 B13R2.221 NC1(Cc2ccccc2)CCC1 Amb20669182 [0,0,0,1,0,1|2,0,0]=4 10206 B13R2.221 OC1(CNC1)Cc2c[n]ccc2 Amb24463303 [0,0,0,1,0,1|2,0,0]=4 10207 B13R2.221 OC1(CNC1)Cc2ccccc2 Amb24416845 [0,0,0,1,0,1|1,0,0]=3 10208 B13R2.221 OC1(Cc2ccccc2)CCC1 Amb25096126 [0,0,0,1,0,1|2,0,0]=4 10209 B13R2.328 CC1CC(=O)c2c(C1)cccc2 Amb17594003 [0,0,0,1,0,1|2,0,0]=4 10210 B13R2.328 CC1CC(=O)c2ccccc2N1 Amb18560059 [0,0,0,1,0,1|2,0,0]=4 10211 B13R2.328 CC1CC(Br)c2ccccc2C1 Amb24352489 [0,0,0,1,0,1|2,0,0]=4 10212 B13R2.328 CC1CC(Cl)c2ccccc2C1 Amb24412362 [0,0,0,1,0,1|2,0,0]=4 10213 B13R2.328 CC1CC(N)c2ccccc2C1 Amb25796465 [0,0,0,1,0,1|2,0,0]=4 10214 B13R2.328 CC1CC(N)c2ccccc2N1 Amb18559939 [0,0,0,1,0,1|2,0,0]=4 10215 B13R2.328 CC1CC(O)c2ccccc2C1 Amb24483433 [0,0,0,1,0,1|2,0,0]=4 10216 B13R2.328 CC1CC(O)c2ccccc2N1 Amb18062464 [0,0,0,1,0,1|2,0,0]=4 10217 B13R2.328 CC1CC(O)c2ccccc2O1 Amb24669760 [0,0,0,1,0,1|2,0,0]=4 10218 B13R2.328 CC1CC(O)c2ccccc2S1 Amb25731002 [0,0,0,1,0,1|2,0,0]=4 10219 B13R2.328 CC1CN(C)Cc2ccccc21 Amb17971060 [0,0,0,1,0,1|2,0,0]=4 10220 B13R2.328 CC1CN(C)c2c(C1)cccc2 Amb10563308 [0,0,0,1,0,1|0,0,0]=2 10221 B13R2.328 CC1CN(C)c2ccccc2N1 Amb18061952 [0,0,0,1,0,1|0,0,0]=2 10222 B13R2.328 CC1C[C@@H](N)c2ccccc2O1 Amb25104415 [0,0,0,1,0,1|2,0,0]=4 10223 B13R2.328 CC1C[C@@H](O)c2ccccc2O1 Amb24760034 [0,0,0,1,0,1|2,0,0]=4 10224 B13R2.328 CC1C[C@H](O)c2ccccc2O1 Amb24364321 [0,0,0,1,0,1|2,0,0]=4 10225 B13R2.328 CC1Cc2ccccc2C(C)N1 Amb18829882 [0,0,0,1,0,1|2,0,0]=4 10226 B13R2.328 CC1NC(C)c2ccccc2O1 Amb25770676 [0,0,0,1,0,1|2,0,0]=4 10227 B13R2.328 CC1Nc2ccccc2C(C)O1 Amb25095786 [0,0,0,1,0,1|2,0,0]=4 10228 B13R2.328 CC1OC(C)c2ccccc2O1 Amb17940033 [0,0,0,1,0,1|2,0,0]=4 10229 B13R2.328 CC=1CN(C)c2ccccc2N1 Amb24591845 [0,0,0,1,0,1|0,0,1]=3 10230 B13R2.328 CN1CC(=O)Nc2ccccc12 Amb21864918 [0,0,0,1,0,1|1,0,1]=4 10231 B13R2.328 CN1CC(N)Cc2ccccc12 Amb25667266 [0,0,0,1,0,1|1,0,0]=3 10232 B13R2.328 C[C@@H]1CC(=O)c2ccccc2O1 Amb25713529 [0,0,0,1,0,1|2,0,0]=4 10233 B13R2.328 C[C@@H]1C[C@@H](O)c2ccccc2C1 Amb25176282 [0,0,0,1,0,1|2,0,0]=4 10234 B13R2.328 C[C@@H]1C[C@@H](O)c2ccccc2N1 Amb24519310 [0,0,0,1,0,1|2,0,0]=4 10235 B13R2.328 C[C@@H]1C[C@@H](O)c2ccccc2O1 Amb24579780 [0,0,0,1,0,1|2,0,0]=4 10236 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2N1 Amb24610143 [0,0,0,1,0,1|2,0,0]=4 10237 B13R2.328 C[C@@H]1C[C@H](N)c2ccccc2O1 Amb25175782 [0,0,0,1,0,1|2,0,0]=4 10238 B13R2.328 C[C@@H]1C[C@H](O)c2ccccc2S1 Amb24555595 [0,0,0,1,0,1|2,0,0]=4 10239 B13R2.328 C[C@H]1CC(=O)c2ccccc2O1 Amb24388644 [0,0,0,1,0,1|2,0,0]=4 10240 B13R2.328 C[C@H]1CC(=O)c2ccccc2S1 Amb25262752 [0,0,0,1,0,1|2,0,0]=4 10241 B13R2.328 C[C@H]1C[C@@H](C)c2ccccc2N1 Amb25360226 [0,0,0,1,0,1|1,0,0]=3 10242 B13R2.328 C[C@H]1C[C@@H](O)c2ccccc2N1 Amb25337617 [0,0,0,1,0,1|2,0,0]=4 10243 B13R2.328 C[C@H]1C[C@@H](O)c2ccccc2O1 Amb25317640 [0,0,0,1,0,1|2,0,0]=4 10244 B13R2.328 C[C@H]1C[C@@H](O)c2ccccc2S1 Amb24629236 [0,0,0,1,0,1|2,0,0]=4 10245 B13R2.328 C[C@H]1N[C@@H](C)c2ccccc2O1 Amb24666555 [0,0,0,1,0,1|2,0,0]=4 10246 B13R2.328 NC1Cc2ccccc2N(O)C1 Amb25685999 [0,0,0,1,0,1|2,0,0]=4 10247 B13R2.328 N[C@@H]1Cc2ccccc2N(O)C1 Amb22747217 [0,0,0,1,0,1|2,0,0]=4 10248 B13R2.444 CC(Oc1ccccc1)C2CO2 Amb24435209 [0,0,0,1,0,1|1,0,0]=3 10249 B13R2.444 C[C@H](Nc1ccccc1)C2CC2 Amb25067654 [0,0,0,1,0,1|1,0,0]=3 10250 B13R2.444 C\C(=C\c1ccccc1)\C2CO2 Amb24670055 [0,0,0,1,0,1|1,0,1]=4 10251 B13R2.444 ClC(Cc1ccccc1)C2CC2 Amb18791201 [0,0,0,1,0,1|2,0,0]=4 10252 B13R2.444 ClC(Sc1ccccc1)C2CC2 Amb25794474 [0,0,0,1,0,1|2,0,0]=4 10253 B13R2.444 NC(C1CC1)Cc2ccccc2 Amb17138534 [0,0,0,1,0,1|2,0,0]=4 10254 B13R2.444 NC(Cc1ccccc1)C2CC2 Amb19515578 [0,0,0,1,0,1|2,0,0]=4 10255 B13R2.444 N[C@@H](Cc1ccccc1)[C@H]2CO2 Amb24578801 [0,0,0,1,0,1|2,0,0]=4 10256 B13R2.444 OC(C1CC1)Cc2ccccc2 Amb17138544 [0,0,0,1,0,1|2,0,0]=4 10257 B13R2.444 OC(Cc1ccccc1)C2CO2 Amb24497698 [0,0,0,1,0,1|2,0,0]=4 10258 B13R2.444 O[C@@H](Cc1ccccc1)[C@@H]2CO2 Amb24661121 [0,0,0,1,0,1|2,0,0]=4 10259 B13R2.444 O[C@H](Cc1ccccc1)[C@@H]2CO2 Amb24558598 [0,0,0,1,0,1|2,0,0]=4 10260 B13R2.444 O[C@H](Cc1ccccc1)[C@H]2CO2 Amb24752264 [0,0,0,1,0,1|2,0,0]=4 10261 B13R2.2959 CC1(CC=C)Cc2ccccc12 Amb17844032 [0,0,0,1,0,1|1,0,1]=4 10262 B13R2.2959 CNCC1(O)Oc2ccccc12 Amb24364764 [0,0,0,1,0,1|1,0,0]=3 10263 B13R2.1 BrCCC1CCc2ccccc21 Amb25175768 [0,1,0,1,0,0|2,0,0]=4 10264 B13R2.1 BrCCC1CNc2ccccc21 Amb24573285 [0,1,0,1,0,0|2,0,0]=4 10265 B13R2.1 C=CCC1CNc2ccccc21 Amb25234208 [0,1,0,1,0,0|1,0,1]=4 10266 B13R2.1 CCNC1CCc2c1cccc2 Amb10610131 [0,1,0,1,0,0|2,0,0]=4 10267 B13R2.1 CCOC1OCc2ccccc21 Amb25088972 [0,1,0,1,0,0|2,0,0]=4 10268 B13R2.1 CNCC1CCc2c1cccc2 Amb17470428 [0,1,0,1,0,0|0,0,0]=2 10269 B13R2.1 CNCC1CCc2cc[n]cc21 Amb25239643 [0,1,0,1,0,0|1,0,0]=3 10270 B13R2.1 CNCC1CCc2ccc[n]c21 Amb25793759 [0,1,0,1,0,0|1,0,0]=3 10271 B13R2.1 CNCC1COc2ccccc21 Amb23586279 [0,1,0,1,0,0|0,0,0]=2 10272 B13R2.1 CNCc1[nH][n]c2ccccc21 Amb18960077 [0,1,0,1,0,0|1,0,1]=4 10273 B13R2.1 CNCc1c[nH]c2c1cccc2 Amb2519349 [0,1,0,1,0,0|0,0,2]=4 10274 B13R2.1 CNCc1c[s]c2ccccc21 Amb18286790 [0,1,0,1,0,0|0,0,2]=4 10275 B13R2.1 CNCc1coc2ccccc21 Amb19649828 [0,1,0,1,0,0|0,0,2]=4 10276 B13R2.1 CNCc1coc2ccccc21 Amb21961522 [0,1,0,1,0,0|0,0,2]=4 10277 B13R2.1 CONC1CSc2ccccc21 Amb24647244 [0,1,0,1,0,0|2,0,0]=4 10278 B13R2.1 CSCC1CCc2ccccc21 Amb25307253 [0,1,0,1,0,0|1,0,0]=3 10279 B13R2.1 CSCC1CSc2ccccc21 Amb24454448 [0,1,0,1,0,0|1,0,0]=3 10280 B13R2.1 ClCCC1CCc2ccccc21 Amb25059218 [0,1,0,1,0,0|2,0,0]=4 10281 B13R2.1 N#CCC1CCc2ccccc21 Amb18644935 [0,1,0,1,0,0|2,0,0]=4 10282 B13R2.1 N#CCC1CNc2ccccc21 Amb18063500 [0,1,0,1,0,0|2,0,0]=4 10283 B13R2.1 N#CCC1CSc2ccccc21 Amb25794587 [0,1,0,1,0,0|2,0,0]=4 10284 B13R2.1 NCCC1CCc2c1cccc2 Amb17232390 [0,1,0,1,0,0|2,0,0]=4 10285 B13R2.1 NCCC1CNc2ccccc21 Amb18560682 [0,1,0,1,0,0|2,0,0]=4 10286 B13R2.1 NCCC1COc2ccccc21 Amb18829250 [0,1,0,1,0,0|2,0,0]=4 10287 B13R2.1 NCCC1CSc2ccccc21 Amb18194201 [0,1,0,1,0,0|2,0,0]=4 10288 B13R2.1 NCCC1OCc2ccccc21 Amb18829221 [0,1,0,1,0,0|2,0,0]=4 10289 B13R2.1 NNCC1CCc2ccc[n]c21 Amb25710942 [0,1,0,1,0,0|2,0,0]=4 10290 B13R2.1 NNCC1COc2ccccc21 Amb25104770 [0,1,0,1,0,0|1,0,0]=3 10291 B13R2.1 OCCC1CCc2c1cccc2 Amb10605019 [0,1,0,1,0,0|2,0,0]=4 10292 B13R2.1 OCCC1CSc2ccccc21 Amb24642413 [0,1,0,1,0,0|2,0,0]=4 10293 B13R2.3 C1=NCC(CN1)c2ccccc2 Amb16210072 [0,1,0,1,0,0|0,0,1]=3 10294 B13R2.3 C1C=C(CCO1)c2ccccc2 Amb21960770 [0,1,0,1,0,0|1,0,1]=4 10295 B13R2.3 C1C=C(NCN1)c2ccccc2 Amb24532691 [0,1,0,1,0,0|0,0,2]=4 10296 B13R2.3 C1C=CCC(N1)c2ccccc2 Amb25827021 [0,1,0,1,0,0|1,0,1]=4 10297 B13R2.3 C1C=CCC(O1)c2ccccc2 Amb25276707 [0,1,0,1,0,0|1,0,1]=4 10298 B13R2.3 C1C=CCCC1c2ccccc2 Amb22731850 [0,1,0,1,0,0|1,0,0]=3 10299 B13R2.3 C1C=CC[C@H](N1)c2ccccc2 Amb25047356 [0,1,0,1,0,0|1,0,1]=4 10300 B13R2.3 C1CC(C=CN1)c2ccccc2 Amb25374926 [0,1,0,1,0,0|0,0,1]=3 10301 B13R2.3 C1CC(C=C[NH2+]1)c2ccccc2 Amb24080270 [0,1,0,1,0,0|0,0,2]=4 10302 B13R2.3 C1CC(CCN1)c2[n]ccc[n]2 Amb19958019 [0,1,0,1,0,0|2,0,0]=4 10303 B13R2.3 C1CC(CCN1)c2[n]ccc[n]2 Amb24323102 [0,1,0,1,0,0|2,0,0]=4 10304 B13R2.3 C1CC(CCN1)c2c[n]c[n]c2 Amb18280659 [0,1,0,1,0,0|2,0,0]=4 10305 B13R2.3 C1CC(CCN1)c2c[n]cc[n]2 Amb18829168 [0,1,0,1,0,0|2,0,0]=4 10306 B13R2.3 C1CC(CCN1)c2c[n]cc[n]2 Amb24323188 [0,1,0,1,0,0|2,0,0]=4 10307 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb22756469 [0,1,0,1,0,0|1,0,0]=3 10308 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb22756575 [0,1,0,1,0,0|1,0,0]=3 10309 B13R2.3 C1CC(CCN1)c2c[n]ccc2 Amb24323180 [0,1,0,1,0,0|1,0,0]=3 10310 B13R2.3 C1CC(CCN1)c2cc[n]c[n]2 Amb18279425 [0,1,0,1,0,0|2,0,0]=4 10311 B13R2.3 C1CC(CCN1)c2cc[n]c[n]2 Amb21955897 [0,1,0,1,0,0|2,0,0]=4 10312 B13R2.3 C1CC(CCN1)c2cc[n]cc2 Amb24323181 [0,1,0,1,0,0|1,0,0]=3 10313 B13R2.3 C1CC(CCN1)c2ccc[n][n]2 Amb23598540 [0,1,0,1,0,0|2,0,0]=4 10314 B13R2.3 C1CC(CCN1)c2cccc[n]2 Amb21857657 [0,1,0,1,0,0|1,0,0]=3 10315 B13R2.3 C1CC(CCN1)c2cccc[n]2 Amb22751795 [0,1,0,1,0,0|1,0,0]=3 10316 B13R2.3 C1CC(CCN1)c2ccccc2 Amb22491685 [0,1,0,1,0,0|0,0,0]=2 10317 B13R2.3 C1CC(CCO1)c2c[n]ccc2 Amb24320765 [0,1,0,1,0,0|2,0,0]=4 10318 B13R2.3 C1CC(CCO1)c2ccccc2 Amb21856446 [0,1,0,1,0,0|1,0,0]=3 10319 B13R2.3 C1CCC(CN1)c2ccccc2 Amb1995213 [0,1,0,1,0,0|0,0,0]=2 10320 B13R2.3 C1CCC(CN1)c2ccccc2 Amb2236473 [0,1,0,1,0,0|0,0,0]=2 10321 B13R2.3 C1CCC(CN1)c2ccncc2 Amb17400120 [0,1,0,1,0,0|1,0,0]=3 10322 B13R2.3 C1CCC(CS1)c2ccccc2 Amb16764110 [0,1,0,1,0,0|1,0,0]=3 10323 B13R2.3 C1CCC(NC1)c2ccccc2 Amb10068914 [0,1,0,1,0,0|1,0,0]=3 10324 B13R2.3 C1CCC(NC1)c2ccccc2 Amb1945350 [0,1,0,1,0,0|1,0,0]=3 10325 B13R2.3 C1CCC(NC1)c2ccccn2 Amb10576617 [0,1,0,1,0,0|2,0,0]=4 10326 B13R2.3 C1CCC(NC1)c2ccccn2 Amb2234698 [0,1,0,1,0,0|2,0,0]=4 10327 B13R2.3 C1CCC(NC1)c2ccccn2 Amb2237208 [0,1,0,1,0,0|2,0,0]=4 10328 B13R2.3 C1CCC(NC1)c2cccnc2 Amb1007730 [0,1,0,1,0,0|2,0,0]=4 10329 B13R2.3 C1CCC(NC1)c2cccnc2 Amb2234656 [0,1,0,1,0,0|2,0,0]=4 10330 B13R2.3 C1CCC(NC1)c2ccncc2 Amb1837043 [0,1,0,1,0,0|2,0,0]=4 10331 B13R2.3 C1CCC(OC1)c2ccccc2 Amb10558590 [0,1,0,1,0,0|1,0,0]=3 10332 B13R2.3 C1CCC(SC1)c2ccccc2 Amb16755477 [0,1,0,1,0,0|1,0,0]=3 10333 B13R2.3 C1CCCC(N1)c2c[n]ccc2 Amb17659186 [0,1,0,1,0,0|2,0,0]=4 10334 B13R2.3 C1CCCC(N1)c2c[n]ccc2 Amb22741090 [0,1,0,1,0,0|2,0,0]=4 10335 B13R2.3 C1CCCC(N1)c2cc[n]cc2 Amb17659185 [0,1,0,1,0,0|2,0,0]=4 10336 B13R2.3 C1CCCC(N1)c2cc[n]cc2 Amb22751945 [0,1,0,1,0,0|2,0,0]=4 10337 B13R2.3 C1CCCCC1c2cccc[n]2 Amb23589742 [0,1,0,1,0,0|2,0,0]=4 10338 B13R2.3 C1CCCC[SiH]1c2ccccc2 Amb22366575 [0,1,0,1,0,0|1,1,0]=4 10339 B13R2.3 C1CCCN=C1c2ccccc2 Amb25835559 [0,1,0,1,0,0|1,0,1]=4 10340 B13R2.3 C1CCC[C@@H](N1)c2cccc[n]2 Amb22751938 [0,1,0,1,0,0|2,0,0]=4 10341 B13R2.3 C1CCC[C@@H](N1)c2ccccc2 Amb24181809 [0,1,0,1,0,0|1,0,0]=3 10342 B13R2.3 C1CCC[C@H](N1)c2cc[n]cc2 Amb24688654 [0,1,0,1,0,0|2,0,0]=4 10343 B13R2.3 C1CCC[C@H](N1)c2ccccc2 Amb24471915 [0,1,0,1,0,0|1,0,0]=3 10344 B13R2.3 C1CCOC(N1)c2ccccc2 Amb22901047 [0,1,0,1,0,0|2,0,0]=4 10345 B13R2.3 C1CC[C@@H](NC1)c2ccccc2 Amb10567815 [0,1,0,1,0,0|1,0,0]=3 10346 B13R2.3 C1CC[C@@H](NC1)c2cccnc2 Amb16229320 [0,1,0,1,0,0|2,0,0]=4 10347 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb1043454 [0,1,0,1,0,0|2,0,0]=4 10348 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb10549378 [0,1,0,1,0,0|2,0,0]=4 10349 B13R2.3 C1CC[C@H](NC1)c2cccnc2 Amb1980982 [0,1,0,1,0,0|2,0,0]=4 10350 B13R2.3 C1CN(CCN1)c2c[n]ccc2 Amb19958646 [0,1,0,1,0,0|2,0,0]=4 10351 B13R2.3 C1CN(CCO1)c2ccccc2 Amb24070610 [0,1,0,1,0,0|2,0,0]=4 10352 B13R2.3 C1CN(CCS1)c2ccccc2 Amb23534640 [0,1,0,1,0,0|2,0,0]=4 10353 B13R2.3 C1CNC(CN1)c2cccnc2 Amb10068869 [0,1,0,1,0,0|1,0,0]=3 10354 B13R2.3 C1CNC(CS1)c2cccnc2 Amb10068814 [0,1,0,1,0,0|2,0,0]=4 10355 B13R2.3 C1CNC(OC1)c2ccccc2 Amb17334580 [0,1,0,1,0,0|2,0,0]=4 10356 B13R2.3 C1CNN=C(N1)c2ccccc2 Amb25301491 [0,1,0,1,0,0|1,0,1]=4 10357 B13R2.3 C1COC(CN1)c2ccccn2 Amb17063307 [0,1,0,1,0,0|1,0,0]=3 10358 B13R2.3 C1COC(CN1)c2cccnc2 Amb10068842 [0,1,0,1,0,0|1,0,0]=3 10359 B13R2.3 C1CP(CCN1)c2ccccc2 Amb24758925 [0,1,0,1,0,0|1,0,0]=3 10360 B13R2.3 C1CSC(CN1)c2cccnc2 Amb10068811 [0,1,0,1,0,0|1,0,0]=3 10361 B13R2.3 C1CSC(CN1)c2cccnc2 Amb10808442 [0,1,0,1,0,0|1,0,0]=3 10362 B13R2.3 C1NC=NCC1c2ccccc2 Amb22536298 [0,1,0,1,0,0|0,0,1]=3 10363 B13R2.3 C1NCCC=C1c2c[n]ccc2 Amb25680273 [0,1,0,1,0,0|1,0,1]=4 10364 B13R2.3 C1NCCC=C1c2cc[n]cc2 Amb24746559 [0,1,0,1,0,0|1,0,1]=4 10365 B13R2.3 C1NCCC=C1c2ccccc2 Amb18645223 [0,1,0,1,0,0|0,0,1]=3 10366 B13R2.3 C1NCCCC1c2[n]ccc[n]2 Amb18064228 [0,1,0,1,0,0|2,0,0]=4 10367 B13R2.3 C1NCCCC1c2c[n]c[n]c2 Amb18829147 [0,1,0,1,0,0|2,0,0]=4 10368 B13R2.3 C1NCCCC1c2c[n]cc[n]2 Amb18829158 [0,1,0,1,0,0|2,0,0]=4 10369 B13R2.3 C1NCCCC1c2cc[n]c[n]2 Amb18946434 [0,1,0,1,0,0|2,0,0]=4 10370 B13R2.3 C1NCCCC1c2cc[n]c[n]2 Amb19372871 [0,1,0,1,0,0|2,0,0]=4 10371 B13R2.3 C1NCCCC1c2cc[n]cc2 Amb22899069 [0,1,0,1,0,0|1,0,0]=3 10372 B13R2.3 C1NCCCC1c2cc[n]cc2 Amb22899070 [0,1,0,1,0,0|1,0,0]=3 10373 B13R2.3 C1NCCCC1c2ccc[n][n]2 Amb24322580 [0,1,0,1,0,0|2,0,0]=4 10374 B13R2.3 C1NCCCC1c2cccc[n]2 Amb21960404 [0,1,0,1,0,0|1,0,0]=3 10375 B13R2.3 C1NCCCP1c2ccccc2 Amb25805271 [0,1,0,1,0,0|1,0,0]=3 10376 B13R2.3 C1NCCC[C@@H]1c2c[n]ccc2 Amb25269640 [0,1,0,1,0,0|1,0,0]=3 10377 B13R2.3 C1NCCC[C@@H]1c2cc[n]cc2 Amb24548285 [0,1,0,1,0,0|1,0,0]=3 10378 B13R2.3 C1NCCC[C@@H]1c2cccc[n]2 Amb22751791 [0,1,0,1,0,0|1,0,0]=3 10379 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb19888168 [0,1,0,1,0,0|0,0,0]=2 10380 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb22755507 [0,1,0,1,0,0|0,0,0]=2 10381 B13R2.3 C1NCCC[C@H]1c2cc[n]cc2 Amb24558408 [0,1,0,1,0,0|1,0,0]=3 10382 B13R2.3 C1NCCC[C@H]1c2ccccc2 Amb19888364 [0,1,0,1,0,0|0,0,0]=2 10383 B13R2.3 C1NCCNC1N2C=CC=CN2 Amb25060660 [0,1,0,1,0,0|2,0,0]=4 10384 B13R2.3 C1NCCNC1c2cc[n]cc2 Amb24319003 [0,1,0,1,0,0|1,0,0]=3 10385 B13R2.3 C1NCCNC1c2cccc[n]2 Amb24319001 [0,1,0,1,0,0|1,0,0]=3 10386 B13R2.3 C1NCCN[C@@H]1c2cccc[n]2 Amb25367203 [0,1,0,1,0,0|1,0,0]=3 10387 B13R2.3 C1NCCN[C@H]1c2cccc[n]2 Amb24578772 [0,1,0,1,0,0|1,0,0]=3 10388 B13R2.3 C1NCCN[C@H]1c2ccccc2 Amb25149925 [0,1,0,1,0,0|0,0,0]=2 10389 B13R2.3 C1NCCOC1c2c[n]ccc2 Amb22034686 [0,1,0,1,0,0|1,0,0]=3 10390 B13R2.3 C1NCCOC1c2c[n]ccc2 Amb22756462 [0,1,0,1,0,0|1,0,0]=3 10391 B13R2.3 C1NCCOC1c2cc[n]c[n]2 Amb20062272 [0,1,0,1,0,0|2,0,0]=4 10392 B13R2.3 C1NCCOC1c2cc[n]cc2 Amb22034687 [0,1,0,1,0,0|1,0,0]=3 10393 B13R2.3 C1NCCOC1c2cccc[n]2 Amb22034685 [0,1,0,1,0,0|1,0,0]=3 10394 B13R2.3 C1NCCOC1c2cccc[n]2 Amb22755066 [0,1,0,1,0,0|1,0,0]=3 10395 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb19889425 [0,1,0,1,0,0|0,0,0]=2 10396 B13R2.3 C1NCCO[C@@H]1c2ccccc2 Amb22899094 [0,1,0,1,0,0|0,0,0]=2 10397 B13R2.3 C1NCCO[C@H]1c2cccc[n]2 Amb25331072 [0,1,0,1,0,0|1,0,0]=3 10398 B13R2.3 C1NCCSC1c2cc[n]c[n]2 Amb18823968 [0,1,0,1,0,0|2,0,0]=4 10399 B13R2.3 C1NCCSC1c2cc[n]cc2 Amb18824330 [0,1,0,1,0,0|1,0,0]=3 10400 B13R2.3 C1OCCCC1c2c[n]ccc2 Amb24320762 [0,1,0,1,0,0|2,0,0]=4 10401 B13R2.3 C1OCCCC1c2cc[n]cc2 Amb24320761 [0,1,0,1,0,0|2,0,0]=4 10402 B13R2.3 C1OCCCC1c2cccc[n]2 Amb24320763 [0,1,0,1,0,0|2,0,0]=4 10403 B13R2.3 C1OCCNC1c2c[n]ccc2 Amb17934236 [0,1,0,1,0,0|2,0,0]=4 10404 B13R2.3 C1OCCNC1c2cc[n]cc2 Amb18563619 [0,1,0,1,0,0|2,0,0]=4 10405 B13R2.3 C1OCCNC1c2cccc[n]2 Amb18563618 [0,1,0,1,0,0|2,0,0]=4 10406 B13R2.3 C1OCCNC1c2ccccc2 Amb18528726 [0,1,0,1,0,0|1,0,0]=3 10407 B13R2.3 C1OCCN[C@@H]1c2c[n]ccc2 Amb22746806 [0,1,0,1,0,0|2,0,0]=4 10408 B13R2.3 C1OCCN[C@@H]1c2cc[n]cc2 Amb22746815 [0,1,0,1,0,0|2,0,0]=4 10409 B13R2.3 C1OCCN[C@@H]1c2cccc[n]2 Amb22746805 [0,1,0,1,0,0|2,0,0]=4 10410 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb20242902 [0,1,0,1,0,0|1,0,0]=3 10411 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb22274558 [0,1,0,1,0,0|1,0,0]=3 10412 B13R2.3 C1OCCN[C@H]1c2cc[n]cc2 Amb25324236 [0,1,0,1,0,0|2,0,0]=4 10413 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb20242901 [0,1,0,1,0,0|1,0,0]=3 10414 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb24077482 [0,1,0,1,0,0|1,0,0]=3 10415 B13R2.3 C1OCCOC1c2ccccc2 Amb24487623 [0,1,0,1,0,0|1,0,0]=3 10416 B13R2.3 C1O[C@@H](CCO1)c2ccccc2 Amb22226715 [0,1,0,1,0,0|1,0,0]=3 10417 B13R2.3 C1SCCNC1c2cc[n]cc2 Amb24549071 [0,1,0,1,0,0|2,0,0]=4 10418 B13R2.3 C1SCCN[C@@H]1c2ccccc2 Amb24652809 [0,1,0,1,0,0|1,0,0]=3 10419 B13R2.3 N1CCC(=CC1)c2ccccc2 Amb1153094 [0,1,0,1,0,0|0,0,1]=3 10420 B13R2.3 N1CCC(CC1)c2ccccc2 Amb1019521 [0,1,0,1,0,0|0,0,0]=2 10421 B13R2.3 N1CCC(CC1)c2ccccc2 Amb2099643 [0,1,0,1,0,0|0,0,0]=2 10422 B13R2.3 N1CCC(CC1)c2ccccn2 Amb15695238 [0,1,0,1,0,0|1,0,0]=3 10423 B13R2.3 N1CCC(CC1)c2cccnc2 Amb16206185 [0,1,0,1,0,0|1,0,0]=3 10424 B13R2.3 N1CCC(CC1)c2ccncc2 Amb1085862 [0,1,0,1,0,0|1,0,0]=3 10425 B13R2.3 N1CCC(CC1)c2ncccn2 Amb10602503 [0,1,0,1,0,0|2,0,0]=4 10426 B13R2.3 N1CCN(CC1)c2ccccc2 Amb2583391 [0,1,0,1,0,0|1,0,0]=3 10427 B13R2.3 N1CCN(CC1)c2ccccn2 Amb1160212 [0,1,0,1,0,0|2,0,0]=4 10428 B13R2.3 N1CCN(CC1)c2cccnc2 Amb10603457 [0,1,0,1,0,0|2,0,0]=4 10429 B13R2.3 N1CCN(CC1)c2cccnc2 Amb1102180 [0,1,0,1,0,0|2,0,0]=4 10430 B13R2.3 N1CCN(CC1)c2ccncc2 Amb1157798 [0,1,0,1,0,0|2,0,0]=4 10431 B13R2.3 N1CCNC(C1)c2ccccc2 Amb10068867 [0,1,0,1,0,0|0,0,0]=2 10432 B13R2.3 N1CCOC(C1)c2ccccc2 Amb1782012 [0,1,0,1,0,0|0,0,0]=2 10433 B13R2.3 N1CCOC(C1)c2ccncc2 Amb17063308 [0,1,0,1,0,0|1,0,0]=3 10434 B13R2.3 N1CCSC(C1)c2ccccc2 Amb10068810 [0,1,0,1,0,0|0,0,0]=2 10435 B13R2.3 O1CCC(CC1)c2ccccn2 Amb10573557 [0,1,0,1,0,0|2,0,0]=4 10436 B13R2.3 O1CCN(CC1)c2ccccc2 Amb1019547 [0,1,0,1,0,0|2,0,0]=4 10437 B13R2.3 O1CCNC(C1)c2ccccc2 Amb10068848 [0,1,0,1,0,0|1,0,0]=3 10438 B13R2.3 [NH2+]1CCN(CC1)c2ccccc2 Amb2416369 [0,1,0,1,0,0|1,0,1]=4 10439 B13R2.10 BrC1CC(CC1)c2c[n]ccc2 Amb24749984 [0,1,0,1,0,0|2,0,0]=4 10440 B13R2.10 C=C1COC(C1)c2ccccc2 Amb25692265 [0,1,0,1,0,0|1,0,1]=4 10441 B13R2.10 CC1=NC(CO1)c2ccccc2 Amb24754160 [0,1,0,1,0,0|2,0,0]=4 10442 B13R2.10 CC1CC(CN1)c2ccc[n]c2 Amb24749030 [0,1,0,1,0,0|1,0,0]=3 10443 B13R2.10 CC1CC(CN1)c2cccc[n]2 Amb24632351 [0,1,0,1,0,0|1,0,0]=3 10444 B13R2.10 CC1CC(CN1)c2ccccc2 Amb18563524 [0,1,0,1,0,0|0,0,0]=2 10445 B13R2.10 CC1CNC(O1)c2ccccc2 Amb18563573 [0,1,0,1,0,0|2,0,0]=4 10446 B13R2.10 CC1COC(N1)c2ccccc2 Amb18563574 [0,1,0,1,0,0|2,0,0]=4 10447 B13R2.10 CC1NC(CS1)c2ccccc2 Amb25375933 [0,1,0,1,0,0|2,0,0]=4 10448 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,1,0,1,0,0|2,0,0]=4 10449 B13R2.10 CC=1CC(NN1)c2ccccc2 Amb24069512 [0,1,0,1,0,0|1,0,1]=4 10450 B13R2.10 CC=1CNC(C1)c2ccccc2 Amb24727039 [0,1,0,1,0,0|1,0,1]=4 10451 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [0,1,0,1,0,0|1,0,1]=4 10452 B13R2.10 CC=1CP(CC1)c2ccccc2 Amb22734694 [0,1,0,1,0,0|2,0,0]=4 10453 B13R2.10 CN1CC(=CC1)c2ccccc2 Amb22235338 [0,1,0,1,0,0|0,0,1]=3 10454 B13R2.10 CN1CC(=CC1)c2ccccc2 Amb25326815 [0,1,0,1,0,0|0,0,1]=3 10455 B13R2.10 CN1CC(CC1)c2cccc[n]2 Amb25357071 [0,1,0,1,0,0|1,0,0]=3 10456 B13R2.10 CN1CCC(=N1)c2ccccc2 Amb25075711 [0,1,0,1,0,0|1,0,1]=4 10457 B13R2.10 CN1CCC(C1)c2cccnc2 Amb17616208 [0,1,0,1,0,0|1,0,0]=3 10458 B13R2.10 CN1CCC(O1)c2ccccc2 Amb22304711 [0,1,0,1,0,0|1,0,0]=3 10459 B13R2.10 CN1CNC(C1)c2ccccc2 Amb18645727 [0,1,0,1,0,0|0,0,0]=2 10460 B13R2.10 CN1COC(C1)c2cccc[n]2 Amb24100558 [0,1,0,1,0,0|1,0,0]=3 10461 B13R2.10 CN1C[C@@H](CC1)c2c[n]ccc2 Amb24085650 [0,1,0,1,0,0|1,0,0]=3 10462 B13R2.10 CN1C[C@H](CC1)c2c[n]ccc2 Amb24085649 [0,1,0,1,0,0|1,0,0]=3 10463 B13R2.10 C[C@@H]1CC[C@H](N1)c2ccccc2 Amb24627148 [0,1,0,1,0,0|2,0,0]=4 10464 B13R2.10 C[C@@H]1CO[C@@H](N1)c2ccccc2 Amb24589650 [0,1,0,1,0,0|2,0,0]=4 10465 B13R2.10 C[C@@H]1C[C@@H](NC1)c2c[n]ccc2 Amb18829579 [0,1,0,1,0,0|2,0,0]=4 10466 B13R2.10 C[C@@H]1C[C@@H](NC1)c2cc[n]cc2 Amb18829581 [0,1,0,1,0,0|2,0,0]=4 10467 B13R2.10 C[C@@H]1C[C@@H](NC1)c2cccc[n]2 Amb18829580 [0,1,0,1,0,0|2,0,0]=4 10468 B13R2.10 C[C@@H]1C[C@@H](NC1)c2ccccc2 Amb18829883 [0,1,0,1,0,0|1,0,0]=3 10469 B13R2.10 C[C@H]1CC[C@H](N1)c2ccccc2 Amb24519292 [0,1,0,1,0,0|2,0,0]=4 10470 B13R2.10 C[C@H]1CN[C@@H](S1)c2ccccc2 Amb25270071 [0,1,0,1,0,0|2,0,0]=4 10471 B13R2.10 C[C@H]1C[C@H](NC1)c2c[n]ccc2 Amb24539921 [0,1,0,1,0,0|2,0,0]=4 10472 B13R2.10 C[C@H]1NC[C@H](S1)c2ccccc2 Amb25327843 [0,1,0,1,0,0|1,0,0]=3 10473 B13R2.10 Cl[C@H]1CC(OC1)c2ccccc2 Amb24692710 [0,1,0,1,0,0|2,0,0]=4 10474 B13R2.10 FC1CC(NC1)c2ccccc2 Amb25045554 [0,1,0,1,0,0|2,0,0]=4 10475 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [0,1,0,1,0,0|0,0,1]=3 10476 B13R2.10 NC1CC(C=C1)c2ccccc2 Amb25142018 [0,1,0,1,0,0|1,0,1]=4 10477 B13R2.10 NC1CC(SC1)c2ccccc2 Amb18824602 [0,1,0,1,0,0|2,0,0]=4 10478 B13R2.10 NC1CCC(C1)c2ccccc2 Amb17400101 [0,1,0,1,0,0|1,0,0]=3 10479 B13R2.10 NC1CCC(C1)c2ccccn2 Amb17400117 [0,1,0,1,0,0|2,0,0]=4 10480 B13R2.10 NC1CCC(C1)c2cccnc2 Amb17400118 [0,1,0,1,0,0|2,0,0]=4 10481 B13R2.10 NC1CCC(C1)c2ccncc2 Amb17400119 [0,1,0,1,0,0|2,0,0]=4 10482 B13R2.10 NC1NCC(O1)c2ccccc2 Amb25135649 [0,1,0,1,0,0|1,0,0]=3 10483 B13R2.10 NC=1CCC(N1)c2ccccc2 Amb24391515 [0,1,0,1,0,0|2,0,0]=4 10484 B13R2.10 N[C@@H]1C[C@@H](C=C1)c2ccccc2 Amb25267512 [0,1,0,1,0,0|1,0,1]=4 10485 B13R2.10 N[C@H]1C[C@H](C=C1)c2ccccc2 Amb24568927 [0,1,0,1,0,0|1,0,1]=4 10486 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [0,1,0,1,0,0|1,0,0]=3 10487 B13R2.10 O=C1CCC(C1)c2ccccn2 Amb17138526 [0,1,0,1,0,0|2,0,0]=4 10488 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [0,1,0,1,0,0|2,0,0]=4 10489 B13R2.10 O=C1CCC(C1)c2ccncc2 Amb17138528 [0,1,0,1,0,0|2,0,0]=4 10490 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [0,1,0,1,0,0|2,0,0]=4 10491 B13R2.10 O=C1CN(CN1)c2ccccc2 Amb24079614 [0,1,0,1,0,0|1,0,1]=4 10492 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [0,1,0,1,0,0|2,0,0]=4 10493 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [0,1,0,1,0,0|2,0,0]=4 10494 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [0,1,0,1,0,0|2,0,0]=4 10495 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [0,1,0,1,0,0|1,0,0]=3 10496 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [0,1,0,1,0,0|0,0,1]=3 10497 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [0,1,0,1,0,0|1,0,0]=3 10498 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [0,1,0,1,0,0|0,0,1]=3 10499 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [0,1,0,1,0,0|0,0,1]=3 10500 B13R2.10 O=C1NCC(C1)c2ccccn2 Amb13952281 [0,1,0,1,0,0|1,0,1]=4 10501 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [0,1,0,1,0,0|1,0,1]=4 10502 B13R2.10 O=C1NCC(C1)c2ccncc2 Amb17400108 [0,1,0,1,0,0|1,0,1]=4 10503 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [0,1,0,1,0,0|1,0,1]=4 10504 B13R2.10 O=C1NCC(O1)c2ccccc2 Amb16232576 [0,1,0,1,0,0|1,0,1]=4 10505 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [0,1,0,1,0,0|1,0,1]=4 10506 B13R2.10 O=C1NC[C@@H](O1)c2ccccc2 Amb22338660 [0,1,0,1,0,0|1,0,1]=4 10507 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [0,1,0,1,0,0|1,0,1]=4 10508 B13R2.10 O=C1NC[C@H](O1)c2ccccc2 Amb24574681 [0,1,0,1,0,0|1,0,1]=4 10509 B13R2.10 O=C1NC[C@H](S1)c2ccccc2 Amb25246623 [0,1,0,1,0,0|1,0,1]=4 10510 B13R2.10 OC1CC(C=C1)c2ccccc2 Amb25357514 [0,1,0,1,0,0|1,0,1]=4 10511 B13R2.10 OC1CC(CO1)c2ccccc2 Amb22752509 [0,1,0,1,0,0|1,0,0]=3 10512 B13R2.10 OC1CC(NC1)c2ccccc2 Amb24710004 [0,1,0,1,0,0|2,0,0]=4 10513 B13R2.10 OC1CCC(C1)c2ccccc2 Amb17400115 [0,1,0,1,0,0|1,0,0]=3 10514 B13R2.10 OC1CCC(C1)c2ccccn2 Amb17400130 [0,1,0,1,0,0|2,0,0]=4 10515 B13R2.10 OC1CCC(C1)c2cccnc2 Amb17400131 [0,1,0,1,0,0|2,0,0]=4 10516 B13R2.10 OC1CCC(C1)c2ccncc2 Amb17400132 [0,1,0,1,0,0|2,0,0]=4 10517 B13R2.10 OC1CCC(O1)c2ccccc2 Amb22752551 [0,1,0,1,0,0|2,0,0]=4 10518 B13R2.10 OC1CC[C@@H](O1)c2ccccc2 Amb22752552 [0,1,0,1,0,0|2,0,0]=4 10519 B13R2.10 OC1C[C@H](CO1)c2ccccc2 Amb25712077 [0,1,0,1,0,0|1,0,0]=3 10520 B13R2.10 OC1NC(NN1)c2ccccc2 Amb24636818 [0,1,0,1,0,0|2,0,0]=4 10521 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [0,1,0,1,0,0|0,0,2]=4 10522 B13R2.10 O[C@@H]1CN(CC1)c2ccccc2 Amb24619169 [0,1,0,1,0,0|2,0,0]=4 10523 B13R2.10 O[C@@H]1C[C@H](C=C1)c2ccccc2 Amb24666654 [0,1,0,1,0,0|1,0,1]=4 10524 B13R2.10 O[C@H]1CN(CC1)c2ccccc2 Amb24423353 [0,1,0,1,0,0|2,0,0]=4 10525 B13R2.10 O[C@H]1C[C@@H](CC1)c2c[n]ccc2 Amb25249203 [0,1,0,1,0,0|2,0,0]=4 10526 B13R2.10 O[C@H]1C[C@H](C=C1)c2ccccc2 Amb24584078 [0,1,0,1,0,0|1,0,1]=4 10527 B13R2.10 O[C@H]1C[C@H](OC1)c2ccccc2 Amb25176989 [0,1,0,1,0,0|2,0,0]=4 10528 B13R2.10 S=C1NCC(S1)c2ccccc2 Amb10810186 [0,1,0,1,0,0|1,0,1]=4 10529 B13R2.10 S=C1NC[C@@H](O1)c2ccccc2 Amb24728461 [0,1,0,1,0,0|1,0,1]=4 10530 B13R2.10 S=C1NC[C@H](S1)c2ccccc2 Amb25150880 [0,1,0,1,0,0|1,0,1]=4 10531 B13R2.56 BrCC1CCC1c2ccccc2 Amb23453481 [0,1,0,1,0,0|2,0,0]=4 10532 B13R2.56 CN[C@@H]1CC[C@H]1c2ccccc2 Amb25339675 [0,1,0,1,0,0|0,0,0]=2 10533 B13R2.56 ClCC1CCC1c2ccccc2 Amb25765680 [0,1,0,1,0,0|2,0,0]=4 10534 B13R2.56 NC[C@@H]1CC[C@H]1c2ccccc2 Amb24624474 [0,1,0,1,0,0|2,0,0]=4 10535 B13R2.56 OCC1CCC1c2ccccc2 Amb23453480 [0,1,0,1,0,0|2,0,0]=4 10536 B13R2.56 OCC1OCC1c2ccccc2 Amb24703890 [0,1,0,1,0,0|2,0,0]=4 10537 B13R2.56 OC[C@H]1CC[C@H]1c2ccccc2 Amb25271469 [0,1,0,1,0,0|2,0,0]=4 10538 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,1,0,1,0,0|2,0,0]=4 10539 B13R2.373 CC1C(N)CC1c2ccccc2 Amb20669477 [0,1,0,1,0,0|2,0,0]=4 10540 B13R2.373 CC1C(N)CC1c2ccccc2 Amb22157239 [0,1,0,1,0,0|2,0,0]=4 10541 B13R2.373 CC1SC(C1O)c2ccccc2 Amb25317360 [0,1,0,1,0,0|2,0,0]=4 10542 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,1,0,1,0,0|2,0,0]=4 10543 B13R2.373 OC1CC(C1Cl)c2ccccc2 Amb24391695 [0,1,0,1,0,0|2,0,0]=4 10544 B13R2.453 CCCC1(CO1)c2ccccc2 Amb18798139 [0,1,0,1,0,0|1,0,0]=3 10545 B13R2.453 CCNC1(CC1)c2ccccc2 Amb25741020 [0,1,0,1,0,0|2,0,0]=4 10546 B13R2.453 CNCC1(CC1)c2c[n]ccc2 Amb25082320 [0,1,0,1,0,0|1,0,0]=3 10547 B13R2.453 CNCC1(CC1)c2cc[n]cc2 Amb24487455 [0,1,0,1,0,0|1,0,0]=3 10548 B13R2.453 CNCC1(CC1)c2ccccc2 Amb18998943 [0,1,0,1,0,0|0,0,0]=2 10549 B13R2.453 COCC1(CO1)c2ccccc2 Amb24384681 [0,1,0,1,0,0|1,0,0]=3 10550 B13R2.453 NCCC1(CC1)c2ccccc2 Amb17232383 [0,1,0,1,0,0|2,0,0]=4 10551 B13R2.453 NNCC1(CC1)c2ccccc2 Amb18788139 [0,1,0,1,0,0|1,0,0]=3 10552 B13R2.453 OCCC1(CC1)c2ccccc2 Amb25306464 [0,1,0,1,0,0|2,0,0]=4 10553 B13R2.453 OCC[C@@]1(CO1)c2ccccc2 Amb24675636 [0,1,0,1,0,0|2,0,0]=4 10554 B13R2.679 BrCC(c1ccccc1)C2CC2 Amb17246874 [0,1,0,1,0,0|1,0,0]=3 10555 B13R2.679 CCC(C1CO1)c2ccccc2 Amb25771144 [0,1,0,1,0,0|1,0,0]=3 10556 B13R2.679 CCN(C1CC1)c2ccccc2 Amb24474801 [0,1,0,1,0,0|2,0,0]=4 10557 B13R2.679 CNC(C1CC1)c2cc[n]cc2 Amb25205159 [0,1,0,1,0,0|2,0,0]=4 10558 B13R2.679 CNC(C1CC1)c2ccc[n]c2 Amb18970023 [0,1,0,1,0,0|2,0,0]=4 10559 B13R2.679 CNC(C1CC1)c2ccc[n]c2 Amb19373210 [0,1,0,1,0,0|2,0,0]=4 10560 B13R2.679 CNC(c1ccccn1)C2CC2 Amb10607920 [0,1,0,1,0,0|2,0,0]=4 10561 B13R2.679 CNC(c1ccccn1)C2CC2 Amb13949180 [0,1,0,1,0,0|2,0,0]=4 10562 B13R2.679 ClCC(c1ccccc1)C2CC2 Amb17233774 [0,1,0,1,0,0|1,0,0]=3 10563 B13R2.679 N#CC(c1ccccc1)C2CC2 Amb17089274 [0,1,0,1,0,0|1,0,1]=4 10564 B13R2.679 NCC(C1CC1)c2cccc[n]2 Amb25135322 [0,1,0,1,0,0|2,0,0]=4 10565 B13R2.679 NCC(c1ccccc1)C2CC2 Amb17087329 [0,1,0,1,0,0|1,0,0]=3 10566 B13R2.679 NNC(C1CC1)c2ccccc2 Amb18788137 [0,1,0,1,0,0|2,0,0]=4 10567 B13R2.679 O=CC(c1ccccc1)C2CC2 Amb17232322 [0,1,0,1,0,0|1,0,1]=4 10568 B13R2.679 OCC(c1ccccc1)C2CC2 Amb17232411 [0,1,0,1,0,0|1,0,0]=3 10569 B13R2.679 ONC(c1ccccc1)C2CC2 Amb10606514 [0,1,0,1,0,0|2,0,0]=4 10570 B13R2.1613 BrCC1CCCc2ccccc21 Amb19514960 [0,1,0,1,0,0|1,0,0]=3 10571 B13R2.1613 BrCC1CCOc2ccccc21 Amb25073800 [0,1,0,1,0,0|2,0,0]=4 10572 B13R2.1613 BrCC1COCc2ccccc21 Amb25054252 [0,1,0,1,0,0|1,0,0]=3 10573 B13R2.1613 BrCC1OCCc2ccccc21 Amb19373964 [0,1,0,1,0,0|2,0,0]=4 10574 B13R2.1613 CCC1CCNc2ccccc21 Amb18829886 [0,1,0,1,0,0|2,0,0]=4 10575 B13R2.1613 CCC1CNCc2ccccc21 Amb22499088 [0,1,0,1,0,0|0,0,0]=2 10576 B13R2.1613 CCC1NCCc2ccccc21 Amb19308514 [0,1,0,1,0,0|2,0,0]=4 10577 B13R2.1613 CCN1CCCc2c1cccc2 Amb15691608 [0,1,0,1,0,0|2,0,0]=4 10578 B13R2.1613 CC[C@@H]1CCNc2ccccc21 Amb24695214 [0,1,0,1,0,0|2,0,0]=4 10579 B13R2.1613 CC[C@H]1NCCc2ccccc21 Amb24696632 [0,1,0,1,0,0|2,0,0]=4 10580 B13R2.1613 CNC1CCCc2ccc[n]c21 Amb22499724 [0,1,0,1,0,0|2,0,0]=4 10581 B13R2.1613 CNC1CCSc2c1cccc2 Amb1139180 [0,1,0,1,0,0|2,0,0]=4 10582 B13R2.1613 CNC1COCc2ccccc21 Amb25275586 [0,1,0,1,0,0|1,0,0]=3 10583 B13R2.1613 CNC1SCCc2ccccc21 Amb25218166 [0,1,0,1,0,0|2,0,0]=4 10584 B13R2.1613 CN[C@@H]1CCCc2ccccc21 Amb20241467 [0,1,0,1,0,0|1,0,0]=3 10585 B13R2.1613 CN[C@H]1CCCc2ccccc21 Amb20241521 [0,1,0,1,0,0|1,0,0]=3 10586 B13R2.1613 COC1CCCc2c1cccc2 Amb2228261 [0,1,0,1,0,0|1,0,0]=3 10587 B13R2.1613 COC1CCNc2ccccc21 Amb18062248 [0,1,0,1,0,0|2,0,0]=4 10588 B13R2.1613 COC1CNCc2ccccc21 Amb18645915 [0,1,0,1,0,0|0,0,0]=2 10589 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [0,1,0,1,0,0|2,0,0]=4 10590 B13R2.1613 CSC1CCCc2ccccc21 Amb24575820 [0,1,0,1,0,0|1,0,0]=3 10591 B13R2.1613 CSC1CCOc2c1cccc2 Amb10569867 [0,1,0,1,0,0|2,0,0]=4 10592 B13R2.1613 ClCC1CCCc2ccccc21 Amb18184969 [0,1,0,1,0,0|1,0,0]=3 10593 B13R2.1613 ClCC1CCOc2ccccc21 Amb24608835 [0,1,0,1,0,0|2,0,0]=4 10594 B13R2.1613 ClCC1NCCc2c1cccc2 Amb17506196 [0,1,0,1,0,0|2,0,0]=4 10595 B13R2.1613 ClCC1NCCc2c1cccc2 Amb17506197 [0,1,0,1,0,0|2,0,0]=4 10596 B13R2.1613 ClCC1OCCc2ccccc21 Amb25238351 [0,1,0,1,0,0|2,0,0]=4 10597 B13R2.1613 ClN[C@@H]1CCCc2ccccc21 Amb22802414 [0,1,0,1,0,0|2,0,0]=4 10598 B13R2.1613 ICC1CCOc2ccccc21 Amb24061617 [0,1,0,1,0,0|2,0,0]=4 10599 B13R2.1613 NCC1CCCc2ccccc21 Amb22749479 [0,1,0,1,0,0|1,0,0]=3 10600 B13R2.1613 NCC1CCCc2ccccc21 Amb22755873 [0,1,0,1,0,0|1,0,0]=3 10601 B13R2.1613 NCC1CCNc2ccccc21 Amb18560249 [0,1,0,1,0,0|2,0,0]=4 10602 B13R2.1613 NCC1CCSc2ccccc21 Amb18824588 [0,1,0,1,0,0|2,0,0]=4 10603 B13R2.1613 NCC1CNCc2c1cccc2 Amb17400116 [0,1,0,1,0,0|0,0,0]=2 10604 B13R2.1613 NCC1NCCc2c1cccc2 Amb10068079 [0,1,0,1,0,0|2,0,0]=4 10605 B13R2.1613 NCC1NCCc2c1cccc2 Amb1033009 [0,1,0,1,0,0|2,0,0]=4 10606 B13R2.1613 NCC1NCCc2ccccc12 Amb17777905 [0,1,0,1,0,0|2,0,0]=4 10607 B13R2.1613 NCC1NCCc2ccccc12 Amb17777906 [0,1,0,1,0,0|2,0,0]=4 10608 B13R2.1613 NCC1SCCc2ccccc21 Amb18648291 [0,1,0,1,0,0|2,0,0]=4 10609 B13R2.1613 NC[C@@H]1CCCc2ccccc21 Amb24636821 [0,1,0,1,0,0|1,0,0]=3 10610 B13R2.1613 NNC1COCc2ccccc21 Amb24694517 [0,1,0,1,0,0|2,0,0]=4 10611 B13R2.1613 O=CC1CCCc2ccccc21 Amb18787961 [0,1,0,1,0,0|1,0,1]=4 10612 B13R2.1613 OCC1CCCc2ccc[n]c21 Amb24691669 [0,1,0,1,0,0|2,0,0]=4 10613 B13R2.1613 OCC1CCCc2ccccc21 Amb18798135 [0,1,0,1,0,0|1,0,0]=3 10614 B13R2.1613 OCC1CCNc2ccccc21 Amb24756520 [0,1,0,1,0,0|2,0,0]=4 10615 B13R2.1613 OCC1CNCc2ccccc21 Amb24468799 [0,1,0,1,0,0|0,0,0]=2 10616 B13R2.1613 OCC1NCCc2ccccc21 Amb20667766 [0,1,0,1,0,0|2,0,0]=4 10617 B13R2.1613 OCC1OCCc2c1cccc2 Amb1094003 [0,1,0,1,0,0|2,0,0]=4 10618 B13R2.1613 OC[C@@H]1CCCc2ccc[n]c21 Amb24532619 [0,1,0,1,0,0|2,0,0]=4 10619 B13R2.1613 OC[C@@H]1CCCc2ccccc21 Amb24642441 [0,1,0,1,0,0|1,0,0]=3 10620 B13R2.1613 OC[C@@H]1CCOc2ccccc21 Amb25306550 [0,1,0,1,0,0|2,0,0]=4 10621 B13R2.1613 OC[C@@H]1CCSc2ccccc21 Amb25846967 [0,1,0,1,0,0|2,0,0]=4 10622 B13R2.1613 OC[C@@H]1NCCc2ccccc21 Amb25359034 [0,1,0,1,0,0|2,0,0]=4 10623 B13R2.1613 OC[C@H]1CCCc2ccc[n]c21 Amb25793548 [0,1,0,1,0,0|2,0,0]=4 10624 B13R2.1613 OC[C@H]1CNCc2ccccc21 Amb25123405 [0,1,0,1,0,0|0,0,0]=2 10625 B13R2.1613 OC[C@H]1NCCc2ccccc21 Amb24358086 [0,1,0,1,0,0|2,0,0]=4 10626 B13R2.1613 OC[C@H]1OCCc2ccccc21 Amb25271375 [0,1,0,1,0,0|2,0,0]=4 10627 B13R2.1613 ONC1CCCc2ccccc21 Amb24493105 [0,1,0,1,0,0|2,0,0]=4 10628 B13R2.1613 ONC1COCc2ccccc21 Amb25291166 [0,1,0,1,0,0|2,0,0]=4 10629 B13R2.1613 ONC1CSCc2ccccc21 Amb25036345 [0,1,0,1,0,0|2,0,0]=4 10630 B13R2.1613 OOC1CCCc2ccccc12 Amb17938665 [0,1,0,1,0,0|2,0,0]=4 10631 B13R2.1613 SCC1CCOc2ccccc21 Amb25283322 [0,1,0,1,0,0|2,0,0]=4 10632 B13R2.1613 SCC1OCCc2ccccc21 Amb25152461 [0,1,0,1,0,0|2,0,0]=4 10633 B13R2.1613 [C-]#[N+]C1CCCc2c1cccc2 Amb2235814 [0,1,0,1,0,0|1,0,1]=4 10634 B13R2.1613 [C-]#[N+][C@@H]1CCCc2ccccc21 Amb19944624 [0,1,0,1,0,0|1,0,1]=4 10635 B13R2.1613 [NH3+]CC1NCCc2ccccc12 Amb17777904 [0,1,0,1,0,0|2,0,0]=4 10636 B13R2.2532 CC1CC1(CO)c2ccccc2 Amb25856407 [0,1,0,1,0,0|1,0,0]=3 10637 B13R2.2532 CC1OC1(CO)c2ccccc2 Amb25296415 [0,1,0,1,0,0|2,0,0]=4 10638 B13R2.2532 CCC1(CC1N)c2ccccc2 Amb18961263 [0,1,0,1,0,0|2,0,0]=4 10639 B13R2.2532 COC1(CC1N)c2ccccc2 Amb23538753 [0,1,0,1,0,0|2,0,0]=4 10640 B13R2.2532 C[C@H]1O[C@@]1(CCl)c2ccccc2 Amb24739716 [0,1,0,1,0,0|2,0,0]=4 10641 B13R2.2532 NC[C@@]1(C[C@H]1F)c2ccccc2 Amb24420022 [0,1,0,1,0,0|2,0,0]=4 10642 B13R2.2532 NC[C@]1(CC1F)c2ccccc2 Amb24578512 [0,1,0,1,0,0|2,0,0]=4 10643 B13R2.2532 NC[C@]1(C[C@@H]1F)c2ccccc2 Amb25195336 [0,1,0,1,0,0|2,0,0]=4 10644 B13R2.2532 [C-]#[N+]C1(CC1C)c2ccccc2 Amb24511318 [0,1,0,1,0,0|1,0,1]=4 10645 B13R2.2539 BrCC1(COC1)c2ccccc2 Amb22737348 [0,1,0,1,0,0|1,0,0]=3 10646 B13R2.2539 CCC1(CCN1)c2ccccc2 Amb25804697 [0,1,0,1,0,0|2,0,0]=4 10647 B13R2.2539 CCC1(CNC1)c2ccccc2 Amb25828959 [0,1,0,1,0,0|0,0,0]=2 10648 B13R2.2539 CNC1(CCC1)c2ccccc2 Amb24747455 [0,1,0,1,0,0|1,0,0]=3 10649 B13R2.2539 CNC1(CNC1)c2ccccc2 Amb25817453 [0,1,0,1,0,0|0,0,0]=2 10650 B13R2.2539 COC1(CNC1)c2ccccc2 Amb13951134 [0,1,0,1,0,0|0,0,0]=2 10651 B13R2.2539 COC1(CNC1)c2ccccc2 Amb17605451 [0,1,0,1,0,0|0,0,0]=2 10652 B13R2.2539 COC1(COC1)c2ccccc2 Amb22497352 [0,1,0,1,0,0|1,0,0]=3 10653 B13R2.2539 ClCC1(CCC1)c2c[n]ccc2 Amb25337821 [0,1,0,1,0,0|2,0,0]=4 10654 B13R2.2539 N#CC1(CNC1)c2ccccc2 Amb24395630 [0,1,0,1,0,0|0,0,1]=3 10655 B13R2.2539 NCC1(CCC1)c2c[n]ccc2 Amb25844855 [0,1,0,1,0,0|2,0,0]=4 10656 B13R2.2539 NCC1(CCC1)c2cccc[n]2 Amb25090004 [0,1,0,1,0,0|2,0,0]=4 10657 B13R2.2539 NCC1(COC1)c2ccccc2 Amb19958669 [0,1,0,1,0,0|1,0,0]=3 10658 B13R2.2539 O=CC1(CCC1)c2ccccc2 Amb17594006 [0,1,0,1,0,0|1,0,1]=4 10659 B13R2.2539 OCC1(CCC1)c2c[n]ccc2 Amb24698704 [0,1,0,1,0,0|2,0,0]=4 10660 B13R2.2539 OCC1(COC1)c2ccccc2 Amb21960823 [0,1,0,1,0,0|1,0,0]=3 10661 B13R2.2931 CC1CC(CCl)c2ccccc21 Amb24685578 [0,1,0,1,0,0|1,0,0]=3 10662 B13R2.2931 CC1CC(NC)c2ccccc21 Amb23555676 [0,1,0,1,0,0|0,0,0]=2 10663 B13R2.2931 CC1CC(NO)c2ccccc21 Amb24358518 [0,1,0,1,0,0|1,0,0]=3 10664 B13R2.2931 CC1CN(C=O)c2ccccc21 Amb25212167 [0,1,0,1,0,0|0,0,1]=3 10665 B13R2.2931 CC1C\C(=N\N)\c2ccccc21 Amb25817326 [0,1,0,1,0,0|1,0,1]=4 10666 B13R2.2931 CC1C\C(=N\O)\c2ccccc21 Amb25036333 [0,1,0,1,0,0|1,0,1]=4 10667 B13R2.2931 CCC1CC(=O)c2c1cccc2 Amb17232326 [0,1,0,1,0,0|2,0,0]=4 10668 B13R2.2931 CCC1CC(N)c2ccccc21 Amb25306698 [0,1,0,1,0,0|2,0,0]=4 10669 B13R2.2931 CCC1OC(O)c2ccccc21 Amb25215873 [0,1,0,1,0,0|2,0,0]=4 10670 B13R2.2931 CCN1CC(N)c2ccccc12 Amb24554552 [0,1,0,1,0,0|1,0,0]=3 10671 B13R2.2931 CC[C@@H]1C[C@H](O)c2ccccc21 Amb24549826 [0,1,0,1,0,0|2,0,0]=4 10672 B13R2.2931 CC[C@@H]1OC(O)c2ccccc21 Amb24404593 [0,1,0,1,0,0|2,0,0]=4 10673 B13R2.2931 CC[C@H]1CC(=O)c2ccccc21 Amb25370725 [0,1,0,1,0,0|2,0,0]=4 10674 B13R2.2931 CC[C@H]1O[C@@H](O)c2ccccc21 Amb24612138 [0,1,0,1,0,0|2,0,0]=4 10675 B13R2.2931 CC[n+]1c[n](C)c2ccccc12 Amb22354613 [0,1,0,1,0,0|1,0,1]=4 10676 B13R2.2931 CCn1cc(C)c2ccccc12 Amb17672668 [0,1,0,1,0,0|0,0,2]=4 10677 B13R2.2931 CN1CC(C=C)c2ccccc12 Amb25270754 [0,1,0,1,0,0|0,0,1]=3 10678 B13R2.2931 CN1CC(C=O)c2ccccc12 Amb23586335 [0,1,0,1,0,0|0,0,1]=3 10679 B13R2.2931 CN1CC(CN)c2ccccc12 Amb18062999 [0,1,0,1,0,0|0,0,0]=2 10680 B13R2.2931 CNC1NC(=O)c2ccccc21 Amb22372260 [0,1,0,1,0,0|1,0,1]=4 10681 B13R2.2931 CNC1OC(=C)c2ccccc21 Amb24739539 [0,1,0,1,0,0|0,0,2]=4 10682 B13R2.2931 CNC1OC(=O)c2ccccc21 Amb18266318 [0,1,0,1,0,0|1,0,1]=4 10683 B13R2.2931 CNc1[n][n](C)c2ccccc21 Amb24564226 [0,1,0,1,0,0|1,0,1]=4 10684 B13R2.2931 CNc1c[n](C)c2ccccc21 Amb18563501 [0,1,0,1,0,0|0,0,2]=4 10685 B13R2.2931 COC1=CC(C)c2ccccc12 Amb17778898 [0,1,0,1,0,0|1,0,1]=4 10686 B13R2.2931 COC1=NC(C)c2ccccc21 Amb25719378 [0,1,0,1,0,0|1,0,1]=4 10687 B13R2.2931 COC1C=C(C)c2ccccc12 Amb17844048 [0,1,0,1,0,0|1,0,1]=4 10688 B13R2.2931 COC1OC(O)c2ccccc21 Amb25156850 [0,1,0,1,0,0|2,0,0]=4 10689 B13R2.2931 COc1[n][n](C)c2ccccc21 Amb23454583 [0,1,0,1,0,0|1,0,1]=4 10690 B13R2.2931 COc1c[n](C)c2ccccc21 Amb22751003 [0,1,0,1,0,0|0,0,2]=4 10691 B13R2.2931 C[C@@H]1C[C@@H](C=O)c2ccccc21 Amb24656170 [0,1,0,1,0,0|1,0,1]=4 10692 B13R2.2931 C[n]1[n]c(CBr)c2ccccc12 Amb22492458 [0,1,0,1,0,0|1,0,1]=4 10693 B13R2.2931 C[n]1[n]c(CI)c2ccccc12 Amb24436382 [0,1,0,1,0,0|1,0,1]=4 10694 B13R2.2931 C[n]1[n]c(CN)c2ccccc12 Amb22490831 [0,1,0,1,0,0|1,0,1]=4 10695 B13R2.2931 C[n]1[n]c(CS)c2ccccc12 Amb25831461 [0,1,0,1,0,0|1,0,1]=4 10696 B13R2.2931 C[n]1cc(CBr)c2ccccc12 Amb23401677 [0,1,0,1,0,0|0,0,2]=4 10697 B13R2.2931 C[n]1cc(CCl)c2ccccc12 Amb18862963 [0,1,0,1,0,0|0,0,2]=4 10698 B13R2.2931 C[n]1cc(CN)c2ccccc12 Amb22042714 [0,1,0,1,0,0|0,0,2]=4 10699 B13R2.2931 C[n]1cc(CS)c2ccccc12 Amb24643924 [0,1,0,1,0,0|0,0,2]=4 10700 B13R2.2931 Cc1[n][n](CO)c2ccccc21 Amb23412212 [0,1,0,1,0,0|1,0,1]=4 10701 B13R2.2931 Cc1c[n](NC)c2ccccc12 Amb24465115 [0,1,0,1,0,0|0,0,2]=4 10702 B13R2.2931 N#CC1CC(c2c1cccc2)C Amb17232225 [0,1,0,1,0,0|1,0,1]=4 10703 B13R2.2931 NCC1CC(=O)c2c1cccc2 Amb17400089 [0,1,0,1,0,0|2,0,0]=4 10704 B13R2.2931 NCC1CC(=O)c2ccccc21 Amb22035182 [0,1,0,1,0,0|2,0,0]=4 10705 B13R2.2931 NCC1CC(c2c1cccc2)C Amb17232393 [0,1,0,1,0,0|1,0,0]=3 10706 B13R2.2931 NCC1CC(c2c1cccc2)O Amb17400129 [0,1,0,1,0,0|2,0,0]=4 10707 B13R2.2931 O=C1CC(CBr)c2ccccc21 Amb22489708 [0,1,0,1,0,0|2,0,0]=4 10708 B13R2.2931 O=C1CC(CCl)c2ccccc21 Amb24692943 [0,1,0,1,0,0|2,0,0]=4 10709 B13R2.2931 OC[C@@H]1CC(=O)c2ccccc21 Amb25086562 [0,1,0,1,0,0|2,0,0]=4 10710 B13R2.2931 O[C@@H]1C[C@H](CO)c2ccccc21 Amb24617735 [0,1,0,1,0,0|2,0,0]=4 10711 B13R2.12 Brc1c[n]c([n]c1)C2CNCC2 Amb24321499 [0,1,0,1,0,0|2,0,0]=4 10712 B13R2.12 Brc1ccc([n]c1)C2CNCC2 Amb24083314 [0,1,0,1,0,0|1,0,0]=3 10713 B13R2.12 Brc1ccc([n]c1)C2COCC2 Amb20617690 [0,1,0,1,0,0|2,0,0]=4 10714 B13R2.12 Brc1ccc(cc1)C2CCCC2 Amb18163151 [0,1,0,1,0,0|1,0,0]=3 10715 B13R2.12 Brc1ccc(cc1)C2CCCN2 Amb20623816 [0,1,0,1,0,0|2,0,0]=4 10716 B13R2.12 Brc1ccc(cc1)C2CCCN2 Amb2234648 [0,1,0,1,0,0|2,0,0]=4 10717 B13R2.12 Brc1ccc(cc1)C2CCCO2 Amb17343724 [0,1,0,1,0,0|2,0,0]=4 10718 B13R2.12 Brc1ccc(cc1)C2CNCC2 Amb17104497 [0,1,0,1,0,0|0,0,0]=2 10719 B13R2.12 Brc1ccc(cc1)C2CNCC2 Amb22234760 [0,1,0,1,0,0|0,0,0]=2 10720 B13R2.12 Brc1ccc(cc1)C2CNCO2 Amb18070328 [0,1,0,1,0,0|1,0,0]=3 10721 B13R2.12 Brc1ccc(cc1)C2COCC2 Amb20617111 [0,1,0,1,0,0|1,0,0]=3 10722 B13R2.12 Brc1ccc(cc1)[C@@H]2CCCN2 Amb23440338 [0,1,0,1,0,0|2,0,0]=4 10723 B13R2.12 Brc1ccc(cc1)[C@H]2CNCC2 Amb25675173 [0,1,0,1,0,0|0,0,0]=2 10724 B13R2.12 Brc1ccc(cn1)C2CCCC2 Amb10600542 [0,1,0,1,0,0|2,0,0]=4 10725 B13R2.12 Brc1ccc(cn1)C2CNCC2 Amb10600925 [0,1,0,1,0,0|1,0,0]=3 10726 B13R2.12 Brc1ccc(cn1)C2COCC2 Amb10600931 [0,1,0,1,0,0|2,0,0]=4 10727 B13R2.12 Brc1ccc(nc1)C2CCCC2 Amb10600816 [0,1,0,1,0,0|2,0,0]=4 10728 B13R2.12 Brc1cnc(cn1)C2CNCC2 Amb10600976 [0,1,0,1,0,0|2,0,0]=4 10729 B13R2.12 Cc1[n]cc(c[n]1)C2CNCC2 Amb18829146 [0,1,0,1,0,0|2,0,0]=4 10730 B13R2.12 Cc1c[n]c([n]c1)C2CNCC2 Amb24428941 [0,1,0,1,0,0|2,0,0]=4 10731 B13R2.12 Cc1c[n]c(c[n]1)C2CCNC2 Amb25067227 [0,1,0,1,0,0|2,0,0]=4 10732 B13R2.12 Cc1ccc(c[n]1)C2CNCC2 Amb18829563 [0,1,0,1,0,0|1,0,0]=3 10733 B13R2.12 Cc1ccc(cc1)C2CCCC2 Amb22436841 [0,1,0,1,0,0|1,0,0]=3 10734 B13R2.12 Cc1ccc(cc1)C2CCCN2 Amb2234807 [0,1,0,1,0,0|2,0,0]=4 10735 B13R2.12 Cc1ccc(cc1)C2CCCO2 Amb17334569 [0,1,0,1,0,0|2,0,0]=4 10736 B13R2.12 Cc1ccc(cc1)C2CCCS2 Amb24397112 [0,1,0,1,0,0|2,0,0]=4 10737 B13R2.12 Cc1ccc(cc1)C2CNCC2 Amb10068900 [0,1,0,1,0,0|0,0,0]=2 10738 B13R2.12 Cc1ccc(cc1)C2CNCC2 Amb17104484 [0,1,0,1,0,0|0,0,0]=2 10739 B13R2.12 Cc1ccc(cc1)C2CNCO2 Amb18563578 [0,1,0,1,0,0|1,0,0]=3 10740 B13R2.12 Cc1ccc(cc1)N2CCNC2 Amb24426137 [0,1,0,1,0,0|1,0,0]=3 10741 B13R2.12 Cc1ccc(cc1)N2CSCC2 Amb1811298 [0,1,0,1,0,0|2,0,0]=4 10742 B13R2.12 Cc1ccc(cc1)[C@@H]2CNCC2 Amb25360903 [0,1,0,1,0,0|0,0,0]=2 10743 B13R2.12 Clc1ccc([n]c1)C2CNCC2 Amb18192238 [0,1,0,1,0,0|1,0,0]=3 10744 B13R2.12 Clc1ccc(cc1)C2CCCN2 Amb13951478 [0,1,0,1,0,0|2,0,0]=4 10745 B13R2.12 Clc1ccc(cc1)C2CCCN2 Amb2234462 [0,1,0,1,0,0|2,0,0]=4 10746 B13R2.12 Clc1ccc(cc1)C2CCCO2 Amb17335592 [0,1,0,1,0,0|2,0,0]=4 10747 B13R2.12 Clc1ccc(cc1)C2CNCC2 Amb10068898 [0,1,0,1,0,0|0,0,0]=2 10748 B13R2.12 Clc1ccc(cc1)C2CNCC2 Amb10603642 [0,1,0,1,0,0|0,0,0]=2 10749 B13R2.12 Clc1ccc(cc1)C2CNCC2 Amb19342018 [0,1,0,1,0,0|0,0,0]=2 10750 B13R2.12 Clc1ccc(cc1)C2CNCO2 Amb18564265 [0,1,0,1,0,0|1,0,0]=3 10751 B13R2.12 Clc1ccc(cc1)C=2CNCC2 Amb24687778 [0,1,0,1,0,0|0,0,2]=4 10752 B13R2.12 Clc1ccc(cc1)N2CCNC2 Amb25798857 [0,1,0,1,0,0|1,0,0]=3 10753 B13R2.12 Clc1ccc(cc1)[C@@H]2CCCN2 Amb24061830 [0,1,0,1,0,0|2,0,0]=4 10754 B13R2.12 Clc1ccc(cc1)[C@@H]2CNCC2 Amb24078510 [0,1,0,1,0,0|0,0,0]=2 10755 B13R2.12 Clc1ccc(cc1)[C@@H]2CNCC2 Amb25768975 [0,1,0,1,0,0|0,0,0]=2 10756 B13R2.12 Clc1ccc(cc1)[C@H]2CCCN2 Amb24078653 [0,1,0,1,0,0|2,0,0]=4 10757 B13R2.12 Clc1ccc(cc1)[C@H]2CNCC2 Amb24061665 [0,1,0,1,0,0|0,0,0]=2 10758 B13R2.12 Fc1c[n]c([n]c1)C2CNCC2 Amb25150913 [0,1,0,1,0,0|2,0,0]=4 10759 B13R2.12 Fc1ccc([n]c1)C2CNCC2 Amb18199643 [0,1,0,1,0,0|1,0,0]=3 10760 B13R2.12 Fc1ccc(c[n]1)C2CNCC2 Amb18199644 [0,1,0,1,0,0|1,0,0]=3 10761 B13R2.12 Fc1ccc(cc1)C2CCCN2 Amb17659144 [0,1,0,1,0,0|2,0,0]=4 10762 B13R2.12 Fc1ccc(cc1)C2CCCN2 Amb24100665 [0,1,0,1,0,0|2,0,0]=4 10763 B13R2.12 Fc1ccc(cc1)C2CCCO2 Amb17334671 [0,1,0,1,0,0|2,0,0]=4 10764 B13R2.12 Fc1ccc(cc1)C2CNCC2 Amb10073032 [0,1,0,1,0,0|0,0,0]=2 10765 B13R2.12 Fc1ccc(cc1)C2CNCC2 Amb10808472 [0,1,0,1,0,0|0,0,0]=2 10766 B13R2.12 Fc1ccc(cc1)C2CNCO2 Amb18563792 [0,1,0,1,0,0|1,0,0]=3 10767 B13R2.12 Fc1ccc(cc1)C=2CCNN2 Amb25116696 [0,1,0,1,0,0|1,0,1]=4 10768 B13R2.12 Fc1ccc(cc1)N2CCCC2 Amb18269494 [0,1,0,1,0,0|2,0,0]=4 10769 B13R2.12 Fc1ccc(cc1)[C@@H]2CCCN2 Amb22225502 [0,1,0,1,0,0|2,0,0]=4 10770 B13R2.12 Fc1ccc(cc1)[C@@H]2CNCC2 Amb23401410 [0,1,0,1,0,0|0,0,0]=2 10771 B13R2.12 Fc1ccc(cc1)[C@@H]2COCN2 Amb24117849 [0,1,0,1,0,0|2,0,0]=4 10772 B13R2.12 Fc1ccc(cc1)[C@H]2CCCN2 Amb22265444 [0,1,0,1,0,0|2,0,0]=4 10773 B13R2.12 Fc1ccc(cc1)[C@H]2CNCC2 Amb24097390 [0,1,0,1,0,0|0,0,0]=2 10774 B13R2.12 Fc1ccc(cc1)[C@H]2COCN2 Amb24531529 [0,1,0,1,0,0|2,0,0]=4 10775 B13R2.12 Ic1ccc(c[n]1)C2CNCC2 Amb25843941 [0,1,0,1,0,0|1,0,0]=3 10776 B13R2.12 Ic1ccc(cc1)N2CCCC2 Amb25302581 [0,1,0,1,0,0|2,0,0]=4 10777 B13R2.12 Ic1ccc(cc1)[C@H]2CNCC2 Amb25770162 [0,1,0,1,0,0|0,0,0]=2 10778 B13R2.12 Nc1[n]cc(c[n]1)C2CNCC2 Amb18199766 [0,1,0,1,0,0|2,0,0]=4 10779 B13R2.12 Nc1c[n]c([n]c1)C2CNCC2 Amb18828742 [0,1,0,1,0,0|2,0,0]=4 10780 B13R2.12 Nc1ccc([n]c1)C2CNCC2 Amb25066860 [0,1,0,1,0,0|1,0,0]=3 10781 B13R2.12 Nc1ccc(cc1)C2CCCC2 Amb17106961 [0,1,0,1,0,0|1,0,0]=3 10782 B13R2.12 Nc1ccc(cc1)C2CCCN2 Amb18562044 [0,1,0,1,0,0|2,0,0]=4 10783 B13R2.12 Nc1ccc(cc1)C2CCCO2 Amb17334584 [0,1,0,1,0,0|2,0,0]=4 10784 B13R2.12 Nc1ccc(cc1)C2CNCC2 Amb18829567 [0,1,0,1,0,0|0,0,0]=2 10785 B13R2.12 Nc1ccc(cc1)C2COCC2 Amb20617112 [0,1,0,1,0,0|1,0,0]=3 10786 B13R2.12 Nc1ccc(cc1)N2CCCC2 Amb10576349 [0,1,0,1,0,0|2,0,0]=4 10787 B13R2.12 Nc1ccc(cc1)N2CCCC2 Amb1834286 [0,1,0,1,0,0|2,0,0]=4 10788 B13R2.12 Nc1ccc(cc1)[C@H]2CCCN2 Amb25149803 [0,1,0,1,0,0|2,0,0]=4 10789 B13R2.12 Nc1ccc(cn1)C2CCCC2 Amb10600543 [0,1,0,1,0,0|2,0,0]=4 10790 B13R2.12 Nc1ccc(cn1)C2CNCC2 Amb10600926 [0,1,0,1,0,0|1,0,0]=3 10791 B13R2.12 Nc1ccc(cn1)C2COCC2 Amb10600932 [0,1,0,1,0,0|2,0,0]=4 10792 B13R2.12 Nc1ccc(nc1)C2CCCC2 Amb10600817 [0,1,0,1,0,0|2,0,0]=4 10793 B13R2.12 Nc1cnc(cn1)C2CNCC2 Amb10600977 [0,1,0,1,0,0|2,0,0]=4 10794 B13R2.12 Oc1[n]cc(c[n]1)C2CNCC2 Amb18828289 [0,1,0,1,0,0|2,0,0]=4 10795 B13R2.12 Oc1ccc(cc1)C2CCCN2 Amb10610042 [0,1,0,1,0,0|2,0,0]=4 10796 B13R2.12 Oc1ccc(cc1)C2CNCC2 Amb18560463 [0,1,0,1,0,0|0,0,0]=2 10797 B13R2.12 Oc1ccc(cc1)C2CNCC2 Amb22899117 [0,1,0,1,0,0|0,0,0]=2 10798 B13R2.12 Oc1ccc(cc1)C2COCC2 Amb20617113 [0,1,0,1,0,0|1,0,0]=3 10799 B13R2.12 Oc1ccc(cc1)C=2CCNN2 Amb24428675 [0,1,0,1,0,0|1,0,1]=4 10800 B13R2.12 Oc1ccc(cc1)C=2CNCC2 Amb24590181 [0,1,0,1,0,0|0,0,2]=4 10801 B13R2.12 Oc1ccc(cc1)N2CCCC2 Amb20622450 [0,1,0,1,0,0|2,0,0]=4 10802 B13R2.12 Oc1ccc(cn1)C2CCCC2 Amb10600544 [0,1,0,1,0,0|2,0,0]=4 10803 B13R2.12 Oc1ccc(nc1)C2CCCC2 Amb10600818 [0,1,0,1,0,0|2,0,0]=4 10804 B13R2.12 Sc1ccc(cc1)C2CNCC2 Amb25240565 [0,1,0,1,0,0|0,0,0]=2 10805 B13R2.12 Sc1ccc(cc1)[C@H]2CCCN2 Amb25667071 [0,1,0,1,0,0|2,0,0]=4 10806 B13R2.42 Brc1ccc(cc1)C2CC2CBr Amb25115124 [0,1,0,1,0,0|2,0,0]=4 10807 B13R2.42 CCC1CC1c2ccc(O)cc2 Amb25272945 [0,1,0,1,0,0|1,0,0]=3 10808 B13R2.42 Cc1ccc(cc1)C2CC2C=O Amb18118196 [0,1,0,1,0,0|2,0,0]=4 10809 B13R2.42 Cc1ccc(cc1)C2CC2CBr Amb25778365 [0,1,0,1,0,0|2,0,0]=4 10810 B13R2.42 Cc1ccc(cc1)C2CC2CO Amb23442828 [0,1,0,1,0,0|2,0,0]=4 10811 B13R2.42 Cc1ccc(cc1)[C@@H]2C[C@@H]2C=O Amb24470339 [0,1,0,1,0,0|2,0,0]=4 10812 B13R2.42 Cc1ccc(cc1)[C@@H]2C[C@H]2CN Amb25219862 [0,1,0,1,0,0|2,0,0]=4 10813 B13R2.42 Cc1ccc(cc1)[C@H]2CC2CO Amb25098667 [0,1,0,1,0,0|2,0,0]=4 10814 B13R2.42 ClCC1CC1c2ccc(I)cc2 Amb25841409 [0,1,0,1,0,0|2,0,0]=4 10815 B13R2.42 Clc1ccc(cc1)C2CC2CCl Amb25830100 [0,1,0,1,0,0|2,0,0]=4 10816 B13R2.42 Fc1ccc(cc1)C2CC2CBr Amb25369758 [0,1,0,1,0,0|2,0,0]=4 10817 B13R2.42 N#CC1CC1c2ccc(cc2)Br Amb17245309 [0,1,0,1,0,0|2,0,0]=4 10818 B13R2.42 N#CC1CC1c2ccc(cc2)C Amb17232209 [0,1,0,1,0,0|2,0,0]=4 10819 B13R2.42 N#CC1CC1c2ccc(cc2)Cl Amb17233376 [0,1,0,1,0,0|2,0,0]=4 10820 B13R2.42 N#CC1CC1c2ccc(cc2)F Amb17232354 [0,1,0,1,0,0|2,0,0]=4 10821 B13R2.42 N#C[C@H]1C[C@H]1c2ccc(F)cc2 Amb25773219 [0,1,0,1,0,0|2,0,0]=4 10822 B13R2.42 NCC1CC1c2ccc(F)cc2 Amb19353866 [0,1,0,1,0,0|2,0,0]=4 10823 B13R2.42 NCC1CC1c2ccc(cc2)Br Amb17247245 [0,1,0,1,0,0|2,0,0]=4 10824 B13R2.42 NCC1CC1c2ccc(cc2)C Amb17232381 [0,1,0,1,0,0|2,0,0]=4 10825 B13R2.42 NCC1CC1c2ccc(cc2)Cl Amb17233872 [0,1,0,1,0,0|2,0,0]=4 10826 B13R2.42 NCC1CC1c2ccc(cc2)F Amb17232529 [0,1,0,1,0,0|2,0,0]=4 10827 B13R2.42 NCC1CC1c2ccc(cc2)O Amb17568134 [0,1,0,1,0,0|2,0,0]=4 10828 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24629824 [0,1,0,1,0,0|2,0,0]=4 10829 B13R2.42 NC[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24391754 [0,1,0,1,0,0|2,0,0]=4 10830 B13R2.42 O=CC1CC1c2ccc(Br)cc2 Amb18118207 [0,1,0,1,0,0|2,0,0]=4 10831 B13R2.42 O=CC1CC1c2ccc(Cl)cc2 Amb18118201 [0,1,0,1,0,0|2,0,0]=4 10832 B13R2.42 O=CC1CC1c2ccc(F)cc2 Amb18636299 [0,1,0,1,0,0|2,0,0]=4 10833 B13R2.42 O=C[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25694932 [0,1,0,1,0,0|2,0,0]=4 10834 B13R2.42 O=C[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb24580746 [0,1,0,1,0,0|2,0,0]=4 10835 B13R2.42 OCC1CC1c2ccc(Br)cc2 Amb23555645 [0,1,0,1,0,0|2,0,0]=4 10836 B13R2.42 OCC1CC1c2ccc(I)cc2 Amb24591425 [0,1,0,1,0,0|2,0,0]=4 10837 B13R2.42 OCC1CC1c2ccc(cc2)Cl Amb17605541 [0,1,0,1,0,0|2,0,0]=4 10838 B13R2.42 OCC1CC1c2ccc(cc2)F Amb17605552 [0,1,0,1,0,0|2,0,0]=4 10839 B13R2.42 OC[C@@H]1C[C@H]1c2ccc(F)cc2 Amb25345004 [0,1,0,1,0,0|2,0,0]=4 10840 B13R2.42 Oc1ccc(cc1)C2CC2C=O Amb18636291 [0,1,0,1,0,0|2,0,0]=4 10841 B13R2.147 CC1CN(C1)c2ccc(Br)cc2 Amb25118213 [0,1,0,1,0,0|2,0,0]=4 10842 B13R2.147 CC1CN(C1)c2ccc(I)cc2 Amb25118214 [0,1,0,1,0,0|2,0,0]=4 10843 B13R2.147 CN1CC(C1)c2ccc(O)cc2 Amb25276692 [0,1,0,1,0,0|0,0,0]=2 10844 B13R2.147 Cc1ccc(cc1)C2CC(O)C2 Amb18792427 [0,1,0,1,0,0|2,0,0]=4 10845 B13R2.147 Cc1ccc(cc1)N2CC(C)C2 Amb25794191 [0,1,0,1,0,0|2,0,0]=4 10846 B13R2.147 NC1CC(C1)c2ccc(Br)cc2 Amb19373627 [0,1,0,1,0,0|2,0,0]=4 10847 B13R2.147 NC1CC(C1)c2ccc(F)cc2 Amb19373526 [0,1,0,1,0,0|2,0,0]=4 10848 B13R2.147 NC1CC(C1)c2ccc(I)cc2 Amb25846988 [0,1,0,1,0,0|2,0,0]=4 10849 B13R2.147 N[C@@H]1C[C@H](C1)c2ccc(F)cc2 Amb25713103 [0,1,0,1,0,0|2,0,0]=4 10850 B13R2.147 Nc1ccc(cc1)[C@@H]2C[C@@H](O)C2 Amb25209497 [0,1,0,1,0,0|2,0,0]=4 10851 B13R2.147 O=C1CC(C1)c2ccc(F)cc2 Amb20622977 [0,1,0,1,0,0|2,0,0]=4 10852 B13R2.147 O=C1CC(C1)c2ccc(I)cc2 Amb24733362 [0,1,0,1,0,0|2,0,0]=4 10853 B13R2.147 O=C1CC(C1)c2ccc(cc2)C Amb13951128 [0,1,0,1,0,0|2,0,0]=4 10854 B13R2.147 O=C1CC(C1)c2ccc(cc2)Cl Amb10071665 [0,1,0,1,0,0|2,0,0]=4 10855 B13R2.147 OC1CC(C1)c2ccc(Br)cc2 Amb19514794 [0,1,0,1,0,0|2,0,0]=4 10856 B13R2.147 OC1CC(C1)c2ccc(Cl)cc2 Amb19057040 [0,1,0,1,0,0|2,0,0]=4 10857 B13R2.147 OC1CC(C1)c2ccc(F)cc2 Amb18792756 [0,1,0,1,0,0|2,0,0]=4 10858 B13R2.147 O[C@@H]1C[C@@H](C1)c2ccc(Br)cc2 Amb22754760 [0,1,0,1,0,0|2,0,0]=4 10859 B13R2.147 O[C@@H]1C[C@@H](C1)c2ccc(Cl)cc2 Amb24592427 [0,1,0,1,0,0|2,0,0]=4 10860 B13R2.147 O[C@@H]1C[C@H](C1)c2ccc(Br)cc2 Amb22748903 [0,1,0,1,0,0|2,0,0]=4 10861 B13R2.147 O[C@@H]1C[C@H](C1)c2ccc(Cl)cc2 Amb25769355 [0,1,0,1,0,0|2,0,0]=4 10862 B13R2.520 CN(C1CC1)c2ccc(Br)cc2 Amb25054986 [0,1,0,1,0,0|2,0,0]=4 10863 B13R2.520 CN(C1CC1)c2ccc(Cl)cc2 Amb25114752 [0,1,0,1,0,0|2,0,0]=4 10864 B13R2.520 Cc1ccc(cc1)C(Cl)C2CC2 Amb18181273 [0,1,0,1,0,0|2,0,0]=4 10865 B13R2.520 Cc1ccc(cc1)[C@@H](N)C2CC2 Amb25667112 [0,1,0,1,0,0|2,0,0]=4 10866 B13R2.520 Cc1ccc(cc1)[C@@H](O)[C@H]2CO2 Amb25236159 [0,1,0,1,0,0|2,0,0]=4 10867 B13R2.520 Cc1ccc(cc1)[C@H](N)C2CC2 Amb24599385 [0,1,0,1,0,0|2,0,0]=4 10868 B13R2.520 Clc1ccc(cc1)C(Cl)C2CC2 Amb18320199 [0,1,0,1,0,0|2,0,0]=4 10869 B13R2.520 Fc1ccc(cc1)C(Cl)C2CC2 Amb19057817 [0,1,0,1,0,0|2,0,0]=4 10870 B13R2.520 NC(C1CC1)c2ccc(O)cc2 Amb18829216 [0,1,0,1,0,0|2,0,0]=4 10871 B13R2.520 N[C@@H](C1CC1)c2ccc(F)cc2 Amb22284331 [0,1,0,1,0,0|2,0,0]=4 10872 B13R2.520 N[C@@H](C1CC1)c2ccc(F)cc2 Amb22744982 [0,1,0,1,0,0|2,0,0]=4 10873 B13R2.520 N[C@@H](C1CC1)c2ccc(O)cc2 Amb24746683 [0,1,0,1,0,0|2,0,0]=4 10874 B13R2.520 N[C@H](C1CC1)c2ccc(F)cc2 Amb22406377 [0,1,0,1,0,0|2,0,0]=4 10875 B13R2.520 Nc1ccc(cc1)C(F)C2CC2 Amb24733634 [0,1,0,1,0,0|2,0,0]=4 10876 B13R2.520 Nc1ccc(cc1)C(O)C2CC2 Amb25275871 [0,1,0,1,0,0|2,0,0]=4 10877 B13R2.520 Nc1ccc(cc1)[C@@H](N)C2CC2 Amb24674175 [0,1,0,1,0,0|2,0,0]=4 10878 B13R2.520 Nc1ccc(cc1)[C@H](N)C2CC2 Amb24424305 [0,1,0,1,0,0|2,0,0]=4 10879 B13R2.520 OC(C1CC1)c2ccc(I)cc2 Amb24457376 [0,1,0,1,0,0|2,0,0]=4 10880 B13R2.520 OC(C1CO1)c2ccc(Cl)cc2 Amb25737190 [0,1,0,1,0,0|2,0,0]=4 10881 B13R2.520 OC(C1CO1)c2ccc(F)cc2 Amb24605647 [0,1,0,1,0,0|2,0,0]=4 10882 B13R2.520 OC(c1ccc(cc1)C)C2CC2 Amb1110339 [0,1,0,1,0,0|2,0,0]=4 10883 B13R2.520 O[C@@H](C1CC1)c2ccc(Br)cc2 Amb24182162 [0,1,0,1,0,0|2,0,0]=4 10884 B13R2.520 O[C@@H](C1CC1)c2ccc(F)cc2 Amb25132744 [0,1,0,1,0,0|2,0,0]=4 10885 B13R2.520 SC(C1CC1)c2ccc(Cl)cc2 Amb19056199 [0,1,0,1,0,0|2,0,0]=4 10886 B13R2.2986 CC1(CCC1)c2ccc(Br)cc2 Amb25248550 [0,1,0,1,0,0|1,0,0]=3 10887 B13R2.2986 CC1(CCC1)c2ccc(Cl)[n]c2 Amb24578655 [0,1,0,1,0,0|2,0,0]=4 10888 B13R2.2986 CC1(CCC1)c2ccc(N)cc2 Amb24497250 [0,1,0,1,0,0|1,0,0]=3 10889 B13R2.2986 CC1(CCO1)c2ccc(Br)cc2 Amb25292728 [0,1,0,1,0,0|2,0,0]=4 10890 B13R2.2986 CC1(CNC1)c2ccc(Br)cc2 Amb18070096 [0,1,0,1,0,0|0,0,0]=2 10891 B13R2.2986 CC1(CNC1)c2ccc(Cl)cc2 Amb18564193 [0,1,0,1,0,0|0,0,0]=2 10892 B13R2.2986 CC1(CNC1)c2ccc(F)cc2 Amb18563685 [0,1,0,1,0,0|0,0,0]=2 10893 B13R2.2986 CC1(COC1)c2ccc(Br)cc2 Amb22737356 [0,1,0,1,0,0|1,0,0]=3 10894 B13R2.2986 CC1(COC1)c2ccc(N)cc2 Amb22388447 [0,1,0,1,0,0|1,0,0]=3 10895 B13R2.2986 Cc1ccc(cc1)C2(C)CCC2 Amb24627464 [0,1,0,1,0,0|1,0,0]=3 10896 B13R2.2986 Cc1ccc(cc1)C2(C)CCN2 Amb24720891 [0,1,0,1,0,0|2,0,0]=4 10897 B13R2.2986 Cc1ccc(cc1)C2(C)CNC2 Amb18563527 [0,1,0,1,0,0|0,0,0]=2 10898 B13R2.2986 Cc1ccc(cc1)C2(F)CNC2 Amb24567560 [0,1,0,1,0,0|1,0,0]=3 10899 B13R2.2986 Cc1ccc(cc1)C2(N)COC2 Amb19892688 [0,1,0,1,0,0|2,0,0]=4 10900 B13R2.2986 Cc1ccc(cc1)C2(N)COC2 Amb22386898 [0,1,0,1,0,0|2,0,0]=4 10901 B13R2.2986 Cc1ccc(cc1)C2(O)CNC2 Amb25843096 [0,1,0,1,0,0|1,0,0]=3 10902 B13R2.2986 Cc1ccc(cc1)C2(O)CSC2 Amb24606288 [0,1,0,1,0,0|2,0,0]=4 10903 B13R2.2986 FC1(CNC1)c2ccc(Cl)cc2 Amb24349451 [0,1,0,1,0,0|1,0,0]=3 10904 B13R2.2986 FC1(COC1)c2ccc(Br)cc2 Amb25047263 [0,1,0,1,0,0|2,0,0]=4 10905 B13R2.2986 Fc1ccc(cc1)C2(F)CNC2 Amb25678435 [0,1,0,1,0,0|1,0,0]=3 10906 B13R2.2986 NC1(CCC1)c2ccc(Cl)cc2 Amb22499156 [0,1,0,1,0,0|2,0,0]=4 10907 B13R2.2986 NC1(CCC1)c2ccc(F)cc2 Amb17991303 [0,1,0,1,0,0|2,0,0]=4 10908 B13R2.2986 NC1(CCC1)c2ccc(I)cc2 Amb24392267 [0,1,0,1,0,0|2,0,0]=4 10909 B13R2.2986 NC1(CCC1)c2ccc(cc2)Br Amb10609476 [0,1,0,1,0,0|2,0,0]=4 10910 B13R2.2986 NC1(CNC1)c2ccc(Br)cc2 Amb23401382 [0,1,0,1,0,0|1,0,0]=3 10911 B13R2.2986 NC1(CNC1)c2ccc(Br)cc2 Amb25326615 [0,1,0,1,0,0|1,0,0]=3 10912 B13R2.2986 NC1(COC1)c2ccc(Br)cc2 Amb19893279 [0,1,0,1,0,0|2,0,0]=4 10913 B13R2.2986 NC1(COC1)c2ccc(Cl)cc2 Amb19892679 [0,1,0,1,0,0|2,0,0]=4 10914 B13R2.2986 NC1(COC1)c2ccc(Cl)cc2 Amb24738563 [0,1,0,1,0,0|2,0,0]=4 10915 B13R2.2986 NC1(COC1)c2ccc(F)cc2 Amb19892676 [0,1,0,1,0,0|2,0,0]=4 10916 B13R2.2986 NC1(COC1)c2ccc(F)cc2 Amb22386899 [0,1,0,1,0,0|2,0,0]=4 10917 B13R2.2986 Nc1ccc(cc1)C2(O)COC2 Amb25135740 [0,1,0,1,0,0|2,0,0]=4 10918 B13R2.2986 OC1(CCC1)c2ccc(Br)cc2 Amb22292373 [0,1,0,1,0,0|2,0,0]=4 10919 B13R2.2986 OC1(COC1)c2ccc(Br)cc2 Amb22386872 [0,1,0,1,0,0|2,0,0]=4 10920 B13R2.2986 OC1(COC1)c2ccc(F)cc2 Amb22386874 [0,1,0,1,0,0|2,0,0]=4 10921 B13R2.2986 OC1(CSC1)c2ccc(Cl)cc2 Amb24597285 [0,1,0,1,0,0|2,0,0]=4 10922 B13R2.2986 Oc1ccc(cc1)C2(O)COC2 Amb22386869 [0,1,0,1,0,0|2,0,0]=4 10923 B13R2.2986 [NH3+]C1(COC1)c2ccc(Br)cc2 Amb20247177 [0,1,0,1,0,0|2,0,0]=4 10924 B13R2.2986 [NH3+]C1(COC1)c2ccc(F)cc2 Amb20247176 [0,1,0,1,0,0|2,0,0]=4 10925 B13R2.2987 CC1(CC1N)c2ccc(Br)cc2 Amb18280089 [0,1,0,1,0,0|2,0,0]=4 10926 B13R2.2987 CC1(CC1N)c2ccc(Cl)cc2 Amb18280086 [0,1,0,1,0,0|2,0,0]=4 10927 B13R2.2987 CC1(CC1N)c2ccc(F)cc2 Amb18947384 [0,1,0,1,0,0|2,0,0]=4 10928 B13R2.2987 CC1CC1(N)c2ccc(Br)cc2 Amb24469663 [0,1,0,1,0,0|2,0,0]=4 10929 B13R2.2987 CC1CC1(O)c2ccc(F)cc2 Amb24380041 [0,1,0,1,0,0|2,0,0]=4 10930 B13R2.2987 Cc1ccc(cc1)C2(C)CC2N Amb18947392 [0,1,0,1,0,0|2,0,0]=4 10931 B13R2.5179 Brc1ccc2c(c1)CCCN2C Amb17134512 [0,1,0,1,0,0|2,0,0]=4 10932 B13R2.5179 CC1CCCc2cc(N)c[n]c21 Amb24758863 [0,1,0,1,0,0|2,0,0]=4 10933 B13R2.5179 CC1CCNc2cc(Cl)ccc21 Amb23589604 [0,1,0,1,0,0|2,0,0]=4 10934 B13R2.5179 CC1CCNc2cc(F)ccc21 Amb18828264 [0,1,0,1,0,0|2,0,0]=4 10935 B13R2.5179 CC1CCNc2cc(N)ccc21 Amb25858185 [0,1,0,1,0,0|2,0,0]=4 10936 B13R2.5179 CC1CNCc2cc(Br)c[n]c21 Amb22276370 [0,1,0,1,0,0|1,0,0]=3 10937 B13R2.5179 CC1CNCc2cc(Br)ccc21 Amb22230132 [0,1,0,1,0,0|0,0,0]=2 10938 B13R2.5179 CC1CNCc2cc(O)ccc21 Amb24663568 [0,1,0,1,0,0|0,0,0]=2 10939 B13R2.5179 CC1NCCc2cc(F)ccc21 Amb19374659 [0,1,0,1,0,0|2,0,0]=4 10940 B13R2.5179 CC1NCCc2cc(F)ccc21 Amb22058745 [0,1,0,1,0,0|2,0,0]=4 10941 B13R2.5179 CC1NCCc2cc(O)ccc21 Amb18063932 [0,1,0,1,0,0|2,0,0]=4 10942 B13R2.5179 CN1CCCc2cc(Cl)ccc12 Amb25225511 [0,1,0,1,0,0|2,0,0]=4 10943 B13R2.5179 CN1CCCc2cc(F)ccc12 Amb24081676 [0,1,0,1,0,0|2,0,0]=4 10944 B13R2.5179 CN1CCCc2cc(O)ccc12 Amb24465126 [0,1,0,1,0,0|2,0,0]=4 10945 B13R2.5179 C[C@@H]1CCNc2cc(Cl)ccc21 Amb25159191 [0,1,0,1,0,0|2,0,0]=4 10946 B13R2.5179 C[C@@H]1NCCc2cc(I)ccc21 Amb24445423 [0,1,0,1,0,0|2,0,0]=4 10947 B13R2.5179 C[C@@H]1NCCc2cc(N)ccc21 Amb24685400 [0,1,0,1,0,0|2,0,0]=4 10948 B13R2.5179 C[C@H]1CCNc2cc(Cl)ccc21 Amb25685932 [0,1,0,1,0,0|2,0,0]=4 10949 B13R2.5179 C[C@H]1NCCc2cc(F)ccc21 Amb24493134 [0,1,0,1,0,0|2,0,0]=4 10950 B13R2.5179 C[C@H]1NCCc2cc(I)ccc21 Amb24396010 [0,1,0,1,0,0|2,0,0]=4 10951 B13R2.5179 C[C@H]1NCCc2cc(O)ccc21 Amb25133624 [0,1,0,1,0,0|2,0,0]=4 10952 B13R2.5179 Cc1ccc2C(C)CCNc2c1 Amb18199823 [0,1,0,1,0,0|2,0,0]=4 10953 B13R2.5179 Cc1ccc2[C@H](C)NCCc2c1 Amb24493007 [0,1,0,1,0,0|2,0,0]=4 10954 B13R2.5179 Cc1ccc2c(c1)CNCC2C Amb17400098 [0,1,0,1,0,0|0,0,0]=2 10955 B13R2.5179 Cc1cnc2c(c1)CCCC2C Amb17334540 [0,1,0,1,0,0|2,0,0]=4 10956 B13R2.5179 Clc1ccc2c(c1)CNCC2C Amb17400900 [0,1,0,1,0,0|0,0,0]=2 10957 B13R2.5179 Fc1ccc2C(F)CNCc2c1 Amb25253133 [0,1,0,1,0,0|1,0,0]=3 10958 B13R2.5179 Fc1ccc2c(c1)CNCC2C Amb17400184 [0,1,0,1,0,0|0,0,0]=2 10959 B13R2.5179 NC1CCCc2cc(Br)ccc21 Amb21964183 [0,1,0,1,0,0|2,0,0]=4 10960 B13R2.5179 NC1CCCc2cc(Br)ccc21 Amb23440435 [0,1,0,1,0,0|2,0,0]=4 10961 B13R2.5179 NC1CCCc2cc(F)ccc21 Amb22001951 [0,1,0,1,0,0|2,0,0]=4 10962 B13R2.5179 NC1CCCc2cc(O)ccc21 Amb18278102 [0,1,0,1,0,0|2,0,0]=4 10963 B13R2.5179 NC1COCc2cc(Br)ccc21 Amb25739116 [0,1,0,1,0,0|2,0,0]=4 10964 B13R2.5179 N[C@@H]1CCCc2cc(Br)ccc21 Amb25364148 [0,1,0,1,0,0|2,0,0]=4 10965 B13R2.5179 N[C@@H]1CCCc2cc(Cl)ccc21 Amb23440379 [0,1,0,1,0,0|2,0,0]=4 10966 B13R2.5179 N[C@@H]1COCc2cc(Br)ccc21 Amb24575223 [0,1,0,1,0,0|2,0,0]=4 10967 B13R2.5179 N[C@H]1CCCc2cc(Cl)ccc21 Amb24578755 [0,1,0,1,0,0|2,0,0]=4 10968 B13R2.5179 N[C@H]1COCc2cc(Br)ccc21 Amb24524720 [0,1,0,1,0,0|2,0,0]=4 10969 B13R2.5179 N[C@H]1COCc2cc(F)ccc21 Amb25296846 [0,1,0,1,0,0|2,0,0]=4 10970 B13R2.5179 Nc1ccc2C(N)COCc2c1 Amb24394425 [0,1,0,1,0,0|2,0,0]=4 10971 B13R2.5179 Nc1ccc2[C@@H](N)CCCc2c1 Amb24351160 [0,1,0,1,0,0|2,0,0]=4 10972 B13R2.5179 O=C1CNCc2cc(Cl)ccc21 Amb24542632 [0,1,0,1,0,0|1,0,1]=4 10973 B13R2.5179 O=C1CNCc2cc(F)ccc21 Amb25309740 [0,1,0,1,0,0|1,0,1]=4 10974 B13R2.5179 OC1CCCc2cc(Br)ccc21 Amb25220886 [0,1,0,1,0,0|2,0,0]=4 10975 B13R2.5179 OC1CCCc2cc(F)ccc21 Amb20623192 [0,1,0,1,0,0|2,0,0]=4 10976 B13R2.5179 OC1CCCc2cc(I)ccc21 Amb25296103 [0,1,0,1,0,0|2,0,0]=4 10977 B13R2.5179 O[C@@H]1CCCc2cc(Cl)ccc21 Amb24644132 [0,1,0,1,0,0|2,0,0]=4 10978 B13R2.5179 O[C@@H]1CCCc2cc(F)ccc21 Amb25087106 [0,1,0,1,0,0|2,0,0]=4 10979 B13R2.5179 O[C@@H]1CCCc2cc(I)ccc21 Amb24396281 [0,1,0,1,0,0|2,0,0]=4 10980 B13R2.5179 O[C@H]1CCCc2cc(F)ccc21 Amb24590117 [0,1,0,1,0,0|2,0,0]=4 10981 B13R2.5179 O[C@H]1CCCc2cc(I)ccc21 Amb25722219 [0,1,0,1,0,0|2,0,0]=4 10982 B13R2.5179 Oc1cc2CCCC(F)c2cc1 Amb24429920 [0,1,0,1,0,0|2,0,0]=4 10983 B13R2.5179 Oc1cc2CNCC(=O)c2cc1 Amb25250025 [0,1,0,1,0,0|1,0,1]=4 10984 B13R2.5179 Oc1cc2CNCC(F)c2cc1 Amb25202299 [0,1,0,1,0,0|1,0,0]=3 10985 B13R2.5179 Oc1ccc2C(O)CCCc2c1 Amb18800788 [0,1,0,1,0,0|2,0,0]=4 10986 B13R2.5179 Oc1ccc2[C@@H](O)CCCc2c1 Amb25823105 [0,1,0,1,0,0|2,0,0]=4 10987 B13R2.5179 Oc1ccc2[C@H](O)CCCc2c1 Amb24458581 [0,1,0,1,0,0|2,0,0]=4 10988 B13R2.5187 Brc1ccc2c(c1)c(C)nn2C Amb10070869 [0,1,0,1,0,0|1,0,1]=4 10989 B13R2.5187 Brc1ccc2c(c1)n(C)nc2C Amb10070872 [0,1,0,1,0,0|1,0,1]=4 10990 B13R2.5187 CC1CC(=O)c2cc(O)ccc21 Amb25807644 [0,1,0,1,0,0|2,0,0]=4 10991 B13R2.5187 CC1CC(=O)c2ccc(Br)cc21 Amb25762965 [0,1,0,1,0,0|2,0,0]=4 10992 B13R2.5187 CC1CC(=O)c2ccc(Cl)cc21 Amb22753082 [0,1,0,1,0,0|2,0,0]=4 10993 B13R2.5187 CC1CC(=O)c2ccc(F)cc21 Amb25698030 [0,1,0,1,0,0|2,0,0]=4 10994 B13R2.5187 CC1CC(C)C=2C=CC(=O)NC21 Amb24642624 [0,1,0,1,0,0|2,0,0]=4 10995 B13R2.5187 CC1CC(Cl)c2cc(F)ccc21 Amb24483385 [0,1,0,1,0,0|2,0,0]=4 10996 B13R2.5187 CC1CC(O)c2cc(F)ccc21 Amb25832193 [0,1,0,1,0,0|2,0,0]=4 10997 B13R2.5187 CC1CC(O)c2ccc(Cl)cc21 Amb24397996 [0,1,0,1,0,0|2,0,0]=4 10998 B13R2.5187 CC1CN(C)c2ccc(O)cc21 Amb24380812 [0,1,0,1,0,0|0,0,0]=2 10999 B13R2.5187 CC=1NN(C)C2=CC(=N)C=CC12 Amb25741644 [0,1,0,1,0,0|1,0,1]=4 11000 B13R2.5187 CN1CC(=O)c2cc(Br)ccc12 Amb18160225 [0,1,0,1,0,0|1,0,1]=4 11001 B13R2.5187 CN1CC(=O)c2cc(N)ccc12 Amb18829714 [0,1,0,1,0,0|1,0,1]=4 11002 B13R2.5187 CN1CC(N)c2cc(Br)ccc12 Amb24685295 [0,1,0,1,0,0|1,0,0]=3 11003 B13R2.5187 CN1CC(N)c2cc(Cl)ccc12 Amb24439461 [0,1,0,1,0,0|1,0,0]=3 11004 B13R2.5187 CN1CC(N)c2ccc(F)cc12 Amb24455753 [0,1,0,1,0,0|1,0,0]=3 11005 B13R2.5187 C[C@@H]1C[C@H](C)C=2C=CC(=O)NC21 Amb25272297 [0,1,0,1,0,0|2,0,0]=4 11006 B13R2.5187 C[C@H]1CC(=O)c2cc(N)ccc21 Amb24341851 [0,1,0,1,0,0|2,0,0]=4 11007 B13R2.5187 C[C@H]1C[C@@H](C)c2cc(N)ccc21 Amb25295295 [0,1,0,1,0,0|1,0,0]=3 11008 B13R2.5187 Cc1[n][n](C)c2cc(N)ccc12 Amb22406275 [0,1,0,1,0,0|1,0,1]=4 11009 B13R2.5187 Cc1[n][n](C)c2cc(O)ccc12 Amb24702668 [0,1,0,1,0,0|1,0,1]=4 11010 B13R2.5187 Cc1[n][n](C)c2ccc(N)cc12 Amb21962822 [0,1,0,1,0,0|1,0,1]=4 11011 B13R2.5187 Cc1[n][n](C)c2ccc(O)cc12 Amb25688948 [0,1,0,1,0,0|1,0,1]=4 11012 B13R2.5187 Cc1c[n](C)c2cc(Cl)ccc12 Amb18893640 [0,1,0,1,0,0|0,0,2]=4 11013 B13R2.5187 Cc1c[n](C)c2cc(F)ccc12 Amb18893477 [0,1,0,1,0,0|0,0,2]=4 11014 B13R2.5187 Cc1c[n](C)c2cc(N)ccc12 Amb25202359 [0,1,0,1,0,0|0,0,2]=4 11015 B13R2.5187 Cc1c[n](C)c2ccc(Br)cc12 Amb18896735 [0,1,0,1,0,0|0,0,2]=4 11016 B13R2.5187 Cc1c[n](C)c2ccc(Cl)cc12 Amb18893638 [0,1,0,1,0,0|0,0,2]=4 11017 B13R2.5187 Cc1c[n](C)c2ccc(F)cc12 Amb18893475 [0,1,0,1,0,0|0,0,2]=4 11018 B13R2.5187 Cc1c[n](C)c2ccc(O)cc12 Amb25702276 [0,1,0,1,0,0|0,0,2]=4 11019 B13R2.5187 Cc1cc2c(cc1)[n](C)cc2C Amb18893426 [0,1,0,1,0,0|0,0,2]=4 11020 B13R2.5187 Cc1cc2c(cc1)c(C)c[n]2C Amb18893432 [0,1,0,1,0,0|0,0,2]=4 11021 B13R2.5187 Cc1ccc2C(C)CC(Br)c2c1 Amb25832196 [0,1,0,1,0,0|2,0,0]=4 11022 B13R2.5187 Cc1ccc2C(C)CC(Cl)c2c1 Amb25832195 [0,1,0,1,0,0|2,0,0]=4 11023 B13R2.5187 Cc1ccc2C(C)CC(O)c2c1 Amb25345511 [0,1,0,1,0,0|2,0,0]=4 11024 B13R2.5187 Oc1ccc2c(c1)C(C)CC2=O Amb2518526 [0,1,0,1,0,0|2,0,0]=4 11025 B13R2.13 Brc1cc([n]cc1)C2CNCC2 Amb24083004 [0,1,0,1,0,0|1,0,0]=3 11026 B13R2.13 Brc1cc([n]cc1)C2COCC2 Amb20617664 [0,1,0,1,0,0|2,0,0]=4 11027 B13R2.13 Brc1cc(c[n]c1)C2CCCC2 Amb20617717 [0,1,0,1,0,0|2,0,0]=4 11028 B13R2.13 Brc1cc(c[n]c1)C2CNCC2 Amb24082796 [0,1,0,1,0,0|1,0,0]=3 11029 B13R2.13 Brc1cc(c[n]c1)C2COCC2 Amb24320760 [0,1,0,1,0,0|2,0,0]=4 11030 B13R2.13 Brc1cc(cc[n]1)C2CSCC2 Amb20617303 [0,1,0,1,0,0|2,0,0]=4 11031 B13R2.13 Brc1cc(ccc1)C2CCCC2 Amb20617099 [0,1,0,1,0,0|1,0,0]=3 11032 B13R2.13 Brc1cc(ccc1)C2CCCN2 Amb17659178 [0,1,0,1,0,0|2,0,0]=4 11033 B13R2.13 Brc1cc(ccc1)C2CNCC2 Amb22284651 [0,1,0,1,0,0|0,0,0]=2 11034 B13R2.13 Brc1cc(ccc1)C2CNCO2 Amb18571829 [0,1,0,1,0,0|1,0,0]=3 11035 B13R2.13 Brc1cc(ccc1)C2COCC2 Amb20617102 [0,1,0,1,0,0|1,0,0]=3 11036 B13R2.13 Brc1cc(ccc1)N2CCCC2 Amb22231985 [0,1,0,1,0,0|2,0,0]=4 11037 B13R2.13 Brc1cc(ccc1)[C@@H]2CCCN2 Amb23440340 [0,1,0,1,0,0|2,0,0]=4 11038 B13R2.13 Brc1cc(ccc1)[C@@H]2CNCC2 Amb24629121 [0,1,0,1,0,0|0,0,0]=2 11039 B13R2.13 Brc1cccc(c1)C2CCCN2 Amb2235034 [0,1,0,1,0,0|2,0,0]=4 11040 B13R2.13 Brc1cccc(c1)C2CCCN2 Amb2237174 [0,1,0,1,0,0|2,0,0]=4 11041 B13R2.13 Brc1cccc(c1)C2CNCC2 Amb17104496 [0,1,0,1,0,0|0,0,0]=2 11042 B13R2.13 Brc1cccc(n1)C2CCCC2 Amb10599826 [0,1,0,1,0,0|2,0,0]=4 11043 B13R2.13 Brc1cccc(n1)C2CNCC2 Amb10600923 [0,1,0,1,0,0|1,0,0]=3 11044 B13R2.13 Brc1cccc(n1)C2COCC2 Amb10600929 [0,1,0,1,0,0|2,0,0]=4 11045 B13R2.13 Brc1ccnc(c1)C2CCCC2 Amb10599895 [0,1,0,1,0,0|2,0,0]=4 11046 B13R2.13 Brc1nccc(c1)C2CCCC2 Amb10600462 [0,1,0,1,0,0|2,0,0]=4 11047 B13R2.13 Brc1nccc(c1)C2CNCC2 Amb10600927 [0,1,0,1,0,0|1,0,0]=3 11048 B13R2.13 Brc1nccc(c1)C2COCC2 Amb10600933 [0,1,0,1,0,0|2,0,0]=4 11049 B13R2.13 Cc1[n]c(cc[n]1)C2CCNC2 Amb18829169 [0,1,0,1,0,0|2,0,0]=4 11050 B13R2.13 Cc1cc([n]c[n]1)C2CCNC2 Amb18829144 [0,1,0,1,0,0|2,0,0]=4 11051 B13R2.13 Cc1cc([n]cc1)C2CNCC2 Amb25034617 [0,1,0,1,0,0|1,0,0]=3 11052 B13R2.13 Cc1cc(ccc1)C2CCCC2 Amb24341581 [0,1,0,1,0,0|1,0,0]=3 11053 B13R2.13 Cc1cc(ccc1)C2CNCC2 Amb22000992 [0,1,0,1,0,0|0,0,0]=2 11054 B13R2.13 Cc1cc(ccc1)C2CNCO2 Amb18563577 [0,1,0,1,0,0|1,0,0]=3 11055 B13R2.13 Cc1cc(ccc1)N2CCCC2 Amb22524397 [0,1,0,1,0,0|2,0,0]=4 11056 B13R2.13 Cc1cc(ccc1)[C@@H]2CNCC2 Amb24379598 [0,1,0,1,0,0|0,0,0]=2 11057 B13R2.13 Cc1cc(ccc1)[C@H]2CCCN2 Amb24426768 [0,1,0,1,0,0|2,0,0]=4 11058 B13R2.13 Cc1cccc([n]1)C2CNCC2 Amb18829562 [0,1,0,1,0,0|1,0,0]=3 11059 B13R2.13 Cc1cccc(c1)C2CCCN2 Amb2234644 [0,1,0,1,0,0|2,0,0]=4 11060 B13R2.13 Cc1cccc(c1)C2CNCC2 Amb17104483 [0,1,0,1,0,0|0,0,0]=2 11061 B13R2.13 Clc1cc([n]cc1)C2CNCC2 Amb18823443 [0,1,0,1,0,0|1,0,0]=3 11062 B13R2.13 Clc1cc([n]cc1)C2CNCC2 Amb24083019 [0,1,0,1,0,0|1,0,0]=3 11063 B13R2.13 Clc1cc([n]cc1)C2COCC2 Amb24320268 [0,1,0,1,0,0|2,0,0]=4 11064 B13R2.13 Clc1cc(cc[n]1)C2COCC2 Amb20617930 [0,1,0,1,0,0|2,0,0]=4 11065 B13R2.13 Clc1cc(cc[n]1)C2CSCC2 Amb20617304 [0,1,0,1,0,0|2,0,0]=4 11066 B13R2.13 Clc1cc(ccc1)C2CCCN2 Amb17659158 [0,1,0,1,0,0|2,0,0]=4 11067 B13R2.13 Clc1cc(ccc1)C2CNCC2 Amb22234362 [0,1,0,1,0,0|0,0,0]=2 11068 B13R2.13 Clc1cc(ccc1)C2CNCO2 Amb18564264 [0,1,0,1,0,0|1,0,0]=3 11069 B13R2.13 Clc1cc(ccc1)N2CCNC2 Amb25348472 [0,1,0,1,0,0|1,0,0]=3 11070 B13R2.13 Clc1cc(ccc1)[C@@H]2CCCN2 Amb23440341 [0,1,0,1,0,0|2,0,0]=4 11071 B13R2.13 Clc1cc(ccc1)[C@@H]2CNCC2 Amb24089109 [0,1,0,1,0,0|0,0,0]=2 11072 B13R2.13 Clc1cc(ccc1)[C@H]2CCCN2 Amb24093535 [0,1,0,1,0,0|2,0,0]=4 11073 B13R2.13 Clc1cc(ccc1)[C@H]2CNCC2 Amb24061063 [0,1,0,1,0,0|0,0,0]=2 11074 B13R2.13 Clc1cc(ccc1)[C@H]2CNCC2 Amb25088886 [0,1,0,1,0,0|0,0,0]=2 11075 B13R2.13 Clc1cccc(c1)C2CCCN2 Amb2234805 [0,1,0,1,0,0|2,0,0]=4 11076 B13R2.13 Clc1cccc(c1)C2CCCN2 Amb2237167 [0,1,0,1,0,0|2,0,0]=4 11077 B13R2.13 Clc1cccc(c1)C2CNCC2 Amb10607470 [0,1,0,1,0,0|0,0,0]=2 11078 B13R2.13 Clc1cccc(c1)N2CCCC2 Amb10071156 [0,1,0,1,0,0|2,0,0]=4 11079 B13R2.13 Clc1ccnc(n1)C2CNCC2 Amb10600979 [0,1,0,1,0,0|2,0,0]=4 11080 B13R2.13 Fc1cc([n]cc1)C2CCCC2 Amb24319240 [0,1,0,1,0,0|2,0,0]=4 11081 B13R2.13 Fc1cc(c[n]c1)C2CNCC2 Amb23586021 [0,1,0,1,0,0|1,0,0]=3 11082 B13R2.13 Fc1cc(cc[n]1)C2CNCC2 Amb24551464 [0,1,0,1,0,0|1,0,0]=3 11083 B13R2.13 Fc1cc(ccc1)C2CCC=C2 Amb25751416 [0,1,0,1,0,0|1,0,1]=4 11084 B13R2.13 Fc1cc(ccc1)C2CCCC2 Amb24548778 [0,1,0,1,0,0|1,0,0]=3 11085 B13R2.13 Fc1cc(ccc1)C2CCCN2 Amb17659166 [0,1,0,1,0,0|2,0,0]=4 11086 B13R2.13 Fc1cc(ccc1)C2CNCC2 Amb18946445 [0,1,0,1,0,0|0,0,0]=2 11087 B13R2.13 Fc1cc(ccc1)C2CNCC2 Amb24078505 [0,1,0,1,0,0|0,0,0]=2 11088 B13R2.13 Fc1cc(ccc1)C2CNCO2 Amb18563794 [0,1,0,1,0,0|1,0,0]=3 11089 B13R2.13 Fc1cc(ccc1)C=2CNCC2 Amb24463417 [0,1,0,1,0,0|0,0,2]=4 11090 B13R2.13 Fc1cc(ccc1)N2CCCC2 Amb18269451 [0,1,0,1,0,0|2,0,0]=4 11091 B13R2.13 Fc1cc(ccc1)[C@@H]2CCCN2 Amb22756941 [0,1,0,1,0,0|2,0,0]=4 11092 B13R2.13 Fc1cc(ccc1)[C@@H]2CNCC2 Amb24065622 [0,1,0,1,0,0|0,0,0]=2 11093 B13R2.13 Fc1cc(ccc1)[C@@H]2CNCC2 Amb25348404 [0,1,0,1,0,0|0,0,0]=2 11094 B13R2.13 Fc1cccc([n]1)C2CCCC2 Amb24319188 [0,1,0,1,0,0|2,0,0]=4 11095 B13R2.13 Fc1cccc([n]1)C2CNCC2 Amb18199641 [0,1,0,1,0,0|1,0,0]=3 11096 B13R2.13 Fc1cccc(c1)C2CCCN2 Amb10609533 [0,1,0,1,0,0|2,0,0]=4 11097 B13R2.13 Fc1cccc(c1)[C@H]2CCCN2 Amb17912088 [0,1,0,1,0,0|2,0,0]=4 11098 B13R2.13 Ic1cc(ccc1)C2CCCN2 Amb17659161 [0,1,0,1,0,0|2,0,0]=4 11099 B13R2.13 Ic1cc(ccc1)[C@@H]2CNCC2 Amb24700262 [0,1,0,1,0,0|0,0,0]=2 11100 B13R2.13 Ic1cc(ccc1)[C@H]2CCCN2 Amb24483625 [0,1,0,1,0,0|2,0,0]=4 11101 B13R2.13 Ic1cccc([n]1)C2CNCC2 Amb25313236 [0,1,0,1,0,0|1,0,0]=3 11102 B13R2.13 Ic1cccc(c1)C2CCCN2 Amb2235906 [0,1,0,1,0,0|2,0,0]=4 11103 B13R2.13 Nc1[n]c(cc[n]1)C2CCNC2 Amb18828737 [0,1,0,1,0,0|2,0,0]=4 11104 B13R2.13 Nc1[n]c(cc[n]1)C2CCNC2 Amb21960303 [0,1,0,1,0,0|2,0,0]=4 11105 B13R2.13 Nc1cc([n]cc1)C2CCCC2 Amb20617630 [0,1,0,1,0,0|2,0,0]=4 11106 B13R2.13 Nc1cc(c[n]c1)C2CCCC2 Amb18829594 [0,1,0,1,0,0|2,0,0]=4 11107 B13R2.13 Nc1cc(cc[n]1)C2CSCC2 Amb20617305 [0,1,0,1,0,0|2,0,0]=4 11108 B13R2.13 Nc1cc(ccc1)C2CC=CC2 Amb24399732 [0,1,0,1,0,0|1,0,1]=4 11109 B13R2.13 Nc1cc(ccc1)C2CCC=C2 Amb25858701 [0,1,0,1,0,0|1,0,1]=4 11110 B13R2.13 Nc1cc(ccc1)C2CCCN2 Amb18064042 [0,1,0,1,0,0|2,0,0]=4 11111 B13R2.13 Nc1cc(ccc1)C2CNCC2 Amb22236081 [0,1,0,1,0,0|0,0,0]=2 11112 B13R2.13 Nc1cc(ccc1)C2COCC2 Amb20617103 [0,1,0,1,0,0|1,0,0]=3 11113 B13R2.13 Nc1cc(ccc1)[C@@H]2CNCC2 Amb24667816 [0,1,0,1,0,0|0,0,0]=2 11114 B13R2.13 Nc1cc(ccc1)[C@H]2CNCC2 Amb24428673 [0,1,0,1,0,0|0,0,0]=2 11115 B13R2.13 Nc1cccc(c1)C2CCCC2 Amb17106960 [0,1,0,1,0,0|1,0,0]=3 11116 B13R2.13 Nc1cccc(c1)C2CCCO2 Amb17334585 [0,1,0,1,0,0|2,0,0]=4 11117 B13R2.13 Nc1cccc(n1)C2CCCC2 Amb10599837 [0,1,0,1,0,0|2,0,0]=4 11118 B13R2.13 Nc1cccc(n1)C2CNCC2 Amb10600924 [0,1,0,1,0,0|1,0,0]=3 11119 B13R2.13 Nc1cccc(n1)C2COCC2 Amb10600930 [0,1,0,1,0,0|2,0,0]=4 11120 B13R2.13 Nc1ccnc(n1)C2CNCC2 Amb10600980 [0,1,0,1,0,0|2,0,0]=4 11121 B13R2.13 Nc1nccc(c1)C2CCCC2 Amb10600463 [0,1,0,1,0,0|2,0,0]=4 11122 B13R2.13 Nc1nccc(c1)C2CNCC2 Amb10600928 [0,1,0,1,0,0|1,0,0]=3 11123 B13R2.13 Nc1nccc(c1)C2COCC2 Amb10600934 [0,1,0,1,0,0|2,0,0]=4 11124 B13R2.13 O=C1C=C(C=NN1)C2CCNC2 Amb24538771 [0,1,0,1,0,0|2,0,0]=4 11125 B13R2.13 O=C1C=CC=C(N1)C2CNCC2 Amb18828786 [0,1,0,1,0,0|1,0,0]=3 11126 B13R2.13 Oc1[n]c(cc[n]1)C2CCNC2 Amb18828320 [0,1,0,1,0,0|2,0,0]=4 11127 B13R2.13 Oc1cc([n]cc1)C2CCCC2 Amb20617631 [0,1,0,1,0,0|2,0,0]=4 11128 B13R2.13 Oc1cc(c[n]c1)C2CCCC2 Amb20617719 [0,1,0,1,0,0|2,0,0]=4 11129 B13R2.13 Oc1cc(ccc1)C2CCC=C2 Amb24370125 [0,1,0,1,0,0|1,0,1]=4 11130 B13R2.13 Oc1cc(ccc1)C2CCCC2 Amb20617100 [0,1,0,1,0,0|1,0,0]=3 11131 B13R2.13 Oc1cc(ccc1)C2CCCN2 Amb18062874 [0,1,0,1,0,0|2,0,0]=4 11132 B13R2.13 Oc1cc(ccc1)C2CNCC2 Amb18062857 [0,1,0,1,0,0|0,0,0]=2 11133 B13R2.13 Oc1cc(ccc1)C2COCC2 Amb20617104 [0,1,0,1,0,0|1,0,0]=3 11134 B13R2.13 Oc1cc(ccc1)C=2CNCC2 Amb24485589 [0,1,0,1,0,0|0,0,2]=4 11135 B13R2.13 Oc1cc(ccc1)N2CCCC2 Amb18645880 [0,1,0,1,0,0|2,0,0]=4 11136 B13R2.13 Oc1cc(ccc1)[C@@H]2CCCN2 Amb24446614 [0,1,0,1,0,0|2,0,0]=4 11137 B13R2.13 Oc1cc(ccc1)[C@H]2CNCC2 Amb25278438 [0,1,0,1,0,0|0,0,0]=2 11138 B13R2.13 Oc1cccc(n1)C2CCCC2 Amb10599838 [0,1,0,1,0,0|2,0,0]=4 11139 B13R2.13 Oc1nccc(c1)C2CCCC2 Amb10600464 [0,1,0,1,0,0|2,0,0]=4 11140 B13R2.13 Sc1cc(ccc1)C2CCCN2 Amb24094046 [0,1,0,1,0,0|2,0,0]=4 11141 B13R2.13 Sc1cc(ccc1)[C@@H]2CCCN2 Amb25088883 [0,1,0,1,0,0|2,0,0]=4 11142 B13R2.13 Sc1cc(ccc1)[C@H]2CCCN2 Amb25697091 [0,1,0,1,0,0|2,0,0]=4 11143 B13R2.136 BrCC1CC1c2cc(I)ccc2 Amb25825812 [0,1,0,1,0,0|2,0,0]=4 11144 B13R2.136 Brc1cc(ccc1)C2CC2CBr Amb25039111 [0,1,0,1,0,0|2,0,0]=4 11145 B13R2.136 C=CC1CC1c2cc(O)ccc2 Amb24646652 [0,1,0,1,0,0|1,0,1]=4 11146 B13R2.136 C=C[C@H]1C[C@@H]1c2cc(O)ccc2 Amb24545679 [0,1,0,1,0,0|1,0,1]=4 11147 B13R2.136 CCC1CC1c2cc(O)ccc2 Amb24364118 [0,1,0,1,0,0|1,0,0]=3 11148 B13R2.136 CC[C@H]1C[C@@H]1c2cc(O)ccc2 Amb25294438 [0,1,0,1,0,0|1,0,0]=3 11149 B13R2.136 Cc1cc(ccc1)C2CC2C=O Amb18636292 [0,1,0,1,0,0|2,0,0]=4 11150 B13R2.136 Cc1cc(ccc1)C2CC2CO Amb23442945 [0,1,0,1,0,0|2,0,0]=4 11151 B13R2.136 Cc1cc(ccc1)[C@@H]2C[C@H]2CO Amb24613537 [0,1,0,1,0,0|2,0,0]=4 11152 B13R2.136 Cc1cc(ccc1)[C@H]2C[C@@H]2CN Amb24586343 [0,1,0,1,0,0|2,0,0]=4 11153 B13R2.136 ClCC1CC1c2cc(I)ccc2 Amb24455187 [0,1,0,1,0,0|2,0,0]=4 11154 B13R2.136 Clc1cc(ccc1)C2CC2CBr Amb25092369 [0,1,0,1,0,0|2,0,0]=4 11155 B13R2.136 N#CC1CC1c2cc(F)ccc2 Amb25241743 [0,1,0,1,0,0|2,0,0]=4 11156 B13R2.136 N#CC1CC1c2cc(O)ccc2 Amb25178470 [0,1,0,1,0,0|2,0,0]=4 11157 B13R2.136 N#CC1CC1c2cccc(c2)Br Amb17245308 [0,1,0,1,0,0|2,0,0]=4 11158 B13R2.136 N#CC1CC1c2cccc(c2)C Amb17232208 [0,1,0,1,0,0|2,0,0]=4 11159 B13R2.136 N#CC1CC1c2cccc(c2)Cl Amb17233375 [0,1,0,1,0,0|2,0,0]=4 11160 B13R2.136 NCC1CC1c2cccc(c2)Br Amb17247244 [0,1,0,1,0,0|2,0,0]=4 11161 B13R2.136 NCC1CC1c2cccc(c2)C Amb17232380 [0,1,0,1,0,0|2,0,0]=4 11162 B13R2.136 NCC1CC1c2cccc(c2)Cl Amb17233871 [0,1,0,1,0,0|2,0,0]=4 11163 B13R2.136 NCC1CC1c2cccc(c2)F Amb17568192 [0,1,0,1,0,0|2,0,0]=4 11164 B13R2.136 NCC1CC1c2cccc(c2)O Amb17568189 [0,1,0,1,0,0|2,0,0]=4 11165 B13R2.136 NC[C@H]1C[C@@H]1c2cc(Cl)ccc2 Amb24585791 [0,1,0,1,0,0|2,0,0]=4 11166 B13R2.136 O=CC1CC1c2cc(Br)ccc2 Amb23584401 [0,1,0,1,0,0|2,0,0]=4 11167 B13R2.136 O=CC1CC1c2cc(F)ccc2 Amb18636312 [0,1,0,1,0,0|2,0,0]=4 11168 B13R2.136 OCC1CC1c2cc(Cl)ccc2 Amb23442782 [0,1,0,1,0,0|2,0,0]=4 11169 B13R2.136 OCC1CC1c2cccc(c2)Br Amb17605536 [0,1,0,1,0,0|2,0,0]=4 11170 B13R2.136 OCC1CC1c2cccc(c2)F Amb17605540 [0,1,0,1,0,0|2,0,0]=4 11171 B13R2.136 Oc1cc(ccc1)C2CC2C=O Amb18636311 [0,1,0,1,0,0|2,0,0]=4 11172 B13R2.151 Cc1cc(ccc1)C2CC(=O)C2 Amb20622979 [0,1,0,1,0,0|2,0,0]=4 11173 B13R2.151 Cc1cc(ccc1)C2CC(O)C2 Amb18792428 [0,1,0,1,0,0|2,0,0]=4 11174 B13R2.151 Cc1cc(ccc1)[C@@H]2C[C@@H](N)C2 Amb25681746 [0,1,0,1,0,0|2,0,0]=4 11175 B13R2.151 NC1CC(C1)c2cc(Cl)ccc2 Amb19375309 [0,1,0,1,0,0|2,0,0]=4 11176 B13R2.151 NC1CC(C1)c2cc(F)ccc2 Amb19373571 [0,1,0,1,0,0|2,0,0]=4 11177 B13R2.151 N[C@@H]1C[C@H](C1)c2cc(F)ccc2 Amb24433769 [0,1,0,1,0,0|2,0,0]=4 11178 B13R2.151 O=C1CC(C1)c2cccc(Cl)c2 Amb20622981 [0,1,0,1,0,0|2,0,0]=4 11179 B13R2.151 O=C1CC(C1)c2cccc(F)c2 Amb20622980 [0,1,0,1,0,0|2,0,0]=4 11180 B13R2.151 O=C1CC(C1)c2cccc(c2)Br Amb10976129 [0,1,0,1,0,0|2,0,0]=4 11181 B13R2.151 OC1CC(C1)c2cc(Br)ccc2 Amb24400910 [0,1,0,1,0,0|2,0,0]=4 11182 B13R2.151 OC1CC(C1)c2cc(Cl)ccc2 Amb19057041 [0,1,0,1,0,0|2,0,0]=4 11183 B13R2.151 OC1CC(C1)c2cc(F)ccc2 Amb18792757 [0,1,0,1,0,0|2,0,0]=4 11184 B13R2.162 Brc1ccc2CCCC(Br)c2c1 Amb25288914 [0,1,0,1,0,0|2,0,0]=4 11185 B13R2.162 Brc1ccc2c(c1)C(N)CCC2 Amb2383244 [0,1,0,1,0,0|2,0,0]=4 11186 B13R2.162 Brc1ccc2c(c1)C(N)COC2 Amb10067683 [0,1,0,1,0,0|2,0,0]=4 11187 B13R2.162 Brc1ccc2c(c1)C(O)CCC2 Amb17108428 [0,1,0,1,0,0|2,0,0]=4 11188 B13R2.162 CC1CCCC2=CNC(=O)C=C21 Amb24379552 [0,1,0,1,0,0|2,0,0]=4 11189 B13R2.162 CC1CCCC=2C=CC(=O)NC21 Amb25347396 [0,1,0,1,0,0|2,0,0]=4 11190 B13R2.162 CC1CCCN2C=CC(=O)C=C21 Amb25093735 [0,1,0,1,0,0|2,0,0]=4 11191 B13R2.162 CC1CCNc2ccc(Br)cc21 Amb22500975 [0,1,0,1,0,0|2,0,0]=4 11192 B13R2.162 CC1CCNc2ccc(Br)cc21 Amb22501043 [0,1,0,1,0,0|2,0,0]=4 11193 B13R2.162 CC1CCNc2ccc(F)cc21 Amb18828263 [0,1,0,1,0,0|2,0,0]=4 11194 B13R2.162 CC1CCNc2ccc(N)cc21 Amb25376953 [0,1,0,1,0,0|2,0,0]=4 11195 B13R2.162 CC1CCOc2ccc(N)cc21 Amb24564627 [0,1,0,1,0,0|2,0,0]=4 11196 B13R2.162 CC1CNCc2ccc(Br)cc21 Amb23512641 [0,1,0,1,0,0|0,0,0]=2 11197 B13R2.162 CC1CNCc2ccc(Cl)cc21 Amb18648572 [0,1,0,1,0,0|0,0,0]=2 11198 B13R2.162 CC1CNCc2ccc(F)cc21 Amb25309863 [0,1,0,1,0,0|0,0,0]=2 11199 B13R2.162 CC1NCCc2ccc(Cl)cc21 Amb18278155 [0,1,0,1,0,0|2,0,0]=4 11200 B13R2.162 CC1NCCc2ccc(F)cc21 Amb18278154 [0,1,0,1,0,0|2,0,0]=4 11201 B13R2.162 CC1NCCc2ccc(F)cc21 Amb19374107 [0,1,0,1,0,0|2,0,0]=4 11202 B13R2.162 CC1NCCc2ccc(I)cc21 Amb25677378 [0,1,0,1,0,0|2,0,0]=4 11203 B13R2.162 CC1NCCc2ccc(N)cc21 Amb24729674 [0,1,0,1,0,0|2,0,0]=4 11204 B13R2.162 CC1NCCc2ccc(O)cc21 Amb18063208 [0,1,0,1,0,0|2,0,0]=4 11205 B13R2.162 CC1NCCc2ccc(O)cc21 Amb20668206 [0,1,0,1,0,0|2,0,0]=4 11206 B13R2.162 CN1CCCc2ccc(Br)cc12 Amb23586166 [0,1,0,1,0,0|2,0,0]=4 11207 B13R2.162 CN1CCCc2ccc(N)cc12 Amb22284277 [0,1,0,1,0,0|2,0,0]=4 11208 B13R2.162 CN1CCCc2ccc(O)cc12 Amb18054646 [0,1,0,1,0,0|2,0,0]=4 11209 B13R2.162 C[C@@H]1NCCc2ccc(I)cc21 Amb25353563 [0,1,0,1,0,0|2,0,0]=4 11210 B13R2.162 C[C@H]1NCCc2ccc(Br)cc21 Amb24659592 [0,1,0,1,0,0|2,0,0]=4 11211 B13R2.162 C[C@H]1NCCc2ccc(F)cc21 Amb25156693 [0,1,0,1,0,0|2,0,0]=4 11212 B13R2.162 C[C@H]1NCCc2ccc(I)cc21 Amb24462980 [0,1,0,1,0,0|2,0,0]=4 11213 B13R2.162 C[C@H]1NCCc2ccc(N)cc21 Amb25126764 [0,1,0,1,0,0|2,0,0]=4 11214 B13R2.162 C[C@H]1NCCc2ccc(O)cc21 Amb24659593 [0,1,0,1,0,0|2,0,0]=4 11215 B13R2.162 Cc1c[n]c2CCCC(C)c2c1 Amb24429863 [0,1,0,1,0,0|2,0,0]=4 11216 B13R2.162 Cc1c[n]c2CNCC(O)c2c1 Amb18828800 [0,1,0,1,0,0|2,0,0]=4 11217 B13R2.162 Cc1ccc2CCCC(F)c2c1 Amb24627976 [0,1,0,1,0,0|2,0,0]=4 11218 B13R2.162 Cc1ccc2CCCC(N)c2c1 Amb23440395 [0,1,0,1,0,0|2,0,0]=4 11219 B13R2.162 Cc1ccc2CCC[C@@H](O)c2c1 Amb24738415 [0,1,0,1,0,0|2,0,0]=4 11220 B13R2.162 Cc1ccc2CCN[C@@H](C)c2c1 Amb24732471 [0,1,0,1,0,0|2,0,0]=4 11221 B13R2.162 Cc1ccc2CNCC(N)c2c1 Amb25364616 [0,1,0,1,0,0|1,0,0]=3 11222 B13R2.162 Cc1ccc2COC[C@H](N)c2c1 Amb24372412 [0,1,0,1,0,0|2,0,0]=4 11223 B13R2.162 Cc1ccc2CSCC(O)c2c1 Amb24428537 [0,1,0,1,0,0|2,0,0]=4 11224 B13R2.162 Cc1ccc2CSC[C@@H](N)c2c1 Amb25790910 [0,1,0,1,0,0|2,0,0]=4 11225 B13R2.162 Cc1ccc2CSC[C@@H](O)c2c1 Amb24751404 [0,1,0,1,0,0|2,0,0]=4 11226 B13R2.162 Cc1ccc2CSC[C@H](O)c2c1 Amb25817075 [0,1,0,1,0,0|2,0,0]=4 11227 B13R2.162 Cc1ccc2c(c1)C(=O)CNC2 Amb17194297 [0,1,0,1,0,0|1,0,1]=4 11228 B13R2.162 Cc1ccc2c(c1)C(Cl)CCC2 Amb17087943 [0,1,0,1,0,0|2,0,0]=4 11229 B13R2.162 Cc1ccc2c(c1)C(N)CCC2 Amb17088094 [0,1,0,1,0,0|2,0,0]=4 11230 B13R2.162 Cc1ccc2c(c1)C(O)CCC2 Amb17087893 [0,1,0,1,0,0|2,0,0]=4 11231 B13R2.162 Cc1ccc2c(c1)C(O)CNC2 Amb17194238 [0,1,0,1,0,0|1,0,0]=3 11232 B13R2.162 ClC1CCCc2ccc(Br)cc21 Amb22059139 [0,1,0,1,0,0|2,0,0]=4 11233 B13R2.162 ClC1CNNc2ccc(Br)cc21 Amb24554773 [0,1,0,1,0,0|2,0,0]=4 11234 B13R2.162 Clc1ccc2c(c1)C(=O)CNC2 Amb17194299 [0,1,0,1,0,0|1,0,1]=4 11235 B13R2.162 Clc1ccc2c(c1)C(Cl)CCC2 Amb17087945 [0,1,0,1,0,0|2,0,0]=4 11236 B13R2.162 Clc1ccc2c(c1)C(N)CCC2 Amb2383242 [0,1,0,1,0,0|2,0,0]=4 11237 B13R2.162 Clc1ccc2c(c1)C(O)CCC2 Amb17087895 [0,1,0,1,0,0|2,0,0]=4 11238 B13R2.162 Clc1ccc2c(c1)C(O)CNC2 Amb17194240 [0,1,0,1,0,0|1,0,0]=3 11239 B13R2.162 Fc1ccc2CCCC(Br)c2c1 Amb24434798 [0,1,0,1,0,0|2,0,0]=4 11240 B13R2.162 Fc1ccc2CCCC(F)c2c1 Amb24511313 [0,1,0,1,0,0|2,0,0]=4 11241 B13R2.162 Fc1ccc2c(c1)C(=O)CNC2 Amb17194298 [0,1,0,1,0,0|1,0,1]=4 11242 B13R2.162 Fc1ccc2c(c1)C(Cl)CCC2 Amb17087944 [0,1,0,1,0,0|2,0,0]=4 11243 B13R2.162 Fc1ccc2c(c1)C(N)CCC2 Amb2383243 [0,1,0,1,0,0|2,0,0]=4 11244 B13R2.162 Fc1ccc2c(c1)C(O)CCC2 Amb17087894 [0,1,0,1,0,0|2,0,0]=4 11245 B13R2.162 Fc1ccc2c(c1)C(O)CNC2 Amb17194239 [0,1,0,1,0,0|1,0,0]=3 11246 B13R2.162 NC1CCCc2ccc(Br)cc21 Amb22304698 [0,1,0,1,0,0|2,0,0]=4 11247 B13R2.162 NC1CCCc2ccc(Cl)cc21 Amb22586284 [0,1,0,1,0,0|2,0,0]=4 11248 B13R2.162 NC1CCCc2ccc(F)cc21 Amb22586300 [0,1,0,1,0,0|2,0,0]=4 11249 B13R2.162 NC1CCCc2ccc(O)cc21 Amb18645877 [0,1,0,1,0,0|2,0,0]=4 11250 B13R2.162 NC1COCc2ccc(Br)cc21 Amb19958190 [0,1,0,1,0,0|2,0,0]=4 11251 B13R2.162 NC1CSCc2ccc(Br)cc21 Amb19958493 [0,1,0,1,0,0|2,0,0]=4 11252 B13R2.162 NC1CSCc2ccc(Br)cc21 Amb24452958 [0,1,0,1,0,0|2,0,0]=4 11253 B13R2.162 NC1CSCc2ccc(Cl)cc21 Amb24452957 [0,1,0,1,0,0|2,0,0]=4 11254 B13R2.162 NC1CSCc2ccc(F)cc21 Amb25062650 [0,1,0,1,0,0|2,0,0]=4 11255 B13R2.162 N[C@@H]1CCCc2ccc(Br)cc21 Amb24475493 [0,1,0,1,0,0|2,0,0]=4 11256 B13R2.162 N[C@@H]1CCCc2ccc(Cl)cc21 Amb25084579 [0,1,0,1,0,0|2,0,0]=4 11257 B13R2.162 N[C@@H]1CCCc2ccc(O)cc21 Amb25148604 [0,1,0,1,0,0|2,0,0]=4 11258 B13R2.162 N[C@@H]1COCc2ccc(Br)cc21 Amb24394443 [0,1,0,1,0,0|2,0,0]=4 11259 B13R2.162 N[C@@H]1COCc2ccc(O)cc21 Amb25081976 [0,1,0,1,0,0|2,0,0]=4 11260 B13R2.162 N[C@@H]1CSCc2ccc(Cl)cc21 Amb25842950 [0,1,0,1,0,0|2,0,0]=4 11261 B13R2.162 N[C@@H]1CSCc2ccc(F)cc21 Amb25327048 [0,1,0,1,0,0|2,0,0]=4 11262 B13R2.162 N[C@H]1CCCc2ccc(I)cc21 Amb25771607 [0,1,0,1,0,0|2,0,0]=4 11263 B13R2.162 N[C@H]1COCc2ccc(Br)cc21 Amb25726350 [0,1,0,1,0,0|2,0,0]=4 11264 B13R2.162 N[C@H]1COCc2ccc(F)cc21 Amb24392847 [0,1,0,1,0,0|2,0,0]=4 11265 B13R2.162 Nc1ccc2CCCC(N)c2c1 Amb25363283 [0,1,0,1,0,0|2,0,0]=4 11266 B13R2.162 Nc1ccc2COC[C@@H](N)c2c1 Amb24446446 [0,1,0,1,0,0|2,0,0]=4 11267 B13R2.162 Nc1ccc2COC[C@H](N)c2c1 Amb24742898 [0,1,0,1,0,0|2,0,0]=4 11268 B13R2.162 Nc1ccc2c(c1)C(O)CCC2 Amb10601400 [0,1,0,1,0,0|2,0,0]=4 11269 B13R2.162 Nc1ccc2c(c1)N(C)CCC2 Amb10603894 [0,1,0,1,0,0|2,0,0]=4 11270 B13R2.162 OC1CCCc2ccc(I)cc21 Amb24672665 [0,1,0,1,0,0|2,0,0]=4 11271 B13R2.162 OC1COCc2ccc(Br)cc21 Amb22490511 [0,1,0,1,0,0|2,0,0]=4 11272 B13R2.162 OC1CSCc2ccc(F)cc21 Amb25156640 [0,1,0,1,0,0|2,0,0]=4 11273 B13R2.162 O[C@@H]1CCCc2ccc(Br)cc21 Amb24676980 [0,1,0,1,0,0|2,0,0]=4 11274 B13R2.162 O[C@@H]1CCCc2ccc(I)cc21 Amb25851381 [0,1,0,1,0,0|2,0,0]=4 11275 B13R2.162 O[C@H]1CCCc2ccc(Br)cc21 Amb25215981 [0,1,0,1,0,0|2,0,0]=4 11276 B13R2.162 O[C@H]1CSCc2ccc(Br)cc21 Amb24354778 [0,1,0,1,0,0|2,0,0]=4 11277 B13R2.162 O[C@H]1CSCc2ccc(Cl)cc21 Amb25156580 [0,1,0,1,0,0|2,0,0]=4 11278 B13R2.162 O[C@H]1CSCc2ccc(F)cc21 Amb25261962 [0,1,0,1,0,0|2,0,0]=4 11279 B13R2.162 Oc1ccc2CCCC(O)c2c1 Amb18646047 [0,1,0,1,0,0|2,0,0]=4 11280 B13R2.162 Oc1ccc2CCC[C@@H](O)c2c1 Amb25159777 [0,1,0,1,0,0|2,0,0]=4 11281 B13R2.162 Oc1ccc2c(c1)C(O)CNC2 Amb17194252 [0,1,0,1,0,0|1,0,0]=3 11282 B13R2.162 Oc1ccc2c(c1)C(O)CNC2 Amb17620484 [0,1,0,1,0,0|1,0,0]=3 11283 B13R2.318 Clc1cccc2C(CCBr)Cc21 Amb25793085 [0,1,0,1,0,0|2,0,0]=4 11284 B13R2.318 Oc1cccc2C(Cc12)CCO Amb25298461 [0,1,0,1,0,0|2,0,0]=4 11285 B13R2.342 CC1CCCc2c(O)cccc21 Amb24721746 [0,1,0,1,0,0|1,0,0]=3 11286 B13R2.342 CC1CCNc2c(Br)cccc21 Amb24423447 [0,1,0,1,0,0|2,0,0]=4 11287 B13R2.342 CC1CCNc2c(Cl)cccc21 Amb24455755 [0,1,0,1,0,0|2,0,0]=4 11288 B13R2.342 CC1CCNc2c(F)cccc21 Amb25699202 [0,1,0,1,0,0|2,0,0]=4 11289 B13R2.342 CC1CCNc2c(I)cccc21 Amb25140759 [0,1,0,1,0,0|2,0,0]=4 11290 B13R2.342 CC1CNCc2c(Cl)cccc21 Amb18648573 [0,1,0,1,0,0|0,0,0]=2 11291 B13R2.342 CC1CNCc2c(F)cccc21 Amb24531591 [0,1,0,1,0,0|0,0,0]=2 11292 B13R2.342 CC1CNCc2c(O)cccc21 Amb24654225 [0,1,0,1,0,0|0,0,0]=2 11293 B13R2.342 CC1NCCc2c(Br)cccc21 Amb22059236 [0,1,0,1,0,0|2,0,0]=4 11294 B13R2.342 CC1NCCc2c(Cl)cccc21 Amb18278153 [0,1,0,1,0,0|2,0,0]=4 11295 B13R2.342 CC1NCCc2c(F)cccc21 Amb18943934 [0,1,0,1,0,0|2,0,0]=4 11296 B13R2.342 CC1NCCc2c(I)cccc21 Amb25087199 [0,1,0,1,0,0|2,0,0]=4 11297 B13R2.342 CC1NCCc2c(O)cccc21 Amb24546272 [0,1,0,1,0,0|2,0,0]=4 11298 B13R2.342 CN1CCCc2c(Br)cccc12 Amb23586165 [0,1,0,1,0,0|2,0,0]=4 11299 B13R2.342 CN1CCCc2c(F)cccc12 Amb25284004 [0,1,0,1,0,0|2,0,0]=4 11300 B13R2.342 CN1CCCc2c(N)cccc12 Amb18943759 [0,1,0,1,0,0|2,0,0]=4 11301 B13R2.342 CN1CCCc2c1cccc2N Amb11172559 [0,1,0,1,0,0|2,0,0]=4 11302 B13R2.342 CN1CCCc2c1cccc2O Amb11032489 [0,1,0,1,0,0|2,0,0]=4 11303 B13R2.342 C[C@@H]1NCCc2c(Cl)cccc21 Amb24455575 [0,1,0,1,0,0|2,0,0]=4 11304 B13R2.342 C[C@@H]1NCCc2c(F)cccc21 Amb25156675 [0,1,0,1,0,0|2,0,0]=4 11305 B13R2.342 C[C@@H]1NCCc2c(I)cccc21 Amb25718451 [0,1,0,1,0,0|2,0,0]=4 11306 B13R2.342 C[C@@H]1NCCc2c(N)cccc21 Amb25676341 [0,1,0,1,0,0|2,0,0]=4 11307 B13R2.342 C[C@H]1NCCc2c(F)cccc21 Amb24395222 [0,1,0,1,0,0|2,0,0]=4 11308 B13R2.342 C[C@H]1NCCc2c(N)cccc21 Amb25156546 [0,1,0,1,0,0|2,0,0]=4 11309 B13R2.342 Cc1cccc2C(=O)CNCc21 Amb24511581 [0,1,0,1,0,0|1,0,1]=4 11310 B13R2.342 Cc1cccc2C(C)CCCc12 Amb22347908 [0,1,0,1,0,0|1,0,0]=3 11311 B13R2.342 Cc1cccc2C(F)CNCc21 Amb24536110 [0,1,0,1,0,0|1,0,0]=3 11312 B13R2.342 Cc1cccc2C(O)CSCc21 Amb24428826 [0,1,0,1,0,0|2,0,0]=4 11313 B13R2.342 Cc1cccc2[C@@H](N)CCCc21 Amb25132142 [0,1,0,1,0,0|2,0,0]=4 11314 B13R2.342 Cc1cccc2[C@@H](N)COCc21 Amb25770655 [0,1,0,1,0,0|2,0,0]=4 11315 B13R2.342 Cc1cccc2[C@@H](N)CSCc21 Amb24669839 [0,1,0,1,0,0|2,0,0]=4 11316 B13R2.342 Cc1cccc2[C@@H](O)CSCc21 Amb25817076 [0,1,0,1,0,0|2,0,0]=4 11317 B13R2.342 Cc1cccc2[C@H](N)COCc21 Amb24572560 [0,1,0,1,0,0|2,0,0]=4 11318 B13R2.342 Cc1cccc2[C@H](O)CSCc21 Amb25817077 [0,1,0,1,0,0|2,0,0]=4 11319 B13R2.342 Fc1cccc2C(F)CNCc12 Amb25247058 [0,1,0,1,0,0|1,0,0]=3 11320 B13R2.342 NC1CCCc2c(Br)cccc21 Amb23440365 [0,1,0,1,0,0|2,0,0]=4 11321 B13R2.342 NC1CCCc2c(Cl)cccc21 Amb22586195 [0,1,0,1,0,0|2,0,0]=4 11322 B13R2.342 NC1CCCc2c(F)cccc21 Amb22002615 [0,1,0,1,0,0|2,0,0]=4 11323 B13R2.342 NC1CCCc2c(I)cccc21 Amb24369344 [0,1,0,1,0,0|2,0,0]=4 11324 B13R2.342 NC1CCCc2c(O)cccc21 Amb18645876 [0,1,0,1,0,0|2,0,0]=4 11325 B13R2.342 NC1CCCc2c1cccc2Cl Amb2383247 [0,1,0,1,0,0|2,0,0]=4 11326 B13R2.342 NC1CCCc2c1cccc2F Amb2383248 [0,1,0,1,0,0|2,0,0]=4 11327 B13R2.342 NC1CNCc2c(F)cccc21 Amb24511795 [0,1,0,1,0,0|1,0,0]=3 11328 B13R2.342 NC1COCc2c(Br)cccc21 Amb24460406 [0,1,0,1,0,0|2,0,0]=4 11329 B13R2.342 NC1COCc2c(F)cccc21 Amb20621264 [0,1,0,1,0,0|2,0,0]=4 11330 B13R2.342 NC1COCc2c(O)cccc21 Amb24452662 [0,1,0,1,0,0|2,0,0]=4 11331 B13R2.342 NC1CSCc2c(Cl)cccc21 Amb25156641 [0,1,0,1,0,0|2,0,0]=4 11332 B13R2.342 N[C@@H]1CCCc2c(Br)cccc21 Amb23440366 [0,1,0,1,0,0|2,0,0]=4 11333 B13R2.342 N[C@@H]1CCCc2c(F)cccc21 Amb23440378 [0,1,0,1,0,0|2,0,0]=4 11334 B13R2.342 N[C@@H]1CCCc2c(F)cccc21 Amb25698316 [0,1,0,1,0,0|2,0,0]=4 11335 B13R2.342 N[C@@H]1CCCc2c(I)cccc21 Amb25733008 [0,1,0,1,0,0|2,0,0]=4 11336 B13R2.342 N[C@@H]1CCCc2c1cccc2O Amb13953016 [0,1,0,1,0,0|2,0,0]=4 11337 B13R2.342 N[C@@H]1COCc2c(Br)cccc21 Amb25313250 [0,1,0,1,0,0|2,0,0]=4 11338 B13R2.342 N[C@@H]1CSCc2c(Cl)cccc21 Amb24459990 [0,1,0,1,0,0|2,0,0]=4 11339 B13R2.342 N[C@H]1CCCc2c(Br)cccc21 Amb25034693 [0,1,0,1,0,0|2,0,0]=4 11340 B13R2.342 N[C@H]1CCCc2c(I)cccc21 Amb24638944 [0,1,0,1,0,0|2,0,0]=4 11341 B13R2.342 N[C@H]1CCCc2c1cccc2O Amb13953017 [0,1,0,1,0,0|2,0,0]=4 11342 B13R2.342 N[C@H]1COCc2c(I)cccc21 Amb25117354 [0,1,0,1,0,0|2,0,0]=4 11343 B13R2.342 N[C@H]1COCc2c(O)cccc21 Amb25834597 [0,1,0,1,0,0|2,0,0]=4 11344 B13R2.342 N[C@H]1CSCc2c(Br)cccc21 Amb24426445 [0,1,0,1,0,0|2,0,0]=4 11345 B13R2.342 N[C@H]1CSCc2c(Cl)cccc21 Amb24654456 [0,1,0,1,0,0|2,0,0]=4 11346 B13R2.342 N[C@H]1CSCc2c(F)cccc21 Amb24376327 [0,1,0,1,0,0|2,0,0]=4 11347 B13R2.342 Nc1cccc2C(F)CCCc21 Amb25225960 [0,1,0,1,0,0|2,0,0]=4 11348 B13R2.342 Nc1cccc2C(O)CCCc21 Amb25707809 [0,1,0,1,0,0|2,0,0]=4 11349 B13R2.342 Nc1cccc2[C@@H](N)CCCc12 Amb25736281 [0,1,0,1,0,0|2,0,0]=4 11350 B13R2.342 O=C1CNCc2c(F)cccc21 Amb24638444 [0,1,0,1,0,0|1,0,1]=4 11351 B13R2.342 OC1CCCc2c(Br)cccc21 Amb22500943 [0,1,0,1,0,0|2,0,0]=4 11352 B13R2.342 OC1CCCc2c(Cl)cccc21 Amb25129474 [0,1,0,1,0,0|2,0,0]=4 11353 B13R2.342 OC1CCCc2c(F)cccc21 Amb25719778 [0,1,0,1,0,0|2,0,0]=4 11354 B13R2.342 OC1CNCc2c1cccc2O Amb17620485 [0,1,0,1,0,0|1,0,0]=3 11355 B13R2.342 OC1CSCc2c(Cl)cccc21 Amb25679722 [0,1,0,1,0,0|2,0,0]=4 11356 B13R2.342 OC1CSCc2c(F)cccc21 Amb24669840 [0,1,0,1,0,0|2,0,0]=4 11357 B13R2.342 O[C@@H]1CCCc2c(Br)cccc21 Amb25801860 [0,1,0,1,0,0|2,0,0]=4 11358 B13R2.342 O[C@@H]1CCCc2c1cccc2O Amb13953013 [0,1,0,1,0,0|2,0,0]=4 11359 B13R2.342 O[C@@H]1CSCc2c(Br)cccc21 Amb24617413 [0,1,0,1,0,0|2,0,0]=4 11360 B13R2.342 O[C@@H]1CSCc2c(Cl)cccc21 Amb25106405 [0,1,0,1,0,0|2,0,0]=4 11361 B13R2.342 O[C@H]1CCCc2c(Br)cccc21 Amb25848497 [0,1,0,1,0,0|2,0,0]=4 11362 B13R2.342 O[C@H]1CCCc2c(F)cccc21 Amb24692631 [0,1,0,1,0,0|2,0,0]=4 11363 B13R2.342 O[C@H]1CCCc2c1cccc2O Amb13953015 [0,1,0,1,0,0|2,0,0]=4 11364 B13R2.342 Oc1cccc2C(=O)CNCc21 Amb25224095 [0,1,0,1,0,0|1,0,1]=4 11365 B13R2.342 Oc1cccc2C(F)CNCc21 Amb24578652 [0,1,0,1,0,0|1,0,0]=3 11366 B13R2.3018 Brc1cccc(c1)C2(C)CCO2 Amb10975946 [0,1,0,1,0,0|2,0,0]=4 11367 B13R2.3018 CC1(CCC1)c2cccc(F)c2 Amb25202327 [0,1,0,1,0,0|1,0,0]=3 11368 B13R2.3018 CC1(CCC1)c2cccc(I)c2 Amb25249495 [0,1,0,1,0,0|1,0,0]=3 11369 B13R2.3018 CC1(CCN1)c2cccc(Br)c2 Amb25137943 [0,1,0,1,0,0|2,0,0]=4 11370 B13R2.3018 CC1(CNC1)c2cccc(Br)c2 Amb18571246 [0,1,0,1,0,0|0,0,0]=2 11371 B13R2.3018 CC1(CNC1)c2cccc(Cl)c2 Amb18564192 [0,1,0,1,0,0|0,0,0]=2 11372 B13R2.3018 CC1(COC1)c2cccc(Br)c2 Amb22737357 [0,1,0,1,0,0|1,0,0]=3 11373 B13R2.3018 Cc1cc(c[n]c1)C2(O)CNC2 Amb25094978 [0,1,0,1,0,0|2,0,0]=4 11374 B13R2.3018 Cc1cc(ccc1)C2(N)COC2 Amb19892687 [0,1,0,1,0,0|2,0,0]=4 11375 B13R2.3018 Cc1cc(ccc1)C2(N)COC2 Amb22737341 [0,1,0,1,0,0|2,0,0]=4 11376 B13R2.3018 Cc1cc(ccc1)C2(O)CSC2 Amb24760660 [0,1,0,1,0,0|2,0,0]=4 11377 B13R2.3018 Cc1cccc(c1)C2(C)CCN2 Amb25856276 [0,1,0,1,0,0|2,0,0]=4 11378 B13R2.3018 Cc1cccc(c1)C2(C)CNC2 Amb18563526 [0,1,0,1,0,0|0,0,0]=2 11379 B13R2.3018 Clc1cccc(c1)C2(N)CCC2 Amb1052366 [0,1,0,1,0,0|2,0,0]=4 11380 B13R2.3018 FC1(CNC1)c2cccc(Cl)c2 Amb24459972 [0,1,0,1,0,0|1,0,0]=3 11381 B13R2.3018 Fc1c[n]cc(c1)C2(F)CNC2 Amb25034896 [0,1,0,1,0,0|2,0,0]=4 11382 B13R2.3018 Fc1cccc(c1)C2(F)CNC2 Amb24428818 [0,1,0,1,0,0|1,0,0]=3 11383 B13R2.3018 NC1(CCC1)c2cccc(Br)c2 Amb19892649 [0,1,0,1,0,0|2,0,0]=4 11384 B13R2.3018 NC1(CCC1)c2cccc(Cl)c2 Amb19892642 [0,1,0,1,0,0|2,0,0]=4 11385 B13R2.3018 NC1(CCC1)c2cccc(F)c2 Amb19892177 [0,1,0,1,0,0|2,0,0]=4 11386 B13R2.3018 NC1(COC1)c2cccc(Br)c2 Amb19892681 [0,1,0,1,0,0|2,0,0]=4 11387 B13R2.3018 NC1(COC1)c2cccc(Br)c2 Amb23440109 [0,1,0,1,0,0|2,0,0]=4 11388 B13R2.3018 NC1(COC1)c2cccc(Cl)c2 Amb19892678 [0,1,0,1,0,0|2,0,0]=4 11389 B13R2.3018 NC1(COC1)c2cccc(F)c2 Amb19892675 [0,1,0,1,0,0|2,0,0]=4 11390 B13R2.3018 NC1(COC1)c2cccc(F)c2 Amb22738799 [0,1,0,1,0,0|2,0,0]=4 11391 B13R2.3018 NC1(COC1)c2cccc(I)c2 Amb24183979 [0,1,0,1,0,0|2,0,0]=4 11392 B13R2.3018 NC1(COC1)c2cccc(I)c2 Amb25714723 [0,1,0,1,0,0|2,0,0]=4 11393 B13R2.3018 Nc1cc(ccc1)C2(O)COC2 Amb24460301 [0,1,0,1,0,0|2,0,0]=4 11394 B13R2.3018 OC1(CNC1)c2c[n]cc(Br)c2 Amb23455506 [0,1,0,1,0,0|2,0,0]=4 11395 B13R2.3018 OC1(CNC1)c2c[n]cc(F)c2 Amb24684257 [0,1,0,1,0,0|2,0,0]=4 11396 B13R2.3018 OC1(CNC1)c2cccc(Br)c2 Amb24493059 [0,1,0,1,0,0|1,0,0]=3 11397 B13R2.3018 OC1(CNC1)c2cccc(Cl)c2 Amb24455953 [0,1,0,1,0,0|1,0,0]=3 11398 B13R2.3018 OC1(COC1)c2cccc(Br)c2 Amb22386873 [0,1,0,1,0,0|2,0,0]=4 11399 B13R2.3018 Oc1cc(ccc1)C2(F)CCC2 Amb24610686 [0,1,0,1,0,0|2,0,0]=4 11400 B13R2.3018 Oc1cccc(c1)C2(O)COC2 Amb22386870 [0,1,0,1,0,0|2,0,0]=4 11401 B13R2.3019 CC1(CC1N)c2cccc(Br)c2 Amb18948984 [0,1,0,1,0,0|2,0,0]=4 11402 B13R2.3019 CC1(CC1N)c2cccc(Cl)c2 Amb18947390 [0,1,0,1,0,0|2,0,0]=4 11403 B13R2.3019 CC1(CC1N)c2cccc(F)c2 Amb18947393 [0,1,0,1,0,0|2,0,0]=4 11404 B13R2.3019 CC1CC1(N)c2cccc(Br)c2 Amb25729607 [0,1,0,1,0,0|2,0,0]=4 11405 B13R2.3019 CC1CC1(O)c2cccc(Cl)c2 Amb25043270 [0,1,0,1,0,0|2,0,0]=4 11406 B13R2.3019 Cc1cccc(c1)C2(C)CC2N Amb18280080 [0,1,0,1,0,0|2,0,0]=4 11407 B13R2.3019 Cc1cccc(c1)C2(N)CC2C Amb25729608 [0,1,0,1,0,0|2,0,0]=4 11408 B13R2.3019 Cc1cccc(c1)C2(O)CC2C Amb25235438 [0,1,0,1,0,0|2,0,0]=4 11409 B13R2.4857 Brc1cccc2c1c(C)nn2C Amb10070865 [0,1,0,1,0,0|1,0,1]=4 11410 B13R2.4857 Brc1cccc2c1n(C)nc2C Amb10070875 [0,1,0,1,0,0|1,0,1]=4 11411 B13R2.4857 CC1CC(=O)c2c(O)cccc21 Amb18645633 [0,1,0,1,0,0|2,0,0]=4 11412 B13R2.4857 CC1CC(Br)c2cccc(F)c21 Amb24748843 [0,1,0,1,0,0|2,0,0]=4 11413 B13R2.4857 CC1CC(C)c2cccc(N)c21 Amb25375271 [0,1,0,1,0,0|1,0,0]=3 11414 B13R2.4857 CC1OC(C)c2cccc(N)c21 Amb25148769 [0,1,0,1,0,0|2,0,0]=4 11415 B13R2.4857 CN1CC(=O)c2cccc(Br)c12 Amb18160222 [0,1,0,1,0,0|1,0,1]=4 11416 B13R2.4857 CN1CC(=O)c2cccc(N)c12 Amb18829719 [0,1,0,1,0,0|1,0,1]=4 11417 B13R2.4857 Cc1[n][n](C)c2c1cccc2N Amb25325275 [0,1,0,1,0,0|1,0,1]=4 11418 B13R2.4857 Cc1[n][n](C)c2c1cccc2O Amb25292929 [0,1,0,1,0,0|1,0,1]=4 11419 B13R2.4857 Cc1[n][n](C)c2cccc(F)c12 Amb25226776 [0,1,0,1,0,0|1,0,1]=4 11420 B13R2.4857 Cc1[n][n](C)c2cccc(O)c12 Amb25674461 [0,1,0,1,0,0|1,0,1]=4 11421 B13R2.4857 Cc1c[n](C)c2c1cccc2Br Amb18896740 [0,1,0,1,0,0|0,0,2]=4 11422 B13R2.4857 Cc1c[n](C)c2c1cccc2Cl Amb18893639 [0,1,0,1,0,0|0,0,2]=4 11423 B13R2.4857 Cc1c[n](C)c2c1cccc2F Amb18893476 [0,1,0,1,0,0|0,0,2]=4 11424 B13R2.4857 Cc1c[n](C)c2c1cccc2N Amb25238891 [0,1,0,1,0,0|0,0,2]=4 11425 B13R2.4857 Cc1c[n](C)c2cccc(Br)c12 Amb24380689 [0,1,0,1,0,0|0,0,2]=4 11426 B13R2.4857 Cc1c[n](C)c2cccc(N)c12 Amb25238895 [0,1,0,1,0,0|0,0,2]=4 11427 B13R2.4857 Cc1cccc2C(Br)CC(C)c12 Amb25058121 [0,1,0,1,0,0|2,0,0]=4 11428 B13R2.4857 Cc1cccc2C(C)CC(=O)c12 Amb24646446 [0,1,0,1,0,0|2,0,0]=4 11429 B13R2.4857 Cc1cccc2C(Cl)CC(C)c12 Amb25680950 [0,1,0,1,0,0|2,0,0]=4 11430 B13R2.4857 Cc1cccc2C(N)CN(C)c12 Amb25762848 [0,1,0,1,0,0|1,0,0]=3 11431 B13R2.4857 Cc1cccc2C(O)CC(C)c12 Amb22059331 [0,1,0,1,0,0|2,0,0]=4 11432 B13R2.4857 Cc1cccc2[C@@H](C)CC(=O)c12 Amb24570365 [0,1,0,1,0,0|2,0,0]=4 11433 B13R2.4857 Cc1cccc2c1[n](C)cc2C Amb18893428 [0,1,0,1,0,0|0,0,2]=4 11434 B13R2.5324 Cc1cc(ccc1)C(O)C2CO2 Amb25077952 [0,1,0,1,0,0|2,0,0]=4 11435 B13R2.5324 Cc1cc(ccc1)[C@@H](N)C2CC2 Amb24761522 [0,1,0,1,0,0|2,0,0]=4 11436 B13R2.5324 Cc1cc(ccc1)[C@H](N)C2CC2 Amb24618170 [0,1,0,1,0,0|2,0,0]=4 11437 B13R2.5324 Cc1cccc(c1)C(C2CC2)O Amb17232417 [0,1,0,1,0,0|2,0,0]=4 11438 B13R2.5324 Clc1cccc(c1)C(C2CC2)O Amb17233966 [0,1,0,1,0,0|2,0,0]=4 11439 B13R2.5324 Fc1cccc(c1)C(C2CC2)O Amb17232582 [0,1,0,1,0,0|2,0,0]=4 11440 B13R2.5324 N[C@@H](C1CC1)c2cccc(Br)c2 Amb25148789 [0,1,0,1,0,0|2,0,0]=4 11441 B13R2.5324 N[C@@H](C1CC1)c2cccc(F)c2 Amb25809463 [0,1,0,1,0,0|2,0,0]=4 11442 B13R2.5324 N[C@@H](C1CC1)c2cccc(I)c2 Amb24376217 [0,1,0,1,0,0|2,0,0]=4 11443 B13R2.5324 N[C@@H](C1CC1)c2cccc(O)c2 Amb25680157 [0,1,0,1,0,0|2,0,0]=4 11444 B13R2.5324 N[C@@H](C1CC1)c2cccc(S)c2 Amb25336300 [0,1,0,1,0,0|2,0,0]=4 11445 B13R2.5324 N[C@H](C1CC1)c2cccc(F)c2 Amb24068844 [0,1,0,1,0,0|2,0,0]=4 11446 B13R2.5324 N[C@H](C1CC1)c2cccc(S)c2 Amb25806194 [0,1,0,1,0,0|2,0,0]=4 11447 B13R2.5324 Nc1cc(ccc1)C(O)C2CC2 Amb24391425 [0,1,0,1,0,0|2,0,0]=4 11448 B13R2.5324 OC(C1CC1)c2cccc(Br)c2 Amb24719965 [0,1,0,1,0,0|2,0,0]=4 11449 B13R2.5324 OC(C1CO1)c2cccc(F)c2 Amb25806758 [0,1,0,1,0,0|2,0,0]=4 11450 B13R2.5324 O[C@@H]([C@@H]1CO1)c2cccc(Cl)c2 Amb25346418 [0,1,0,1,0,0|2,0,0]=4 11451 B13R2.5324 O[C@H](C1CC1)c2cccc(Cl)c2 Amb25704982 [0,1,0,1,0,0|2,0,0]=4 11452 B13R2.5324 O[C@H](C1CC1)c2cccc(F)c2 Amb24555671 [0,1,0,1,0,0|2,0,0]=4 11453 B13R2.5324 Oc1cccc(c1)C(O)C2CC2 Amb25802911 [0,1,0,1,0,0|2,0,0]=4 11454 B13R2.52 CCN1CC(C1)c2ccccc2 Amb24407305 [0,1,0,1,0,0|0,0,0]=2 11455 B13R2.52 CNC1CC(C1)c2c[n]cc[n]2 Amb24379361 [0,1,0,1,0,0|2,0,0]=4 11456 B13R2.52 CNC1CC(C1)c2c[n]ccc2 Amb25064394 [0,1,0,1,0,0|1,0,0]=3 11457 B13R2.52 NCC1CC(C1)c2ccc[n]c2 Amb24644040 [0,1,0,1,0,0|2,0,0]=4 11458 B13R2.52 NCC1CC(C1)c2ccccc2 Amb24537646 [0,1,0,1,0,0|1,0,0]=3 11459 B13R2.52 O=CC1CC(C1)c2ccccc2 Amb25725908 [0,1,0,1,0,0|1,0,1]=4 11460 B13R2.52 ON=C1CC(C1)c2ccccc2 Amb25719470 [0,1,0,1,0,0|1,0,1]=4 11461 B13R2.52 ONC1CC(C1)c2ccccc2 Amb25085729 [0,1,0,1,0,0|1,0,0]=3 11462 B13R2.223 BrC1(CC=CC1)c2ccccc2 Amb21856760 [0,1,0,1,0,0|1,0,1]=4 11463 B13R2.223 BrC1(CCC=C1)c2ccccc2 Amb21856767 [0,1,0,1,0,0|1,0,1]=4 11464 B13R2.223 BrC1(CCCC1)c2ccccc2 Amb24732789 [0,1,0,1,0,0|1,0,0]=3 11465 B13R2.223 CC1(CCCN1)c2c[n]ccc2 Amb24660358 [0,1,0,1,0,0|2,0,0]=4 11466 B13R2.223 CC1(CCCN1)c2ccccc2 Amb18829881 [0,1,0,1,0,0|1,0,0]=3 11467 B13R2.223 CC1(CNCC1)c2c[n]ccc2 Amb18947277 [0,1,0,1,0,0|1,0,0]=3 11468 B13R2.223 CC1(CNCC1)c2cc[n]cc2 Amb18947281 [0,1,0,1,0,0|1,0,0]=3 11469 B13R2.223 CC1(CNCC1)c2cccc[n]2 Amb18947274 [0,1,0,1,0,0|1,0,0]=3 11470 B13R2.223 CC1(CNCC1)c2ccccc2 Amb18280004 [0,1,0,1,0,0|0,0,0]=2 11471 B13R2.223 CC1(COCN1)c2ccccc2 Amb25311138 [0,1,0,1,0,0|1,0,0]=3 11472 B13R2.223 CC1(NCCO1)c2ccccc2 Amb24739762 [0,1,0,1,0,0|2,0,0]=4 11473 B13R2.223 CC1(NCCS1)c2ccccc2 Amb22356242 [0,1,0,1,0,0|2,0,0]=4 11474 B13R2.223 CC1(OCCS1)c2ccccc2 Amb24604445 [0,1,0,1,0,0|2,0,0]=4 11475 B13R2.223 CC1(SCCS1)c2ccccc2 Amb25279851 [0,1,0,1,0,0|2,0,0]=4 11476 B13R2.223 C[P+]1(CCCC1)c2ccccc2 Amb16204267 [0,1,0,1,0,0|2,0,0]=4 11477 B13R2.223 FC1(CNCC1)c2c[n]ccc2 Amb24366079 [0,1,0,1,0,0|1,0,0]=3 11478 B13R2.223 FC1(CNCC1)c2ccccc2 Amb24359513 [0,1,0,1,0,0|0,0,0]=2 11479 B13R2.223 FC1(COCC1)c2ccccc2 Amb24636914 [0,1,0,1,0,0|1,0,0]=3 11480 B13R2.223 NC1(CC=CC1)c2ccccc2 Amb24593679 [0,1,0,1,0,0|1,0,1]=4 11481 B13R2.223 NC1(CCCC1)c2c[n]ccc2 Amb18944274 [0,1,0,1,0,0|2,0,0]=4 11482 B13R2.223 NC1(CCCC1)c2cc[n]cc2 Amb18829612 [0,1,0,1,0,0|2,0,0]=4 11483 B13R2.223 NC1(CCCC1)c2cc[n]cc2 Amb22292259 [0,1,0,1,0,0|2,0,0]=4 11484 B13R2.223 NC1(CCCC1)c2cccc[n]2 Amb22292258 [0,1,0,1,0,0|2,0,0]=4 11485 B13R2.223 NC1(CCCC1)c2ccccc2 Amb17991297 [0,1,0,1,0,0|1,0,0]=3 11486 B13R2.223 NC1(CCCC1)c2ccccn2 Amb17106973 [0,1,0,1,0,0|2,0,0]=4 11487 B13R2.223 NC1(CNCC1)c2ccccc2 Amb24381975 [0,1,0,1,0,0|0,0,0]=2 11488 B13R2.223 NC1(COCC1)c2ccccc2 Amb24120651 [0,1,0,1,0,0|1,0,0]=3 11489 B13R2.223 O=P1(CCCC1)c2ccccc2 Amb25833532 [0,1,0,1,0,0|2,0,0]=4 11490 B13R2.223 OC1(CCCC1)c2c[n]ccc2 Amb18792484 [0,1,0,1,0,0|2,0,0]=4 11491 B13R2.223 OC1(CCCO1)c2ccccc2 Amb22752498 [0,1,0,1,0,0|2,0,0]=4 11492 B13R2.223 OC1(CNCC1)c2c[n]c[n]c2 Amb24387076 [0,1,0,1,0,0|2,0,0]=4 11493 B13R2.223 OC1(CNCC1)c2c[n]cc[n]2 Amb25187479 [0,1,0,1,0,0|2,0,0]=4 11494 B13R2.223 OC1(CNCC1)c2c[n]ccc2 Amb24063163 [0,1,0,1,0,0|1,0,0]=3 11495 B13R2.223 OC1(CNCC1)c2cc[n]c[n]2 Amb25134968 [0,1,0,1,0,0|2,0,0]=4 11496 B13R2.223 OC1(CNCC1)c2cccc[n]2 Amb24093357 [0,1,0,1,0,0|1,0,0]=3 11497 B13R2.223 OC1(CNCC1)c2ccccc2 Amb1775519 [0,1,0,1,0,0|0,0,0]=2 11498 B13R2.223 OC1(COCC1)c2c[n]ccc2 Amb25343096 [0,1,0,1,0,0|2,0,0]=4 11499 B13R2.223 OC1(COCC1)c2cc[n]cc2 Amb24645221 [0,1,0,1,0,0|2,0,0]=4 11500 B13R2.223 OC1(CSCC1)c2c[n]ccc2 Amb25669503 [0,1,0,1,0,0|2,0,0]=4 11501 B13R2.371 Br[C@@H]1CC[C@@H](Br)c2ccccc21 Amb22747644 [0,1,0,1,0,0|2,0,0]=4 11502 B13R2.371 CC1=CCC(N)c2ccccc21 Amb18645218 [0,1,0,1,0,0|2,0,0]=4 11503 B13R2.371 CC1=NCC(C)c2cc[n]cc12 Amb25060121 [0,1,0,1,0,0|1,0,1]=4 11504 B13R2.371 CC1=NNC(Cl)c2ccccc21 Amb24634201 [0,1,0,1,0,0|1,0,1]=4 11505 B13R2.371 CC1C=CC(N)c2ccccc21 Amb18645216 [0,1,0,1,0,0|1,0,1]=4 11506 B13R2.371 CC1CCC(C)c2ccccc21 Amb22734862 [0,1,0,1,0,0|1,0,0]=3 11507 B13R2.371 CC1CCC(Cl)c2ccccc21 Amb25832972 [0,1,0,1,0,0|1,0,0]=3 11508 B13R2.371 CC1CCC(N)c2ccccc21 Amb22059731 [0,1,0,1,0,0|1,0,0]=3 11509 B13R2.371 CC1CCC(O)c2ccccc21 Amb25730348 [0,1,0,1,0,0|1,0,0]=3 11510 B13R2.371 CC1CC[C@@H](N)c2ccccc21 Amb25806821 [0,1,0,1,0,0|1,0,0]=3 11511 B13R2.371 CC1CNC(=S)c2ccccc21 Amb25324007 [0,1,0,1,0,0|0,0,1]=3 11512 B13R2.371 CC1N=CC(Cl)c2ccccc21 Amb24365358 [0,1,0,1,0,0|2,0,0]=4 11513 B13R2.371 CC1NCC(C)c2c[n]ccc21 Amb25035195 [0,1,0,1,0,0|1,0,0]=3 11514 B13R2.371 CC1SC[C@H](O)c2ccccc21 Amb25156579 [0,1,0,1,0,0|2,0,0]=4 11515 B13R2.371 CN1C=CC(O)c2ccccc12 Amb25324366 [0,1,0,1,0,0|1,0,1]=4 11516 B13R2.371 CN1C=NC(O)c2ccccc12 Amb24099682 [0,1,0,1,0,0|1,0,1]=4 11517 B13R2.371 CN1CCC(=O)c2ccccc12 Amb18560299 [0,1,0,1,0,0|1,0,1]=4 11518 B13R2.371 CN1CCC(N)c2ccc[n]c12 Amb18829159 [0,1,0,1,0,0|2,0,0]=4 11519 B13R2.371 CN1CCC(N)c2ccccc12 Amb18560283 [0,1,0,1,0,0|1,0,0]=3 11520 B13R2.371 CN1CCC(O)c2ccccc12 Amb22372300 [0,1,0,1,0,0|1,0,0]=3 11521 B13R2.371 CN1CCC(c2c1cccc2)C Amb10553427 [0,1,0,1,0,0|0,0,0]=2 11522 B13R2.371 CN1CCC(c2c1cccc2)C Amb10559890 [0,1,0,1,0,0|0,0,0]=2 11523 B13R2.371 CN1CCN(C)c2ccc[n]c12 Amb23401939 [0,1,0,1,0,0|2,0,0]=4 11524 B13R2.371 C[C@@H]1NC[C@@H](C)c2ccccc21 Amb24519326 [0,1,0,1,0,0|0,0,0]=2 11525 B13R2.371 C[C@H]1CCC(=O)c2ccccc21 Amb25830043 [0,1,0,1,0,0|1,0,1]=4 11526 B13R2.371 C[C@H]1CC[C@@H](O)c2ccccc21 Amb25333722 [0,1,0,1,0,0|1,0,0]=3 11527 B13R2.371 C[C@H]1CNC(=S)c2ccccc21 Amb24756583 [0,1,0,1,0,0|0,0,1]=3 11528 B13R2.371 ClC1CCC(Cl)c2ccccc21 Amb24452261 [0,1,0,1,0,0|2,0,0]=4 11529 B13R2.371 NC1CCC(F)c2ccccc21 Amb25331924 [0,1,0,1,0,0|2,0,0]=4 11530 B13R2.371 NC1CNC(=O)c2ccccc21 Amb18645672 [0,1,0,1,0,0|1,0,1]=4 11531 B13R2.371 O=C1NCC(c2c1cccc2)C Amb17400088 [0,1,0,1,0,0|0,0,1]=3 11532 B13R2.371 O=C1NCC(c2c1cccc2)O Amb17615447 [0,1,0,1,0,0|1,0,1]=4 11533 B13R2.371 OC1CCC(O)c2ccccc21 Amb24484191 [0,1,0,1,0,0|2,0,0]=4 11534 B13R2.371 O[C@@H]1CC[C@H](O)c2ccccc21 Amb25802026 [0,1,0,1,0,0|2,0,0]=4 11535 B13R2.382 C=C1CC1C(O)c2ccccc2 Amb22363901 [0,1,0,1,0,0|2,0,0]=4 11536 B13R2.382 C=C1C[C@@H]1C(O)c2ccccc2 Amb25725445 [0,1,0,1,0,0|2,0,0]=4 11537 B13R2.382 CC1CC1C(Br)c2ccccc2 Amb25711666 [0,1,0,1,0,0|2,0,0]=4 11538 B13R2.382 CC1CC1C(Cl)c2ccccc2 Amb18181271 [0,1,0,1,0,0|2,0,0]=4 11539 B13R2.382 CC1CC1C(N)c2ccccc2 Amb19515274 [0,1,0,1,0,0|2,0,0]=4 11540 B13R2.382 CC1CC1C(O)c2ccccc2 Amb18792431 [0,1,0,1,0,0|2,0,0]=4 11541 B13R2.382 CC=1CC1C(O)c2ccccc2 Amb24465590 [0,1,0,1,0,0|2,0,0]=4 11542 B13R2.382 C[C@H]1O[C@@H]1[C@H](O)c2ccccc2 Amb24580699 [0,1,0,1,0,0|2,0,0]=4 11543 B13R2.413 CC1(CCC1=O)c2ccccc2 Amb22496413 [0,1,0,1,0,0|1,0,1]=4 11544 B13R2.413 CC1(CCC1Cl)c2ccccc2 Amb25684847 [0,1,0,1,0,0|1,0,0]=3 11545 B13R2.413 CC1CCC1(O)c2ccccc2 Amb25073632 [0,1,0,1,0,0|2,0,0]=4 11546 B13R2.413 C[C@H]1NC[C@@]1(O)c2ccccc2 Amb24519309 [0,1,0,1,0,0|1,0,0]=3 11547 B13R2.413 C[C@]1(CCC1=O)c2ccccc2 Amb24608634 [0,1,0,1,0,0|1,0,1]=4 11548 B13R2.413 C[C@]1(CC[C@H]1O)c2ccccc2 Amb24558241 [0,1,0,1,0,0|1,0,0]=3 11549 B13R2.413 NC1CCC1(O)c2ccccc2 Amb25674413 [0,1,0,1,0,0|2,0,0]=4 11550 B13R2.413 O=C1NC[C@]1(Cl)c2ccccc2 Amb25159108 [0,1,0,1,0,0|1,0,1]=4 11551 B13R2.413 OC1(CNC1=O)c2ccccc2 Amb24682843 [0,1,0,1,0,0|1,0,1]=4 11552 B13R2.413 OC1CCC1(O)c2ccccc2 Amb25188176 [0,1,0,1,0,0|2,0,0]=4 11553 B13R2.413 O[C@@]1(CNC1=O)c2ccccc2 Amb24419956 [0,1,0,1,0,0|1,0,1]=4 11554 B13R2.413 O[C@]1(CNC1=O)c2ccccc2 Amb24680220 [0,1,0,1,0,0|1,0,1]=4 11555 B13R2.633 CC1(CC1CBr)c2cc[n]cc2 Amb24363911 [0,1,0,1,0,0|2,0,0]=4 11556 B13R2.633 CC1(CC1CBr)c2cccc[n]2 Amb25725776 [0,1,0,1,0,0|2,0,0]=4 11557 B13R2.633 CC1(CC1CBr)c2ccccc2 Amb25141302 [0,1,0,1,0,0|1,0,0]=3 11558 B13R2.633 CC1(CC1CCl)c2ccccc2 Amb24676060 [0,1,0,1,0,0|1,0,0]=3 11559 B13R2.633 CC1(CC1CN)c2c[n]ccc2 Amb18963626 [0,1,0,1,0,0|2,0,0]=4 11560 B13R2.633 CC1(CC1CN)c2cc[n]cc2 Amb18963624 [0,1,0,1,0,0|2,0,0]=4 11561 B13R2.633 CC1(CC1CN)c2cccc[n]2 Amb18287087 [0,1,0,1,0,0|2,0,0]=4 11562 B13R2.633 CC1(CC1CN)c2ccccc2 Amb18963638 [0,1,0,1,0,0|1,0,0]=3 11563 B13R2.633 CC1(CC1CO)c2cccc[n]2 Amb24363405 [0,1,0,1,0,0|2,0,0]=4 11564 B13R2.633 CC1(CC1CO)c2ccccc2 Amb23555669 [0,1,0,1,0,0|1,0,0]=3 11565 B13R2.633 CC1(OC1CN)c2ccccc2 Amb25148602 [0,1,0,1,0,0|2,0,0]=4 11566 B13R2.633 CCC1CC1(N)c2ccccc2 Amb24663143 [0,1,0,1,0,0|1,0,0]=3 11567 B13R2.633 CCC1CC1(O)c2cccc[n]2 Amb24406540 [0,1,0,1,0,0|2,0,0]=4 11568 B13R2.633 CCC1CC1(O)c2ccccc2 Amb25720459 [0,1,0,1,0,0|1,0,0]=3 11569 B13R2.633 C[C@@]1(C[C@@H]1CO)c2ccccc2 Amb25227888 [0,1,0,1,0,0|1,0,0]=3 11570 B13R2.633 C[C@@]1(C[C@H]1C=O)c2ccccc2 Amb24573493 [0,1,0,1,0,0|1,0,1]=4 11571 B13R2.633 C[C@@]1(C[C@H]1CO)c2ccccc2 Amb24579436 [0,1,0,1,0,0|1,0,0]=3 11572 B13R2.633 C[C@]1(C[C@@H]1CO)c2ccccc2 Amb25277277 [0,1,0,1,0,0|1,0,0]=3 11573 B13R2.633 C[C@]1(C[C@H]1C=O)c2ccccc2 Amb24744714 [0,1,0,1,0,0|1,0,1]=4 11574 B13R2.633 N#CC1OC1(C)c2ccccc2 Amb10069679 [0,1,0,1,0,0|2,0,0]=4 11575 B13R2.633 NC[C@@H]1C[C@]1(F)c2ccccc2 Amb24519147 [0,1,0,1,0,0|2,0,0]=4 11576 B13R2.633 NC[C@H]1C[C@]1(F)c2ccccc2 Amb24519148 [0,1,0,1,0,0|2,0,0]=4 11577 B13R2.633 OC[C@H]1C[C@]1(F)c2ccccc2 Amb25272015 [0,1,0,1,0,0|2,0,0]=4 11578 B13R2.690 CC(CC1CO1)c2ccccc2 Amb18798136 [0,1,0,1,0,0|1,0,0]=3 11579 B13R2.690 CC(NC1CC1)c2cccc[n]2 Amb22274349 [0,1,0,1,0,0|2,0,0]=4 11580 B13R2.690 CC(c1ccccc1)NC2CC2 Amb1114089 [0,1,0,1,0,0|1,0,0]=3 11581 B13R2.690 CC(c1ccccn1)NC2CC2 Amb1113800 [0,1,0,1,0,0|2,0,0]=4 11582 B13R2.690 CC(c1cccnc1)NC2CC2 Amb1116757 [0,1,0,1,0,0|2,0,0]=4 11583 B13R2.690 CC(c1ccncc1)NC2CC2 Amb1116949 [0,1,0,1,0,0|2,0,0]=4 11584 B13R2.690 CN(c1ccccc1)CC2CC2 Amb17232382 [0,1,0,1,0,0|2,0,0]=4 11585 B13R2.690 CN(c1ccccc1)CC2OC2 Amb1130983 [0,1,0,1,0,0|2,0,0]=4 11586 B13R2.690 C[C@@H](NC1CC1)c2cc[n]cc2 Amb24626170 [0,1,0,1,0,0|2,0,0]=4 11587 B13R2.690 C[C@@H](NC1CC1)c2cccc[n]2 Amb24465202 [0,1,0,1,0,0|2,0,0]=4 11588 B13R2.690 ClC(CC1CC1)c2ccccc2 Amb18796387 [0,1,0,1,0,0|2,0,0]=4 11589 B13R2.690 NC(CC1CC1)c2ccccc2 Amb18292886 [0,1,0,1,0,0|2,0,0]=4 11590 B13R2.690 O=C(c1ccccc1)CN2CC2 Amb17400091 [0,1,0,1,0,0|1,0,1]=4 11591 B13R2.690 OC(CC1CC1)c2ccccc2 Amb18792434 [0,1,0,1,0,0|2,0,0]=4 11592 B13R2.690 OC(CC1CO1)c2ccccc2 Amb24758463 [0,1,0,1,0,0|2,0,0]=4 11593 B13R2.690 OC(c1ccccc1)CN2CC2 Amb17400133 [0,1,0,1,0,0|1,0,0]=3 11594 B13R2.690 OC(c1ccccn1)CN2CC2 Amb17400153 [0,1,0,1,0,0|2,0,0]=4 11595 B13R2.690 OC(c1cccnc1)CN2CC2 Amb17400154 [0,1,0,1,0,0|2,0,0]=4 11596 B13R2.690 OC(c1ccncc1)CN2CC2 Amb17400155 [0,1,0,1,0,0|2,0,0]=4 11597 B13R2.690 O[C@@H](C[C@@H]1CO1)c2ccccc2 Amb24733179 [0,1,0,1,0,0|2,0,0]=4 11598 B13R2.690 O[C@@H](C[C@H]1CO1)c2ccccc2 Amb25333471 [0,1,0,1,0,0|2,0,0]=4 11599 B13R2.690 O[C@H](CC1CC1)c2ccccc2 Amb25126835 [0,1,0,1,0,0|2,0,0]=4 11600 B13R2.1028 C#CCNC1Cc2ccccc21 Amb24386779 [0,1,0,1,0,0|1,0,1]=4 11601 B13R2.1028 C=CCNC1Cc2ccccc21 Amb25741289 [0,1,0,1,0,0|1,0,1]=4 11602 B13R2.1028 CCCCC1Cc2ccccc12 Amb17758498 [0,1,0,1,0,0|1,0,0]=3 11603 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [0,1,0,1,0,0|0,0,0]=2 11604 B13R2.1028 CNCCC1Cc2ccccc21 Amb25723615 [0,1,0,1,0,0|0,0,0]=2 11605 B13R2.1028 CONCC1Cc2ccccc21 Amb24725780 [0,1,0,1,0,0|0,0,0]=2 11606 B13R2.1028 ClCCCC1Cc2ccccc21 Amb25798843 [0,1,0,1,0,0|1,0,0]=3 11607 B13R2.1028 N#CCNC1Cc2ccccc21 Amb25331859 [0,1,0,1,0,0|2,0,0]=4 11608 B13R2.1028 N#CNCC1Cc2ccccc21 Amb25857329 [0,1,0,1,0,0|0,0,1]=3 11609 B13R2.1028 NNCCC1Cc2ccccc21 Amb25755548 [0,1,0,1,0,0|1,0,0]=3 11610 B13R2.1028 O=C=NCC1Cc2ccccc21 Amb25067184 [0,1,0,1,0,0|0,0,2]=4 11611 B13R2.1028 [N-]=[N+]=NCC1Cc2ccccc21 Amb25150144 [0,1,0,1,0,0|1,0,1]=4 11612 B13R2.5252 C=C1CNCCc2ccccc21 Amb25096241 [0,1,0,1,0,0|0,0,2]=4 11613 B13R2.5252 CC1CCCNc2ccccc21 Amb25764580 [0,1,0,1,0,0|1,0,0]=3 11614 B13R2.5252 CC1CNCCc2ccccc21 Amb24728196 [0,1,0,1,0,0|0,0,0]=2 11615 B13R2.5252 CC1NCCCc2ccccc21 Amb25685960 [0,1,0,1,0,0|1,0,0]=3 11616 B13R2.5252 CC1NCCNc2ccccc21 Amb25214036 [0,1,0,1,0,0|2,0,0]=4 11617 B13R2.5252 CC1NCCOc2c1cccc2 Amb10609534 [0,1,0,1,0,0|2,0,0]=4 11618 B13R2.5252 CN1CCCNc2c1cccc2 Amb17617816 [0,1,0,1,0,0|2,0,0]=4 11619 B13R2.5252 CN1CCCOc2ccccc12 Amb24430622 [0,1,0,1,0,0|2,0,0]=4 11620 B13R2.5252 CN1CCNCc2ccc[n]c12 Amb22174183 [0,1,0,1,0,0|2,0,0]=4 11621 B13R2.5252 CN1CCNCc2ccccc12 Amb18047038 [0,1,0,1,0,0|1,0,0]=3 11622 B13R2.5252 CN1CCOCc2ccccc12 Amb25740277 [0,1,0,1,0,0|2,0,0]=4 11623 B13R2.5252 C[C@@H]1CCNCc2ccccc21 Amb24381977 [0,1,0,1,0,0|0,0,0]=2 11624 B13R2.5252 C[C@@H]1CNCCc2ccccc21 Amb25760828 [0,1,0,1,0,0|0,0,0]=2 11625 B13R2.5252 C[C@H]1NCCCc2ccccc21 Amb24451232 [0,1,0,1,0,0|1,0,0]=3 11626 B13R2.5252 FC1CCCNc2ccccc21 Amb24754400 [0,1,0,1,0,0|2,0,0]=4 11627 B13R2.5252 FC1CCNCc2ccccc21 Amb24695490 [0,1,0,1,0,0|1,0,0]=3 11628 B13R2.5252 NC1CCCCc2c1cccc2 Amb1113859 [0,1,0,1,0,0|2,0,0]=4 11629 B13R2.5252 NC1CCCNc2ccccc21 Amb22228244 [0,1,0,1,0,0|2,0,0]=4 11630 B13R2.5252 NC1CCCOc2ccccc21 Amb22039480 [0,1,0,1,0,0|2,0,0]=4 11631 B13R2.5252 NC1CNCCc2ccccc21 Amb25759447 [0,1,0,1,0,0|1,0,0]=3 11632 B13R2.5252 N[C@@H]1CCCCc2ccccc21 Amb25703568 [0,1,0,1,0,0|2,0,0]=4 11633 B13R2.5252 N[C@@H]1CCCNc2ccccc21 Amb22232856 [0,1,0,1,0,0|2,0,0]=4 11634 B13R2.5252 N[C@@H]1CCCOc2ccccc21 Amb24532641 [0,1,0,1,0,0|2,0,0]=4 11635 B13R2.5252 N[C@H]1CCCCc2ccccc21 Amb24674187 [0,1,0,1,0,0|2,0,0]=4 11636 B13R2.5252 N[C@H]1CCCNc2ccccc21 Amb25340381 [0,1,0,1,0,0|2,0,0]=4 11637 B13R2.5252 N[C@H]1CCCOc2ccccc21 Amb25853163 [0,1,0,1,0,0|2,0,0]=4 11638 B13R2.5252 N[C@H]1CCSCc2ccccc21 Amb24431394 [0,1,0,1,0,0|2,0,0]=4 11639 B13R2.5252 O=C1CCNCc2ccccc21 Amb22499160 [0,1,0,1,0,0|1,0,1]=4 11640 B13R2.5252 O=S1CCNCc2ccccc12 Amb25217617 [0,1,0,1,0,0|2,0,0]=4 11641 B13R2.5252 OC1CCCCc2c1cccc2 Amb1109646 [0,1,0,1,0,0|2,0,0]=4 11642 B13R2.5252 OC1CCCNc2ccccc21 Amb25148561 [0,1,0,1,0,0|2,0,0]=4 11643 B13R2.5252 OC1CCCOc2c1cccc2 Amb17578185 [0,1,0,1,0,0|2,0,0]=4 11644 B13R2.5252 OC1CCCSc2c1cccc2 Amb2413585 [0,1,0,1,0,0|2,0,0]=4 11645 B13R2.5252 OC1CCNCc2ccccc21 Amb24378329 [0,1,0,1,0,0|1,0,0]=3 11646 B13R2.5252 OC1CCSCc2ccccc21 Amb25156581 [0,1,0,1,0,0|2,0,0]=4 11647 B13R2.5252 OC1CSCCc2ccccc21 Amb24414992 [0,1,0,1,0,0|2,0,0]=4 11648 B13R2.5252 OC1OCCCc2ccccc21 Amb24488564 [0,1,0,1,0,0|2,0,0]=4 11649 B13R2.5252 O[C@@H]1CCCNc2ccccc21 Amb24399922 [0,1,0,1,0,0|2,0,0]=4 11650 B13R2.5252 O[C@@H]1CCCOc2ccccc21 Amb25093048 [0,1,0,1,0,0|2,0,0]=4 11651 B13R2.5252 O[C@@H]1CCSCc2ccccc21 Amb24617414 [0,1,0,1,0,0|2,0,0]=4 11652 B13R2.5252 O[C@H]1CC=CCc2ccccc21 Amb25333523 [0,1,0,1,0,0|2,0,0]=4 11653 B13R2.5252 O[C@H]1CCCSc2ccccc21 Amb25076028 [0,1,0,1,0,0|2,0,0]=4 11654 B13R2.5252 O[C@H]1CCSCc2ccccc21 Amb24350890 [0,1,0,1,0,0|2,0,0]=4 11655 B13R2.8137 BrC(C1CCC1)c2ccccc2 Amb23590207 [0,1,0,1,0,0|2,0,0]=4 11656 B13R2.8137 CC(c1c[n]ccc1)N2CCC2 Amb25854835 [0,1,0,1,0,0|2,0,0]=4 11657 B13R2.8137 CN(C1CNC1)c2ccccc2 Amb24483517 [0,1,0,1,0,0|1,0,0]=3 11658 B13R2.8137 ClC(C1CCC1)c2ccccc2 Amb18181272 [0,1,0,1,0,0|2,0,0]=4 11659 B13R2.8137 NC(C1CCC1)c2ccccc2 Amb23438851 [0,1,0,1,0,0|2,0,0]=4 11660 B13R2.8137 N[C@@H](C1CCC1)c2ccccc2 Amb23438857 [0,1,0,1,0,0|2,0,0]=4 11661 B13R2.8137 N[C@H](C1CCC1)c2ccccc2 Amb25824594 [0,1,0,1,0,0|2,0,0]=4 11662 B13R2.8137 O=C(C1CNC1)c2ccccc2 Amb22230239 [0,1,0,1,0,0|1,0,1]=4 11663 B13R2.8137 O=S(C1CNC1)c2ccccc2 Amb25676084 [0,1,0,1,0,0|2,0,0]=4 11664 B13R2.8137 OC(C1CNC1)c2cc[n]cc2 Amb23598812 [0,1,0,1,0,0|2,0,0]=4 11665 B13R2.8137 OC(C1CNC1)c2ccc[n]c2 Amb23598813 [0,1,0,1,0,0|2,0,0]=4 11666 B13R2.8137 OC(C1CNC1)c2cccc[n]2 Amb23598814 [0,1,0,1,0,0|2,0,0]=4 11667 B13R2.8137 OC(c1ccccc1)C2CCC2 Amb17194467 [0,1,0,1,0,0|2,0,0]=4 11668 B13R2.32 CC1C(C)CNc2ccccc21 Amb25751543 [0,1,0,1,0,0|2,0,0]=4 11669 B13R2.32 CC1CCc2c(N1C)cccc2 Amb10563332 [0,1,0,1,0,0|2,0,0]=4 11670 B13R2.32 CC1CCc2ccccc2C1Br Amb25106373 [0,1,0,1,0,0|2,0,0]=4 11671 B13R2.32 CC1CCc2ccccc2C1Cl Amb18186761 [0,1,0,1,0,0|2,0,0]=4 11672 B13R2.32 CC1CCc2ccccc2C1O Amb18800659 [0,1,0,1,0,0|2,0,0]=4 11673 B13R2.32 CC1NCc2ccccc2C1C Amb25808011 [0,1,0,1,0,0|0,0,0]=2 11674 B13R2.32 CC1NCc2ccccc2C1O Amb25817106 [0,1,0,1,0,0|1,0,0]=3 11675 B13R2.32 CC1SCc2ccccc2C1O Amb25836129 [0,1,0,1,0,0|2,0,0]=4 11676 B13R2.32 CC1c2ccccc2CCN1O Amb24537644 [0,1,0,1,0,0|2,0,0]=4 11677 B13R2.32 CN1C(=C)NCc2ccccc12 Amb25245953 [0,1,0,1,0,0|1,0,1]=4 11678 B13R2.32 C[C@@H]1CCc2ccccc2[C@@H]1O Amb24555476 [0,1,0,1,0,0|2,0,0]=4 11679 B13R2.32 C[C@@H]1NCc2ccccc2[C@@H]1C Amb24724526 [0,1,0,1,0,0|0,0,0]=2 11680 B13R2.32 C[C@@H]1c2ccccc2CCN1O Amb24623717 [0,1,0,1,0,0|2,0,0]=4 11681 B13R2.32 C[C@H]1NCc2ccccc2[C@H]1C Amb24513026 [0,1,0,1,0,0|0,0,0]=2 11682 B13R2.32 C[C@H]1c2ccccc2CCN1O Amb24713361 [0,1,0,1,0,0|2,0,0]=4 11683 B13R2.32 FC1C(Cl)CCc2ccccc21 Amb25685830 [0,1,0,1,0,0|2,0,0]=4 11684 B13R2.32 F[C@@H]1[C@H](Cl)CCc2ccccc21 Amb25179064 [0,1,0,1,0,0|2,0,0]=4 11685 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,1,0,1,0,0|1,0,1]=4 11686 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,1,0,1,0,0|1,0,1]=4 11687 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22491803 [0,1,0,1,0,0|1,0,1]=4 11688 B13R2.32 NC1C(F)CCc2ccccc21 Amb25117934 [0,1,0,1,0,0|2,0,0]=4 11689 B13R2.32 NC1C(I)CCc2ccccc21 Amb25136183 [0,1,0,1,0,0|2,0,0]=4 11690 B13R2.32 NC1C(N)CCc2ccccc21 Amb18645719 [0,1,0,1,0,0|2,0,0]=4 11691 B13R2.32 NC1C(O)CCc2ccccc21 Amb18645888 [0,1,0,1,0,0|2,0,0]=4 11692 B13R2.32 NC1C(O)CCc2ccccc21 Amb22275991 [0,1,0,1,0,0|2,0,0]=4 11693 B13R2.32 NC1CCc2c(C1O)cccc2 Amb2383071 [0,1,0,1,0,0|2,0,0]=4 11694 B13R2.32 NC1CCc2ccccc2C1O Amb21964517 [0,1,0,1,0,0|2,0,0]=4 11695 B13R2.32 NC1OCc2ccccc2C1O Amb25674826 [0,1,0,1,0,0|2,0,0]=4 11696 B13R2.32 N[C@@H]1CCc2ccccc2[C@H]1O Amb25249079 [0,1,0,1,0,0|2,0,0]=4 11697 B13R2.32 N[C@@H]1[C@@H](O)CCc2ccccc21 Amb22744930 [0,1,0,1,0,0|2,0,0]=4 11698 B13R2.32 N[C@@H]1[C@H](O)CCc2ccccc21 Amb22748703 [0,1,0,1,0,0|2,0,0]=4 11699 B13R2.32 N[C@H]1CCc2ccccc2[C@@H]1O Amb24652537 [0,1,0,1,0,0|2,0,0]=4 11700 B13R2.32 N[C@H]1CCc2ccccc2[C@H]1O Amb25210520 [0,1,0,1,0,0|2,0,0]=4 11701 B13R2.32 N[C@H]1[C@H](F)CCc2ccccc21 Amb25294343 [0,1,0,1,0,0|2,0,0]=4 11702 B13R2.32 OC1OCc2ccccc2C1Cl Amb25279566 [0,1,0,1,0,0|2,0,0]=4 11703 B13R2.32 OC1[C@@H](O)CCc2ccccc21 Amb25741467 [0,1,0,1,0,0|2,0,0]=4 11704 B13R2.32 O[C@@H]1CCc2ccccc2[C@@H]1Cl Amb24512123 [0,1,0,1,0,0|2,0,0]=4 11705 B13R2.32 O[C@@H]1CCc2ccccc2[C@@H]1F Amb25346461 [0,1,0,1,0,0|2,0,0]=4 11706 B13R2.32 O[C@@H]1[C@@H](Cl)CCc2ccccc21 Amb24739627 [0,1,0,1,0,0|2,0,0]=4 11707 B13R2.32 O[C@H]1CCc2ccccc2[C@@H]1F Amb24520445 [0,1,0,1,0,0|2,0,0]=4 11708 B13R2.32 O[C@H]1[C@@H](O)CCc2ccccc21 Amb22224796 [0,1,0,1,0,0|2,0,0]=4 11709 B13R2.32 O[C@H]1[C@H](O)CCc2ccccc21 Amb25250666 [0,1,0,1,0,0|2,0,0]=4 11710 B13R2.45 CC1C(C=O)Nc2ccccc21 Amb18829943 [0,1,0,1,0,0|2,0,0]=4 11711 B13R2.45 CC1C(CCl)Cc2ccccc21 Amb24634202 [0,1,0,1,0,0|2,0,0]=4 11712 B13R2.45 CC1C(CN)Oc2ccccc21 Amb25071717 [0,1,0,1,0,0|2,0,0]=4 11713 B13R2.45 CC1C(CO)Cc2ccccc21 Amb25832766 [0,1,0,1,0,0|2,0,0]=4 11714 B13R2.45 CC1C(CO)Nc2ccccc21 Amb25055729 [0,1,0,1,0,0|2,0,0]=4 11715 B13R2.45 CCC1Cc2ccccc2C1Cl Amb18186760 [0,1,0,1,0,0|2,0,0]=4 11716 B13R2.45 CCC1Cc2ccccc2C1N Amb18279401 [0,1,0,1,0,0|2,0,0]=4 11717 B13R2.45 CCC1Cc2ccccc2C1O Amb18800660 [0,1,0,1,0,0|2,0,0]=4 11718 B13R2.45 CCC1Oc2ccccc2C1O Amb24449068 [0,1,0,1,0,0|2,0,0]=4 11719 B13R2.45 CCC1Sc2ccccc2C1N Amb25151112 [0,1,0,1,0,0|2,0,0]=4 11720 B13R2.45 CC[C@@H]1Cc2ccccc2[C@@H]1O Amb24520334 [0,1,0,1,0,0|2,0,0]=4 11721 B13R2.45 CC[C@@H]1Cc2ccccc2[C@H]1O Amb24544415 [0,1,0,1,0,0|2,0,0]=4 11722 B13R2.45 CC[C@H]1Cc2ccccc2[C@@H]1O Amb24520335 [0,1,0,1,0,0|2,0,0]=4 11723 B13R2.45 CC[C@H]1Cc2ccccc2[C@H]1O Amb24576483 [0,1,0,1,0,0|2,0,0]=4 11724 B13R2.45 CNC1Cc2ccccc2C1Cl Amb25731818 [0,1,0,1,0,0|1,0,0]=3 11725 B13R2.45 CNC1Cc2ccccc2C1N Amb25680007 [0,1,0,1,0,0|1,0,0]=3 11726 B13R2.45 CNC1Cc2ccccc2C1O Amb18645898 [0,1,0,1,0,0|1,0,0]=3 11727 B13R2.45 CN[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25173003 [0,1,0,1,0,0|1,0,0]=3 11728 B13R2.45 CN[C@@H]1Cc2ccccc2[C@H]1O Amb24056611 [0,1,0,1,0,0|1,0,0]=3 11729 B13R2.45 CN[C@H]1Cc2ccccc2[C@@H]1N Amb24680132 [0,1,0,1,0,0|1,0,0]=3 11730 B13R2.45 CN[C@H]1Cc2ccccc2[C@H]1O Amb24540763 [0,1,0,1,0,0|1,0,0]=3 11731 B13R2.45 COC1Cc2c(C1N)cccc2 Amb1140146 [0,1,0,1,0,0|2,0,0]=4 11732 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,1,0,1,0,0|2,0,0]=4 11733 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1N Amb24519372 [0,1,0,1,0,0|2,0,0]=4 11734 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1O Amb24515517 [0,1,0,1,0,0|2,0,0]=4 11735 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,1,0,1,0,0|2,0,0]=4 11736 B13R2.45 CSC1Cc2ccccc2C1Cl Amb25275259 [0,1,0,1,0,0|2,0,0]=4 11737 B13R2.45 CSC1Cc2ccccc2C1N Amb25150959 [0,1,0,1,0,0|2,0,0]=4 11738 B13R2.45 CS[C@H]1Cc2ccccc2[C@@H]1Cl Amb24656132 [0,1,0,1,0,0|2,0,0]=4 11739 B13R2.45 C[C@@H]1[C@H](CN)Oc2ccccc21 Amb25139682 [0,1,0,1,0,0|2,0,0]=4 11740 B13R2.45 C[n]1c2ccccc2cc1NC Amb22753877 [0,1,0,1,0,0|1,0,1]=4 11741 B13R2.45 C\N=C/1\Nc2ccccc2C1C Amb24512972 [0,1,0,1,0,0|0,0,2]=4 11742 B13R2.45 NNC1Cc2ccccc2C1O Amb24488639 [0,1,0,1,0,0|2,0,0]=4 11743 B13R2.98 CC1(CC1c2ccccc2)C=O Amb25674437 [0,1,0,1,0,0|2,0,0]=4 11744 B13R2.98 CC1(CCl)CC1c2ccccc2 Amb25758625 [0,1,0,1,0,0|2,0,0]=4 11745 B13R2.98 CCC1(N)CC1c2ccccc2 Amb25228204 [0,1,0,1,0,0|1,0,0]=3 11746 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb24523691 [0,1,0,1,0,0|2,0,0]=4 11747 B13R2.98 C[C@@]1(CO)C[C@@H]1c2ccccc2 Amb24604913 [0,1,0,1,0,0|2,0,0]=4 11748 B13R2.98 C[C@@]1(C[C@@H]1c2ccccc2)C=O Amb24460888 [0,1,0,1,0,0|2,0,0]=4 11749 B13R2.98 C[C@@]1(C[C@H]1c2ccccc2)C=O Amb24678176 [0,1,0,1,0,0|2,0,0]=4 11750 B13R2.98 C[C@]1(CO)C[C@@H]1c2ccccc2 Amb25206362 [0,1,0,1,0,0|2,0,0]=4 11751 B13R2.98 C[C@]1(CO)C[C@H]1c2ccccc2 Amb24675437 [0,1,0,1,0,0|2,0,0]=4 11752 B13R2.98 C[C@]1(C[C@@H]1c2ccccc2)C=O Amb24589199 [0,1,0,1,0,0|2,0,0]=4 11753 B13R2.98 C[C@]1(C[C@H]1c2ccccc2)C=O Amb24545890 [0,1,0,1,0,0|2,0,0]=4 11754 B13R2.98 O=C[C@]1(Cl)C[C@H]1c2ccccc2 Amb24617209 [0,1,0,1,0,0|2,0,0]=4 11755 B13R2.98 OCC1(Cl)CC1c2ccccc2 Amb25225656 [0,1,0,1,0,0|2,0,0]=4 11756 B13R2.98 OCC1(Cl)C[C@@H]1c2ccccc2 Amb25157839 [0,1,0,1,0,0|2,0,0]=4 11757 B13R2.98 OC[C@]1(Cl)C[C@H]1c2ccccc2 Amb25257187 [0,1,0,1,0,0|2,0,0]=4 11758 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,1,0,1,0,0|0,0,1]=3 11759 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,1,0,1,0,0|0,0,1]=3 11760 B13R2.3085 CC1C(Br)c2ccccc2C1C Amb24702860 [0,1,0,1,0,0|2,0,0]=4 11761 B13R2.3085 CC1C(Cl)C(=O)c2ccccc21 Amb24390287 [0,1,0,1,0,0|2,0,0]=4 11762 B13R2.3085 CC1C(N)C(C)c2ccccc21 Amb18645544 [0,1,0,1,0,0|1,0,0]=3 11763 B13R2.3085 CC1C(N)c2ccccc2C1C Amb24677093 [0,1,0,1,0,0|2,0,0]=4 11764 B13R2.3085 CC1C(O)c2ccccc2N1C Amb24362737 [0,1,0,1,0,0|1,0,0]=3 11765 B13R2.3085 CC=1c2ccccc2C(C)C1Br Amb25849928 [0,1,0,1,0,0|1,0,1]=4 11766 B13R2.3085 CN1C(=O)C(Br)c2ccccc12 Amb22749190 [0,1,0,1,0,0|1,0,1]=4 11767 B13R2.3085 CN1C(=O)C(N)c2ccccc12 Amb22586861 [0,1,0,1,0,0|1,0,1]=4 11768 B13R2.3085 CN1C(=O)N(C)c2ccccc12 Amb18004177 [0,1,0,1,0,0|1,0,1]=4 11769 B13R2.3085 CN1C(=S)N(C)c2ccccc12 Amb20666683 [0,1,0,1,0,0|1,0,1]=4 11770 B13R2.3085 CN1C(C)C(C)c2ccccc12 Amb24593827 [0,1,0,1,0,0|0,0,0]=2 11771 B13R2.3085 CN1C(N)C(=O)c2ccccc12 Amb24078928 [0,1,0,1,0,0|1,0,1]=4 11772 B13R2.3085 CN1C(O)N(C)c2ccccc12 Amb25071653 [0,1,0,1,0,0|1,0,0]=3 11773 B13R2.3085 CN1[C@H](C)[C@H](C)c2ccccc12 Amb24433476 [0,1,0,1,0,0|0,0,0]=2 11774 B13R2.3085 C[C@@H]1C(O)[C@@H](C)c2ccccc21 Amb24748340 [0,1,0,1,0,0|1,0,0]=3 11775 B13R2.3085 C[C@@H]1[C@@H](C)c2ccccc2C1=O Amb24736164 [0,1,0,1,0,0|2,0,0]=4 11776 B13R2.3085 C[C@@H]1[C@@H](N)[C@H](C)c2ccccc21 Amb24443864 [0,1,0,1,0,0|1,0,0]=3 11777 B13R2.3085 C[C@@H]1[C@@H](O)[C@H](C)c2ccccc21 Amb24748619 [0,1,0,1,0,0|1,0,0]=3 11778 B13R2.3085 C[n]1c(=C)[n](C)c2ccccc12 Amb24065291 [0,1,0,1,0,0|1,0,1]=4 11779 B13R2.3085 C[n]1c(N)[n+](C)c2ccccc12 Amb25026044 [0,1,0,1,0,0|1,0,1]=4 11780 B13R2.3085 Cc1c2ccccc2[n](C)c1Cl Amb23569031 [0,1,0,1,0,0|0,0,2]=4 11781 B13R2.3085 Cc1c2ccccc2[n](C)c1I Amb21963101 [0,1,0,1,0,0|0,0,2]=4 11782 B13R2.3085 N=C1N(C)c2c(C1C)cccc2 Amb16210593 [0,1,0,1,0,0|0,0,1]=3 11783 B13R2.3085 O=c1n(C)c2c(n1C)cccc2 Amb1778538 [0,1,0,1,0,0|1,0,1]=4 11784 B13R2.7350 CCC1(O)C(C)c2ccccc12 Amb17778669 [0,1,0,1,0,0|1,0,0]=3 11785 B13R2.8138 CC(c1ccccc1)C2(O)CC2 Amb24684522 [0,1,0,1,0,0|1,0,0]=3 11786 B13R2.8138 CC1(CC1)C(N)c2ccccc2 Amb18563532 [0,1,0,1,0,0|2,0,0]=4 11787 B13R2.8138 CC1(CC1)C(O)c2ccccc2 Amb25197789 [0,1,0,1,0,0|2,0,0]=4 11788 B13R2.8138 CC1(CC1)[C@@H](O)c2ccccc2 Amb25734393 [0,1,0,1,0,0|2,0,0]=4 11789 B13R2.8138 CN(c1ccccc1)C2(C)CC2 Amb24096732 [0,1,0,1,0,0|2,0,0]=4 11790 B13R2.8138 C[C@]1(CO1)[C@H](O)c2ccccc2 Amb24520202 [0,1,0,1,0,0|2,0,0]=4 11791 B13R2.8138 NC(c1ccccc1)C2(O)CC2 Amb22236255 [0,1,0,1,0,0|2,0,0]=4 11792 B13R2.8138 NC1(CC1)C(F)c2ccccc2 Amb25270207 [0,1,0,1,0,0|2,0,0]=4 11793 B13R2.8138 NC1(CC1)C(O)c2ccccc2 Amb24095286 [0,1,0,1,0,0|2,0,0]=4 11794 B13R2.8138 N[C@@H](c1ccccc1)C2(O)CC2 Amb22225452 [0,1,0,1,0,0|2,0,0]=4 11795 B13R2.8138 N[C@H](c1ccccc1)C2(O)CC2 Amb25682407 [0,1,0,1,0,0|2,0,0]=4 11796 B13R2.8138 OC(c1ccccc1)C2(O)CC2 Amb25847841 [0,1,0,1,0,0|2,0,0]=4 11797 B13R2.15272 C#CC(O)C1Cc2ccccc21 Amb24531554 [0,1,0,1,0,0|1,0,1]=4 11798 B13R2.15272 C=CC(N)C1Cc2ccccc21 Amb25265602 [0,1,0,1,0,0|1,0,1]=4 11799 B13R2.15272 C=CC(O)C1Cc2ccccc21 Amb25831984 [0,1,0,1,0,0|1,0,1]=4 11800 B13R2.15272 CC(NN)C1Cc2ccccc21 Amb24643619 [0,1,0,1,0,0|1,0,0]=3 11801 B13R2.15272 CCC(N)C1Cc2ccccc21 Amb25724412 [0,1,0,1,0,0|1,0,0]=3 11802 B13R2.15272 CC[C@@H](N)C1Cc2ccccc21 Amb24758536 [0,1,0,1,0,0|1,0,0]=3 11803 B13R2.15272 CC[C@H](O)C1Cc2ccccc21 Amb25726263 [0,1,0,1,0,0|1,0,0]=3 11804 B13R2.15272 COC(=N)C1Cc2ccccc21 Amb24707799 [0,1,0,1,0,0|1,0,1]=4 11805 B13R2.15272 ONC(=O)C1Cc2ccccc21 Amb24406877 [0,1,0,1,0,0|1,0,1]=4 11806 B13R2.238 CC1(CC(=O)C1)c2ccccc2 Amb19373258 [0,1,0,1,0,0|1,0,0]=3 11807 B13R2.238 CC1(CC(=O)N1)c2ccccc2 Amb23444108 [0,1,0,1,0,0|2,0,0]=4 11808 B13R2.238 CC1(CC(N)C1)c2ccccc2 Amb19373291 [0,1,0,1,0,0|1,0,0]=3 11809 B13R2.238 CC1CC(N)(C1)c2c[n]ccc2 Amb25756823 [0,1,0,1,0,0|2,0,0]=4 11810 B13R2.238 CC1CC(N)(C1)c2cc[n]cc2 Amb25708835 [0,1,0,1,0,0|2,0,0]=4 11811 B13R2.238 CC1CC(O)(C1)c2c[n]ccc2 Amb25779082 [0,1,0,1,0,0|2,0,0]=4 11812 B13R2.238 CC1CC(O)(C1)c2ccccc2 Amb25280560 [0,1,0,1,0,0|1,0,0]=3 11813 B13R2.238 CN1CC(O)(C1)c2c[n]ccc2 Amb24727739 [0,1,0,1,0,0|1,0,0]=3 11814 B13R2.238 CN1CC(O)(C1)c2cccc[n]2 Amb24665933 [0,1,0,1,0,0|1,0,0]=3 11815 B13R2.238 C[C@@]1(CC(=O)N1)c2ccccc2 Amb24532712 [0,1,0,1,0,0|2,0,0]=4 11816 B13R2.238 C[C@]1(CC(=O)N1)c2ccccc2 Amb24343443 [0,1,0,1,0,0|2,0,0]=4 11817 B13R2.238 NC1(CC(F)C1)c2ccccc2 Amb23449157 [0,1,0,1,0,0|2,0,0]=4 11818 B13R2.238 NC1(CC(O)C1)c2ccccc2 Amb23536867 [0,1,0,1,0,0|2,0,0]=4 11819 B13R2.238 NC1CC(N)(C1)c2ccccc2 Amb25103797 [0,1,0,1,0,0|2,0,0]=4 11820 B13R2.238 NC1CC(O)(C1)c2ccccc2 Amb25829244 [0,1,0,1,0,0|2,0,0]=4 11821 B13R2.238 N[C@@H]1C[C@@](F)(C1)c2ccccc2 Amb24460912 [0,1,0,1,0,0|2,0,0]=4 11822 B13R2.238 N[C@@H]1C[C@](F)(C1)c2ccccc2 Amb24402476 [0,1,0,1,0,0|2,0,0]=4 11823 B13R2.238 OC1(CC(=O)C1)c2ccccc2 Amb25729108 [0,1,0,1,0,0|2,0,0]=4 11824 B13R2.3063 CC(O)(C1CC1)c2c[n]ccc2 Amb23454967 [0,1,0,1,0,0|2,0,0]=4 11825 B13R2.3063 CC(O)(C1CC1)c2cc[n]cc2 Amb23454969 [0,1,0,1,0,0|2,0,0]=4 11826 B13R2.3063 CC(O)(C1CC1)c2cccc[n]2 Amb23454955 [0,1,0,1,0,0|2,0,0]=4 11827 B13R2.3063 FC(F)(C1CC1)c2ccccc2 Amb20670158 [0,1,0,1,0,0|2,0,0]=4 11828 B13R2.3122 CC1(C)CCCc2ccccc12 Amb25328610 [0,1,0,1,0,0|1,0,0]=3 11829 B13R2.3122 CC1(C)CCNc2ccccc12 Amb18061657 [0,1,0,1,0,0|2,0,0]=4 11830 B13R2.3122 CC1(C)CNCc2c1cccc2 Amb17106475 [0,1,0,1,0,0|0,0,0]=2 11831 B13R2.3122 CC1(C)CNCc2ccc[n]c12 Amb25751265 [0,1,0,1,0,0|1,0,0]=3 11832 B13R2.3122 CC1(C)CNCc2ccccc12 Amb22498746 [0,1,0,1,0,0|0,0,0]=2 11833 B13R2.3122 CC1(C)NCCc2ccccc12 Amb18645550 [0,1,0,1,0,0|2,0,0]=4 11834 B13R2.3122 CC1(N)C=CCc2ccccc12 Amb18645217 [0,1,0,1,0,0|1,0,1]=4 11835 B13R2.3122 CC1(N)CCCc2c1cccc2 Amb13952456 [0,1,0,1,0,0|1,0,0]=3 11836 B13R2.3122 CC1(N)CCNc2ccccc12 Amb24644178 [0,1,0,1,0,0|2,0,0]=4 11837 B13R2.3122 CC1(N)CCOc2c1cccc2 Amb17519223 [0,1,0,1,0,0|2,0,0]=4 11838 B13R2.3122 CC1(O)CCCc2c[n]ccc12 Amb24407161 [0,1,0,1,0,0|2,0,0]=4 11839 B13R2.3122 CC1(O)CCCc2ccc[n]c12 Amb25736761 [0,1,0,1,0,0|2,0,0]=4 11840 B13R2.3122 CC1(O)CCNc2ccccc12 Amb25723767 [0,1,0,1,0,0|2,0,0]=4 11841 B13R2.3122 FC1(F)CCCc2ccccc12 Amb20670159 [0,1,0,1,0,0|2,0,0]=4 11842 B13R2.3122 FC1(F)CNCc2ccccc12 Amb19372985 [0,1,0,1,0,0|1,0,0]=3 11843 B13R2.3122 FC1(F)CNCc2ccccc12 Amb20668388 [0,1,0,1,0,0|1,0,0]=3 11844 B13R2.12159 CC1(C)CC(Cl)c2ccccc12 Amb25139356 [0,1,0,1,0,0|2,0,0]=4 11845 B13R2.12159 CC1(C)CC(O)c2ccccc12 Amb22229024 [0,1,0,1,0,0|2,0,0]=4 11846 B13R2.12159 CC1(C)C[C@H](N)c2ccccc12 Amb25765747 [0,1,0,1,0,0|2,0,0]=4 11847 B13R2.12159 CC1(C)C[C@H](O)c2ccccc12 Amb24715656 [0,1,0,1,0,0|2,0,0]=4 11848 B13R2.12159 CC1(O)CC(N)c2ccccc12 Amb24554827 [0,1,0,1,0,0|2,0,0]=4 11849 B13R2.12159 CC1=CC(C)(C)c2ccccc12 Amb22002270 [0,1,0,1,0,0|1,0,1]=4 11850 B13R2.12159 CC1=CC(C)(O)c2ccccc12 Amb17778887 [0,1,0,1,0,0|1,0,1]=4 11851 B13R2.12159 CC1CC(C)(C)c2ccccc21 Amb25198302 [0,1,0,1,0,0|1,0,0]=3 11852 B13R2.12159 CC1CC(C)(O)c2ccccc21 Amb24359344 [0,1,0,1,0,0|1,0,0]=3 11853 B13R2.12159 C[N+]1=CC(C)(C)c2ccccc12 Amb24518267 [0,1,0,1,0,0|0,0,2]=4 11854 B13R2.12159 NC1CC(c2c1cccc2)(C)C Amb17232394 [0,1,0,1,0,0|2,0,0]=4 11855 B13R2.173 FC1(F)CC(C1)c2ccccc2 Amb25850210 [0,1,0,1,0,0|2,0,0]=4 11856 B13R2.244 CC1C(c2ccccc21)C(O)=O Amb25108282 [0,1,0,1,0,0|2,0,0]=4 11857 B13R2.244 C[C@@H]1[C@H](c2ccccc21)C(O)=O Amb24550599 [0,1,0,1,0,0|2,0,0]=4 11858 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [0,1,0,1,0,0|2,0,0]=4 11859 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [0,1,0,1,0,0|1,0,0]=3 11860 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,1,0,1,0,0|1,0,0]=3 11861 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,1,0,1,0,0|2,0,0]=4 11862 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,1,0,1,0,0|1,0,0]=3 11863 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,1,0,1,0,0|2,0,0]=4 11864 B13R2.423 CC(C)C1CC1c2ccccc2 Amb24070198 [0,1,0,1,0,0|1,0,0]=3 11865 B13R2.423 CC(C)[C@@H]1C[C@H]1c2ccccc2 Amb25253110 [0,1,0,1,0,0|1,0,0]=3 11866 B13R2.423 CC(C)[C@@H]1O[C@@H]1c2ccccc2 Amb24741243 [0,1,0,1,0,0|2,0,0]=4 11867 B13R2.423 CC(C)[C@@H]1O[C@H]1c2ccccc2 Amb25322432 [0,1,0,1,0,0|2,0,0]=4 11868 B13R2.423 CC(C)[C@H]1C[C@H]1c2ccccc2 Amb24068901 [0,1,0,1,0,0|1,0,0]=3 11869 B13R2.423 CC(C1CC1c2ccccc2)N Amb10610180 [0,1,0,1,0,0|1,0,0]=3 11870 B13R2.423 CC(C1CC1c2ccccc2)O Amb17605479 [0,1,0,1,0,0|1,0,0]=3 11871 B13R2.423 CC(C1OC1c2ccccc2)C Amb1139864 [0,1,0,1,0,0|2,0,0]=4 11872 B13R2.423 CC(Cl)C1OC1c2ccccc2 Amb25124060 [0,1,0,1,0,0|2,0,0]=4 11873 B13R2.423 CC(Cl)[C@H]1O[C@@H]1c2ccccc2 Amb24635731 [0,1,0,1,0,0|2,0,0]=4 11874 B13R2.423 CC(O)C1CC1c2c[n]ccc2 Amb23442766 [0,1,0,1,0,0|2,0,0]=4 11875 B13R2.423 CC(O)[C@@H]1C[C@@H]1c2ccccc2 Amb25306520 [0,1,0,1,0,0|1,0,0]=3 11876 B13R2.423 C[C@@H](O)C1OC1c2ccccc2 Amb25817089 [0,1,0,1,0,0|2,0,0]=4 11877 B13R2.423 C[C@@H](O)[C@@H]1O[C@@H]1c2ccccc2 Amb24519692 [0,1,0,1,0,0|2,0,0]=4 11878 B13R2.423 C[C@@H](O)[C@H]1O[C@@H]1c2ccccc2 Amb24576520 [0,1,0,1,0,0|2,0,0]=4 11879 B13R2.423 C[C@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520371 [0,1,0,1,0,0|1,0,0]=3 11880 B13R2.423 C[C@H](O)[C@@H]1O[C@H]1c2ccccc2 Amb25176782 [0,1,0,1,0,0|2,0,0]=4 11881 B13R2.423 C[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24583667 [0,1,0,1,0,0|1,0,0]=3 11882 B13R2.423 C[C@H](O)[C@H]1O[C@@H]1c2ccccc2 Amb24555494 [0,1,0,1,0,0|2,0,0]=4 11883 B13R2.423 NC(=N)C1CC1c2ccccc2 Amb25242569 [0,1,0,1,0,0|2,0,0]=4 11884 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [0,1,0,1,0,0|2,0,0]=4 11885 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [0,1,0,1,0,0|2,0,0]=4 11886 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [0,1,0,1,0,0|2,0,0]=4 11887 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,1,0,1,0,0|2,0,0]=4 11888 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [0,1,0,1,0,0|2,0,0]=4 11889 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [0,1,0,1,0,0|2,0,0]=4 11890 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [0,1,0,1,0,0|2,0,0]=4 11891 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,1,0,1,0,0|2,0,0]=4 11892 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,1,0,1,0,0|2,0,0]=4 11893 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,1,0,1,0,0|2,0,0]=4 11894 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [0,1,0,1,0,0|2,0,0]=4 11895 B13R2.3201 CC1(C)C[C@]1(N)c2ccccc2 Amb25242601 [0,1,0,1,0,0|2,0,0]=4 11896 B13R2.3201 CC1(C)NC1(C)c2ccccc2 Amb24056778 [0,1,0,1,0,0|2,0,0]=4 11897 B13R2.5881 CC(=O)CC1Cc2ccccc21 Amb25129209 [0,1,0,1,0,0|1,0,0]=3 11898 B13R2.5881 CC(=O)NC1Cc2ccccc12 Amb17778879 [0,1,0,1,0,0|2,0,0]=4 11899 B13R2.5881 CC(=O)OC1Cc2ccccc12 Amb17778687 [0,1,0,1,0,0|2,0,0]=4 11900 B13R2.5881 CC(C)NC1Cc2ccccc21 Amb24749344 [0,1,0,1,0,0|2,0,0]=4 11901 B13R2.5881 CC(Cl)CC1Cc2ccccc21 Amb24570076 [0,1,0,1,0,0|1,0,0]=3 11902 B13R2.5881 CC(N)CC1Cc2ccccc21 Amb24738028 [0,1,0,1,0,0|1,0,0]=3 11903 B13R2.5881 CN(C)CC1Cc2ccccc21 Amb22446492 [0,1,0,1,0,0|0,0,0]=2 11904 B13R2.5881 NC(=N)CC1Cc2ccccc21 Amb25150145 [0,1,0,1,0,0|2,0,0]=4 11905 B13R2.5881 OC(=O)CC1Cc2ccccc21 Amb25279494 [0,1,0,1,0,0|2,0,0]=4 11906 B13R2.18 Brc1[n]cccc1C2CCCC2 Amb24319280 [0,1,0,1,0,0|2,0,0]=4 11907 B13R2.18 Brc1[n]cccc1C2CNCC2 Amb25301377 [0,1,0,1,0,0|1,0,0]=3 11908 B13R2.18 Brc1c[n]ccc1C2CCCC2 Amb24320562 [0,1,0,1,0,0|2,0,0]=4 11909 B13R2.18 Brc1c[n]ccc1C2CNCC2 Amb24082791 [0,1,0,1,0,0|1,0,0]=3 11910 B13R2.18 Brc1cc[n]cc1C2CCCC2 Amb20617517 [0,1,0,1,0,0|2,0,0]=4 11911 B13R2.18 Brc1ccc[n]c1C2CCCC2 Amb24320673 [0,1,0,1,0,0|2,0,0]=4 11912 B13R2.18 Brc1ccccc1C2CCCC2 Amb18760094 [0,1,0,1,0,0|1,0,0]=3 11913 B13R2.18 Brc1ccccc1C2CCCN2 Amb17659160 [0,1,0,1,0,0|2,0,0]=4 11914 B13R2.18 Brc1ccccc1C2CCCN2 Amb20626046 [0,1,0,1,0,0|2,0,0]=4 11915 B13R2.18 Brc1ccccc1C2CCCN2 Amb2237168 [0,1,0,1,0,0|2,0,0]=4 11916 B13R2.18 Brc1ccccc1C2CNCC2 Amb18571277 [0,1,0,1,0,0|0,0,0]=2 11917 B13R2.18 Brc1ccccc1C2CNCO2 Amb18571585 [0,1,0,1,0,0|1,0,0]=3 11918 B13R2.18 Brc1ccccc1C2COCC2 Amb20617119 [0,1,0,1,0,0|1,0,0]=3 11919 B13R2.18 Brc1ccccc1N2CCCC2 Amb19959459 [0,1,0,1,0,0|2,0,0]=4 11920 B13R2.18 Brc1ccccc1[C@H]2CNCC2 Amb24685897 [0,1,0,1,0,0|0,0,0]=2 11921 B13R2.18 Cc1[n]c[n]cc1C2CNCC2 Amb18829145 [0,1,0,1,0,0|2,0,0]=4 11922 B13R2.18 Cc1[n]cccc1C2CNCC2 Amb23586023 [0,1,0,1,0,0|1,0,0]=3 11923 B13R2.18 Cc1c[n]c[n]c1C2CCNC2 Amb18829170 [0,1,0,1,0,0|2,0,0]=4 11924 B13R2.18 Cc1c[n]ccc1C2CNCC2 Amb25737168 [0,1,0,1,0,0|1,0,0]=3 11925 B13R2.18 Cc1cc[n]cc1C2CNCC2 Amb24471679 [0,1,0,1,0,0|1,0,0]=3 11926 B13R2.18 Cc1ccccc1C2CCCN2 Amb20668068 [0,1,0,1,0,0|2,0,0]=4 11927 B13R2.18 Cc1ccccc1C2CCCN2 Amb2234653 [0,1,0,1,0,0|2,0,0]=4 11928 B13R2.18 Cc1ccccc1C2CNCC2 Amb13952285 [0,1,0,1,0,0|0,0,0]=2 11929 B13R2.18 Cc1ccccc1C2CNCC2 Amb24094033 [0,1,0,1,0,0|0,0,0]=2 11930 B13R2.18 Cc1ccccc1C2CNCO2 Amb18563576 [0,1,0,1,0,0|1,0,0]=3 11931 B13R2.18 Cc1ccccc1C=2CCNN2 Amb25697316 [0,1,0,1,0,0|1,0,1]=4 11932 B13R2.18 Cc1ccccc1C=2CNCC2 Amb22059719 [0,1,0,1,0,0|0,0,2]=4 11933 B13R2.18 Cc1ccccc1N2CCCC2 Amb24418554 [0,1,0,1,0,0|2,0,0]=4 11934 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb23440375 [0,1,0,1,0,0|2,0,0]=4 11935 B13R2.18 Cc1ccccc1[C@@H]2CCCN2 Amb24117100 [0,1,0,1,0,0|2,0,0]=4 11936 B13R2.18 Cc1ccccc1[C@H]2CCCN2 Amb24714734 [0,1,0,1,0,0|2,0,0]=4 11937 B13R2.18 Clc1[n]cccc1C2CCCC2 Amb24319281 [0,1,0,1,0,0|2,0,0]=4 11938 B13R2.18 Clc1c[n]ccc1C2CNCC2 Amb18823441 [0,1,0,1,0,0|1,0,0]=3 11939 B13R2.18 Clc1cc[n]cc1C2CNCC2 Amb18823442 [0,1,0,1,0,0|1,0,0]=3 11940 B13R2.18 Clc1ccc[n]c1C2CNCC2 Amb18823440 [0,1,0,1,0,0|1,0,0]=3 11941 B13R2.18 Clc1ccccc1C2CCCN2 Amb19887240 [0,1,0,1,0,0|2,0,0]=4 11942 B13R2.18 Clc1ccccc1C2CCCN2 Amb2236611 [0,1,0,1,0,0|2,0,0]=4 11943 B13R2.18 Clc1ccccc1C2CNCC2 Amb10068901 [0,1,0,1,0,0|0,0,0]=2 11944 B13R2.18 Clc1ccccc1C2CNCC2 Amb10602146 [0,1,0,1,0,0|0,0,0]=2 11945 B13R2.18 Clc1ccccc1C2CNCC2 Amb19958389 [0,1,0,1,0,0|0,0,0]=2 11946 B13R2.18 Clc1ccccc1C2CNCO2 Amb18564263 [0,1,0,1,0,0|1,0,0]=3 11947 B13R2.18 Clc1ccccc1N2CCCC2 Amb18268600 [0,1,0,1,0,0|2,0,0]=4 11948 B13R2.18 Clc1ccccc1[C@@H]2CCCN2 Amb24062899 [0,1,0,1,0,0|2,0,0]=4 11949 B13R2.18 Clc1ccccc1[C@@H]2CNCC2 Amb22748208 [0,1,0,1,0,0|0,0,0]=2 11950 B13R2.18 Clc1ccccc1[C@@H]2CNCC2 Amb24061925 [0,1,0,1,0,0|0,0,0]=2 11951 B13R2.18 Clc1ccccc1[C@H]2CCCN2 Amb24078711 [0,1,0,1,0,0|2,0,0]=4 11952 B13R2.18 Clc1ccccc1[C@H]2CNCC2 Amb24062133 [0,1,0,1,0,0|0,0,0]=2 11953 B13R2.18 Fc1[n]cccc1C2CNCC2 Amb18827733 [0,1,0,1,0,0|1,0,0]=3 11954 B13R2.18 Fc1c[n]ccc1C2CNCC2 Amb24758349 [0,1,0,1,0,0|1,0,0]=3 11955 B13R2.18 Fc1ccccc1C2CCCC2 Amb24484262 [0,1,0,1,0,0|1,0,0]=3 11956 B13R2.18 Fc1ccccc1C2CNCC2 Amb19351410 [0,1,0,1,0,0|0,0,0]=2 11957 B13R2.18 Fc1ccccc1C2CNCO2 Amb18563791 [0,1,0,1,0,0|1,0,0]=3 11958 B13R2.18 Fc1ccccc1C=2CNCC2 Amb22059720 [0,1,0,1,0,0|0,0,2]=4 11959 B13R2.18 Fc1ccccc1N2CCCC2 Amb18269455 [0,1,0,1,0,0|2,0,0]=4 11960 B13R2.18 Fc1ccccc1[C@@H]2CCCN2 Amb24094371 [0,1,0,1,0,0|2,0,0]=4 11961 B13R2.18 Fc1ccccc1[C@@H]2CNCC2 Amb24099973 [0,1,0,1,0,0|0,0,0]=2 11962 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb24099980 [0,1,0,1,0,0|2,0,0]=4 11963 B13R2.18 Fc1ccccc1[C@H]2CCCN2 Amb25237112 [0,1,0,1,0,0|2,0,0]=4 11964 B13R2.18 Fc1ccccc1[C@H]2CNCC2 Amb24094222 [0,1,0,1,0,0|0,0,0]=2 11965 B13R2.18 Fc1ccccc1[C@H]2CNCC2 Amb24485702 [0,1,0,1,0,0|0,0,0]=2 11966 B13R2.18 Ic1ccccc1C2CNCC2 Amb24652660 [0,1,0,1,0,0|0,0,0]=2 11967 B13R2.18 Ic1ccccc1[C@H]2CNCC2 Amb24435412 [0,1,0,1,0,0|0,0,0]=2 11968 B13R2.18 Nc1[n]cccc1C2CCCC2 Amb18829596 [0,1,0,1,0,0|2,0,0]=4 11969 B13R2.18 Nc1c[n]ccc1C2CCCC2 Amb18829606 [0,1,0,1,0,0|2,0,0]=4 11970 B13R2.18 Nc1cc[n]cc1C2CCCC2 Amb24319530 [0,1,0,1,0,0|2,0,0]=4 11971 B13R2.18 Nc1ccc[n]c1C2CCCC2 Amb18829595 [0,1,0,1,0,0|2,0,0]=4 11972 B13R2.18 Nc1ccccc1C2CCC=C2 Amb18126193 [0,1,0,1,0,0|1,0,1]=4 11973 B13R2.18 Nc1ccccc1C2CCCC2 Amb17106959 [0,1,0,1,0,0|1,0,0]=3 11974 B13R2.18 Nc1ccccc1C2CCCN2 Amb18064028 [0,1,0,1,0,0|2,0,0]=4 11975 B13R2.18 Nc1ccccc1C2CCCO2 Amb25756209 [0,1,0,1,0,0|2,0,0]=4 11976 B13R2.18 Nc1ccccc1C2CCCS2 Amb18648289 [0,1,0,1,0,0|2,0,0]=4 11977 B13R2.18 Nc1ccccc1C2COCC2 Amb20617120 [0,1,0,1,0,0|1,0,0]=3 11978 B13R2.18 Nc1ccccc1C2CSCC2 Amb25249833 [0,1,0,1,0,0|1,0,0]=3 11979 B13R2.18 Nc1ccccc1N2CCCC2 Amb24053263 [0,1,0,1,0,0|2,0,0]=4 11980 B13R2.18 Nc1ccccc1[C@H]2CCCN2 Amb25149804 [0,1,0,1,0,0|2,0,0]=4 11981 B13R2.18 O=C1C=CC=CN1C2CNCC2 Amb18038062 [0,1,0,1,0,0|1,0,0]=3 11982 B13R2.18 O=C1N=CC=CN1C2CNCC2 Amb18540386 [0,1,0,1,0,0|2,0,0]=4 11983 B13R2.18 Oc1[n]cccc1C2CCCC2 Amb24319282 [0,1,0,1,0,0|2,0,0]=4 11984 B13R2.18 Oc1c[n]c[n]c1C2CCNC2 Amb25851482 [0,1,0,1,0,0|2,0,0]=4 11985 B13R2.18 Oc1c[n]ccc1C2CNCC2 Amb25207921 [0,1,0,1,0,0|1,0,0]=3 11986 B13R2.18 Oc1ccc[n]c1C2CCCC2 Amb24320675 [0,1,0,1,0,0|2,0,0]=4 11987 B13R2.18 Oc1ccccc1C2C=CCC2 Amb1150411 [0,1,0,1,0,0|1,0,1]=4 11988 B13R2.18 Oc1ccccc1C2CCCN2 Amb18560469 [0,1,0,1,0,0|2,0,0]=4 11989 B13R2.18 Oc1ccccc1C2CCCO2 Amb18646054 [0,1,0,1,0,0|2,0,0]=4 11990 B13R2.18 Oc1ccccc1C2CCCS2 Amb18648415 [0,1,0,1,0,0|2,0,0]=4 11991 B13R2.18 Oc1ccccc1C2CNCC2 Amb18062861 [0,1,0,1,0,0|0,0,0]=2 11992 B13R2.18 Oc1ccccc1C2COCC2 Amb20617121 [0,1,0,1,0,0|1,0,0]=3 11993 B13R2.18 Oc1ccccc1C2CSCC2 Amb24536182 [0,1,0,1,0,0|1,0,0]=3 11994 B13R2.18 Oc1ccccc1[C@@H]2CCCN2 Amb24431174 [0,1,0,1,0,0|2,0,0]=4 11995 B13R2.18 Oc1ccccc1[C@@H]2CNCC2 Amb24394460 [0,1,0,1,0,0|0,0,0]=2 11996 B13R2.18 Sc1ccccc1C2CCCN2 Amb24089709 [0,1,0,1,0,0|2,0,0]=4 11997 B13R2.18 Sc1ccccc1C2CNCC2 Amb24379546 [0,1,0,1,0,0|0,0,0]=2 11998 B13R2.18 Sc1ccccc1[C@H]2CCCN2 Amb25129494 [0,1,0,1,0,0|2,0,0]=4 11999 B13R2.216 CC1CN(C1)c2ccccc2N Amb24383763 [0,1,0,1,0,0|2,0,0]=4 12000 B13R2.216 Cc1ccccc1C2CC(=O)C2 Amb19286389 [0,1,0,1,0,0|2,0,0]=4 12001 B13R2.216 Cc1ccccc1C2CC(N)C2 Amb19148955 [0,1,0,1,0,0|2,0,0]=4 12002 B13R2.216 Cc1ccccc1C2CC(O)C2 Amb18792429 [0,1,0,1,0,0|2,0,0]=4 12003 B13R2.216 Cc1ccccc1[C@@H]2C[C@@H](N)C2 Amb24624964 [0,1,0,1,0,0|2,0,0]=4 12004 B13R2.216 NC1CC(C1)c2ccccc2Br Amb19514826 [0,1,0,1,0,0|2,0,0]=4 12005 B13R2.216 NC1CC(C1)c2ccccc2Cl Amb19374604 [0,1,0,1,0,0|2,0,0]=4 12006 B13R2.216 NC1CC(C1)c2ccccc2F Amb19373545 [0,1,0,1,0,0|2,0,0]=4 12007 B13R2.216 N[C@@H]1C[C@H](C1)c2ccccc2Cl Amb24683487 [0,1,0,1,0,0|2,0,0]=4 12008 B13R2.216 N[C@@H]1C[C@H](C1)c2ccccc2F Amb25159862 [0,1,0,1,0,0|2,0,0]=4 12009 B13R2.216 O=C1CC(C1)c2ccccc2Br Amb20622984 [0,1,0,1,0,0|2,0,0]=4 12010 B13R2.216 O=C1CC(C1)c2ccccc2Cl Amb20622983 [0,1,0,1,0,0|2,0,0]=4 12011 B13R2.216 O=C1CC(C1)c2ccccc2F Amb19286390 [0,1,0,1,0,0|2,0,0]=4 12012 B13R2.216 O=C1CC(C1)c2ccccc2I Amb25100551 [0,1,0,1,0,0|2,0,0]=4 12013 B13R2.216 OC1CC(C1)c2ccccc2Cl Amb19057039 [0,1,0,1,0,0|2,0,0]=4 12014 B13R2.216 OC1CC(C1)c2ccccc2F Amb18792758 [0,1,0,1,0,0|2,0,0]=4 12015 B13R2.216 OC1CC(C1)c2ccccc2I Amb25724081 [0,1,0,1,0,0|2,0,0]=4 12016 B13R2.567 Brc1ccccc1C2CC2CBr Amb25334152 [0,1,0,1,0,0|2,0,0]=4 12017 B13R2.567 Cc1ccccc1C2CC2C=O Amb18636297 [0,1,0,1,0,0|2,0,0]=4 12018 B13R2.567 Cc1ccccc1C2CC2CO Amb23442939 [0,1,0,1,0,0|2,0,0]=4 12019 B13R2.567 Cc1ccccc1[C@@H]2C[C@H]2CN Amb25251137 [0,1,0,1,0,0|2,0,0]=4 12020 B13R2.567 ClCC1CC1c2ccccc2Br Amb25257293 [0,1,0,1,0,0|2,0,0]=4 12021 B13R2.567 Clc1ccccc1C2CC2CBr Amb25734661 [0,1,0,1,0,0|2,0,0]=4 12022 B13R2.567 Fc1ccccc1C2CC2CBr Amb24387325 [0,1,0,1,0,0|2,0,0]=4 12023 B13R2.567 Fc1ccccc1C2CC2CCl Amb25778333 [0,1,0,1,0,0|2,0,0]=4 12024 B13R2.567 N#CC1CC1c2ccccc2Br Amb24596448 [0,1,0,1,0,0|2,0,0]=4 12025 B13R2.567 N#CC1CC1c2ccccc2C Amb17232207 [0,1,0,1,0,0|2,0,0]=4 12026 B13R2.567 N#CC1CC1c2ccccc2Cl Amb17233374 [0,1,0,1,0,0|2,0,0]=4 12027 B13R2.567 N#CC1CC1c2ccccc2F Amb17232353 [0,1,0,1,0,0|2,0,0]=4 12028 B13R2.567 NCC1CC1c2ccccc2Br Amb17568203 [0,1,0,1,0,0|2,0,0]=4 12029 B13R2.567 NCC1CC1c2ccccc2C Amb17232379 [0,1,0,1,0,0|2,0,0]=4 12030 B13R2.567 NCC1CC1c2ccccc2Cl Amb17233870 [0,1,0,1,0,0|2,0,0]=4 12031 B13R2.567 NCC1CC1c2ccccc2F Amb17232528 [0,1,0,1,0,0|2,0,0]=4 12032 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2Br Amb25264940 [0,1,0,1,0,0|2,0,0]=4 12033 B13R2.567 NC[C@@H]1C[C@H]1c2ccccc2F Amb25204987 [0,1,0,1,0,0|2,0,0]=4 12034 B13R2.567 O=CC1CC1c2ccccc2Br Amb18636317 [0,1,0,1,0,0|2,0,0]=4 12035 B13R2.567 O=CC1CC1c2ccccc2Cl Amb18636302 [0,1,0,1,0,0|2,0,0]=4 12036 B13R2.567 O=CC1CC1c2ccccc2F Amb18636293 [0,1,0,1,0,0|2,0,0]=4 12037 B13R2.567 OCC1CC1c2ccccc2Br Amb17605545 [0,1,0,1,0,0|2,0,0]=4 12038 B13R2.567 OCC1CC1c2ccccc2Cl Amb17605562 [0,1,0,1,0,0|2,0,0]=4 12039 B13R2.567 OCC1CC1c2ccccc2F Amb17605538 [0,1,0,1,0,0|2,0,0]=4 12040 B13R2.3097 CN(C1CC1)c2ccccc2Cl Amb24571668 [0,1,0,1,0,0|2,0,0]=4 12041 B13R2.3097 Cc1ccccc1[C@@H](N)C2CC2 Amb25149826 [0,1,0,1,0,0|2,0,0]=4 12042 B13R2.3097 Cc1ccccc1[C@@H](O)C2CC2 Amb25837926 [0,1,0,1,0,0|2,0,0]=4 12043 B13R2.3097 Cc1ccccc1[C@H](N)C2CC2 Amb24460722 [0,1,0,1,0,0|2,0,0]=4 12044 B13R2.3097 Cc1ccccc1[C@H](O)C2CC2 Amb24749624 [0,1,0,1,0,0|2,0,0]=4 12045 B13R2.3097 NC(C1CC1)c2ccccc2Br Amb22234402 [0,1,0,1,0,0|2,0,0]=4 12046 B13R2.3097 NC(C1CC1)c2ccccc2I Amb25854116 [0,1,0,1,0,0|2,0,0]=4 12047 B13R2.3097 NC(C1CC1)c2ccccc2O Amb24385683 [0,1,0,1,0,0|2,0,0]=4 12048 B13R2.3097 NC(c1ccccc1Cl)C2CC2 Amb17233873 [0,1,0,1,0,0|2,0,0]=4 12049 B13R2.3097 NC(c1ccccc1F)C2CC2 Amb17232530 [0,1,0,1,0,0|2,0,0]=4 12050 B13R2.3097 N[C@@H](C1CC1)c2ccccc2Br Amb24683361 [0,1,0,1,0,0|2,0,0]=4 12051 B13R2.3097 N[C@@H](C1CC1)c2ccccc2Cl Amb25149825 [0,1,0,1,0,0|2,0,0]=4 12052 B13R2.3097 N[C@@H](C1CC1)c2ccccc2F Amb22406379 [0,1,0,1,0,0|2,0,0]=4 12053 B13R2.3097 N[C@@H](C1CC1)c2ccccc2O Amb25148539 [0,1,0,1,0,0|2,0,0]=4 12054 B13R2.3097 N[C@H](C1CC1)c2ccccc2F Amb22406378 [0,1,0,1,0,0|2,0,0]=4 12055 B13R2.3097 N[C@H](C1CC1)c2ccccc2F Amb25113412 [0,1,0,1,0,0|2,0,0]=4 12056 B13R2.3097 N[C@H](C1CC1)c2ccccc2O Amb24409532 [0,1,0,1,0,0|2,0,0]=4 12057 B13R2.3097 Nc1ccccc1C(O)C2CC2 Amb25683042 [0,1,0,1,0,0|2,0,0]=4 12058 B13R2.3097 Nc1ccccc1[C@H](N)C2CC2 Amb25832046 [0,1,0,1,0,0|2,0,0]=4 12059 B13R2.3097 OC(C1CC1)c2ccccc2Br Amb24625121 [0,1,0,1,0,0|2,0,0]=4 12060 B13R2.3097 OC(C1CC1)c2ccccc2I Amb24535446 [0,1,0,1,0,0|2,0,0]=4 12061 B13R2.3097 OC(C1CO1)c2ccccc2Cl Amb25843713 [0,1,0,1,0,0|2,0,0]=4 12062 B13R2.3097 OC(c1ccccc1C)C2CC2 Amb17232415 [0,1,0,1,0,0|2,0,0]=4 12063 B13R2.3097 OC(c1ccccc1Cl)C2CC2 Amb17233964 [0,1,0,1,0,0|2,0,0]=4 12064 B13R2.3097 OC(c1ccccc1F)C2CC2 Amb17232579 [0,1,0,1,0,0|2,0,0]=4 12065 B13R2.3097 O[C@@H](C1CC1)c2ccccc2F Amb24182072 [0,1,0,1,0,0|2,0,0]=4 12066 B13R2.3097 O[C@H](C1CC1)c2ccccc2Br Amb25826145 [0,1,0,1,0,0|2,0,0]=4 12067 B13R2.3097 O[C@H](C1CC1)c2ccccc2Cl Amb24466238 [0,1,0,1,0,0|2,0,0]=4 12068 B13R2.3097 O[C@H](C1CC1)c2ccccc2F Amb24717101 [0,1,0,1,0,0|2,0,0]=4 12069 B13R2.3097 Oc1ccccc1C(F)C2CC2 Amb24359119 [0,1,0,1,0,0|2,0,0]=4 12070 B13R2.3569 CC1(CCN1)c2ccccc2Br Amb24691104 [0,1,0,1,0,0|2,0,0]=4 12071 B13R2.3569 CC1(CCN1)c2ccccc2Cl Amb24378797 [0,1,0,1,0,0|2,0,0]=4 12072 B13R2.3569 CC1(CCN1)c2ccccc2F Amb24703129 [0,1,0,1,0,0|2,0,0]=4 12073 B13R2.3569 CC1(CNC1)c2ccccc2Cl Amb18564191 [0,1,0,1,0,0|0,0,0]=2 12074 B13R2.3569 CC1(CNC1)c2ccccc2F Amb18563684 [0,1,0,1,0,0|0,0,0]=2 12075 B13R2.3569 CC1(COC1)c2ccccc2O Amb22295892 [0,1,0,1,0,0|1,0,0]=3 12076 B13R2.3569 Cc1cc[n]cc1C2(F)CNC2 Amb25738932 [0,1,0,1,0,0|2,0,0]=4 12077 B13R2.3569 Cc1ccccc1C2(C)CCC2 Amb24636942 [0,1,0,1,0,0|1,0,0]=3 12078 B13R2.3569 Cc1ccccc1C2(C)CCN2 Amb24483655 [0,1,0,1,0,0|2,0,0]=4 12079 B13R2.3569 Cc1ccccc1C2(C)CNC2 Amb18563525 [0,1,0,1,0,0|0,0,0]=2 12080 B13R2.3569 Cc1ccccc1C2(F)CNC2 Amb25327020 [0,1,0,1,0,0|1,0,0]=3 12081 B13R2.3569 Cc1ccccc1C2(N)COC2 Amb19892685 [0,1,0,1,0,0|2,0,0]=4 12082 B13R2.3569 Cc1ccccc1C2(O)CCC2 Amb24399581 [0,1,0,1,0,0|2,0,0]=4 12083 B13R2.3569 Cc1ccccc1C2(O)CNC2 Amb25323719 [0,1,0,1,0,0|1,0,0]=3 12084 B13R2.3569 FC1(CCC1)c2ccccc2Br Amb25276719 [0,1,0,1,0,0|2,0,0]=4 12085 B13R2.3569 Fc1ccccc1C2(F)CNC2 Amb24425207 [0,1,0,1,0,0|1,0,0]=3 12086 B13R2.3569 NC1(CCC1)c2ccccc2Br Amb18948441 [0,1,0,1,0,0|2,0,0]=4 12087 B13R2.3569 NC1(CCC1)c2ccccc2Br Amb19892796 [0,1,0,1,0,0|2,0,0]=4 12088 B13R2.3569 NC1(CCC1)c2ccccc2Cl Amb18279451 [0,1,0,1,0,0|2,0,0]=4 12089 B13R2.3569 NC1(CCC1)c2ccccc2Cl Amb19892631 [0,1,0,1,0,0|2,0,0]=4 12090 B13R2.3569 NC1(CCC1)c2ccccc2F Amb19892633 [0,1,0,1,0,0|2,0,0]=4 12091 B13R2.3569 NC1(CCC1)c2ccccc2I Amb25041002 [0,1,0,1,0,0|2,0,0]=4 12092 B13R2.3569 NC1(CCC1)c2ccccc2O Amb25719491 [0,1,0,1,0,0|2,0,0]=4 12093 B13R2.3569 NC1(COC1)c2ccccc2Cl Amb19892677 [0,1,0,1,0,0|2,0,0]=4 12094 B13R2.3569 NC1(COC1)c2ccccc2F Amb19892674 [0,1,0,1,0,0|2,0,0]=4 12095 B13R2.3569 NC1(COC1)c2ccccc2F Amb24518551 [0,1,0,1,0,0|2,0,0]=4 12096 B13R2.3569 Nc1cc[n]cc1C2(F)CNC2 Amb25238071 [0,1,0,1,0,0|2,0,0]=4 12097 B13R2.3569 Nc1cc[n]cc1C2(O)CNC2 Amb25237470 [0,1,0,1,0,0|2,0,0]=4 12098 B13R2.3569 OC1(CNC1)c2cc[n]cc2F Amb25340112 [0,1,0,1,0,0|2,0,0]=4 12099 B13R2.3569 OC1(CNC1)c2ccccc2F Amb25738686 [0,1,0,1,0,0|1,0,0]=3 12100 B13R2.3569 OC1(CSC1)c2ccccc2F Amb25264727 [0,1,0,1,0,0|2,0,0]=4 12101 B13R2.3570 CC1(CC1N)c2ccccc2Br Amb18280091 [0,1,0,1,0,0|2,0,0]=4 12102 B13R2.3570 CC1(CC1N)c2ccccc2Cl Amb18280093 [0,1,0,1,0,0|2,0,0]=4 12103 B13R2.3570 CC1(CC1N)c2ccccc2Cl Amb19374682 [0,1,0,1,0,0|2,0,0]=4 12104 B13R2.3570 CC1(CC1N)c2ccccc2F Amb18280069 [0,1,0,1,0,0|2,0,0]=4 12105 B13R2.3570 CC1(CC1N)c2ccccc2F Amb19148073 [0,1,0,1,0,0|2,0,0]=4 12106 B13R2.3570 CC1CC1(N)c2ccccc2Cl Amb24667535 [0,1,0,1,0,0|2,0,0]=4 12107 B13R2.3570 CC1CC1(O)c2ccccc2Cl Amb25345293 [0,1,0,1,0,0|2,0,0]=4 12108 B13R2.3570 Cc1ccccc1C2(C)CC2N Amb18947396 [0,1,0,1,0,0|2,0,0]=4 12109 B13R2.3570 Cc1ccccc1C2(C)CC2N Amb19302399 [0,1,0,1,0,0|2,0,0]=4 12110 B13R2.3570 Cc1ccccc1C2(N)CC2C Amb25726208 [0,1,0,1,0,0|2,0,0]=4 12111 B13R2.3570 Cc1ccccc1C2(O)CC2C Amb25295091 [0,1,0,1,0,0|2,0,0]=4 12112 B13R2.4818 CC1CCCc2cccc(N)c21 Amb24635924 [0,1,0,1,0,0|1,0,0]=3 12113 B13R2.4818 CC1CCCc2cccc(O)c21 Amb25667444 [0,1,0,1,0,0|1,0,0]=3 12114 B13R2.4818 CC1CCNc2cccc(F)c21 Amb18828265 [0,1,0,1,0,0|2,0,0]=4 12115 B13R2.4818 CC1CCOc2cccc(O)c21 Amb25717760 [0,1,0,1,0,0|2,0,0]=4 12116 B13R2.4818 CC1CNCc2cccc(Cl)c21 Amb18648574 [0,1,0,1,0,0|0,0,0]=2 12117 B13R2.4818 CC1CNCc2cccc(N)c21 Amb18355178 [0,1,0,1,0,0|0,0,0]=2 12118 B13R2.4818 CC1CNCc2cccc(O)c21 Amb24536241 [0,1,0,1,0,0|0,0,0]=2 12119 B13R2.4818 CC1NCCc2cccc(Br)c21 Amb25707530 [0,1,0,1,0,0|2,0,0]=4 12120 B13R2.4818 CC1NCCc2cccc(Cl)c21 Amb25116590 [0,1,0,1,0,0|2,0,0]=4 12121 B13R2.4818 CC1NCCc2cccc(F)c21 Amb19374693 [0,1,0,1,0,0|2,0,0]=4 12122 B13R2.4818 CC1NCCc2cccc(I)c21 Amb24682219 [0,1,0,1,0,0|2,0,0]=4 12123 B13R2.4818 CN1CCCc2cccc(Br)c12 Amb18159824 [0,1,0,1,0,0|2,0,0]=4 12124 B13R2.4818 CN1CCCc2cccc(O)c12 Amb18645879 [0,1,0,1,0,0|2,0,0]=4 12125 B13R2.4818 C[C@@H]1NCCc2cccc(I)c21 Amb24493113 [0,1,0,1,0,0|2,0,0]=4 12126 B13R2.4818 C[C@@H]1NCCc2cccc(O)c21 Amb24492976 [0,1,0,1,0,0|2,0,0]=4 12127 B13R2.4818 C[C@H]1NCCc2cccc(Cl)c21 Amb24493064 [0,1,0,1,0,0|2,0,0]=4 12128 B13R2.4818 C[C@H]1NCCc2cccc(I)c21 Amb25213478 [0,1,0,1,0,0|2,0,0]=4 12129 B13R2.4818 Cc1cc[n]c2CNCC(O)c21 Amb18828799 [0,1,0,1,0,0|2,0,0]=4 12130 B13R2.4818 Cc1cccc2CCCC(C)c12 Amb25314391 [0,1,0,1,0,0|1,0,0]=3 12131 B13R2.4818 Cc1cccc2CCCN(C)c12 Amb25741031 [0,1,0,1,0,0|2,0,0]=4 12132 B13R2.4818 Cc1cccc2CCC[C@@H](N)c21 Amb24578693 [0,1,0,1,0,0|2,0,0]=4 12133 B13R2.4818 Cc1cccc2CNCC(F)c21 Amb24663494 [0,1,0,1,0,0|1,0,0]=3 12134 B13R2.4818 Cc1cccc2COC[C@@H](N)c21 Amb25277380 [0,1,0,1,0,0|2,0,0]=4 12135 B13R2.4818 FC1CCCc2cccc(Cl)c21 Amb25249415 [0,1,0,1,0,0|2,0,0]=4 12136 B13R2.4818 FC1CNCc2cccc(Cl)c21 Amb25212001 [0,1,0,1,0,0|1,0,0]=3 12137 B13R2.4818 NC1CCCc2cccc(Br)c21 Amb22500451 [0,1,0,1,0,0|2,0,0]=4 12138 B13R2.4818 NC1CCCc2cccc(Cl)c21 Amb24082283 [0,1,0,1,0,0|2,0,0]=4 12139 B13R2.4818 NC1CCCc2cccc(F)c21 Amb22295835 [0,1,0,1,0,0|2,0,0]=4 12140 B13R2.4818 NC1CCCc2cccc(I)c21 Amb25076288 [0,1,0,1,0,0|2,0,0]=4 12141 B13R2.4818 NC1CCCc2cccc(S)c21 Amb25054001 [0,1,0,1,0,0|2,0,0]=4 12142 B13R2.4818 N[C@@H]1CCCc2cccc(Cl)c21 Amb24655887 [0,1,0,1,0,0|2,0,0]=4 12143 B13R2.4818 N[C@@H]1CCCc2cccc(F)c21 Amb25142278 [0,1,0,1,0,0|2,0,0]=4 12144 B13R2.4818 N[C@@H]1CCCc2cccc(O)c21 Amb24411209 [0,1,0,1,0,0|2,0,0]=4 12145 B13R2.4818 N[C@@H]1COCc2cccc(I)c21 Amb25277324 [0,1,0,1,0,0|2,0,0]=4 12146 B13R2.4818 N[C@@H]1COCc2cccc(O)c21 Amb25313297 [0,1,0,1,0,0|2,0,0]=4 12147 B13R2.4818 N[C@H]1CCCc2cccc(F)c21 Amb25791398 [0,1,0,1,0,0|2,0,0]=4 12148 B13R2.4818 N[C@H]1CCCc2cccc(O)c21 Amb25302636 [0,1,0,1,0,0|2,0,0]=4 12149 B13R2.4818 N[C@H]1COCc2cccc(Cl)c21 Amb25301937 [0,1,0,1,0,0|2,0,0]=4 12150 B13R2.4818 N[C@H]1COCc2cccc(F)c21 Amb25756249 [0,1,0,1,0,0|2,0,0]=4 12151 B13R2.4818 N[C@H]1COCc2cccc(O)c21 Amb25131243 [0,1,0,1,0,0|2,0,0]=4 12152 B13R2.4818 Nc1cccc2CCCC(F)c21 Amb25270208 [0,1,0,1,0,0|2,0,0]=4 12153 B13R2.4818 Nc1cccc2CCCC(O)c21 Amb24741556 [0,1,0,1,0,0|2,0,0]=4 12154 B13R2.4818 Nc1cccc2CCC[C@H](N)c12 Amb25687250 [0,1,0,1,0,0|2,0,0]=4 12155 B13R2.4818 Nc1cccc2COC[C@@H](N)c12 Amb25218934 [0,1,0,1,0,0|2,0,0]=4 12156 B13R2.4818 Nc1cccc2COC[C@H](N)c12 Amb24394533 [0,1,0,1,0,0|2,0,0]=4 12157 B13R2.4818 Oc1cccc2CCCC(O)c12 Amb22491810 [0,1,0,1,0,0|2,0,0]=4 12158 B13R3.1962 C1C2CCC1c3cc[n]cc32 Amb23536233 [0,0,0,2,0,0|2,0,0]=4 12159 B13R3.1962 C1CC2NC1c3ccccc32 Amb18124757 [0,0,0,2,0,0|2,0,0]=4 12160 B13R3.1962 C1C[C@H]2N[C@@H]1c3c2cccc3 Amb10606699 [0,0,0,2,0,0|2,0,0]=4 12161 B13R3.1962 C1C[C@H]2O[C@@H]1c3ccccc32 Amb25679044 [0,0,0,2,0,0|2,0,0]=4 12162 B13R3.1962 C1NC2CC1c3ccccc32 Amb18124756 [0,0,0,2,0,0|0,0,0]=2 12163 B13R3.1962 C1N[C@@H]2C[C@H]1c3ccccc32 Amb24614643 [0,0,0,2,0,0|0,0,0]=2 12164 B13R3.1962 C1N[C@H]2C[C@@H]1c3ccccc32 Amb25174781 [0,0,0,2,0,0|0,0,0]=2 12165 B13R3.1962 C1[C@@H]2C=C[C@H]1c3ccccc32 Amb25858647 [0,0,0,2,0,0|1,0,1]=4 12166 B13R3.352 OC1CC2C1c3ccccc32 Amb25317279 [0,0,0,2,0,0|2,0,0]=4 12167 B13R3.6977 C1C2CC1(C2)c3ccccc3 Amb24058119 [0,0,0,2,0,0|1,0,0]=3 12168 B13R3.28 C1C[C@@H]2O[C@H]2c3ccccc31 Amb25175696 [0,0,0,2,0,0|2,0,0]=4 12169 B13R3.28 c1ccc2c(c1)C3OC3CC2 Amb2383739 [0,0,0,2,0,0|2,0,0]=4 12170 B13R3.274 CC1C2OC2c3ccccc31 Amb24091856 [0,0,0,2,0,0|1,0,0]=3 12171 B13R3.274 O=C1C2CC2c3ccccc31 Amb24533047 [0,0,0,2,0,0|2,0,0]=4 12172 B13R3.274 O=C1[C@H]2C[C@H]2c3ccccc31 Amb24512663 [0,0,0,2,0,0|2,0,0]=4 12173 B13R3.274 OC1C2CC2c3c1cccc3 Amb10560547 [0,0,0,2,0,0|2,0,0]=4 12174 B13R3.274 O[C@@H]1[C@H]2O[C@H]2c3ccccc31 Amb25221422 [0,0,0,2,0,0|2,0,0]=4 12175 B13R3.274 O[C@H]1[C@@H]2C[C@@H]2c3ccccc31 Amb24620905 [0,0,0,2,0,0|2,0,0]=4 12176 B13R3.2083 COC12OC1c3ccccc23 Amb24334687 [0,0,0,2,0,0|2,0,0]=4 12177 B13R3.1925 C1c:2:c:c:3COCN1c3:c:c2 Amb24079212 [0,0,0,2,0,0|2,0,0]=4 12178 B13R3.78 NC12CC1Cc3ccccc23 Amb25044471 [0,0,0,2,0,0|2,0,0]=4 12179 B9R1.11 BrCC(c1cccs1)C Amb17238292 [1,0,0,0,1,0|2,0,0]=4 12180 B9R1.11 CC(CCl)=C1C=CC=C1 Amb25705321 [1,0,0,0,1,0|1,0,1]=4 12181 B9R1.11 CC(CN)[n]1c[n]cc1 Amb22586949 [1,0,0,0,1,0|2,0,0]=4 12182 B9R1.11 CC(CN)[n]1ccc[n]1 Amb21954212 [1,0,0,0,1,0|2,0,0]=4 12183 B9R1.11 CC(CN)[n]1ccc[n]1 Amb22587139 [1,0,0,0,1,0|2,0,0]=4 12184 B9R1.11 CC(CN)c1[n]cco1 Amb25808994 [1,0,0,0,1,0|2,0,0]=4 12185 B9R1.11 CC(CN)c1c[nH]cc1 Amb18062922 [1,0,0,0,1,0|1,0,0]=3 12186 B9R1.11 CC(CN)c1c[s]cc1 Amb18958489 [1,0,0,0,1,0|1,0,0]=3 12187 B9R1.11 CC(CN)c1cc[n][s]1 Amb18202550 [1,0,0,0,1,0|2,0,0]=4 12188 B9R1.11 CC(CN)c1cc[n]o1 Amb24559475 [1,0,0,0,1,0|2,0,0]=4 12189 B9R1.11 CC(NN)c1c[nH]cc1 Amb18222164 [1,0,0,0,1,0|2,0,0]=4 12190 B9R1.11 CC(NN)c1c[s]cc1 Amb25675360 [1,0,0,0,1,0|2,0,0]=4 12191 B9R1.11 CC(NO)c1c[s]cc1 Amb24529065 [1,0,0,0,1,0|2,0,0]=4 12192 B9R1.11 CC(NO)c1cocc1 Amb24756333 [1,0,0,0,1,0|2,0,0]=4 12193 B9R1.11 CCC(C)[n]1c[n]cc1 Amb20624437 [1,0,0,0,1,0|2,0,0]=4 12194 B9R1.11 CCC(C)c1[nH]cc[n]1 Amb25146047 [1,0,0,0,1,0|2,0,0]=4 12195 B9R1.11 CCC(C)c1cc[nH][n]1 Amb25075015 [1,0,0,0,1,0|2,0,0]=4 12196 B9R1.11 CCC(C)c1cc[n]o1 Amb25061708 [1,0,0,0,1,0|2,0,0]=4 12197 B9R1.11 CCC(C)c1ccc[nH]1 Amb24376687 [1,0,0,0,1,0|1,0,0]=3 12198 B9R1.11 CCC(C)c1cco[n]1 Amb25759993 [1,0,0,0,1,0|2,0,0]=4 12199 B9R1.11 CCC(N)c1c[nH]cc1 Amb18893265 [1,0,0,0,1,0|2,0,0]=4 12200 B9R1.11 CCC(N)c1c[s]cc1 Amb18523733 [1,0,0,0,1,0|2,0,0]=4 12201 B9R1.11 CCC(N)c1ccc[nH]1 Amb18832877 [1,0,0,0,1,0|2,0,0]=4 12202 B9R1.11 CCC(O)c1c[s]cc1 Amb25070368 [1,0,0,0,1,0|2,0,0]=4 12203 B9R1.11 CCC(O)c1ccc[nH]1 Amb25781453 [1,0,0,0,1,0|2,0,0]=4 12204 B9R1.11 CCC(S)c1ccc[s]1 Amb18787791 [1,0,0,0,1,0|2,0,0]=4 12205 B9R1.11 CCC(c1ccco1)Cl Amb17138399 [1,0,0,0,1,0|2,0,0]=4 12206 B9R1.11 CCC(c1ccco1)N Amb17061211 [1,0,0,0,1,0|2,0,0]=4 12207 B9R1.11 CCC(c1ccco1)O Amb17138369 [1,0,0,0,1,0|2,0,0]=4 12208 B9R1.11 CCC(c1cccs1)Cl Amb17138515 [1,0,0,0,1,0|2,0,0]=4 12209 B9R1.11 CCC(c1cccs1)N Amb10609665 [1,0,0,0,1,0|2,0,0]=4 12210 B9R1.11 CCC(c1cccs1)N Amb1102446 [1,0,0,0,1,0|2,0,0]=4 12211 B9R1.11 CCN(C)c1c[s]cc1 Amb24679311 [1,0,0,0,1,0|2,0,0]=4 12212 B9R1.11 CC[C@@H](N)c1ccc[s]1 Amb24666373 [1,0,0,0,1,0|2,0,0]=4 12213 B9R1.11 CC[C@@H](N)c1ccco1 Amb25246133 [1,0,0,0,1,0|2,0,0]=4 12214 B9R1.11 CC[C@@H](O)[n]1cccc1 Amb24644142 [1,0,0,0,1,0|2,0,0]=4 12215 B9R1.11 CC[C@@H](O)c1c[nH]cc1 Amb25032173 [1,0,0,0,1,0|2,0,0]=4 12216 B9R1.11 CC[C@@H](O)c1c[s]cc1 Amb24441265 [1,0,0,0,1,0|2,0,0]=4 12217 B9R1.11 CC[C@@H](O)c1ccc[s]1 Amb25162319 [1,0,0,0,1,0|2,0,0]=4 12218 B9R1.11 CC[C@H](N)c1c[nH]cc1 Amb24680216 [1,0,0,0,1,0|2,0,0]=4 12219 B9R1.11 CC[C@H](N)c1c[s]cc1 Amb24477830 [1,0,0,0,1,0|2,0,0]=4 12220 B9R1.11 CNC(C)c1[n]cc[s]1 Amb18282541 [1,0,0,0,1,0|2,0,0]=4 12221 B9R1.11 CNC(C)c1[n]cco1 Amb25106029 [1,0,0,0,1,0|2,0,0]=4 12222 B9R1.11 CNC(C)c1c[nH][n]c1 Amb18963919 [1,0,0,0,1,0|2,0,0]=4 12223 B9R1.11 CNC(C)c1c[nH]cc1 Amb18893263 [1,0,0,0,1,0|1,0,0]=3 12224 B9R1.11 CNC(C)c1c[n]c[s]1 Amb18286662 [1,0,0,0,1,0|2,0,0]=4 12225 B9R1.11 CNC(C)c1c[s]c[n]1 Amb19648829 [1,0,0,0,1,0|2,0,0]=4 12226 B9R1.11 CNC(C)c1c[s]cc1 Amb18288002 [1,0,0,0,1,0|1,0,0]=3 12227 B9R1.11 CNC(C)c1cc[nH][n]1 Amb18281499 [1,0,0,0,1,0|2,0,0]=4 12228 B9R1.11 CNC(C)c1cc[s][n]1 Amb25144447 [1,0,0,0,1,0|2,0,0]=4 12229 B9R1.11 CNC(C)c1ccco1 Amb19888104 [1,0,0,0,1,0|1,0,0]=3 12230 B9R1.11 CNC(c1ccco1)C Amb1127360 [1,0,0,0,1,0|1,0,0]=3 12231 B9R1.11 CNC(c1cccs1)C Amb1799863 [1,0,0,0,1,0|1,0,0]=3 12232 B9R1.11 CNC(c1cocc1)C Amb2234942 [1,0,0,0,1,0|1,0,0]=3 12233 B9R1.11 CN[C@@H](C)c1c[s]cc1 Amb24628804 [1,0,0,0,1,0|1,0,0]=3 12234 B9R1.11 CN[C@@H](C)c1ccc[s]1 Amb24364654 [1,0,0,0,1,0|1,0,0]=3 12235 B9R1.11 CN[C@H](C)c1c[s]cc1 Amb24436085 [1,0,0,0,1,0|1,0,0]=3 12236 B9R1.11 CN[C@H](C)c1ccc[s]1 Amb24635445 [1,0,0,0,1,0|1,0,0]=3 12237 B9R1.11 CN[C@H](C)c1ccco1 Amb24434234 [1,0,0,0,1,0|1,0,0]=3 12238 B9R1.11 CN[C@H](C)c1cocc1 Amb25361831 [1,0,0,0,1,0|1,0,0]=3 12239 B9R1.11 COC(C)c1ccc[s]1 Amb25026642 [1,0,0,0,1,0|2,0,0]=4 12240 B9R1.11 COC(C)c1ccco1 Amb25220078 [1,0,0,0,1,0|2,0,0]=4 12241 B9R1.11 CSC(C)c1ccc[s]1 Amb24476743 [1,0,0,0,1,0|2,0,0]=4 12242 B9R1.11 C[C@@H](CO)[n]1cccc1 Amb24417094 [1,0,0,0,1,0|2,0,0]=4 12243 B9R1.11 C[C@@H](CO)c1c[s]cc1 Amb24734195 [1,0,0,0,1,0|2,0,0]=4 12244 B9R1.11 C[C@@H](CO)c1ccc[s]1 Amb24619184 [1,0,0,0,1,0|2,0,0]=4 12245 B9R1.11 C[C@@H](CO)c1ccco1 Amb24340224 [1,0,0,0,1,0|2,0,0]=4 12246 B9R1.11 C[C@@H](NO)c1ccc[s]1 Amb24445194 [1,0,0,0,1,0|2,0,0]=4 12247 B9R1.11 C[C@H](CN)c1c[n]c[nH]1 Amb25074426 [1,0,0,0,1,0|2,0,0]=4 12248 B9R1.11 C[C@H](CO)C1=CCC=C1 Amb25745076 [1,0,0,0,1,0|1,0,1]=4 12249 B9R1.11 C[C@H](CO)[n]1cccc1 Amb24481818 [1,0,0,0,1,0|2,0,0]=4 12250 B9R1.11 C[C@H](NO)c1ccco1 Amb25354707 [1,0,0,0,1,0|2,0,0]=4 12251 B9R1.11 ClCC(c1cccs1)C Amb17232346 [1,0,0,0,1,0|2,0,0]=4 12252 B9R1.11 NCC(F)c1ccc[s]1 Amb25842892 [1,0,0,0,1,0|2,0,0]=4 12253 B9R1.11 NCC(F)c1ccco1 Amb24573586 [1,0,0,0,1,0|2,0,0]=4 12254 B9R1.11 NCC(O)c1c[nH]cc1 Amb18062992 [1,0,0,0,1,0|2,0,0]=4 12255 B9R1.11 NCC(O)c1cocc1 Amb22642021 [1,0,0,0,1,0|2,0,0]=4 12256 B9R1.11 NCC(O)c1cocc1 Amb24656205 [1,0,0,0,1,0|2,0,0]=4 12257 B9R1.11 NCC(c1ccc[nH]1)O Amb1108226 [1,0,0,0,1,0|2,0,0]=4 12258 B9R1.11 NCC(c1ccco1)O Amb1108638 [1,0,0,0,1,0|2,0,0]=4 12259 B9R1.11 NCC(c1cccs1)O Amb1108252 [1,0,0,0,1,0|2,0,0]=4 12260 B9R1.11 NCC(c1cscc1)O Amb1108450 [1,0,0,0,1,0|2,0,0]=4 12261 B9R1.11 NC[C@@H](N)c1c[s]cc1 Amb25075755 [1,0,0,0,1,0|2,0,0]=4 12262 B9R1.11 NC[C@@H](N)c1ccc[nH]1 Amb24534316 [1,0,0,0,1,0|2,0,0]=4 12263 B9R1.11 NC[C@@H](O)c1ccc[nH]1 Amb24117030 [1,0,0,0,1,0|2,0,0]=4 12264 B9R1.11 NC[C@@H](O)c1ccc[s]1 Amb25804883 [1,0,0,0,1,0|2,0,0]=4 12265 B9R1.11 NC[C@@H](O)c1ccco1 Amb22747769 [1,0,0,0,1,0|2,0,0]=4 12266 B9R1.11 NC[C@H](N)c1c[nH]cc1 Amb25324785 [1,0,0,0,1,0|2,0,0]=4 12267 B9R1.11 NC[C@H](N)c1c[s]cc1 Amb24532151 [1,0,0,0,1,0|2,0,0]=4 12268 B9R1.11 NC[C@H](N)c1ccc[nH]1 Amb25680046 [1,0,0,0,1,0|2,0,0]=4 12269 B9R1.11 NC[C@H](N)c1ccco1 Amb24467396 [1,0,0,0,1,0|2,0,0]=4 12270 B9R1.11 NC[C@H](O)c1c[s]cc1 Amb25828147 [1,0,0,0,1,0|2,0,0]=4 12271 B9R1.11 NOC(c1cccs1)C Amb17089184 [1,0,0,0,1,0|2,0,0]=4 12272 B9R1.11 OCC(c1cccs1)C Amb17231948 [1,0,0,0,1,0|2,0,0]=4 12273 B9R1.11 ONC(c1ccco1)C Amb10605011 [1,0,0,0,1,0|2,0,0]=4 12274 B9R1.11 ONC(c1cccs1)C Amb10606933 [1,0,0,0,1,0|2,0,0]=4 12275 B9R1.12 CCCCC1C=CC=C1 Amb21962871 [1,0,0,0,1,0|1,0,1]=4 12276 B9R1.12 CCCCc1c[nH]cc1 Amb25771565 [1,0,0,0,1,0|2,0,0]=4 12277 B9R1.12 CCCCc1ccco1 Amb10070290 [1,0,0,0,1,0|2,0,0]=4 12278 B9R1.12 CCCCc1ccsc1 Amb17779303 [1,0,0,0,1,0|2,0,0]=4 12279 B9R1.12 CNCCC=1CC=CC1 Amb25755843 [1,0,0,0,1,0|0,0,1]=3 12280 B9R1.12 CNCC[n]1c[n]cc1 Amb21954316 [1,0,0,0,1,0|2,0,0]=4 12281 B9R1.12 CNCC[n]1c[n]cc1 Amb22586829 [1,0,0,0,1,0|2,0,0]=4 12282 B9R1.12 CNCC[n]1ccc[n]1 Amb18299424 [1,0,0,0,1,0|2,0,0]=4 12283 B9R1.12 CNCC[n]1cccc1 Amb18994357 [1,0,0,0,1,0|1,0,0]=3 12284 B9R1.12 CNCCc1[nH]cc[n]1 Amb18222179 [1,0,0,0,1,0|2,0,0]=4 12285 B9R1.12 CNCCc1[n]cco1 Amb18222315 [1,0,0,0,1,0|2,0,0]=4 12286 B9R1.12 CNCCc1c[nH][n]c1 Amb22587664 [1,0,0,0,1,0|2,0,0]=4 12287 B9R1.12 CNCCc1c[nH]c[n]1 Amb22367617 [1,0,0,0,1,0|2,0,0]=4 12288 B9R1.12 CNCCc1c[nH]c[n]1 Amb23603746 [1,0,0,0,1,0|2,0,0]=4 12289 B9R1.12 CNCCc1c[nH]cc1 Amb18062858 [1,0,0,0,1,0|1,0,0]=3 12290 B9R1.12 CNCCc1c[nH]nc1 Amb1995188 [1,0,0,0,1,0|2,0,0]=4 12291 B9R1.12 CNCCc1ccc[s]1 Amb21959880 [1,0,0,0,1,0|1,0,0]=3 12292 B9R1.12 CNCCc1ccco1 Amb17399803 [1,0,0,0,1,0|1,0,0]=3 12293 B9R1.12 CNCCc1cco[n]1 Amb25078186 [1,0,0,0,1,0|2,0,0]=4 12294 B9R1.12 CNCCc1cocc1 Amb25682417 [1,0,0,0,1,0|1,0,0]=3 12295 B9R1.12 COCCc1ccc[s]1 Amb25147094 [1,0,0,0,1,0|2,0,0]=4 12296 B9R1.12 COCCc1ccco1 Amb25147016 [1,0,0,0,1,0|2,0,0]=4 12297 B9R1.12 CSCC[n]1cccc1 Amb24501482 [1,0,0,0,1,0|2,0,0]=4 12298 B9R1.12 CSCCc1c[s]cc1 Amb24394930 [1,0,0,0,1,0|2,0,0]=4 12299 B9R1.12 NNCCc1cocc1 Amb25100152 [1,0,0,0,1,0|2,0,0]=4 12300 B11R1.852 CC(C=O)C=1CC=CC=CC1 Amb24484730 [1,0,0,0,0,1|1,0,1]=4 12301 B11R1.852 CC(CO)C1C=CC=CC=C1 Amb25763818 [1,0,0,0,0,1|1,0,1]=4 12302 B11R1.203 NCCCC1=CNC=CC=C1 Amb25114442 [1,0,0,0,0,1|2,0,0]=4 12303 B13R1.42 CC(CC#C)NCc1ccccc1 Amb25725732 [0,0,0,0,0,2|1,0,1]=4 12304 B13R1.42 CC(CC#N)CCc1ccccc1 Amb24062158 [0,0,0,0,0,2|2,0,0]=4 12305 B13R1.42 CC(CC#N)NCc1ccccc1 Amb17334998 [0,0,0,0,0,2|2,0,0]=4 12306 B13R1.42 CC(CC=C)NCc1ccccc1 Amb18127528 [0,0,0,0,0,2|1,0,1]=4 12307 B13R1.42 CC(CC=O)CCc1ccccc1 Amb21618942 [0,0,0,0,0,2|2,0,0]=4 12308 B13R1.42 CC(CC=O)OCc1ccccc1 Amb18128218 [0,0,0,0,0,2|2,0,0]=4 12309 B13R1.42 CC(CCCl)NCc1ccccc1 Amb25276293 [0,0,0,0,0,2|2,0,0]=4 12310 B13R1.42 CC(CCI)OCc1ccccc1 Amb25191689 [0,0,0,0,0,2|2,0,0]=4 12311 B13R1.42 CC(CCN)NCc1ccccc1 Amb20090494 [0,0,0,0,0,2|2,0,0]=4 12312 B13R1.42 CC(CCO)C#Cc1ccccc1 Amb25099409 [0,0,0,0,0,2|2,0,0]=4 12313 B13R1.42 CC(CCO)NCc1ccccc1 Amb18128514 [0,0,0,0,0,2|2,0,0]=4 12314 B13R1.42 CC(CCO)OCc1ccccc1 Amb24533309 [0,0,0,0,0,2|2,0,0]=4 12315 B13R1.42 CCCC(C)NCc1ccccc1 Amb21959687 [0,0,0,0,0,2|1,0,0]=3 12316 B13R1.42 CCCC(Cl)OCc1ccccc1 Amb25361111 [0,0,0,0,0,2|2,0,0]=4 12317 B13R1.42 CCCC(N)C#Cc1ccccc1 Amb25856696 [0,0,0,0,0,2|2,0,0]=4 12318 B13R1.42 CCCC(O)CCc1ccccc1 Amb18796052 [0,0,0,0,0,2|2,0,0]=4 12319 B13R1.42 CCCC(O)OCc1ccccc1 Amb25769338 [0,0,0,0,0,2|2,0,0]=4 12320 B13R1.42 CCCN(C)OCc1ccccc1 Amb25355878 [0,0,0,0,0,2|2,0,0]=4 12321 B13R1.42 CCC[C@H](C)NCc1ccccc1 Amb25074570 [0,0,0,0,0,2|1,0,0]=3 12322 B13R1.42 CCNC(C)C#Cc1ccccc1 Amb25192205 [0,0,0,0,0,2|2,0,0]=4 12323 B13R1.42 CNCC(=O)C#Cc1ccccc1 Amb24383348 [0,0,0,0,0,2|1,0,1]=4 12324 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,0,0,0,0,2|1,0,1]=4 12325 B13R1.42 CNCC(=O)NNc1ccccc1 Amb24735727 [0,0,0,0,0,2|1,0,1]=4 12326 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,0,0,0,0,2|1,0,1]=4 12327 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,0,0,0,0,2|1,0,1]=4 12328 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,0,0,0,0,2|1,0,1]=4 12329 B13R1.42 CNCC(C)NCc1ccccc1 Amb24571148 [0,0,0,0,0,2|0,0,0]=2 12330 B13R1.42 CNCC(C)OCc1ccccc1 Amb18184560 [0,0,0,0,0,2|0,0,0]=2 12331 B13R1.42 COCC(N)C#Cc1ccccc1 Amb25361535 [0,0,0,0,0,2|2,0,0]=4 12332 B13R1.42 COCC(O)C#Cc1ccccc1 Amb25670565 [0,0,0,0,0,2|2,0,0]=4 12333 B13R1.42 CSCC(C)NCc1ccccc1 Amb25088724 [0,0,0,0,0,2|1,0,0]=3 12334 B13R1.42 CSCC(O)C#Cc1ccccc1 Amb24391060 [0,0,0,0,0,2|2,0,0]=4 12335 B13R1.42 C[C@@H](CC#N)NCc1ccccc1 Amb25073250 [0,0,0,0,0,2|2,0,0]=4 12336 B13R1.42 C[C@@H](CC=O)OCc1ccccc1 Amb24490409 [0,0,0,0,0,2|2,0,0]=4 12337 B13R1.42 C[C@@H](CCCl)NCc1ccccc1 Amb25275059 [0,0,0,0,0,2|2,0,0]=4 12338 B13R1.42 C[C@@H](CCO)C#Cc1ccccc1 Amb24415019 [0,0,0,0,0,2|2,0,0]=4 12339 B13R1.42 C[C@H](CC=O)C#Cc1ccccc1 Amb24583057 [0,0,0,0,0,2|2,0,0]=4 12340 B13R1.42 C[C@H](CCO)OCc1ccccc1 Amb25670536 [0,0,0,0,0,2|2,0,0]=4 12341 B13R1.42 C\C(\COC)=N/Nc1ccccc1 Amb25706754 [0,0,0,0,0,2|1,0,1]=4 12342 B13R1.42 C\C=C\C(C)NCc1ccccc1 Amb24355890 [0,0,0,0,0,2|1,0,1]=4 12343 B13R1.42 C\C=C\[C@@H](C)NCc1ccccc1 Amb25350237 [0,0,0,0,0,2|1,0,1]=4